*HEADER    DNA BINDING PROTEIN, CHAPERONE          09-NOV-11   2LLH              
*TITLE     NMR STRUCTURE OF NPM1_C70                                             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: NUCLEOPHOSMIN;                                             
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: NUCLEOLAR LOCALIZATION REGION RESIDUES 225-294;            
*COMPND   5 SYNONYM: NPM, NUCLEOLAR PHOSPHOPROTEIN B23, NUCLEOLAR PROTEIN NO38,  
*COMPND   6 NUMATRIN;                                                            
*COMPND   7 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: NPM1, NPM;                                                     
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PET28+(A)                                  
*KEYWDS    NUCLEOLAR, CHAPERONE, ONCOPROTEIN, DNA BINDING PROTEIN                
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    L.BANCI, I.BERTINI, M.BRUNORI, A.DI MATTEO, L.FEDERICI, A.GALLO, C.LO 
*AUTHOR   2 STERZO, M.MORI                                                       
*REVDAT   1   27-JUN-12 2LLH    0                                                


  2 GLU  QB   3 SER   HN       5.08
  3 SER  QB   4 PHE   HN       5.61
  4 PHE  HA   5 LYS  QB        5.45
  4 PHE HB3   5 LYS  QB        4.90
  5 LYS   HN  5 LYS  QG        4.92
  5 LYS  QB   6 LYS   HN       5.80
  7 GLN HB3   8 GLU  HA        5.68
  8 GLU  HA   9 LYS HB2        5.80
  8 GLU  HA   9 LYS HG2        5.43
  8 GLU  QB   9 LYS   HN       4.68
  9 LYS   HN  9 LYS HG2        5.80
  9 LYS   HN  9 LYS  QG        5.77
  9 LYS  HA   9 LYS HG2        4.13
  9 LYS  HA   9 LYS  QD        5.73
  9 LYS  HA  10 THR QG2        5.08
  9 LYS HB2  10 THR   HN       5.39
  9 LYS HB3  10 THR   HN       4.86
 10 THR   HN 10 THR QG2        5.55
 10 THR   HN 11 PRO  HA        5.80
 10 THR  HA  11 PRO HD2        4.02
 10 THR  HA  11 PRO HD3        3.98
 10 THR QG2  11 PRO HD2        4.97
 10 THR QG2  11 PRO HD3        4.89
 11 PRO HB2  12 LYS  QE        5.80
 12 LYS   HN 12 LYS  QD        4.62
 12 LYS  HA  12 LYS  QE        4.40
 12 LYS  QB  13 THR  HA        5.21
 12 LYS  QG  12 LYS  QD        2.60
 13 THR   HN 15 LYS  QD        5.80
 13 THR  HA  14 PRO  QG        5.80
 13 THR QG2  15 LYS  QD        3.39
 14 PRO  HA  15 LYS  QB        5.21
 14 PRO  HA  15 LYS  QD        4.77
 14 PRO  HA  15 LYS  QG        5.75
 14 PRO HB2  15 LYS  QD        5.80
 14 PRO  QG  15 LYS  HA        5.65
 15 LYS   HN 15 LYS  QB        4.16
 15 LYS   HN 15 LYS  QG        4.98
 15 LYS  HA  15 LYS  QD        4.22
 15 LYS  QB  15 LYS  QD        3.49
 15 LYS  QB  15 LYS  QE        4.58
 15 LYS  QG  16 GLY   HN       5.72
 16 GLY   HN 17 PRO  HA        5.10
 16 GLY   HN 17 PRO HB3        5.80
 16 GLY   HN 17 PRO  QD        5.32
 16 GLY HA2  26 LYS HG2        5.07
 16 GLY HA2  26 LYS  QB        5.80
 17 PRO  HA  22 ASP HB2        4.28
 17 PRO HB2  22 ASP HB2        4.27
 17 PRO HB3  22 ASP  HA        5.70
 17 PRO HG2  23 ILE   HN       5.80
 17 PRO HG3  18 SER   HN       4.92
 17 PRO HG3  19 SER   HN       5.80
 17 PRO  QD  22 ASP   HN       4.47
 17 PRO  QD  22 ASP HB2        5.80
 17 PRO  QD  23 ILE   HN       5.65
 17 PRO  QG  18 SER   HN       5.64
 17 PRO  QG  19 SER   HN       5.80
 17 PRO  QG  22 ASP  HA        5.39
 17 PRO  QG  22 ASP HB2        5.80
 18 SER   HN 19 SER   HN       5.15
 18 SER  QB  19 SER   HN       5.80
 19 SER   HN 22 ASP HB2        5.05
 19 SER   HN 22 ASP HB3        5.06
 19 SER HB2  20 VAL QG2        5.80
 19 SER HB2  21 GLU   HN       4.39
 19 SER HB3  20 VAL QG1        5.70
 20 VAL   HN 20 VAL QG1        4.06
 20 VAL   HN 20 VAL QG2        4.48
 20 VAL  HA  20 VAL QG1        4.21
 20 VAL  HA  20 VAL QG2        4.06
 20 VAL  HA  22 ASP   HN       5.15
 20 VAL  HA  23 ILE   HN       4.52
 20 VAL  HA  23 ILE QD1        5.80
 20 VAL  HA  23 ILE QG2        5.42
 20 VAL  HA  24 LYS   HN       5.78
 20 VAL  HB  21 GLU   HN       4.25
 20 VAL  HB  63 LEU QQD        4.20
 20 VAL   O  24 LYS   HN       2.00
 20 VAL   O  24 LYS   N        3.00
 20 VAL QG1  21 GLU   HN       4.59
 20 VAL QG1  21 GLU  QG        5.21
 20 VAL QG1  22 ASP   HN       5.71
 20 VAL QG1  23 ILE   HN       4.98
 20 VAL QG1  23 ILE QD1        4.56
 20 VAL QG1  23 ILE QG2        3.94
 20 VAL QG1  62 ASP HB3        5.05
 20 VAL QG1  63 LEU  HG        3.81
 20 VAL QG2  21 GLU   HN       4.94
 20 VAL QG2  21 GLU  HA        5.74
 20 VAL QG2  21 GLU  QG        5.75
 20 VAL QG2  22 ASP   HN       5.80
 20 VAL QG2  23 ILE   HN       5.80
 20 VAL QG2  23 ILE QG2        5.80
 20 VAL QG2  59 ALA  HA        4.14
 20 VAL QG2  59 ALA  QB        4.07
 20 VAL QG2  62 ASP HB3        5.47
 21 GLU   HN 21 GLU  QB        3.65
 21 GLU   HN 21 GLU  QG        3.83
 21 GLU   HN 22 ASP   HN       3.70
 21 GLU   O  25 ALA   HN       2.00
 21 GLU   O  25 ALA   N        3.00
 21 GLU  QB  22 ASP   HN       4.23
 21 GLU  QB  22 ASP HB2        5.71
 21 GLU  QB  25 ALA  QB        4.50
 21 GLU  QG  22 ASP   HN       5.37
 22 ASP   HN 22 ASP HB2        3.84
 22 ASP  HA  23 ILE  HA        5.73
 22 ASP  HA  25 ALA   HN       5.26
 22 ASP  HA  25 ALA  QB        3.78
 22 ASP  HA  26 LYS   HN       4.83
 22 ASP  HA  26 LYS HD3        5.07
 22 ASP  HA  26 LYS  QB        4.80
 22 ASP HB2  23 ILE   HN       4.38
 22 ASP HB2  26 LYS HD3        4.99
 22 ASP HB3  23 ILE   HN       4.76
 22 ASP HB3  23 ILE  HA        5.80
 22 ASP HB3  25 ALA  QB        5.80
 22 ASP   O  26 LYS   HN       2.00
 22 ASP   O  26 LYS   N        3.00
 23 ILE   HN 23 ILE QD1        4.21
 23 ILE   HN 23 ILE QG1        4.13
 23 ILE   HN 23 ILE QG2        4.53
 23 ILE   HN 24 LYS   HN       3.99
 23 ILE   HN 24 LYS HB2        5.80
 23 ILE  HA  23 ILE QD1        3.95
 23 ILE  HA  23 ILE QG1        4.21
 23 ILE  HA  25 ALA   HN       5.80
 23 ILE  HA  26 LYS   HN       4.93
 23 ILE  HA  26 LYS HD2        5.32
 23 ILE  HA  26 LYS HD3        5.80
 23 ILE  HA  26 LYS  QB        4.50
 23 ILE  HA  27 MET   HN       5.80
 23 ILE  HB  23 ILE QD1        3.85
 23 ILE   O  27 MET   HN       2.00
 23 ILE   O  27 MET   N        3.00
 23 ILE QD1  24 LYS   HN       5.37
 23 ILE QD1  52 PHE  HA        5.80
 23 ILE QD1  52 PHE HB2        4.62
 23 ILE QD1  52 PHE HB3        5.09
 23 ILE QD1  53 ARG  QB        5.80
 23 ILE QG1  52 PHE HB3        4.82
 23 ILE QG2  23 ILE QD1        3.41
 23 ILE QG2  23 ILE QG1        3.94
 23 ILE QG2  24 LYS   HN       5.00
 23 ILE QG2  24 LYS  HA        4.07
 23 ILE QG2  24 LYS HB2        5.72
 23 ILE QG2  24 LYS HD3        4.22
 23 ILE QG2  26 LYS   HN       5.10
 23 ILE QG2  27 MET   HN       5.44
 23 ILE QG2  27 MET HB2        5.80
 23 ILE QG2  48 VAL QG2        4.94
 23 ILE QG2  52 PHE HB2        5.80
 23 ILE QG2  63 LEU HB3        5.22
 23 ILE QG2  63 LEU QQD        4.04
 24 LYS   HN 24 LYS HB2        3.78
 24 LYS   HN 24 LYS HB3        3.96
 24 LYS   HN 24 LYS HD2        5.33
 24 LYS   HN 24 LYS HG2        4.61
 24 LYS   HN 24 LYS HG3        4.71
 24 LYS   HN 25 ALA   HN       4.15
 24 LYS  HA  24 LYS HD2        5.33
 24 LYS  HA  24 LYS HD3        4.89
 24 LYS  HA  27 MET   HN       4.84
 24 LYS  HA  27 MET HB2        4.11
 24 LYS  HA  27 MET HB3        5.65
 24 LYS  HA  28 GLN   HN       5.57
 24 LYS  HA  28 GLN HE22        5.29
 24 LYS HB2  25 ALA   HN       4.09
 24 LYS HB3  24 LYS  QE        5.80
 24 LYS HB3  25 ALA   HN       4.20
 24 LYS HB3  26 LYS   HN       5.36
 24 LYS HB3  28 GLN   HN       5.80
 24 LYS HD2  25 ALA   HN       5.15
 24 LYS HG3  25 ALA   HN       5.54
 24 LYS HG3  25 ALA  QB        5.80
 24 LYS HG3  63 LEU QQD        4.72
 24 LYS   O  28 GLN   HN       2.00
 24 LYS   O  28 GLN   N        3.00
 25 ALA   HN 25 ALA  QB        3.15
 25 ALA   HN 26 LYS   HN       4.09
 25 ALA   HN 27 MET   HN       5.80
 25 ALA  HA  27 MET   HN       5.80
 25 ALA  HA  28 GLN   HN       4.94
 25 ALA  HA  29 ALA  QB        5.80
 25 ALA   O  29 ALA   HN       2.00
 25 ALA   O  29 ALA   N        3.00
 25 ALA  QB  26 LYS   HN       3.80
 25 ALA  QB  28 GLN   HN       5.77
 25 ALA  QB  29 ALA   HN       5.80
 26 LYS   HN 26 LYS HD2        5.79
 26 LYS   HN 26 LYS HD3        5.36
 26 LYS   HN 26 LYS HG2        5.60
 26 LYS   HN 26 LYS  QB        3.45
 26 LYS   HN 27 MET   HN       3.69
 26 LYS   HN 28 GLN   HN       5.80
 26 LYS   HN 29 ALA   HN       5.80
 26 LYS  HA  26 LYS HD2        4.82
 26 LYS  HA  26 LYS HD3        4.55
 26 LYS  HA  26 LYS HG3        3.71
 26 LYS  HA  29 ALA   HN       4.65
 26 LYS  HA  29 ALA  QB        3.83
 26 LYS HG2  27 MET   HN       5.80
 26 LYS   O  30 SER   HN       2.00
 26 LYS   O  30 SER   N        3.00
 26 LYS  QB  26 LYS  QE        5.45
 26 LYS  QB  27 MET   HN       3.82
 26 LYS  QB  27 MET  HA        5.68
 27 MET   HN 27 MET HB2        3.86
 27 MET   HN 27 MET HB3        4.20
 27 MET   HN 28 GLN   HN       4.03
 27 MET   HN 28 GLN HE22        5.62
 27 MET  HA  28 GLN  HA        5.45
 27 MET  HA  28 GLN HE22        5.80
 27 MET  HA  29 ALA   HN       5.80
 27 MET  HA  31 ILE   HN       5.80
 27 MET HB2  28 GLN   HN       3.78
 27 MET HB2  30 SER   HN       5.80
 27 MET HB3  28 GLN   HN       5.51
 27 MET HB3  28 GLN HE22        5.16
 27 MET HB3  29 ALA   HN       5.80
 27 MET   O  31 ILE   HN       2.00
 27 MET   O  31 ILE   N        3.00
 28 GLN   HN 28 GLN HB3        3.89
 28 GLN   HN 28 GLN HE21        5.71
 28 GLN   HN 28 GLN HE22        4.79
 28 GLN   HN 28 GLN HG3        5.05
 28 GLN   HN 29 ALA   HN       3.84
 28 GLN   HN 29 ALA  QB        5.21
 28 GLN   HN 30 SER   HN       5.52
 28 GLN  HA  28 GLN HE22        5.68
 28 GLN  HA  28 GLN HG3        4.20
 28 GLN  HA  31 ILE   HN       4.67
 28 GLN  HA  31 ILE  HB        4.34
 28 GLN  HA  31 ILE QG1        5.26
 28 GLN  HA  31 ILE QG2        5.34
 28 GLN HB2  28 GLN HE22        5.51
 28 GLN HB2  29 ALA   HN       4.03
 28 GLN HB2  29 ALA  HA        4.78
 28 GLN HE22  70 LEU QD1        4.57
 28 GLN HE22  70 LEU QD2        4.62
 28 GLN HG2  29 ALA   HN       5.80
 28 GLN HG3  29 ALA   HN       5.77
 28 GLN   O  32 GLU   HN       2.00
 28 GLN   O  32 GLU   N        3.00
 28 GLN  QB  29 ALA   HN       4.50
 28 GLN  QB  29 ALA  HA        4.52
 28 GLN  QB  29 ALA  QB        5.80
 29 ALA   HN 29 ALA  QB        3.08
 29 ALA   HN 30 SER   HN       4.21
 29 ALA  HA  32 GLU   HN       4.75
 29 ALA  HA  33 LYS   HN       5.11
 29 ALA  HA  33 LYS HB2        5.71
 29 ALA  HA  33 LYS HG2        5.80
 29 ALA   O  33 LYS   HN       2.00
 29 ALA   O  33 LYS   N        3.00
 29 ALA  QB  30 SER   HN       3.63
 29 ALA  QB  30 SER  HA        5.80
 29 ALA  QB  30 SER  QB        5.80
 30 SER   HN 31 ILE  HB        5.79
 30 SER   HN 32 GLU   HN       5.23
 30 SER  HA  31 ILE  HA        5.80
 30 SER  HA  34 GLY   HN       4.68
 30 SER   O  34 GLY   HN       2.00
 30 SER   O  34 GLY   N        3.00
 31 ILE   HN 31 ILE  HB        3.57
 31 ILE   HN 31 ILE QD1        4.88
 31 ILE   HN 31 ILE QG1        4.08
 31 ILE   HN 31 ILE QG2        4.07
 31 ILE   HN 32 GLU   HN       4.26
 31 ILE  HA  31 ILE QD1        4.66
 31 ILE  HA  31 ILE QG2        3.70
 31 ILE  HA  35 GLY   HN       4.26
 31 ILE  HA  36 SER   HN       3.47
 31 ILE  HB  31 ILE QD1        4.24
 31 ILE  HB  32 GLU   HN       4.38
 31 ILE  HB  33 LYS   HN       5.80
 31 ILE QD1  32 GLU   HN       5.76
 31 ILE QD1  32 GLU HG2        5.80
 31 ILE QD1  70 LEU QD1        3.97
 31 ILE QD1  70 LEU QD2        4.89
 31 ILE QG1  32 GLU   HN       5.80
 31 ILE QG1  32 GLU HG2        5.70
 31 ILE QG2  31 ILE QD1        3.84
 31 ILE QG2  31 ILE QG1        3.68
 31 ILE QG2  32 GLU   HN       4.35
 31 ILE QG2  32 GLU  HA        4.68
 31 ILE QG2  32 GLU HG2        5.80
 31 ILE QG2  32 GLU  QB        5.80
 31 ILE QG2  33 LYS   HN       5.75
 31 ILE QG2  70 LEU QD1        3.80
 32 GLU   HN 32 GLU HG2        3.86
 32 GLU   HN 32 GLU HG3        4.04
 32 GLU   HN 33 LYS   HN       3.92
 32 GLU  HA  32 GLU HG3        4.10
 32 GLU  HA  33 LYS HG2        5.80
 32 GLU  HA  34 GLY   HN       4.51
 32 GLU HG3  33 LYS HG3        5.80
 32 GLU  QB  33 LYS   HN       3.78
 33 LYS   HN 33 LYS HB3        3.68
 33 LYS   HN 33 LYS HG2        3.84
 33 LYS   HN 33 LYS HG3        4.96
 33 LYS   HN 33 LYS  QD        5.14
 33 LYS   HN 33 LYS  QE        5.80
 33 LYS   HN 34 GLY   HN       3.27
 33 LYS   HN 34 GLY HA3        5.80
 33 LYS   HN 35 GLY   HN       4.52
 33 LYS HB2  34 GLY   HN       5.76
 33 LYS HB3  34 GLY   HN       5.20
 33 LYS HG2  34 GLY   HN       5.80
 33 LYS HG3  33 LYS  QE        4.02
 34 GLY   HN 35 GLY   HN       3.42
 34 GLY HA3  35 GLY HA3        5.16
 35 GLY   HN 36 SER   HN       4.93
 35 GLY HA3  36 SER  HA        5.80
 36 SER   HN 36 SER  QB        3.87
 36 SER   HN 37 LEU   HN       5.44
 36 SER  HA  37 LEU   HN       3.49
 36 SER  QB  37 LEU   HN       4.40
 38 PRO  HA  39 LYS HB3        5.19
 38 PRO  HA  44 PHE  HA        5.80
 38 PRO HD3  44 PHE  HA        4.79
 38 PRO HG3  44 PHE  HA        4.99
 38 PRO HG3  47 TYR  QB        3.71
 38 PRO  QB  40 VAL   HN       5.57
 39 LYS   HN 39 LYS HG2        5.80
 39 LYS   HN 39 LYS HG3        5.80
 39 LYS   HN 39 LYS  QD        4.92
 39 LYS   HN 39 LYS  QE        5.80
 39 LYS   HN 40 VAL   HN       3.55
 39 LYS   HN 40 VAL QQG        5.80
 39 LYS HB2  40 VAL   HN       5.80
 39 LYS HB3  40 VAL   HN       5.80
 39 LYS HG2  40 VAL   HN       5.80
 39 LYS HG3  39 LYS  QE        4.02
 39 LYS  QE  40 VAL QG1        5.60
 40 VAL   HN 40 VAL  HB        3.55
 40 VAL   HN 40 VAL QG1        5.28
 40 VAL   HN 40 VAL QG2        4.20
 40 VAL   HN 40 VAL QQG        3.66
 40 VAL   HN 41 GLU   HN       5.46
 40 VAL   HN 44 PHE  HA        5.80
 40 VAL   HN 44 PHE HB3        5.80
 40 VAL  HA  40 VAL QG2        3.74
 40 VAL  HA  40 VAL QQG        3.36
 40 VAL  HA  41 GLU   HN       3.57
 40 VAL  HA  41 GLU HB2        5.80
 40 VAL  HA  44 PHE   HN       5.44
 40 VAL  HA  44 PHE HB3        5.80
 40 VAL  HB  41 GLU   HN       4.47
 40 VAL   O  44 PHE   HN       2.00
 40 VAL   O  44 PHE   N        3.00
 40 VAL QG1  41 GLU   HN       3.53
 40 VAL QG1  41 GLU HB3        5.71
 40 VAL QG1  44 PHE HB3        5.80
 40 VAL QG2  41 GLU   HN       5.19
 41 GLU   HN 41 GLU HB2        4.08
 41 GLU   HN 42 ALA   HN       4.61
 41 GLU   HN 42 ALA  HA        5.80
 41 GLU   HN 42 ALA  QB        5.80
 41 GLU  HA  44 PHE HB3        3.55
 41 GLU  HA  45 ILE QD1        5.80
 41 GLU HB2  42 ALA   HN       5.01
 41 GLU HB2  44 PHE   HN       5.80
 41 GLU HB2  64 TRP HE1        4.47
 41 GLU HB3  42 ALA   HN       4.25
 41 GLU HB3  44 PHE   HN       5.80
 41 GLU   O  45 ILE   HN       2.00
 41 GLU   O  45 ILE   N        3.00
 42 ALA   HN 42 ALA  QB        3.18
 42 ALA   HN 43 LYS   HN       3.97
 42 ALA   HN 43 LYS  QG        5.49
 42 ALA   HN 45 ILE QD1        5.64
 42 ALA  HA  43 LYS  QG        5.69
 42 ALA  HA  45 ILE   HN       4.79
 42 ALA  HA  45 ILE  HB        3.80
 42 ALA  HA  45 ILE QD1        4.09
 42 ALA  HA  45 ILE QG1        4.81
 42 ALA  HA  45 ILE QG2        5.22
 42 ALA  HA  46 ASN   HN       5.62
 42 ALA   O  46 ASN   HN       2.00
 42 ALA   O  46 ASN   N        3.00
 42 ALA  QB  43 LYS   HN       3.86
 42 ALA  QB  43 LYS  HA        5.16
 42 ALA  QB  44 PHE   HN       5.60
 42 ALA  QB  45 ILE   HN       5.80
 42 ALA  QB  45 ILE QD1        5.80
 42 ALA  QB  45 ILE QG1        5.37
 42 ALA  QB  46 ASN  QB        5.80
 43 LYS   HN 43 LYS  QB        3.44
 43 LYS   HN 43 LYS  QE        5.80
 43 LYS   HN 43 LYS  QG        4.07
 43 LYS   HN 44 PHE   HN       3.41
 43 LYS   HN 44 PHE  HA        5.80
 43 LYS   HN 45 ILE   HN       5.52
 43 LYS   HN 45 ILE QG1        5.75
 43 LYS  HA  46 ASN HD21        4.88
 43 LYS   O  47 TYR   HN       2.00
 43 LYS   O  47 TYR   N        3.00
 43 LYS  QB  44 PHE   HN       3.91
 43 LYS  QB  44 PHE  HA        5.75
 43 LYS  QB  46 ASN HD21        5.49
 43 LYS  QB  46 ASN HD22        5.70
 43 LYS  QE  44 PHE   HN       5.12
 43 LYS  QG  44 PHE   HN       5.80
 43 LYS  QG  44 PHE  HA        5.69
 44 PHE   HN 44 PHE HB2        3.87
 44 PHE   HN 44 PHE HB3        4.10
 44 PHE   HN 45 ILE QG1        5.72
 44 PHE  HA  47 TYR   HN       5.12
 44 PHE  HA  47 TYR  QB        4.76
 44 PHE  HA  48 VAL   HN       5.38
 44 PHE  HA  48 VAL  HB        5.80
 44 PHE  HA  48 VAL QG2        5.80
 44 PHE HB2  45 ILE   HN       4.34
 44 PHE HB2  45 ILE QG1        5.80
 44 PHE HB3  45 ILE   HN       5.45
 44 PHE   O  48 VAL   HN       2.00
 44 PHE   O  48 VAL   N        3.00
 45 ILE   HN 45 ILE  HB        3.22
 45 ILE   HN 45 ILE QD1        4.39
 45 ILE   HN 45 ILE QG1        3.99
 45 ILE   HN 45 ILE QG2        4.66
 45 ILE   HN 46 ASN   HN       3.95
 45 ILE   HN 46 ASN  QB        5.80
 45 ILE   HN 47 TYR   HN       5.80
 45 ILE   HN 47 TYR  QB        5.32
 45 ILE  HA  45 ILE QD1        4.34
 45 ILE  HA  45 ILE QG1        3.79
 45 ILE  HA  45 ILE QG2        4.02
 45 ILE  HA  47 TYR   HN       5.80
 45 ILE  HA  48 VAL   HN       5.63
 45 ILE  HA  48 VAL  HB        4.79
 45 ILE  HA  48 VAL QG2        4.47
 45 ILE  HA  60 ILE QD1        4.58
 45 ILE  HB  45 ILE QD1        3.52
 45 ILE  HB  46 ASN   HN       3.60
 45 ILE  HB  46 ASN  HA        5.79
 45 ILE  HB  46 ASN  QB        5.70
 45 ILE  HB  47 TYR   HN       5.80
 45 ILE   O  49 LYS   HN       2.00
 45 ILE   O  49 LYS   N        3.00
 45 ILE QD1  46 ASN   HN       5.42
 45 ILE QG2  46 ASN   HN       4.24
 45 ILE QG2  46 ASN  HA        4.87
 45 ILE QG2  49 LYS  QE        4.11
 45 ILE QG2  60 ILE QD1        3.75
 46 ASN   HN 46 ASN  QB        3.35
 46 ASN   HN 47 TYR   HN       3.95
 46 ASN   HN 48 VAL   HN       5.80
 46 ASN   HN 48 VAL  HB        5.80
 46 ASN  HA  49 LYS   HN       4.80
 46 ASN  HA  49 LYS HB2        4.49
 46 ASN HD22  47 TYR   HN       4.78
 46 ASN HD22  47 TYR  QB        4.13
 46 ASN   O  50 ASN   HN       2.00
 46 ASN   O  50 ASN   N        3.00
 46 ASN  QB  47 TYR   HN       4.01
 46 ASN  QB  47 TYR  HA        5.69
 46 ASN  QB  48 VAL   HN       5.33
 47 TYR   HN 47 TYR  QB        3.71
 47 TYR   HN 48 VAL   HN       4.14
 47 TYR   HN 48 VAL QG2        5.26
 47 TYR   HN 49 LYS HB2        5.80
 47 TYR   HN 50 ASN   HN       5.80
 47 TYR  HA  50 ASN HB3        4.96
 47 TYR   O  51 CYS   HN       2.00
 47 TYR   O  51 CYS   N        3.00
 47 TYR  QB  48 VAL   HN       4.01
 47 TYR  QB  48 VAL  HB        5.28
 47 TYR  QB  48 VAL QG2        5.46
 47 TYR  QB  49 LYS   HN       5.80
 48 VAL   HN 48 VAL  HB        3.79
 48 VAL   HN 48 VAL QG1        4.93
 48 VAL   HN 48 VAL QG2        3.64
 48 VAL   HN 49 LYS   HN       4.96
 48 VAL   HN 49 LYS HB2        5.80
 48 VAL  HA  48 VAL QG1        4.20
 48 VAL  HA  48 VAL QG2        3.98
 48 VAL  HA  50 ASN HD21        5.36
 48 VAL  HA  51 CYS   HN       5.68
 48 VAL  HA  52 PHE   HN       4.21
 48 VAL  HA  52 PHE HB3        5.80
 48 VAL  HB  49 LYS   HN       4.08
 48 VAL  HB  49 LYS  HA        5.64
 48 VAL  HB  49 LYS  QG        3.93
 48 VAL  HB  52 PHE   HN       5.80
 48 VAL   O  52 PHE   HN       2.00
 48 VAL   O  52 PHE   N        3.00
 48 VAL QG1  49 LYS   HN       5.60
 48 VAL QG1  49 LYS  HA        5.80
 48 VAL QG1  49 LYS HD2        5.49
 48 VAL QG1  52 PHE   HN       5.80
 48 VAL QG1  52 PHE  HA        5.80
 48 VAL QG1  52 PHE HB2        5.80
 48 VAL QG1  54 MET HB2        3.87
 48 VAL QG1  60 ILE QD1        4.58
 48 VAL QG2  49 LYS   HN       4.23
 48 VAL QG2  50 ASN   HN       5.80
 49 LYS   HN 49 LYS HB2        3.72
 49 LYS   HN 49 LYS  QE        5.52
 49 LYS   HN 49 LYS  QG        5.70
 49 LYS   HN 50 ASN   HN       3.67
 49 LYS   HN 51 CYS   HN       5.80
 49 LYS  HA  49 LYS HD2        4.75
 49 LYS  HA  49 LYS HD3        5.47
 49 LYS  HA  52 PHE   HN       5.44
 49 LYS  HA  53 ARG   HN       4.87
 49 LYS HB2  49 LYS  QE        5.62
 49 LYS HB2  50 ASN   HN       4.41
 49 LYS HB3  49 LYS  QE        5.13
 49 LYS  QE  60 ILE QD1        4.57
 49 LYS  QG  49 LYS  QE        4.11
 50 ASN   HN 50 ASN HB2        3.99
 50 ASN   HN 51 CYS   HN       4.03
 50 ASN   HN 51 CYS HB2        4.63
 50 ASN   HN 52 PHE   HN       4.77
 50 ASN  HA  50 ASN HD21        4.30
 50 ASN  HA  50 ASN HD22        5.11
 50 ASN HB2  51 CYS   HN       4.78
 50 ASN HB3  51 CYS   HN       4.48
 50 ASN HB3  51 CYS  HA        5.80
 50 ASN HB3  52 PHE   HN       5.36
 50 ASN HD21  51 CYS   HN       4.20
 50 ASN HD21  51 CYS HB2        5.30
 50 ASN HD21  51 CYS HB3        5.59
 50 ASN HD21  52 PHE   HN       4.90
 51 CYS   HN 51 CYS HB2        3.83
 51 CYS   HN 52 PHE   HN       3.79
 51 CYS HB2  52 PHE   HN       4.83
 52 PHE  HA  53 ARG  QG        5.80
 52 PHE  HA  54 MET   HN       5.14
 52 PHE HB2  53 ARG   HN       5.80
 52 PHE HB3  54 MET   HN       5.20
 53 ARG   HN 53 ARG  QD        5.80
 53 ARG   HN 53 ARG  QG        4.01
 53 ARG   HN 54 MET   HN       4.17
 53 ARG  HA  53 ARG  QD        5.72
 53 ARG  QB  54 MET   HN       5.12
 53 ARG  QG  54 MET   HN       5.70
 54 MET   HN 54 MET HB2        4.05
 54 MET   HN 55 THR   HN       5.80
 54 MET  HA  55 THR QG2        5.42
 54 MET HB2  55 THR   HN       5.80
 54 MET HB2  56 ASP   HN       4.97
 54 MET HB3  60 ILE QD1        5.80
 54 MET HB3  60 ILE QG1        4.41
 55 THR   HN 55 THR QG2        4.67
 55 THR   HN 56 ASP   HN       4.21
 55 THR   HN 56 ASP HB2        5.80
 55 THR   HN 56 ASP HB3        5.80
 55 THR   HN 60 ILE QD1        5.80
 55 THR  HA  55 THR QG2        3.16
 55 THR  HA  57 GLN   HN       5.80
 55 THR  HA  60 ILE QD1        4.11
 55 THR QG2  56 ASP   HN       5.43
 56 ASP   HN 56 ASP HB2        4.10
 56 ASP   HN 56 ASP HB3        3.87
 56 ASP   HN 57 GLN   HN       5.64
 56 ASP   HN 60 ILE  HB        5.75
 56 ASP   HN 60 ILE QD1        5.68
 56 ASP  HA  57 GLN   HN       3.39
 56 ASP  HA  57 GLN  HA        5.37
 56 ASP  HA  57 GLN  QB        5.31
 56 ASP  HA  58 GLU   HN       5.60
 56 ASP  HA  60 ILE QD1        5.71
 56 ASP HB2  57 GLN   HN       5.62
 56 ASP HB2  58 GLU   HN       5.53
 56 ASP HB2  59 ALA   HN       4.71
 56 ASP HB2  59 ALA  QB        3.89
 56 ASP HB2  60 ILE  HB        5.80
 56 ASP HB3  57 GLN   HN       4.97
 56 ASP HB3  58 GLU   HN       5.75
 56 ASP HB3  59 ALA   HN       5.70
 56 ASP HB3  59 ALA  QB        4.28
 56 ASP   O  60 ILE   HN       2.00
 56 ASP   O  60 ILE   N        3.00
 57 GLN   HN 57 GLN HB2        3.33
 57 GLN   HN 57 GLN HG2        4.69
 57 GLN   HN 57 GLN HG3        5.27
 57 GLN   HN 57 GLN  QB        4.11
 57 GLN   HN 58 GLU   HN       4.17
 57 GLN   HN 59 ALA   HN       5.74
 57 GLN   HN 60 ILE   HN       5.58
 57 GLN   HN 60 ILE QD1        5.80
 57 GLN  HA  57 GLN HE21        5.19
 57 GLN  HA  59 ALA   HN       5.80
 57 GLN  HA  60 ILE   HN       4.78
 57 GLN  HA  60 ILE  HB        3.96
 57 GLN  HA  60 ILE QD1        4.06
 57 GLN  HA  60 ILE QG1        5.80
 57 GLN  HA  61 GLN   HN       5.21
 57 GLN  HA  61 GLN HG2        5.73
 57 GLN HE22  60 ILE  HA        5.47
 57 GLN HG3  60 ILE QD1        4.78
 57 GLN   O  61 GLN   HN       2.00
 57 GLN   O  61 GLN   N        3.00
 57 GLN  QB  57 GLN HE21        5.80
 58 GLU   HN 58 GLU HB2        4.02
 58 GLU   HN 58 GLU HB3        3.97
 58 GLU   HN 58 GLU HG2        5.18
 58 GLU   HN 58 GLU HG3        5.80
 58 GLU   HN 58 GLU  QB        3.18
 58 GLU   HN 59 ALA   HN       3.69
 58 GLU   HN 59 ALA  QB        5.19
 58 GLU  HA  61 GLN   HN       4.76
 58 GLU  HA  61 GLN HE22        4.49
 58 GLU  HA  61 GLN HG2        5.80
 58 GLU  HA  61 GLN HG3        5.75
 58 GLU HB2  59 ALA   HN       4.66
 58 GLU HB3  59 ALA   HN       4.72
 58 GLU HG2  59 ALA  QB        4.79
 58 GLU HG3  59 ALA   HN       4.85
 58 GLU HG3  59 ALA  HA        5.80
 58 GLU HG3  59 ALA  QB        4.07
 58 GLU   O  62 ASP   HN       2.00
 58 GLU   O  62 ASP   N        3.00
 58 GLU  QB  59 ALA   HN       3.71
 58 GLU  QB  60 ILE   HN       5.20
 59 ALA   HN 59 ALA  QB        3.27
 59 ALA   HN 60 ILE   HN       3.36
 59 ALA   HN 60 ILE  HB        5.02
 59 ALA   HN 61 GLN   HN       5.69
 59 ALA  HA  62 ASP   HN       4.24
 59 ALA  HA  62 ASP HB2        4.30
 59 ALA  HA  62 ASP HB3        4.02
 59 ALA  HA  63 LEU   HN       4.93
 59 ALA  HA  63 LEU QQD        5.61
 59 ALA   O  63 LEU   HN       2.00
 59 ALA   O  63 LEU   N        3.00
 59 ALA  QB  60 ILE   HN       3.92
 59 ALA  QB  60 ILE  HA        5.48
 59 ALA  QB  60 ILE QG1        4.21
 59 ALA  QB  62 ASP   HN       5.16
 59 ALA  QB  63 LEU  HA        5.77
 59 ALA  QB  63 LEU QQD        4.33
 60 ILE   HN 60 ILE  HB        3.34
 60 ILE   HN 60 ILE QD1        4.51
 60 ILE   HN 60 ILE QG1        4.11
 60 ILE   HN 60 ILE QG2        5.27
 60 ILE   HN 61 GLN   HN       3.76
 60 ILE   HN 61 GLN  QB        5.80
 60 ILE  HA  60 ILE QD1        4.90
 60 ILE  HA  60 ILE QG1        3.57
 60 ILE  HA  60 ILE QG2        3.95
 60 ILE  HA  61 GLN  HA        5.80
 60 ILE  HA  63 LEU HB3        5.80
 60 ILE  HA  64 TRP   HN       5.80
 60 ILE  HB  60 ILE QD1        4.12
 60 ILE  HB  61 GLN   HN       3.84
 60 ILE   O  64 TRP   HN       2.00
 60 ILE   O  64 TRP   N        3.00
 60 ILE QD1  61 GLN   HN       5.59
 60 ILE QD1  61 GLN  QB        5.80
 60 ILE QD1  61 GLN  QG        5.70
 60 ILE QG1  61 GLN   HN       5.80
 60 ILE QG1  61 GLN  QG        5.75
 60 ILE QG2  60 ILE QD1        3.65
 60 ILE QG2  60 ILE QG1        3.53
 60 ILE QG2  61 GLN   HN       4.64
 60 ILE QG2  61 GLN  HA        5.07
 60 ILE QG2  62 ASP   HN       5.73
 60 ILE QG2  64 TRP   HN       5.44
 60 ILE QG2  64 TRP HB3        5.80
 61 GLN   HN 61 GLN HG2        3.89
 61 GLN   HN 61 GLN HG3        4.75
 61 GLN   HN 61 GLN  QB        3.26
 61 GLN   HN 61 GLN  QG        4.39
 61 GLN  HA  65 GLN   HN       5.67
 61 GLN  HA  65 GLN HE21        4.71
 61 GLN HE21  62 ASP HB3        5.80
 61 GLN HE22  62 ASP HB3        5.16
 61 GLN HG3  61 GLN HE21        4.02
 61 GLN HG3  62 ASP   HN       4.83
 61 GLN   O  65 GLN   HN       2.00
 61 GLN   O  65 GLN   N        3.00
 61 GLN  QB  61 GLN HE21        4.92
 61 GLN  QB  61 GLN HE22        5.49
 61 GLN  QB  62 ASP   HN       4.42
 61 GLN  QB  62 ASP  HA        5.12
 61 GLN  QB  65 GLN   HN       5.80
 61 GLN  QB  65 GLN HE21        4.44
 61 GLN  QB  65 GLN HE22        4.95
 62 ASP   HN 62 ASP HB2        3.50
 62 ASP   HN 62 ASP HB3        4.03
 62 ASP   HN 63 LEU   HN       3.79
 62 ASP   HN 63 LEU HB2        5.80
 62 ASP   HN 63 LEU HB3        5.62
 62 ASP   HN 63 LEU QQD        5.78
 62 ASP   HN 64 TRP   HN       5.71
 62 ASP   HN 65 GLN HE21        5.80
 62 ASP  HA  64 TRP   HN       5.80
 62 ASP  HA  65 GLN HB2        4.84
 62 ASP  HA  65 GLN HB3        5.11
 62 ASP  HA  66 TRP HB2        5.80
 62 ASP HB2  63 LEU   HN       4.25
 62 ASP HB2  63 LEU HB2        5.80
 62 ASP HB2  63 LEU QQD        5.54
 62 ASP HB3  63 LEU   HN       4.16
 62 ASP HB3  65 GLN   HN       5.80
 62 ASP   O  66 TRP   HN       2.00
 62 ASP   O  66 TRP   N        3.00
 63 LEU   HN 63 LEU HB2        3.74
 63 LEU   HN 63 LEU  HG        4.78
 63 LEU   HN 64 TRP   HN       3.61
 63 LEU   HN 64 TRP HB2        5.76
 63 LEU  HA  63 LEU QQD        3.64
 63 LEU  HA  65 GLN   HN       5.09
 63 LEU  HA  66 TRP   HN       4.35
 63 LEU  HA  66 TRP HB2        4.29
 63 LEU  HA  66 TRP HB3        4.72
 63 LEU  HA  67 ARG   HN       5.34
 63 LEU HB2  63 LEU QQD        4.20
 63 LEU HB2  64 TRP   HN       4.24
 63 LEU HB3  63 LEU QQD        3.89
 63 LEU HB3  64 TRP   HN       4.77
 63 LEU  HG  64 TRP   HN       5.65
 63 LEU   O  67 ARG   HN       2.00
 63 LEU   O  67 ARG   N        3.00
 63 LEU QQD  64 TRP   HN       5.80
 64 TRP   HN 64 TRP HB2        3.66
 64 TRP   HN 64 TRP HB3        3.94
 64 TRP   HN 65 GLN   HN       4.03
 64 TRP   HN 65 GLN HE21        5.01
 64 TRP   HN 65 GLN HE22        5.80
 64 TRP   HN 66 TRP   HN       5.55
 64 TRP   HN 67 ARG   HN       5.80
 64 TRP  HA  66 TRP   HN       5.80
 64 TRP  HA  68 LYS   HN       5.16
 64 TRP HB2  65 GLN   HN       4.70
 64 TRP HB2  65 GLN HE21        5.80
 64 TRP HB2  65 GLN HE22        4.77
 64 TRP HB3  65 GLN   HN       5.12
 64 TRP HB3  65 GLN HE21        5.37
 64 TRP HB3  65 GLN HE22        4.93
 64 TRP   O  68 LYS   HN       2.00
 64 TRP   O  68 LYS   N        3.00
 65 GLN   HN 65 GLN HB2        3.50
 65 GLN   HN 65 GLN HE21        5.80
 65 GLN   HN 65 GLN HE22        4.96
 65 GLN   HN 65 GLN  QG        4.45
 65 GLN   HN 66 TRP   HN       4.09
 65 GLN  HA  65 GLN HE22        5.71
 65 GLN  HA  67 ARG   HN       5.80
 65 GLN  HA  68 LYS   HN       5.45
 65 GLN  HA  68 LYS HB3        5.80
 65 GLN  HA  68 LYS  QG        5.80
 65 GLN HB2  65 GLN HE21        5.12
 65 GLN HB2  66 TRP   HN       4.94
 65 GLN HB2  66 TRP  HA        5.80
 65 GLN HB3  65 GLN HE21        5.80
 65 GLN HB3  66 TRP   HN       4.84
 65 GLN   O  69 SER   HN       2.00
 65 GLN   O  69 SER   N        3.00
 65 GLN  QG  65 GLN HE21        3.86
 65 GLN  QG  66 TRP   HN       4.79
 66 TRP   HN 66 TRP HB2        3.59
 66 TRP   HN 66 TRP HB3        3.72
 66 TRP   HN 67 ARG   HN       3.54
 66 TRP HB2  67 ARG   HN       4.03
 66 TRP HB3  67 ARG   HN       4.84
 67 ARG   HN 68 LYS   HN       4.13
 67 ARG   HN 68 LYS HB3        5.80
 67 ARG   HN 69 SER   HN       5.59
 68 LYS   HN 68 LYS  QE        5.52
 68 LYS   HN 68 LYS  QG        4.22
 68 LYS   HN 69 SER   HN       3.93
 68 LYS  HA  68 LYS  QE        4.93
 68 LYS  HA  70 LEU   HN       5.52
 68 LYS HB2  68 LYS  QE        4.44
 68 LYS HB2  69 SER   HN       5.80
 68 LYS HB3  68 LYS  QE        5.67
 68 LYS HB3  69 SER   HN       5.33
 69 SER   HN 70 LEU   HN       4.01
 69 SER   HN 70 LEU  QB        5.80
 69 SER   HN 70 LEU QD1        5.23
 69 SER  HA  70 LEU  HA        5.80
 69 SER  HA  70 LEU  QB        5.16
 69 SER HB2  70 LEU   HN       5.80
 69 SER HB3  70 LEU   HN       5.61
 70 LEU   HN 70 LEU  HG        4.23
 70 LEU   HN 70 LEU  QB        3.42
 70 LEU   HN 70 LEU QD1        4.63
 70 LEU   HN 70 LEU QD2        4.70
 70 LEU  HA  70 LEU QD1        4.82
 70 LEU  HA  70 LEU QD2        3.62
 70 LEU  QB  70 LEU QD1        3.85
 70 LEU  QB  70 LEU QD2        4.13
   1 GLN   CHI1   -335.0   -25.0
   1 GLN   CHI1   -205.0    95.0
   1 GLN   PSI     -85.0   195.0
   2 GLU   PHI    -315.0   -45.0
   2 GLU   PHI    -185.0    75.0
   2 GLU   CHI1   -335.0   -25.0
   2 GLU   CHI1   -205.0    95.0
   2 GLU   PSI     -85.0   195.0
   3 SER   PHI    -315.0   -45.0
   3 SER   PHI    -185.0    75.0
   3 SER   PSI     -85.0   205.0
   4 PHE   PHI    -315.0   -45.0
   4 PHE   PHI    -185.0    75.0
   4 PHE   CHI1   -335.0   -25.0
   4 PHE   CHI1   -205.0    95.0
   4 PHE   PSI     -85.0   195.0
   5 LYS   PHI    -315.0   -45.0
   5 LYS   PHI    -185.0    75.0
   5 LYS   CHI1   -335.0   -25.0
   5 LYS   CHI1   -205.0    95.0
   5 LYS   PSI     -85.0   195.0
   6 LYS   PHI    -315.0   -45.0
   6 LYS   PHI    -185.0    75.0
   6 LYS   CHI1   -335.0   -25.0
   6 LYS   CHI1   -205.0    95.0
   6 LYS   PSI     -85.0   205.0
   7 GLN   PHI    -315.0   -45.0
   7 GLN   PHI    -185.0    75.0
   7 GLN   CHI1   -335.0   -25.0
   7 GLN   CHI1   -205.0    95.0
   7 GLN   PSI     -85.0   195.0
   8 GLU   PHI    -315.0   -45.0
   8 GLU   PHI    -185.0    75.0
   8 GLU   CHI1   -335.0   -25.0
   8 GLU   CHI1   -205.0    95.0
   8 GLU   PSI     -85.0   195.0
   9 LYS   PHI    -315.0   -45.0
   9 LYS   PHI    -185.0    75.0
   9 LYS   CHI1   -335.0   -25.0
   9 LYS   CHI1   -205.0    95.0
   9 LYS   PSI     -85.0   195.0
  10 THR   PHI      45.0   285.0
  10 THR   PHI    -185.0    75.0
  10 THR   CHI1   -205.0    75.0
  10 THR   CHI1    -65.0   185.0
  10 THR   PSI      55.0   165.0
  10 THR   PSI    -215.0    85.0
  11 PRO   PSI    -295.0    -5.0
  11 PRO   PSI     -55.0   195.0
  12 LYS   PHI    -315.0   -45.0
  12 LYS   PHI    -185.0    75.0
  12 LYS   CHI1   -335.0   -25.0
  12 LYS   CHI1   -205.0    95.0
  12 LYS   PSI     -85.0   195.0
  13 THR   PHI    -315.0   -45.0
  13 THR   PHI    -185.0    75.0
  13 THR   CHI1   -205.0    75.0
  13 THR   CHI1    -65.0   185.0
  13 THR   PSI      55.0   165.0
  13 THR   PSI    -215.0    85.0
  14 PRO   PSI    -295.0    -5.0
  14 PRO   PSI     -55.0   195.0
  15 LYS   PHI    -315.0   -45.0
  15 LYS   PHI    -185.0    75.0
  15 LYS   CHI1   -335.0   -25.0
  15 LYS   CHI1   -205.0    95.0
  15 LYS   PSI     -85.0   205.0
  16 GLY   PHI      45.0   295.0
  16 GLY   PSI      55.0   295.0
  16 GLY   PSI    -205.0    85.0
  16 GLY   PSI     -95.0   205.0
  17 PRO   PSI    -295.0    -5.0
  17 PRO   PSI    -225.0    75.0
  17 PRO   PSI     -55.0   195.0
  18 SER   PHI    -315.0   -45.0
  18 SER   PHI    -185.0    75.0
  18 SER   PSI     -85.0   205.0
  19 SER   PHI    -315.0   -45.0
  19 SER   PHI    -185.0    75.0
  19 SER   PSI     -85.0   205.0
  20 VAL   PHI    -315.0   -45.0
  20 VAL   PHI    -185.0    75.0
  20 VAL   CHI1   -315.0   -45.0
  20 VAL   CHI1   -195.0    85.0
  20 VAL   CHI1    -95.0   205.0
  20 VAL   PSI     -85.0   195.0
  21 GLU   PHI    -315.0   -45.0
  21 GLU   PHI    -185.0    75.0
  21 GLU   CHI1   -335.0   -25.0
  21 GLU   CHI1   -205.0    95.0
  21 GLU   PSI     -85.0   105.0
  22 ASP   PHI    -315.0   -45.0
  22 ASP   PHI    -185.0    75.0
  22 ASP   CHI1   -225.0   115.0
  22 ASP   PSI     -85.0   205.0
  23 ILE   PHI    -315.0   -45.0
  23 ILE   PHI    -185.0    75.0
  23 ILE   CHI1   -335.0   -25.0
  23 ILE   CHI1   -195.0    85.0
  23 ILE   CHI1    -75.0   205.0
  23 ILE   PSI     -85.0   125.0
  24 LYS   PHI    -185.0   -45.0
  24 LYS   CHI1   -335.0   -25.0
  24 LYS   CHI1   -205.0    75.0
  24 LYS   PSI     -85.0     5.0
  25 ALA   PHI    -315.0   -45.0
  25 ALA   PHI    -185.0    75.0
  25 ALA   PSI     -85.0   125.0
  26 LYS   PHI    -315.0   -45.0
  26 LYS   PHI    -185.0    75.0
  26 LYS   CHI1   -335.0   -25.0
  26 LYS   CHI1   -205.0    95.0
  26 LYS   PSI     -85.0   105.0
  27 MET   PHI    -315.0   -45.0
  27 MET   PHI    -185.0    75.0
  27 MET   CHI1   -335.0   -25.0
  27 MET   CHI1   -205.0    95.0
  27 MET   PSI     -85.0   125.0
  28 GLN   PHI    -185.0   -45.0
  28 GLN   CHI1   -335.0   -25.0
  28 GLN   CHI1   -205.0    95.0
  28 GLN   PSI     -85.0    15.0
  29 ALA   PHI    -315.0   -45.0
  29 ALA   PHI    -185.0    75.0
  29 ALA   PSI     -85.0   125.0
  30 SER   PHI    -315.0   -45.0
  30 SER   PHI    -185.0    75.0
  30 SER   PSI     -85.0   205.0
  31 ILE   PHI    -165.0   -45.0
  31 ILE   CHI1   -195.0   -25.0
  31 ILE   CHI1    -75.0   205.0
  31 ILE   PSI     -85.0    35.0
  32 GLU   PHI    -315.0   -45.0
  32 GLU   PHI    -185.0    75.0
  32 GLU   CHI1   -335.0   -25.0
  32 GLU   CHI1   -205.0    95.0
  32 GLU   PSI     -85.0   115.0
  33 LYS   PHI    -315.0   -45.0
  33 LYS   PHI    -185.0    75.0
  33 LYS   CHI1   -335.0   -25.0
  33 LYS   CHI1   -205.0    95.0
  33 LYS   PSI     -85.0   205.0
  34 GLY   PHI    -315.0   -45.0
  34 GLY   PSI    -115.0   115.0
  35 GLY   PHI    -315.0   -45.0
  36 SER   PHI    -315.0   -45.0
  36 SER   PHI    -185.0    75.0
  36 SER   PSI      -5.0   205.0
  37 LEU   PHI    -315.0   -45.0
  37 LEU   PHI    -185.0    75.0
  37 LEU   CHI1   -265.0    85.0
  37 LEU   CHI1   -195.0   105.0
  37 LEU   PSI      55.0   165.0
  37 LEU   PSI    -215.0    85.0
  38 PRO   PSI    -295.0    -5.0
  38 PRO   PSI     -55.0   195.0
  39 LYS   PHI    -315.0   -45.0
  39 LYS   PHI    -185.0    75.0
  39 LYS   CHI1   -335.0   -25.0
  39 LYS   CHI1   -205.0    95.0
  39 LYS   PSI     -85.0   195.0
  40 VAL   PHI    -315.0   -45.0
  40 VAL   PHI    -185.0    75.0
  40 VAL   CHI1   -315.0   -45.0
  40 VAL   CHI1   -195.0    85.0
  40 VAL   CHI1    -95.0   205.0
  40 VAL   PSI     -15.0   195.0
  41 GLU   PHI    -185.0   -45.0
  41 GLU   CHI1   -335.0   -25.0
  41 GLU   CHI1   -205.0    85.0
  41 GLU   PSI    -235.0    -5.0
  41 GLU   PSI    -205.0   135.0
  41 GLU   PSI     -85.0   195.0
  42 ALA   PHI    -315.0   -45.0
  42 ALA   PHI    -185.0    75.0
  42 ALA   PSI     -85.0   125.0
  43 LYS   PHI    -315.0   -45.0
  43 LYS   PHI    -185.0    75.0
  43 LYS   CHI1   -335.0   -25.0
  43 LYS   CHI1   -205.0    95.0
  43 LYS   PSI     -85.0    95.0
  44 PHE   PHI    -315.0   -45.0
  44 PHE   PHI    -185.0    75.0
  44 PHE   CHI1   -335.0   -25.0
  44 PHE   CHI1   -205.0    95.0
  44 PHE   PSI    -285.0    45.0
  44 PHE   PSI     -85.0   195.0
  45 ILE   PHI    -155.0   -45.0
  45 ILE   CHI1    -75.0   -25.0
  45 ILE   PSI     -85.0    -5.0
  46 ASN   PHI    -315.0   -45.0
  46 ASN   PHI    -185.0    75.0
  46 ASN   CHI1   -225.0   115.0
  46 ASN   PSI     -85.0   125.0
  47 TYR   PHI    -315.0   -45.0
  47 TYR   PHI    -185.0    75.0
  47 TYR   CHI1   -335.0   -25.0
  47 TYR   CHI1   -205.0    95.0
  47 TYR   PSI     -85.0   135.0
  48 VAL   PHI    -175.0   -45.0
  48 VAL   CHI1   -315.0   -45.0
  48 VAL   CHI1   -195.0    85.0
  48 VAL   CHI1    -85.0   205.0
  48 VAL   PSI    -265.0    15.0
  48 VAL   PSI     -85.0   195.0
  49 LYS   PHI    -315.0   -45.0
  49 LYS   PHI    -185.0    75.0
  49 LYS   CHI1   -335.0   -25.0
  49 LYS   CHI1   -205.0    95.0
  49 LYS   PSI     -85.0   105.0
  50 ASN   PHI    -315.0   -45.0
  50 ASN   PHI    -185.0    75.0
  50 ASN   CHI1   -225.0   115.0
  50 ASN   PSI     -85.0   135.0
  51 CYS   PHI    -315.0   -45.0
  51 CYS   PHI    -185.0    75.0
  51 CYS   CHI1   -335.0   -25.0
  51 CYS   CHI1   -205.0    85.0
  51 CYS   PSI     -85.0   195.0
  52 PHE   PHI    -315.0   -45.0
  52 PHE   PHI    -185.0    75.0
  52 PHE   CHI1   -335.0   -25.0
  52 PHE   CHI1   -205.0    95.0
  52 PHE   PSI     -85.0   195.0
  53 ARG   PHI    -315.0   -45.0
  53 ARG   PHI    -185.0    75.0
  53 ARG   CHI1   -335.0   -25.0
  53 ARG   CHI1   -205.0    95.0
  53 ARG   PSI     -85.0   135.0
  54 MET   PHI    -315.0   -45.0
  54 MET   PHI    -185.0    75.0
  54 MET   CHI1   -335.0   -25.0
  54 MET   CHI1   -205.0    95.0
  54 MET   PSI     -85.0   195.0
  55 THR   PHI    -315.0   -45.0
  55 THR   PHI    -185.0    75.0
  55 THR   CHI1   -215.0    95.0
  55 THR   CHI1    -75.0   205.0
  55 THR   PSI     -85.0   125.0
  56 ASP   PHI    -315.0   -45.0
  56 ASP   PHI    -185.0    65.0
  56 ASP   CHI1   -225.0   115.0
  56 ASP   PSI       5.0   205.0
  57 GLN   PHI    -185.0   -45.0
  57 GLN   CHI1     35.0   305.0
  57 GLN   CHI1   -205.0    45.0
  57 GLN   PSI     -85.0   -15.0
  58 GLU   PHI    -185.0   -45.0
  58 GLU   CHI1   -335.0   -25.0
  58 GLU   CHI1   -205.0    55.0
  58 GLU   PSI     -85.0     5.0
  59 ALA   PHI    -315.0   -45.0
  59 ALA   PHI    -185.0    75.0
  59 ALA   PSI     -85.0    95.0
  60 ILE   PHI    -155.0   -45.0
  60 ILE   CHI1    -75.0   -25.0
  60 ILE   PSI     -85.0     5.0
  61 GLN   PHI    -315.0   -45.0
  61 GLN   PHI    -185.0    75.0
  61 GLN   CHI1   -335.0   -25.0
  61 GLN   CHI1   -205.0    95.0
  61 GLN   PSI     -85.0   195.0
  62 ASP   PHI    -185.0   -45.0
  62 ASP   CHI1   -335.0     5.0
  62 ASP   CHI1   -225.0    85.0
  62 ASP   PSI     -85.0    15.0
  63 LEU   PHI    -315.0   -45.0
  63 LEU   PHI    -185.0    75.0
  63 LEU   CHI1   -225.0   105.0
  63 LEU   PSI     -85.0    35.0
  64 TRP   PHI    -185.0   -45.0
  64 TRP   CHI1   -335.0   -25.0
  64 TRP   CHI1   -205.0    95.0
  64 TRP   PSI     -85.0    25.0
  65 GLN   PHI    -315.0   -45.0
  65 GLN   PHI    -185.0    75.0
  65 GLN   CHI1   -325.0   -25.0
  65 GLN   CHI1   -205.0    95.0
  65 GLN   PSI     -85.0   125.0
  66 TRP   PHI    -185.0   -45.0
  66 TRP   CHI1   -285.0   -35.0
  66 TRP   CHI1   -205.0    95.0
  66 TRP   PSI     -85.0    15.0
  67 ARG   PHI    -315.0   -45.0
  67 ARG   PHI    -185.0    75.0
  67 ARG   CHI1   -335.0   -25.0
  67 ARG   CHI1   -205.0    95.0
  67 ARG   PSI     -85.0   135.0
  68 LYS   PHI    -315.0   -45.0
  68 LYS   PHI    -185.0    65.0
  68 LYS   CHI1   -335.0   -25.0
  68 LYS   CHI1   -205.0    95.0
  68 LYS   PSI    -285.0    45.0
  68 LYS   PSI     -85.0   115.0
  69 SER   PHI    -315.0   -45.0
  69 SER   PHI    -185.0    75.0
  69 SER   PSI     -85.0   135.0
  70 LEU   PHI    -315.0   -45.0
  70 LEU   PHI    -185.0    75.0
  70 LEU   CHI1   -225.0   105.0

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    GLN   1           H1       GLN   1 -26.913 -21.535  19.963
    2    HA   GLN   1           HA       GLN   1 -27.508 -19.308  19.251
    3    HB2  GLN   1           HB2      GLN   1 -26.147 -19.265  17.155
    4    HB3  GLN   1           HB3      GLN   1 -25.372 -19.990  18.557
    5    HG2  GLN   1           HG2      GLN   1 -25.815 -22.260  17.660
    6    HG3  GLN   1           HG3      GLN   1 -26.604 -21.556  16.242
    7   HE21  GLN   1          HE21      GLN   1 -24.291 -23.302  16.146
    8   HE22  GLN   1          HE22      GLN   1 -22.900 -22.302  15.685
    9    H    GLU   2           H        GLU   2 -28.471 -17.921  17.642
   10    HA   GLU   2           HA       GLU   2 -30.730 -19.176  16.164
   11    HB2  GLU   2           HB2      GLU   2 -31.173 -18.968  18.656
   12    HB3  GLU   2           HB3      GLU   2 -31.120 -17.216  18.465
   13    HG2  GLU   2           HG2      GLU   2 -33.098 -17.222  17.102
   14    HG3  GLU   2           HG3      GLU   2 -32.978 -18.964  16.806
   15    H    SER   3           H        SER   3 -31.996 -17.788  14.894
   16    HA   SER   3           HA       SER   3 -30.635 -15.296  13.995
   17    HB2  SER   3           HB2      SER   3 -31.405 -15.754  11.782
   18    HB3  SER   3           HB3      SER   3 -30.573 -17.186  12.402
   19    HG   SER   3           HG       SER   3 -32.648 -18.061  12.926
   20    H    PHE   4           H        PHE   4 -31.757 -13.568  13.294
   21    HA   PHE   4           HA       PHE   4 -34.700 -13.408  13.538
   22    HB2  PHE   4           HB2      PHE   4 -34.815 -11.897  15.211
   23    HB3  PHE   4           HB3      PHE   4 -33.307 -12.673  15.681
   24    HD1  PHE   4           HD2      PHE   4 -31.104 -11.520  15.310
   25    HD2  PHE   4           HD1      PHE   4 -34.884  -9.585  14.541
   26    HE1  PHE   4           HE2      PHE   4 -29.975  -9.311  15.284
   27    HE2  PHE   4           HE1      PHE   4 -33.751  -7.373  14.547
   28    HZ   PHE   4           HZ       PHE   4 -31.291  -7.234  14.912
   29    H    LYS   5           H        LYS   5 -31.653 -11.829  12.670
   30    HA   LYS   5           HA       LYS   5 -31.002 -10.674  10.811
   31    HB2  LYS   5           HB2      LYS   5 -31.313 -13.176  10.584
   32    HB3  LYS   5           HB3      LYS   5 -32.736 -12.841   9.613
   33    HG2  LYS   5           HG2      LYS   5 -31.367 -11.615   7.966
   34    HG3  LYS   5           HG3      LYS   5 -29.932 -11.779   8.999
   35    HD2  LYS   5           HD2      LYS   5 -30.112 -14.264   8.750
   36    HD3  LYS   5           HD3      LYS   5 -31.435 -14.031   7.596
   37    HE2  LYS   5           HE2      LYS   5 -28.570 -12.996   7.318
   38    HE3  LYS   5           HE3      LYS   5 -29.244 -14.405   6.491
   39    HZ1  LYS   5           HZ1      LYS   5 -30.056 -11.580   6.096
   40    HZ2  LYS   5           HZ2      LYS   5 -30.884 -12.847   5.463
   41    HZ3  LYS   5           HZ3      LYS   5 -29.338 -12.558   4.996
   42    H    LYS   6           H        LYS   6 -33.117  -9.232  11.841
   43    HA   LYS   6           HA       LYS   6 -34.887  -8.519   9.584
   44    HB2  LYS   6           HB2      LYS   6 -35.511  -9.073  12.115
   45    HB3  LYS   6           HB3      LYS   6 -35.140  -7.375  12.366
   46    HG2  LYS   6           HG2      LYS   6 -37.489  -7.610  12.025
   47    HG3  LYS   6           HG3      LYS   6 -36.858  -6.794  10.600
   48    HD2  LYS   6           HD2      LYS   6 -36.980  -9.791  10.430
   49    HD3  LYS   6           HD3      LYS   6 -38.539  -8.992  10.594
   50    HE2  LYS   6           HE2      LYS   6 -38.293  -7.742   8.608
   51    HE3  LYS   6           HE3      LYS   6 -36.557  -8.072   8.486
   52    HZ1  LYS   6           HZ1      LYS   6 -37.050 -10.373   8.007
   53    HZ2  LYS   6           HZ2      LYS   6 -37.952  -9.462   6.986
   54    HZ3  LYS   6           HZ3      LYS   6 -38.648 -10.168   8.301
   55    H    GLN   7           H        GLN   7 -32.289  -7.076  11.372
   56    HA   GLN   7           HA       GLN   7 -32.249  -4.767   9.545
   57    HB2  GLN   7           HB2      GLN   7 -32.372  -4.408  12.568
   58    HB3  GLN   7           HB3      GLN   7 -31.961  -3.155  11.389
   59    HG2  GLN   7           HG2      GLN   7 -34.253  -3.366  10.413
   60    HG3  GLN   7           HG3      GLN   7 -34.650  -4.564  11.653
   61   HE21  GLN   7          HE21      GLN   7 -36.430  -2.995  12.236
   62   HE22  GLN   7          HE22      GLN   7 -35.986  -1.649  13.262
   63    H    GLU   8           H        GLU   8 -30.635  -5.694  12.655
   64    HA   GLU   8           HA       GLU   8 -28.492  -5.789  13.269
   65    HB2  GLU   8           HB2      GLU   8 -28.029  -7.225  10.643
   66    HB3  GLU   8           HB3      GLU   8 -26.935  -7.192  12.023
   67    HG2  GLU   8           HG2      GLU   8 -28.697  -8.260  13.427
   68    HG3  GLU   8           HG3      GLU   8 -29.716  -8.427  11.995
   69    H    LYS   9           H        LYS   9 -29.199  -3.340  12.306
   70    HA   LYS   9           HA       LYS   9 -28.609  -1.389  11.369
   71    HB2  LYS   9           HB2      LYS   9 -26.618  -0.402  12.138
   72    HB3  LYS   9           HB3      LYS   9 -27.241  -1.450  13.395
   73    HG2  LYS   9           HG2      LYS   9 -25.537  -3.113  12.976
   74    HG3  LYS   9           HG3      LYS   9 -24.976  -2.256  11.522
   75    HD2  LYS   9           HD2      LYS   9 -24.487  -0.278  13.101
   76    HD3  LYS   9           HD3      LYS   9 -24.701  -1.417  14.436
   77    HE2  LYS   9           HE2      LYS   9 -22.706  -1.661  12.132
   78    HE3  LYS   9           HE3      LYS   9 -22.324  -1.081  13.748
   79    HZ1  LYS   9           HZ1      LYS   9 -23.034  -3.357  14.552
   80    HZ2  LYS   9           HZ2      LYS   9 -21.694  -3.334  13.599
   81    HZ3  LYS   9           HZ3      LYS   9 -23.137  -3.831  12.995
   82    H    THR  10           H        THR  10 -26.266  -0.351  10.164
   83    HA   THR  10           HA       THR  10 -26.499  -1.592   7.478
   84    HB   THR  10           HB       THR  10 -25.577   0.516   6.629
   85    HG1  THR  10           HG1      THR  10 -25.341   2.219   7.928
   86   HG21  THR  10          HG21      THR  10 -28.049   0.212   6.844
   87   HG22  THR  10          HG22      THR  10 -27.541   1.903   6.991
   88   HG23  THR  10          HG23      THR  10 -27.984   0.986   8.443
   89    HA   PRO  11           HA       PRO  11 -22.212  -2.853   7.663
   90    HB2  PRO  11           HB2      PRO  11 -22.109  -2.243   4.715
   91    HB3  PRO  11           HB3      PRO  11 -21.596  -3.725   5.580
   92    HG2  PRO  11           HG2      PRO  11 -23.930  -3.686   4.205
   93    HG3  PRO  11           HG3      PRO  11 -23.861  -4.450   5.827
   94    HD2  PRO  11           HD2      PRO  11 -24.819  -1.656   5.112
   95    HD3  PRO  11           HD3      PRO  11 -25.610  -2.901   6.129
   96    H    LYS  12           H        LYS  12 -20.219  -1.882   7.921
   97    HA   LYS  12           HA       LYS  12 -19.368   0.358   6.292
   98    HB2  LYS  12           HB2      LYS  12 -20.713   1.566   8.050
   99    HB3  LYS  12           HB3      LYS  12 -19.641   0.922   9.279
  100    HG2  LYS  12           HG2      LYS  12 -19.114   3.247   8.717
  101    HG3  LYS  12           HG3      LYS  12 -17.759   2.179   8.401
  102    HD2  LYS  12           HD2      LYS  12 -18.012   3.917   6.673
  103    HD3  LYS  12           HD3      LYS  12 -18.130   2.297   6.009
  104    HE2  LYS  12           HE2      LYS  12 -19.759   3.668   4.922
  105    HE3  LYS  12           HE3      LYS  12 -20.607   2.495   5.924
  106    HZ1  LYS  12           HZ1      LYS  12 -21.502   4.773   6.077
  107    HZ2  LYS  12           HZ2      LYS  12 -20.112   5.322   6.738
  108    HZ3  LYS  12           HZ3      LYS  12 -21.036   4.217   7.543
  109    H    THR  13           H        THR  13 -18.657  -1.390   9.298
  110    HA   THR  13           HA       THR  13 -16.825  -2.274  10.207
  111    HB   THR  13           HB       THR  13 -17.600  -3.965   8.778
  112    HG1  THR  13           HG1      THR  13 -15.883  -4.358  10.059
  113   HG21  THR  13          HG21      THR  13 -16.531  -4.653   6.711
  114   HG22  THR  13          HG22      THR  13 -15.571  -3.165   6.668
  115   HG23  THR  13          HG23      THR  13 -17.340  -3.096   6.519
  116    HA   PRO  14           HA       PRO  14 -13.423   0.658   9.184
  117    HB2  PRO  14           HB2      PRO  14 -13.091   1.740  11.662
  118    HB3  PRO  14           HB3      PRO  14 -14.341   2.309  10.514
  119    HG2  PRO  14           HG2      PRO  14 -14.675   0.346  12.807
  120    HG3  PRO  14           HG3      PRO  14 -15.688   1.772  12.422
  121    HD2  PRO  14           HD2      PRO  14 -16.368  -0.752  11.652
  122    HD3  PRO  14           HD3      PRO  14 -16.724   0.664  10.620
  123    H    LYS  15           H        LYS  15 -11.255   0.217   9.511
  124    HA   LYS  15           HA       LYS  15 -10.310  -1.712  11.522
  125    HB2  LYS  15           HB2      LYS  15 -10.385  -2.399   8.550
  126    HB3  LYS  15           HB3      LYS  15  -9.152  -3.040   9.616
  127    HG2  LYS  15           HG2      LYS  15 -10.534  -4.772   9.801
  128    HG3  LYS  15           HG3      LYS  15 -11.186  -3.816  11.106
  129    HD2  LYS  15           HD2      LYS  15 -12.957  -4.834   9.806
  130    HD3  LYS  15           HD3      LYS  15 -13.048  -3.100   9.665
  131    HE2  LYS  15           HE2      LYS  15 -13.570  -4.121   7.565
  132    HE3  LYS  15           HE3      LYS  15 -12.083  -3.190   7.393
  133    HZ1  LYS  15           HZ1      LYS  15 -12.053  -6.123   7.887
  134    HZ2  LYS  15           HZ2      LYS  15 -10.817  -5.202   7.369
  135    HZ3  LYS  15           HZ3      LYS  15 -12.096  -5.507   6.381
  136    H    GLY  16           H        GLY  16  -8.244  -1.461  12.057
  137    HA2  GLY  16           HA2      GLY  16  -6.125  -0.446  10.319
  138    HA3  GLY  16           HA3      GLY  16  -6.648   0.741  11.499
  139    HA   PRO  17           HA       PRO  17  -4.653  -2.908  14.074
  140    HB2  PRO  17           HB2      PRO  17  -3.150  -4.206  11.787
  141    HB3  PRO  17           HB3      PRO  17  -3.732  -4.951  13.313
  142    HG2  PRO  17           HG2      PRO  17  -5.199  -5.278  11.109
  143    HG3  PRO  17           HG3      PRO  17  -6.024  -4.751  12.615
  144    HD2  PRO  17           HD2      PRO  17  -5.086  -3.055  10.294
  145    HD3  PRO  17           HD3      PRO  17  -6.669  -3.060  11.100
  146    H    SER  18           H        SER  18  -2.087  -3.804  14.287
  147    HA   SER  18           HA       SER  18  -0.530  -1.332  14.650
  148    HB2  SER  18           HB2      SER  18   0.322  -4.147  15.368
  149    HB3  SER  18           HB3      SER  18   0.880  -2.621  16.059
  150    HG   SER  18           HG       SER  18  -1.374  -2.391  16.845
  151    H    SER  19           H        SER  19  -0.549  -3.919  12.363
  152    HA   SER  19           HA       SER  19   2.191  -3.280  11.321
  153    HB2  SER  19           HB2      SER  19   1.921  -5.358  12.776
  154    HB3  SER  19           HB3      SER  19   0.938  -6.032  11.468
  155    HG   SER  19           HG       SER  19   3.049  -6.667  11.259
  156    H    VAL  20           H        VAL  20   2.004  -5.214   9.188
  157    HA   VAL  20           HA       VAL  20   1.060  -3.521   7.125
  158    HB   VAL  20           HB       VAL  20   1.578  -6.509   6.885
  159   HG11  VAL  20          HG11      VAL  20   2.294  -5.904   4.569
  160   HG12  VAL  20          HG12      VAL  20   0.586  -5.600   4.844
  161   HG13  VAL  20          HG13      VAL  20   1.737  -4.242   4.851
  162   HG21  VAL  20          HG21      VAL  20   3.552  -4.192   6.725
  163   HG22  VAL  20          HG22      VAL  20   3.559  -5.511   7.915
  164   HG23  VAL  20          HG23      VAL  20   3.907  -5.864   6.223
  165    H    GLU  21           H        GLU  21  -0.804  -5.946   8.890
  166    HA   GLU  21           HA       GLU  21  -3.018  -6.070   7.087
  167    HB2  GLU  21           HB2      GLU  21  -2.810  -6.375  10.096
  168    HB3  GLU  21           HB3      GLU  21  -4.359  -6.496   9.242
  169    HG2  GLU  21           HG2      GLU  21  -3.447  -8.249   7.764
  170    HG3  GLU  21           HG3      GLU  21  -1.917  -8.203   8.630
  171    H    ASP  22           H        ASP  22  -2.050  -3.353   9.140
  172    HA   ASP  22           HA       ASP  22  -4.506  -1.796   8.805
  173    HB2  ASP  22           HB2      ASP  22  -2.849  -1.249  10.542
  174    HB3  ASP  22           HB3      ASP  22  -1.632  -0.925   9.306
  175    H    ILE  23           H        ILE  23  -1.396  -1.996   7.003
  176    HA   ILE  23           HA       ILE  23  -2.114  -0.147   4.985
  177    HB   ILE  23           HB       ILE  23  -0.241  -2.537   4.956
  178   HG12  ILE  23          HG12      ILE  23   0.388   0.424   4.725
  179   HG13  ILE  23          HG13      ILE  23   0.251  -0.399   6.280
  180   HG21  ILE  23          HG21      ILE  23  -0.989  -2.387   2.657
  181   HG22  ILE  23          HG22      ILE  23  -0.760  -0.618   2.656
  182   HG23  ILE  23          HG23      ILE  23   0.630  -1.707   2.768
  183   HD11  ILE  23          HD11      ILE  23   2.261  -1.166   4.119
  184   HD12  ILE  23          HD12      ILE  23   2.592  -0.231   5.576
  185   HD13  ILE  23          HD13      ILE  23   2.082  -1.918   5.720
  186    H    LYS  24           H        LYS  24  -2.728  -3.653   5.123
  187    HA   LYS  24           HA       LYS  24  -4.054  -3.795   2.600
  188    HB2  LYS  24           HB2      LYS  24  -3.089  -5.681   4.005
  189    HB3  LYS  24           HB3      LYS  24  -4.498  -5.557   5.054
  190    HG2  LYS  24           HG2      LYS  24  -4.728  -7.375   3.465
  191    HG3  LYS  24           HG3      LYS  24  -5.973  -6.157   3.174
  192    HD2  LYS  24           HD2      LYS  24  -4.930  -5.405   1.159
  193    HD3  LYS  24           HD3      LYS  24  -3.367  -6.106   1.610
  194    HE2  LYS  24           HE2      LYS  24  -4.294  -7.564  -0.070
  195    HE3  LYS  24           HE3      LYS  24  -4.450  -8.395   1.477
  196    HZ1  LYS  24           HZ1      LYS  24  -6.818  -7.545   1.516
  197    HZ2  LYS  24           HZ2      LYS  24  -6.478  -8.651   0.367
  198    HZ3  LYS  24           HZ3      LYS  24  -6.599  -7.063  -0.047
  199    H    ALA  25           H        ALA  25  -5.422  -3.209   5.850
  200    HA   ALA  25           HA       ALA  25  -8.178  -3.060   5.042
  201    HB1  ALA  25           HB1      ALA  25  -6.704  -1.737   7.371
  202    HB2  ALA  25           HB2      ALA  25  -8.458  -1.943   7.222
  203    HB3  ALA  25           HB3      ALA  25  -7.408  -3.364   7.380
  204    H    LYS  26           H        LYS  26  -5.614  -0.577   5.308
  205    HA   LYS  26           HA       LYS  26  -7.306   1.651   4.529
  206    HB2  LYS  26           HB2      LYS  26  -4.361   1.211   5.028
  207    HB3  LYS  26           HB3      LYS  26  -4.902   2.685   4.242
  208    HG2  LYS  26           HG2      LYS  26  -4.623   2.953   6.684
  209    HG3  LYS  26           HG3      LYS  26  -6.235   3.352   6.086
  210    HD2  LYS  26           HD2      LYS  26  -6.970   1.073   6.978
  211    HD3  LYS  26           HD3      LYS  26  -5.380   0.936   7.722
  212    HE2  LYS  26           HE2      LYS  26  -7.384   3.165   8.236
  213    HE3  LYS  26           HE3      LYS  26  -7.130   1.759   9.276
  214    HZ1  LYS  26           HZ1      LYS  26  -5.151   3.874   8.685
  215    HZ2  LYS  26           HZ2      LYS  26  -4.829   2.508   9.583
  216    HZ3  LYS  26           HZ3      LYS  26  -5.931   3.640  10.098
  217    H    MET  27           H        MET  27  -5.182  -0.531   2.663
  218    HA   MET  27           HA       MET  27  -5.558   0.662   0.099
  219    HB2  MET  27           HB2      MET  27  -5.290  -2.235   0.977
  220    HB3  MET  27           HB3      MET  27  -5.490  -1.781  -0.708
  221    HG2  MET  27           HG2      MET  27  -3.416  -0.660  -0.787
  222    HG3  MET  27           HG3      MET  27  -3.245  -0.638   0.961
  223    HE1  MET  27           HE1      MET  27  -3.637  -3.199  -2.103
  224    HE2  MET  27           HE2      MET  27  -3.019  -4.690  -1.356
  225    HE3  MET  27           HE3      MET  27  -4.546  -3.989  -0.798
  226    H    GLN  28           H        GLN  28  -7.729  -1.651   1.904
  227    HA   GLN  28           HA       GLN  28  -9.725  -1.673  -0.178
  228    HB2  GLN  28           HB2      GLN  28 -10.340  -1.976   2.776
  229    HB3  GLN  28           HB3      GLN  28 -11.310  -2.474   1.405
  230    HG2  GLN  28           HG2      GLN  28  -8.915  -3.796   2.607
  231    HG3  GLN  28           HG3      GLN  28 -10.465  -4.475   2.157
  232   HE21  GLN  28          HE21      GLN  28  -7.228  -4.064   1.223
  233   HE22  GLN  28          HE22      GLN  28  -7.393  -4.741  -0.418
  234    H    ALA  29           H        ALA  29  -9.348   0.454   2.714
  235    HA   ALA  29           HA       ALA  29 -11.680   1.996   2.266
  236    HB1  ALA  29           HB1      ALA  29 -10.620   3.656   3.724
  237    HB2  ALA  29           HB2      ALA  29 -10.354   2.020   4.357
  238    HB3  ALA  29           HB3      ALA  29  -9.043   2.880   3.514
  239    H    SER  30           H        SER  30  -8.338   2.579   0.950
  240    HA   SER  30           HA       SER  30  -9.036   4.932  -0.499
  241    HB2  SER  30           HB2      SER  30  -6.932   2.847  -1.180
  242    HB3  SER  30           HB3      SER  30  -7.036   4.481  -1.854
  243    HG   SER  30           HG       SER  30  -7.100   4.910   0.688
  244    H    ILE  31           H        ILE  31  -9.121   1.482  -1.627
  245    HA   ILE  31           HA       ILE  31 -10.008   2.341  -4.254
  246    HB   ILE  31           HB       ILE  31  -8.527   0.376  -3.718
  247   HG12  ILE  31          HG12      ILE  31 -10.854  -0.227  -5.568
  248   HG13  ILE  31          HG13      ILE  31  -9.557   0.913  -5.946
  249   HG21  ILE  31          HG21      ILE  31  -9.482  -1.765  -3.183
  250   HG22  ILE  31          HG22      ILE  31 -10.051  -0.611  -1.980
  251   HG23  ILE  31          HG23      ILE  31 -11.139  -1.133  -3.271
  252   HD11  ILE  31          HD11      ILE  31  -9.236  -2.080  -5.475
  253   HD12  ILE  31          HD12      ILE  31  -9.085  -1.208  -7.008
  254   HD13  ILE  31          HD13      ILE  31  -7.892  -0.937  -5.724
  255    H    GLU  32           H        GLU  32 -11.770   1.694  -1.366
  256    HA   GLU  32           HA       GLU  32 -14.361   1.550  -2.833
  257    HB2  GLU  32           HB2      GLU  32 -13.621   1.387   0.100
  258    HB3  GLU  32           HB3      GLU  32 -15.280   1.416  -0.478
  259    HG2  GLU  32           HG2      GLU  32 -13.328  -0.681  -1.511
  260    HG3  GLU  32           HG3      GLU  32 -14.148  -0.870   0.032
  261    H    LYS  33           H        LYS  33 -12.958   3.671  -0.246
  262    HA   LYS  33           HA       LYS  33 -15.101   5.609  -0.536
  263    HB2  LYS  33           HB2      LYS  33 -12.469   5.932   0.966
  264    HB3  LYS  33           HB3      LYS  33 -13.941   6.871   1.172
  265    HG2  LYS  33           HG2      LYS  33 -15.123   4.772   1.915
  266    HG3  LYS  33           HG3      LYS  33 -13.566   3.924   1.860
  267    HD2  LYS  33           HD2      LYS  33 -12.642   5.692   3.440
  268    HD3  LYS  33           HD3      LYS  33 -14.287   6.314   3.611
  269    HE2  LYS  33           HE2      LYS  33 -13.239   3.564   4.405
  270    HE3  LYS  33           HE3      LYS  33 -13.770   4.862   5.481
  271    HZ1  LYS  33           HZ1      LYS  33 -16.024   4.589   4.422
  272    HZ2  LYS  33           HZ2      LYS  33 -15.497   3.247   5.280
  273    HZ3  LYS  33           HZ3      LYS  33 -15.445   3.241   3.663
  274    H    GLY  34           H        GLY  34 -11.655   5.610  -1.469
  275    HA2  GLY  34           HA2      GLY  34 -11.888   8.178  -2.922
  276    HA3  GLY  34           HA3      GLY  34 -10.460   7.159  -2.746
  277    H    GLY  35           H        GLY  35 -12.274   4.804  -3.630
  278    HA2  GLY  35           HA2      GLY  35 -13.050   3.787  -5.563
  279    HA3  GLY  35           HA3      GLY  35 -12.860   5.295  -6.452
  280    H    SER  36           H        SER  36  -9.915   5.139  -5.211
  281    HA   SER  36           HA       SER  36  -8.724   3.392  -7.312
  282    HB2  SER  36           HB2      SER  36  -8.298   6.385  -6.974
  283    HB3  SER  36           HB3      SER  36  -7.204   5.329  -7.882
  284    HG   SER  36           HG       SER  36  -9.825   6.126  -8.466
  285    H    LEU  37           H        LEU  37  -6.577   2.917  -7.089
  286    HA   LEU  37           HA       LEU  37  -5.108   3.563  -4.606
  287    HB2  LEU  37           HB2      LEU  37  -6.459   1.492  -4.195
  288    HB3  LEU  37           HB3      LEU  37  -5.769   0.764  -5.642
  289    HG   LEU  37           HG       LEU  37  -3.486   0.896  -4.525
  290   HD11  LEU  37          HD11      LEU  37  -5.183   1.491  -2.058
  291   HD12  LEU  37          HD12      LEU  37  -4.085   2.649  -2.817
  292   HD13  LEU  37          HD13      LEU  37  -3.436   1.185  -2.086
  293   HD21  LEU  37          HD21      LEU  37  -3.892  -1.043  -3.088
  294   HD22  LEU  37          HD22      LEU  37  -4.837  -1.180  -4.580
  295   HD23  LEU  37          HD23      LEU  37  -5.639  -0.697  -3.074
  296    HA   PRO  38           HA       PRO  38  -2.148   4.076  -7.795
  297    HB2  PRO  38           HB2      PRO  38   0.041   3.292  -5.889
  298    HB3  PRO  38           HB3      PRO  38  -0.066   4.736  -6.937
  299    HG2  PRO  38           HG2      PRO  38  -0.615   4.954  -4.310
  300    HG3  PRO  38           HG3      PRO  38  -1.698   5.746  -5.500
  301    HD2  PRO  38           HD2      PRO  38  -2.073   3.075  -4.110
  302    HD3  PRO  38           HD3      PRO  38  -3.214   4.430  -4.278
  303    H    LYS  39           H        LYS  39  -0.972   3.044  -9.367
  304    HA   LYS  39           HA       LYS  39  -1.000   0.039  -9.246
  305    HB2  LYS  39           HB2      LYS  39  -1.810   0.024 -11.509
  306    HB3  LYS  39           HB3      LYS  39  -2.867   0.983 -10.478
  307    HG2  LYS  39           HG2      LYS  39  -1.797   3.079 -11.365
  308    HG3  LYS  39           HG3      LYS  39  -0.795   2.079 -12.436
  309    HD2  LYS  39           HD2      LYS  39  -2.855   1.196 -13.522
  310    HD3  LYS  39           HD3      LYS  39  -3.846   2.143 -12.407
  311    HE2  LYS  39           HE2      LYS  39  -3.785   3.304 -14.485
  312    HE3  LYS  39           HE3      LYS  39  -2.871   4.249 -13.310
  313    HZ1  LYS  39           HZ1      LYS  39  -1.798   3.978 -15.560
  314    HZ2  LYS  39           HZ2      LYS  39  -1.601   2.386 -15.251
  315    HZ3  LYS  39           HZ3      LYS  39  -0.835   3.513 -14.329
  316    H    VAL  40           H        VAL  40   1.240   2.351  -9.297
  317    HA   VAL  40           HA       VAL  40   3.195   0.683 -10.802
  318    HB   VAL  40           HB       VAL  40   2.446   2.625 -12.141
  319   HG11  VAL  40          HG11      VAL  40   3.160   4.886 -11.618
  320   HG12  VAL  40          HG12      VAL  40   2.113   4.295 -10.321
  321   HG13  VAL  40          HG13      VAL  40   3.877   4.360 -10.090
  322   HG21  VAL  40          HG21      VAL  40   4.627   1.618 -12.523
  323   HG22  VAL  40          HG22      VAL  40   4.668   3.362 -12.820
  324   HG23  VAL  40          HG23      VAL  40   5.352   2.712 -11.318
  325    H    GLU  41           H        GLU  41   5.219   0.459  -9.856
  326    HA   GLU  41           HA       GLU  41   4.895   0.189  -7.139
  327    HB2  GLU  41           HB2      GLU  41   7.094  -0.709  -6.993
  328    HB3  GLU  41           HB3      GLU  41   6.338  -1.214  -8.499
  329    HG2  GLU  41           HG2      GLU  41   7.687   0.479  -9.732
  330    HG3  GLU  41           HG3      GLU  41   8.456   0.956  -8.219
  331    H    ALA  42           H        ALA  42   6.957   2.808  -8.568
  332    HA   ALA  42           HA       ALA  42   7.967   3.563  -6.010
  333    HB1  ALA  42           HB1      ALA  42   7.827   5.231  -8.554
  334    HB2  ALA  42           HB2      ALA  42   8.956   5.404  -7.190
  335    HB3  ALA  42           HB3      ALA  42   9.047   3.976  -8.224
  336    H    LYS  43           H        LYS  43   5.136   4.680  -7.792
  337    HA   LYS  43           HA       LYS  43   4.421   6.856  -5.955
  338    HB2  LYS  43           HB2      LYS  43   2.811   5.373  -8.090
  339    HB3  LYS  43           HB3      LYS  43   2.222   6.739  -7.135
  340    HG2  LYS  43           HG2      LYS  43   4.212   8.067  -7.930
  341    HG3  LYS  43           HG3      LYS  43   4.566   6.752  -9.064
  342    HD2  LYS  43           HD2      LYS  43   2.433   7.099 -10.211
  343    HD3  LYS  43           HD3      LYS  43   1.915   8.258  -8.965
  344    HE2  LYS  43           HE2      LYS  43   3.821   9.741  -9.554
  345    HE3  LYS  43           HE3      LYS  43   4.291   8.629 -10.849
  346    HZ1  LYS  43           HZ1      LYS  43   1.640   9.952 -10.686
  347    HZ2  LYS  43           HZ2      LYS  43   2.237   9.103 -11.971
  348    HZ3  LYS  43           HZ3      LYS  43   2.893  10.575 -11.510
  349    H    PHE  44           H        PHE  44   3.478   3.428  -6.355
  350    HA   PHE  44           HA       PHE  44   1.608   3.448  -4.208
  351    HB2  PHE  44           HB2      PHE  44   1.742   1.678  -5.935
  352    HB3  PHE  44           HB3      PHE  44   3.311   1.177  -5.324
  353    HD1  PHE  44           HD1      PHE  44  -0.301   1.526  -4.357
  354    HD2  PHE  44           HD2      PHE  44   3.483  -0.366  -3.527
  355    HE1  PHE  44           HE1      PHE  44  -1.400   0.060  -2.682
  356    HE2  PHE  44           HE2      PHE  44   2.374  -1.871  -1.909
  357    HZ   PHE  44           HZ       PHE  44  -0.073  -1.646  -1.462
  358    H    ILE  45           H        ILE  45   5.167   2.805  -4.218
  359    HA   ILE  45           HA       ILE  45   5.449   2.327  -1.407
  360    HB   ILE  45           HB       ILE  45   7.351   3.286  -3.557
  361   HG12  ILE  45          HG12      ILE  45   7.255   0.682  -1.960
  362   HG13  ILE  45          HG13      ILE  45   6.408   0.886  -3.481
  363   HG21  ILE  45          HG21      ILE  45   8.213   4.243  -1.458
  364   HG22  ILE  45          HG22      ILE  45   8.038   2.662  -0.649
  365   HG23  ILE  45          HG23      ILE  45   9.220   2.897  -1.953
  366   HD11  ILE  45          HD11      ILE  45   8.467  -0.250  -3.931
  367   HD12  ILE  45          HD12      ILE  45   8.586   1.380  -4.619
  368   HD13  ILE  45          HD13      ILE  45   9.424   0.981  -3.098
  369    H    ASN  46           H        ASN  46   5.576   5.464  -3.220
  370    HA   ASN  46           HA       ASN  46   5.971   7.140  -0.941
  371    HB2  ASN  46           HB2      ASN  46   6.134   8.219  -3.034
  372    HB3  ASN  46           HB3      ASN  46   4.628   7.538  -3.635
  373   HD21  ASN  46          HD21      ASN  46   2.699   8.689  -3.329
  374   HD22  ASN  46          HD22      ASN  46   2.587  10.089  -2.268
  375    H    TYR  47           H        TYR  47   2.907   5.891  -2.321
  376    HA   TYR  47           HA       TYR  47   1.150   7.071  -0.413
  377    HB2  TYR  47           HB2      TYR  47   0.225   6.410  -2.410
  378    HB3  TYR  47           HB3      TYR  47   1.003   4.841  -2.413
  379    HD1  TYR  47           HD1      TYR  47   0.205   2.974  -0.960
  380    HD2  TYR  47           HD2      TYR  47  -2.016   6.644  -1.429
  381    HE1  TYR  47           HE1      TYR  47  -1.812   1.886   0.016
  382    HE2  TYR  47           HE2      TYR  47  -4.052   5.521  -0.556
  383    HH   TYR  47           HH       TYR  47  -4.962   3.540   0.275
  384    H    VAL  48           H        VAL  48   2.639   3.773  -0.401
  385    HA   VAL  48           HA       VAL  48   1.508   2.891   2.053
  386    HB   VAL  48           HB       VAL  48   4.064   2.178   0.582
  387   HG11  VAL  48          HG11      VAL  48   3.066   0.951   3.181
  388   HG12  VAL  48          HG12      VAL  48   4.246   0.184   2.093
  389   HG13  VAL  48          HG13      VAL  48   4.649   1.709   2.883
  390   HG21  VAL  48          HG21      VAL  48   1.879   1.432  -0.370
  391   HG22  VAL  48          HG22      VAL  48   2.858   0.071   0.172
  392   HG23  VAL  48          HG23      VAL  48   1.493   0.631   1.164
  393    H    LYS  49           H        LYS  49   4.608   4.682   1.549
  394    HA   LYS  49           HA       LYS  49   5.041   4.860   4.440
  395    HB2  LYS  49           HB2      LYS  49   6.423   6.128   2.050
  396    HB3  LYS  49           HB3      LYS  49   6.865   6.492   3.729
  397    HG2  LYS  49           HG2      LYS  49   7.149   4.038   4.157
  398    HG3  LYS  49           HG3      LYS  49   6.900   3.717   2.438
  399    HD2  LYS  49           HD2      LYS  49   9.093   5.526   3.531
  400    HD3  LYS  49           HD3      LYS  49   9.299   3.787   3.301
  401    HE2  LYS  49           HE2      LYS  49   8.864   3.999   0.895
  402    HE3  LYS  49           HE3      LYS  49   8.586   5.738   1.074
  403    HZ1  LYS  49           HZ1      LYS  49  10.866   5.259   0.345
  404    HZ2  LYS  49           HZ2      LYS  49  11.151   4.370   1.703
  405    HZ3  LYS  49           HZ3      LYS  49  10.860   5.990   1.815
  406    H    ASN  50           H        ASN  50   3.034   6.676   2.346
  407    HA   ASN  50           HA       ASN  50   2.706   8.901   4.244
  408    HB2  ASN  50           HB2      ASN  50   2.231   9.679   2.159
  409    HB3  ASN  50           HB3      ASN  50   1.686   8.137   1.547
  410   HD21  ASN  50          HD21      ASN  50  -0.524   7.488   1.860
  411   HD22  ASN  50          HD22      ASN  50  -1.720   8.738   2.100
  412    H    CYS  51           H        CYS  51   1.049   5.823   3.526
  413    HA   CYS  51           HA       CYS  51  -1.120   6.337   5.406
  414    HB2  CYS  51           HB2      CYS  51  -0.362   3.936   3.684
  415    HB3  CYS  51           HB3      CYS  51  -1.854   4.083   4.623
  416    HG   CYS  51           HG       CYS  51  -2.199   4.408   2.024
  417    H    PHE  52           H        PHE  52   1.993   4.763   5.781
  418    HA   PHE  52           HA       PHE  52   1.204   3.817   8.474
  419    HB2  PHE  52           HB2      PHE  52   0.639   2.014   6.828
  420    HB3  PHE  52           HB3      PHE  52   2.323   1.979   6.325
  421    HD1  PHE  52           HD1      PHE  52   0.103   1.604   9.347
  422    HD2  PHE  52           HD2      PHE  52   3.821   0.503   7.463
  423    HE1  PHE  52           HE1      PHE  52   0.636   0.105  11.251
  424    HE2  PHE  52           HE2      PHE  52   4.358  -0.978   9.376
  425    HZ   PHE  52           HZ       PHE  52   2.790  -1.148  11.282
  426    H    ARG  53           H        ARG  53   2.970   3.032   9.763
  427    HA   ARG  53           HA       ARG  53   5.545   4.403   9.465
  428    HB2  ARG  53           HB2      ARG  53   4.370   2.535  11.550
  429    HB3  ARG  53           HB3      ARG  53   6.006   3.203  11.647
  430    HG2  ARG  53           HG2      ARG  53   4.905   5.521  11.369
  431    HG3  ARG  53           HG3      ARG  53   3.382   4.716  11.742
  432    HD2  ARG  53           HD2      ARG  53   4.244   3.962  13.905
  433    HD3  ARG  53           HD3      ARG  53   5.839   4.634  13.546
  434    HE   ARG  53           HE       ARG  53   3.546   6.068  14.568
  435   HH11  ARG  53          HH11      ARG  53   6.458   6.586  12.595
  436   HH12  ARG  53          HH12      ARG  53   6.355   8.322  12.881
  437   HH21  ARG  53          HH21      ARG  53   3.550   8.335  14.744
  438   HH22  ARG  53          HH22      ARG  53   4.858   9.208  13.953
  439    H    MET  54           H        MET  54   5.504   3.034   7.257
  440    HA   MET  54           HA       MET  54   6.460   0.300   7.543
  441    HB2  MET  54           HB2      MET  54   4.959   1.325   5.667
  442    HB3  MET  54           HB3      MET  54   6.470   1.894   4.965
  443    HG2  MET  54           HG2      MET  54   5.879  -0.195   3.957
  444    HG3  MET  54           HG3      MET  54   7.302  -0.478   4.962
  445    HE1  MET  54           HE1      MET  54   6.670  -3.107   4.502
  446    HE2  MET  54           HE2      MET  54   5.110  -3.824   4.953
  447    HE3  MET  54           HE3      MET  54   5.185  -2.623   3.647
  448    H    THR  55           H        THR  55   8.489  -0.459   7.618
  449    HA   THR  55           HA       THR  55  10.788   1.235   6.689
  450    HB   THR  55           HB       THR  55  12.044   0.562   8.704
  451    HG1  THR  55           HG1      THR  55   9.640  -0.084   9.987
  452   HG21  THR  55          HG21      THR  55   9.484   2.041   9.443
  453   HG22  THR  55          HG22      THR  55  10.902   2.766   8.660
  454   HG23  THR  55          HG23      THR  55  11.047   2.090  10.289
  455    H    ASP  56           H        ASP  56   9.477  -2.007   7.086
  456    HA   ASP  56           HA       ASP  56  12.038  -3.327   6.525
  457    HB2  ASP  56           HB2      ASP  56   9.237  -4.442   6.767
  458    HB3  ASP  56           HB3      ASP  56  10.729  -5.387   6.727
  459    H    GLN  57           H        GLN  57  12.817  -3.203   4.458
  460    HA   GLN  57           HA       GLN  57  11.204  -2.750   2.165
  461    HB2  GLN  57           HB2      GLN  57  13.927  -2.676   2.799
  462    HB3  GLN  57           HB3      GLN  57  13.831  -3.973   1.614
  463    HG2  GLN  57           HG2      GLN  57  12.740  -1.133   1.284
  464    HG3  GLN  57           HG3      GLN  57  14.251  -1.728   0.600
  465   HE21  GLN  57          HE21      GLN  57  11.249  -0.934  -0.392
  466   HE22  GLN  57          HE22      GLN  57  10.936  -2.233  -1.562
  467    H    GLU  58           H        GLU  58  12.542  -5.809   3.378
  468    HA   GLU  58           HA       GLU  58  11.440  -7.559   1.463
  469    HB2  GLU  58           HB2      GLU  58  11.538  -9.258   3.281
  470    HB3  GLU  58           HB3      GLU  58  13.005  -8.344   3.007
  471    HG2  GLU  58           HG2      GLU  58  12.070  -6.848   5.038
  472    HG3  GLU  58           HG3      GLU  58  11.193  -8.326   5.393
  473    H    ALA  59           H        ALA  59   9.705  -6.032   4.228
  474    HA   ALA  59           HA       ALA  59   7.220  -7.497   3.695
  475    HB1  ALA  59           HB1      ALA  59   7.803  -6.674   5.939
  476    HB2  ALA  59           HB2      ALA  59   7.633  -5.004   5.340
  477    HB3  ALA  59           HB3      ALA  59   6.236  -6.098   5.330
  478    H    ILE  60           H        ILE  60   8.621  -4.351   2.734
  479    HA   ILE  60           HA       ILE  60   6.316  -3.242   1.436
  480    HB   ILE  60           HB       ILE  60   9.275  -2.807   1.098
  481   HG12  ILE  60          HG12      ILE  60   7.043  -1.046   2.180
  482   HG13  ILE  60          HG13      ILE  60   8.137  -2.019   3.165
  483   HG21  ILE  60          HG21      ILE  60   8.291  -2.350  -1.130
  484   HG22  ILE  60          HG22      ILE  60   7.020  -1.357  -0.379
  485   HG23  ILE  60          HG23      ILE  60   8.721  -0.843  -0.361
  486   HD11  ILE  60          HD11      ILE  60  10.072  -0.727   2.167
  487   HD12  ILE  60          HD12      ILE  60   8.862   0.394   1.485
  488   HD13  ILE  60          HD13      ILE  60   8.989   0.188   3.238
  489    H    GLN  61           H        GLN  61   8.983  -5.217  -0.003
  490    HA   GLN  61           HA       GLN  61   7.560  -5.383  -2.511
  491    HB2  GLN  61           HB2      GLN  61   9.309  -6.826  -3.255
  492    HB3  GLN  61           HB3      GLN  61   9.972  -5.484  -2.336
  493    HG2  GLN  61           HG2      GLN  61  11.236  -7.244  -1.533
  494    HG3  GLN  61           HG3      GLN  61  10.014  -7.072  -0.312
  495   HE21  GLN  61          HE21      GLN  61   9.640  -9.160   0.452
  496   HE22  GLN  61          HE22      GLN  61   9.422 -10.569  -0.594
  497    H    ASP  62           H        ASP  62   7.554  -7.534   0.358
  498    HA   ASP  62           HA       ASP  62   5.977  -9.629  -0.801
  499    HB2  ASP  62           HB2      ASP  62   7.191  -9.809   1.324
  500    HB3  ASP  62           HB3      ASP  62   6.164  -8.574   2.046
  501    H    LEU  63           H        LEU  63   5.068  -6.517   0.645
  502    HA   LEU  63           HA       LEU  63   2.226  -6.942   0.473
  503    HB2  LEU  63           HB2      LEU  63   3.314  -5.552   2.155
  504    HB3  LEU  63           HB3      LEU  63   3.872  -4.428   0.936
  505    HG   LEU  63           HG       LEU  63   1.923  -3.751   2.375
  506   HD11  LEU  63          HD11      LEU  63   1.323  -3.661  -0.595
  507   HD12  LEU  63          HD12      LEU  63   2.438  -2.584   0.288
  508   HD13  LEU  63          HD13      LEU  63   0.706  -2.588   0.650
  509   HD21  LEU  63          HD21      LEU  63   0.283  -5.628   0.631
  510   HD22  LEU  63          HD22      LEU  63  -0.324  -4.496   1.847
  511   HD23  LEU  63          HD23      LEU  63   0.667  -5.866   2.356
  512    H    TRP  64           H        TRP  64   4.628  -5.201  -1.599
  513    HA   TRP  64           HA       TRP  64   2.802  -4.196  -3.537
  514    HB2  TRP  64           HB2      TRP  64   5.166  -3.532  -3.439
  515    HB3  TRP  64           HB3      TRP  64   5.663  -5.164  -3.839
  516    HD1  TRP  64           HD1      TRP  64   6.648  -5.144  -6.126
  517    HE1  TRP  64           HE1      TRP  64   6.100  -4.191  -8.433
  518    HE3  TRP  64           HE3      TRP  64   2.461  -2.433  -4.922
  519    HZ2  TRP  64           HZ2      TRP  64   4.137  -2.449  -9.606
  520    HZ3  TRP  64           HZ3      TRP  64   1.310  -1.086  -6.666
  521    HH2  TRP  64           HH2      TRP  64   2.116  -1.128  -9.011
  522    H    GLN  65           H        GLN  65   4.510  -7.365  -3.480
  523    HA   GLN  65           HA       GLN  65   3.178  -8.465  -5.772
  524    HB2  GLN  65           HB2      GLN  65   4.730  -9.511  -3.419
  525    HB3  GLN  65           HB3      GLN  65   3.706 -10.654  -4.271
  526    HG2  GLN  65           HG2      GLN  65   6.088 -10.544  -5.078
  527    HG3  GLN  65           HG3      GLN  65   4.838 -10.431  -6.303
  528   HE21  GLN  65          HE21      GLN  65   6.873  -8.163  -4.285
  529   HE22  GLN  65          HE22      GLN  65   7.323  -7.202  -5.690
  530    H    TRP  66           H        TRP  66   2.198  -8.550  -2.275
  531    HA   TRP  66           HA       TRP  66  -0.192 -10.037  -2.718
  532    HB2  TRP  66           HB2      TRP  66   0.975  -9.551  -0.550
  533    HB3  TRP  66           HB3      TRP  66   0.323  -7.923  -0.605
  534    HD1  TRP  66           HD1      TRP  66  -2.206 -10.529  -1.626
  535    HE1  TRP  66           HE1      TRP  66  -3.805 -11.039   0.302
  536    HE3  TRP  66           HE3      TRP  66   0.257  -8.079   2.134
  537    HZ2  TRP  66           HZ2      TRP  66  -3.998 -10.463   3.127
  538    HZ3  TRP  66           HZ3      TRP  66  -0.693  -8.020   4.429
  539    HH2  TRP  66           HH2      TRP  66  -2.809  -9.219   4.940
  540    H    ARG  67           H        ARG  67   0.364  -6.511  -2.963
  541    HA   ARG  67           HA       ARG  67  -2.402  -5.841  -3.582
  542    HB2  ARG  67           HB2      ARG  67  -0.875  -4.266  -2.518
  543    HB3  ARG  67           HB3      ARG  67   0.204  -4.281  -3.906
  544    HG2  ARG  67           HG2      ARG  67  -2.694  -3.509  -4.340
  545    HG3  ARG  67           HG3      ARG  67  -1.642  -2.369  -3.523
  546    HD2  ARG  67           HD2      ARG  67  -0.092  -2.292  -5.359
  547    HD3  ARG  67           HD3      ARG  67  -0.926  -3.561  -6.242
  548    HE   ARG  67           HE       ARG  67  -1.565  -0.760  -6.237
  549   HH11  ARG  67          HH11      ARG  67  -3.213  -3.893  -6.669
  550   HH12  ARG  67          HH12      ARG  67  -4.471  -3.100  -7.592
  551   HH21  ARG  67          HH21      ARG  67  -3.159   0.047  -7.370
  552   HH22  ARG  67          HH22      ARG  67  -4.508  -0.964  -7.877
  553    H    LYS  68           H        LYS  68   0.329  -6.798  -5.601
  554    HA   LYS  68           HA       LYS  68  -1.130  -6.259  -8.099
  555    HB2  LYS  68           HB2      LYS  68   1.378  -6.146  -7.777
  556    HB3  LYS  68           HB3      LYS  68   1.392  -7.913  -7.677
  557    HG2  LYS  68           HG2      LYS  68   0.489  -8.079  -9.945
  558    HG3  LYS  68           HG3      LYS  68   0.281  -6.329 -10.050
  559    HD2  LYS  68           HD2      LYS  68   2.988  -7.674  -9.661
  560    HD3  LYS  68           HD3      LYS  68   2.286  -7.322 -11.245
  561    HE2  LYS  68           HE2      LYS  68   2.204  -4.919 -10.729
  562    HE3  LYS  68           HE3      LYS  68   2.914  -5.217  -9.130
  563    HZ1  LYS  68           HZ1      LYS  68   4.255  -5.953 -11.679
  564    HZ2  LYS  68           HZ2      LYS  68   4.923  -5.995 -10.183
  565    HZ3  LYS  68           HZ3      LYS  68   4.572  -4.564 -10.882
  566    H    SER  69           H        SER  69  -0.928  -8.878  -5.855
  567    HA   SER  69           HA       SER  69  -2.209 -10.879  -7.547
  568    HB2  SER  69           HB2      SER  69  -1.794 -10.909  -4.538
  569    HB3  SER  69           HB3      SER  69  -2.161 -12.291  -5.580
  570    HG   SER  69           HG       SER  69   0.209 -10.701  -5.659
  571    H    LEU  70           H        LEU  70  -3.918  -8.726  -7.688
  572    HA   LEU  70           HA       LEU  70  -6.042  -9.116  -5.620
  573    HB2  LEU  70           HB2      LEU  70  -4.607  -6.963  -5.911
  574    HB3  LEU  70           HB3      LEU  70  -5.688  -6.589  -7.244
  575    HG   LEU  70           HG       LEU  70  -6.558  -7.159  -4.369
  576   HD11  LEU  70          HD11      LEU  70  -6.122  -4.506  -5.802
  577   HD12  LEU  70          HD12      LEU  70  -5.133  -5.163  -4.479
  578   HD13  LEU  70          HD13      LEU  70  -6.818  -4.698  -4.179
  579   HD21  LEU  70          HD21      LEU  70  -8.665  -6.101  -4.958
  580   HD22  LEU  70          HD22      LEU  70  -8.376  -7.446  -6.064
  581   HD23  LEU  70          HD23      LEU  70  -8.089  -5.777  -6.603
  Start of MODEL    2
    1    H    GLN   1           H1       GLN   1 -40.972  -2.884  29.717
    2    HA   GLN   1           HA       GLN   1 -41.849  -0.248  28.739
    3    HB2  GLN   1           HB2      GLN   1 -40.970  -1.139  31.513
    4    HB3  GLN   1           HB3      GLN   1 -41.260   0.534  31.040
    5    HG2  GLN   1           HG2      GLN   1 -43.619   0.086  30.649
    6    HG3  GLN   1           HG3      GLN   1 -43.397  -1.637  30.978
    7   HE21  GLN   1          HE21      GLN   1 -45.302  -0.164  32.406
    8   HE22  GLN   1          HE22      GLN   1 -44.762  -0.104  34.071
    9    H    GLU   2           H        GLU   2 -40.279   1.338  28.477
   10    HA   GLU   2           HA       GLU   2 -37.462   0.841  29.249
   11    HB2  GLU   2           HB2      GLU   2 -38.479   1.263  26.419
   12    HB3  GLU   2           HB3      GLU   2 -36.929   1.940  26.885
   13    HG2  GLU   2           HG2      GLU   2 -37.561  -1.026  27.163
   14    HG3  GLU   2           HG3      GLU   2 -36.837  -0.293  25.742
   15    H    SER   3           H        SER   3 -36.239   2.820  29.443
   16    HA   SER   3           HA       SER   3 -37.813   5.356  29.176
   17    HB2  SER   3           HB2      SER   3 -37.906   4.572  31.514
   18    HB3  SER   3           HB3      SER   3 -36.139   4.642  31.601
   19    HG   SER   3           HG       SER   3 -36.243   6.858  31.268
   20    H    PHE   4           H        PHE   4 -34.596   3.827  28.936
   21    HA   PHE   4           HA       PHE   4 -33.542   6.408  27.861
   22    HB2  PHE   4           HB2      PHE   4 -32.182   4.773  30.031
   23    HB3  PHE   4           HB3      PHE   4 -31.523   6.198  29.239
   24    HD1  PHE   4           HD1      PHE   4 -32.797   8.436  29.466
   25    HD2  PHE   4           HD2      PHE   4 -33.571   5.007  31.967
   26    HE1  PHE   4           HE1      PHE   4 -33.954   9.894  31.102
   27    HE2  PHE   4           HE2      PHE   4 -34.742   6.478  33.592
   28    HZ   PHE   4           HZ       PHE   4 -34.944   8.914  33.163
   29    H    LYS   5           H        LYS   5 -31.988   6.313  26.372
   30    HA   LYS   5           HA       LYS   5 -31.171   3.625  25.302
   31    HB2  LYS   5           HB2      LYS   5 -32.584   5.048  23.838
   32    HB3  LYS   5           HB3      LYS   5 -31.377   6.338  23.945
   33    HG2  LYS   5           HG2      LYS   5 -29.702   4.884  22.819
   34    HG3  LYS   5           HG3      LYS   5 -30.874   3.559  22.802
   35    HD2  LYS   5           HD2      LYS   5 -30.843   4.539  20.619
   36    HD3  LYS   5           HD3      LYS   5 -32.379   4.960  21.378
   37    HE2  LYS   5           HE2      LYS   5 -31.298   7.201  22.009
   38    HE3  LYS   5           HE3      LYS   5 -29.938   6.738  20.965
   39    HZ1  LYS   5           HZ1      LYS   5 -31.554   6.559  19.124
   40    HZ2  LYS   5           HZ2      LYS   5 -31.552   8.080  19.781
   41    HZ3  LYS   5           HZ3      LYS   5 -32.763   7.035  20.134
   42    H    LYS   6           H        LYS   6 -29.905   6.914  26.005
   43    HA   LYS   6           HA       LYS   6 -27.121   5.851  26.045
   44    HB2  LYS   6           HB2      LYS   6 -26.377   7.351  24.283
   45    HB3  LYS   6           HB3      LYS   6 -27.637   6.285  23.662
   46    HG2  LYS   6           HG2      LYS   6 -29.311   8.105  23.841
   47    HG3  LYS   6           HG3      LYS   6 -28.083   9.145  24.584
   48    HD2  LYS   6           HD2      LYS   6 -26.723   9.022  22.518
   49    HD3  LYS   6           HD3      LYS   6 -28.005   8.077  21.754
   50    HE2  LYS   6           HE2      LYS   6 -28.183  10.398  21.073
   51    HE3  LYS   6           HE3      LYS   6 -29.584   9.972  22.059
   52    HZ1  LYS   6           HZ1      LYS   6 -28.543  12.147  22.596
   53    HZ2  LYS   6           HZ2      LYS   6 -27.195  11.374  23.129
   54    HZ3  LYS   6           HZ3      LYS   6 -28.618  11.167  23.916
   55    H    GLN   7           H        GLN   7 -25.540   7.200  26.846
   56    HA   GLN   7           HA       GLN   7 -26.263   9.970  27.650
   57    HB2  GLN   7           HB2      GLN   7 -24.762   8.154  29.599
   58    HB3  GLN   7           HB3      GLN   7 -25.170   9.847  29.786
   59    HG2  GLN   7           HG2      GLN   7 -26.718   8.799  31.143
   60    HG3  GLN   7           HG3      GLN   7 -27.646   9.113  29.688
   61   HE21  GLN   7          HE21      GLN   7 -29.022   7.331  30.870
   62   HE22  GLN   7          HE22      GLN   7 -28.567   5.669  30.508
   63    H    GLU   8           H        GLU   8 -23.540   7.755  28.010
   64    HA   GLU   8           HA       GLU   8 -21.780   9.053  26.072
   65    HB2  GLU   8           HB2      GLU   8 -20.050   9.559  27.751
   66    HB3  GLU   8           HB3      GLU   8 -21.517  10.492  28.038
   67    HG2  GLU   8           HG2      GLU   8 -22.141   8.605  29.749
   68    HG3  GLU   8           HG3      GLU   8 -20.453   8.129  29.606
   69    H    LYS   9           H        LYS   9 -19.696   7.702  25.936
   70    HA   LYS   9           HA       LYS   9 -20.198   4.840  26.644
   71    HB2  LYS   9           HB2      LYS   9 -20.003   4.171  24.298
   72    HB3  LYS   9           HB3      LYS   9 -21.449   5.093  24.633
   73    HG2  LYS   9           HG2      LYS   9 -18.988   6.381  23.376
   74    HG3  LYS   9           HG3      LYS   9 -20.194   5.509  22.433
   75    HD2  LYS   9           HD2      LYS   9 -21.972   7.060  23.231
   76    HD3  LYS   9           HD3      LYS   9 -20.745   7.989  24.107
   77    HE2  LYS   9           HE2      LYS   9 -19.521   8.284  21.904
   78    HE3  LYS   9           HE3      LYS   9 -20.949   7.618  21.110
   79    HZ1  LYS   9           HZ1      LYS   9 -21.092  10.017  21.194
   80    HZ2  LYS   9           HZ2      LYS   9 -20.910  10.050  22.841
   81    HZ3  LYS   9           HZ3      LYS   9 -22.257   9.417  22.159
   82    H    THR  10           H        THR  10 -17.849   7.191  25.549
   83    HA   THR  10           HA       THR  10 -15.559   7.070  25.301
   84    HB   THR  10           HB       THR  10 -14.501   6.687  27.488
   85    HG1  THR  10           HG1      THR  10 -15.455   5.312  28.680
   86   HG21  THR  10          HG21      THR  10 -17.126   8.217  27.681
   87   HG22  THR  10          HG22      THR  10 -15.629   8.835  26.941
   88   HG23  THR  10          HG23      THR  10 -15.673   8.448  28.668
   89    HA   PRO  11           HA       PRO  11 -15.657   2.568  24.415
   90    HB2  PRO  11           HB2      PRO  11 -14.637   3.312  21.679
   91    HB3  PRO  11           HB3      PRO  11 -15.916   2.132  22.120
   92    HG2  PRO  11           HG2      PRO  11 -16.610   4.553  21.165
   93    HG3  PRO  11           HG3      PRO  11 -17.471   3.914  22.612
   94    HD2  PRO  11           HD2      PRO  11 -15.103   5.806  22.521
   95    HD3  PRO  11           HD3      PRO  11 -16.653   6.037  23.366
   96    H    LYS  12           H        LYS  12 -12.927   4.530  23.249
   97    HA   LYS  12           HA       LYS  12 -10.762   4.112  22.816
   98    HB2  LYS  12           HB2      LYS  12 -10.791   2.468  25.357
   99    HB3  LYS  12           HB3      LYS  12  -9.374   3.139  24.559
  100    HG2  LYS  12           HG2      LYS  12 -11.589   4.634  26.000
  101    HG3  LYS  12           HG3      LYS  12  -9.882   4.557  26.407
  102    HD2  LYS  12           HD2      LYS  12 -11.162   6.070  24.098
  103    HD3  LYS  12           HD3      LYS  12 -10.370   6.743  25.524
  104    HE2  LYS  12           HE2      LYS  12  -8.208   5.767  24.775
  105    HE3  LYS  12           HE3      LYS  12  -9.018   5.102  23.345
  106    HZ1  LYS  12           HZ1      LYS  12  -7.833   7.246  22.985
  107    HZ2  LYS  12           HZ2      LYS  12  -8.948   8.003  23.936
  108    HZ3  LYS  12           HZ3      LYS  12  -9.436   7.305  22.547
  109    H    THR  13           H        THR  13 -12.116   2.877  21.141
  110    HA   THR  13           HA       THR  13 -10.885   0.172  20.711
  111    HB   THR  13           HB       THR  13 -13.710   0.984  19.973
  112    HG1  THR  13           HG1      THR  13 -14.253  -0.449  21.585
  113   HG21  THR  13          HG21      THR  13 -12.245  -1.693  19.904
  114   HG22  THR  13          HG22      THR  13 -12.702  -0.764  18.466
  115   HG23  THR  13          HG23      THR  13 -13.962  -1.438  19.512
  116    HA   PRO  14           HA       PRO  14  -9.754   2.775  17.042
  117    HB2  PRO  14           HB2      PRO  14  -7.111   2.177  16.935
  118    HB3  PRO  14           HB3      PRO  14  -7.756   3.388  18.086
  119    HG2  PRO  14           HG2      PRO  14  -7.143   0.458  18.623
  120    HG3  PRO  14           HG3      PRO  14  -6.617   1.886  19.573
  121    HD2  PRO  14           HD2      PRO  14  -8.810   0.409  20.236
  122    HD3  PRO  14           HD3      PRO  14  -8.754   2.177  20.499
  123    H    LYS  15           H        LYS  15  -8.867   1.967  14.964
  124    HA   LYS  15           HA       LYS  15  -8.875  -0.994  14.574
  125    HB2  LYS  15           HB2      LYS  15 -10.483   1.047  12.972
  126    HB3  LYS  15           HB3      LYS  15 -10.076  -0.554  12.386
  127    HG2  LYS  15           HG2      LYS  15 -12.135  -1.034  13.245
  128    HG3  LYS  15           HG3      LYS  15 -11.156  -1.390  14.667
  129    HD2  LYS  15           HD2      LYS  15 -11.671   1.011  15.447
  130    HD3  LYS  15           HD3      LYS  15 -12.765   1.132  14.068
  131    HE2  LYS  15           HE2      LYS  15 -14.062  -0.790  14.947
  132    HE3  LYS  15           HE3      LYS  15 -12.922  -0.942  16.303
  133    HZ1  LYS  15           HZ1      LYS  15 -14.873   0.375  16.959
  134    HZ2  LYS  15           HZ2      LYS  15 -14.639   1.398  15.706
  135    HZ3  LYS  15           HZ3      LYS  15 -13.554   1.344  16.956
  136    H    GLY  16           H        GLY  16  -7.102  -1.635  13.631
  137    HA2  GLY  16           HA2      GLY  16  -5.698  -0.771  11.420
  138    HA3  GLY  16           HA3      GLY  16  -5.183   0.355  12.667
  139    HA   PRO  17           HA       PRO  17  -3.749  -3.947  14.232
  140    HB2  PRO  17           HB2      PRO  17  -3.516  -5.450  11.648
  141    HB3  PRO  17           HB3      PRO  17  -3.940  -6.065  13.275
  142    HG2  PRO  17           HG2      PRO  17  -5.891  -5.664  11.449
  143    HG3  PRO  17           HG3      PRO  17  -6.124  -5.102  13.142
  144    HD2  PRO  17           HD2      PRO  17  -5.250  -3.492  10.737
  145    HD3  PRO  17           HD3      PRO  17  -6.503  -3.105  11.936
  146    H    SER  18           H        SER  18  -1.664  -4.140  14.797
  147    HA   SER  18           HA       SER  18   0.112  -2.317  13.679
  148    HB2  SER  18           HB2      SER  18   0.683  -4.535  15.679
  149    HB3  SER  18           HB3      SER  18   1.689  -3.096  15.407
  150    HG   SER  18           HG       SER  18  -0.085  -1.808  15.948
  151    H    SER  19           H        SER  19  -0.020  -5.717  12.776
  152    HA   SER  19           HA       SER  19   2.644  -5.419  11.433
  153    HB2  SER  19           HB2      SER  19   1.192  -7.939  12.256
  154    HB3  SER  19           HB3      SER  19   2.706  -7.845  11.327
  155    HG   SER  19           HG       SER  19   3.255  -8.075  13.484
  156    H    VAL  20           H        VAL  20   1.951  -4.289   9.713
  157    HA   VAL  20           HA       VAL  20   1.175  -3.747   7.691
  158    HB   VAL  20           HB       VAL  20   1.279  -6.688   7.002
  159   HG11  VAL  20          HG11      VAL  20   2.131  -5.815   4.847
  160   HG12  VAL  20          HG12      VAL  20   0.500  -5.244   5.186
  161   HG13  VAL  20          HG13      VAL  20   1.882  -4.149   5.427
  162   HG21  VAL  20          HG21      VAL  20   3.373  -6.237   8.179
  163   HG22  VAL  20          HG22      VAL  20   3.714  -6.273   6.451
  164   HG23  VAL  20          HG23      VAL  20   3.587  -4.715   7.292
  165    H    GLU  21           H        GLU  21  -0.977  -6.066   9.213
  166    HA   GLU  21           HA       GLU  21  -3.002  -5.927   7.225
  167    HB2  GLU  21           HB2      GLU  21  -3.056  -6.860  10.102
  168    HB3  GLU  21           HB3      GLU  21  -4.475  -6.911   9.045
  169    HG2  GLU  21           HG2      GLU  21  -3.009  -8.167   7.368
  170    HG3  GLU  21           HG3      GLU  21  -1.810  -8.328   8.654
  171    H    ASP  22           H        ASP  22  -2.273  -3.518   9.639
  172    HA   ASP  22           HA       ASP  22  -4.643  -1.920   9.440
  173    HB2  ASP  22           HB2      ASP  22  -2.801  -1.326  10.943
  174    HB3  ASP  22           HB3      ASP  22  -1.705  -1.130   9.579
  175    H    ILE  23           H        ILE  23  -1.642  -1.521   7.436
  176    HA   ILE  23           HA       ILE  23  -3.039   0.181   5.672
  177    HB   ILE  23           HB       ILE  23  -0.569   0.103   5.991
  178   HG12  ILE  23          HG12      ILE  23  -1.267   0.086   3.051
  179   HG13  ILE  23          HG13      ILE  23  -1.970   1.298   4.120
  180   HG21  ILE  23          HG21      ILE  23   0.791  -1.302   4.438
  181   HG22  ILE  23          HG22      ILE  23  -0.072  -2.253   5.634
  182   HG23  ILE  23          HG23      ILE  23  -0.670  -2.187   3.963
  183   HD11  ILE  23          HD11      ILE  23   0.097   2.057   2.929
  184   HD12  ILE  23          HD12      ILE  23   0.169   2.234   4.679
  185   HD13  ILE  23          HD13      ILE  23   1.030   0.897   3.900
  186    H    LYS  24           H        LYS  24  -2.733  -3.327   5.622
  187    HA   LYS  24           HA       LYS  24  -3.865  -3.671   3.007
  188    HB2  LYS  24           HB2      LYS  24  -2.675  -5.413   4.443
  189    HB3  LYS  24           HB3      LYS  24  -4.159  -5.556   5.387
  190    HG2  LYS  24           HG2      LYS  24  -3.869  -7.321   3.678
  191    HG3  LYS  24           HG3      LYS  24  -5.372  -6.408   3.478
  192    HD2  LYS  24           HD2      LYS  24  -4.614  -5.310   1.534
  193    HD3  LYS  24           HD3      LYS  24  -2.914  -5.579   1.925
  194    HE2  LYS  24           HE2      LYS  24  -3.690  -6.972   0.019
  195    HE3  LYS  24           HE3      LYS  24  -3.058  -7.903   1.383
  196    HZ1  LYS  24           HZ1      LYS  24  -5.420  -8.296   2.057
  197    HZ2  LYS  24           HZ2      LYS  24  -5.042  -8.942   0.597
  198    HZ3  LYS  24           HZ3      LYS  24  -5.923  -7.596   0.663
  199    H    ALA  25           H        ALA  25  -5.515  -3.447   6.211
  200    HA   ALA  25           HA       ALA  25  -8.176  -3.699   5.113
  201    HB1  ALA  25           HB1      ALA  25  -8.862  -2.871   7.352
  202    HB2  ALA  25           HB2      ALA  25  -7.693  -4.191   7.459
  203    HB3  ALA  25           HB3      ALA  25  -7.163  -2.519   7.736
  204    H    LYS  26           H        LYS  26  -6.182  -0.853   6.012
  205    HA   LYS  26           HA       LYS  26  -8.091   1.177   5.252
  206    HB2  LYS  26           HB2      LYS  26  -5.101   1.107   5.759
  207    HB3  LYS  26           HB3      LYS  26  -5.861   2.547   5.118
  208    HG2  LYS  26           HG2      LYS  26  -5.561   2.689   7.549
  209    HG3  LYS  26           HG3      LYS  26  -7.252   2.831   7.058
  210    HD2  LYS  26           HD2      LYS  26  -7.552   0.436   7.790
  211    HD3  LYS  26           HD3      LYS  26  -5.894   0.455   8.394
  212    HE2  LYS  26           HE2      LYS  26  -8.081   2.369   9.317
  213    HE3  LYS  26           HE3      LYS  26  -7.698   0.840  10.104
  214    HZ1  LYS  26           HZ1      LYS  26  -5.388   1.700  10.407
  215    HZ2  LYS  26           HZ2      LYS  26  -6.531   2.487  11.269
  216    HZ3  LYS  26           HZ3      LYS  26  -5.905   3.182   9.921
  217    H    MET  27           H        MET  27  -5.675  -0.611   3.303
  218    HA   MET  27           HA       MET  27  -6.347   0.811   0.875
  219    HB2  MET  27           HB2      MET  27  -4.876  -1.775   1.394
  220    HB3  MET  27           HB3      MET  27  -5.295  -1.243  -0.235
  221    HG2  MET  27           HG2      MET  27  -4.157   0.894   0.093
  222    HG3  MET  27           HG3      MET  27  -3.702   0.437   1.732
  223    HE1  MET  27           HE1      MET  27  -0.324   0.492  -0.289
  224    HE2  MET  27           HE2      MET  27  -1.743   1.477  -0.714
  225    HE3  MET  27           HE3      MET  27  -1.296   1.250   0.992
  226    H    GLN  28           H        GLN  28  -7.892  -2.076   2.417
  227    HA   GLN  28           HA       GLN  28  -9.580  -2.592   0.102
  228    HB2  GLN  28           HB2      GLN  28 -10.296  -3.127   2.999
  229    HB3  GLN  28           HB3      GLN  28 -11.070  -3.781   1.568
  230    HG2  GLN  28           HG2      GLN  28  -8.506  -4.583   2.867
  231    HG3  GLN  28           HG3      GLN  28  -9.833  -5.570   2.300
  232   HE21  GLN  28          HE21      GLN  28  -6.772  -4.218   1.523
  233   HE22  GLN  28          HE22      GLN  28  -6.649  -4.904  -0.109
  234    H    ALA  29           H        ALA  29  -9.942  -0.511   2.997
  235    HA   ALA  29           HA       ALA  29 -12.484   0.622   2.333
  236    HB1  ALA  29           HB1      ALA  29 -11.392   0.850   4.537
  237    HB2  ALA  29           HB2      ALA  29 -10.120   1.851   3.813
  238    HB3  ALA  29           HB3      ALA  29 -11.793   2.428   3.849
  239    H    SER  30           H        SER  30  -9.165   1.788   1.541
  240    HA   SER  30           HA       SER  30  -9.898   3.962  -0.086
  241    HB2  SER  30           HB2      SER  30  -7.493   2.122  -0.371
  242    HB3  SER  30           HB3      SER  30  -7.661   3.707  -1.130
  243    HG   SER  30           HG       SER  30  -7.716   3.169   1.682
  244    H    ILE  31           H        ILE  31  -9.376   0.551  -1.222
  245    HA   ILE  31           HA       ILE  31  -9.920   1.300  -3.948
  246    HB   ILE  31           HB       ILE  31  -8.422  -0.578  -3.128
  247   HG12  ILE  31          HG12      ILE  31 -10.361  -1.184  -5.399
  248   HG13  ILE  31          HG13      ILE  31  -8.975  -0.090  -5.494
  249   HG21  ILE  31          HG21      ILE  31  -9.336  -2.761  -2.744
  250   HG22  ILE  31          HG22      ILE  31 -10.241  -1.657  -1.712
  251   HG23  ILE  31          HG23      ILE  31 -10.971  -2.251  -3.208
  252   HD11  ILE  31          HD11      ILE  31  -8.881  -3.094  -5.012
  253   HD12  ILE  31          HD12      ILE  31  -8.382  -2.219  -6.466
  254   HD13  ILE  31          HD13      ILE  31  -7.468  -2.009  -4.956
  255    H    GLU  32           H        GLU  32 -12.077   0.509  -1.360
  256    HA   GLU  32           HA       GLU  32 -14.348   0.177  -3.276
  257    HB2  GLU  32           HB2      GLU  32 -14.064  -0.083  -0.283
  258    HB3  GLU  32           HB3      GLU  32 -15.624  -0.099  -1.092
  259    HG2  GLU  32           HG2      GLU  32 -13.442  -2.016  -1.983
  260    HG3  GLU  32           HG3      GLU  32 -14.441  -2.363  -0.585
  261    H    LYS  33           H        LYS  33 -12.985   2.660  -1.175
  262    HA   LYS  33           HA       LYS  33 -15.393   4.344  -1.500
  263    HB2  LYS  33           HB2      LYS  33 -12.912   4.666   0.217
  264    HB3  LYS  33           HB3      LYS  33 -14.320   5.733   0.238
  265    HG2  LYS  33           HG2      LYS  33 -15.776   3.943   1.004
  266    HG3  LYS  33           HG3      LYS  33 -14.521   2.739   0.827
  267    HD2  LYS  33           HD2      LYS  33 -14.663   3.272   3.158
  268    HD3  LYS  33           HD3      LYS  33 -13.126   3.869   2.523
  269    HE2  LYS  33           HE2      LYS  33 -14.225   6.155   2.292
  270    HE3  LYS  33           HE3      LYS  33 -15.618   5.501   3.162
  271    HZ1  LYS  33           HZ1      LYS  33 -14.146   5.074   5.063
  272    HZ2  LYS  33           HZ2      LYS  33 -14.031   6.642   4.608
  273    HZ3  LYS  33           HZ3      LYS  33 -12.839   5.579   4.205
  274    H    GLY  34           H        GLY  34 -12.386   4.179  -3.101
  275    HA2  GLY  34           HA2      GLY  34 -13.284   6.395  -4.778
  276    HA3  GLY  34           HA3      GLY  34 -11.788   6.771  -3.914
  277    H    GLY  35           H        GLY  35 -10.627   4.122  -4.030
  278    HA2  GLY  35           HA2      GLY  35  -9.544   2.641  -5.485
  279    HA3  GLY  35           HA3      GLY  35 -10.404   3.337  -6.855
  280    H    SER  36           H        SER  36  -8.955   5.865  -5.081
  281    HA   SER  36           HA       SER  36  -7.037   6.243  -7.257
  282    HB2  SER  36           HB2      SER  36  -7.840   8.046  -4.970
  283    HB3  SER  36           HB3      SER  36  -6.765   8.490  -6.318
  284    HG   SER  36           HG       SER  36  -8.909   9.086  -6.783
  285    H    LEU  37           H        LEU  37  -6.091   4.180  -6.335
  286    HA   LEU  37           HA       LEU  37  -3.824   4.703  -4.499
  287    HB2  LEU  37           HB2      LEU  37  -4.770   2.151  -5.876
  288    HB3  LEU  37           HB3      LEU  37  -3.318   2.276  -4.914
  289    HG   LEU  37           HG       LEU  37  -4.908   1.208  -3.588
  290   HD11  LEU  37          HD11      LEU  37  -5.075   2.591  -1.613
  291   HD12  LEU  37          HD12      LEU  37  -4.856   4.073  -2.561
  292   HD13  LEU  37          HD13      LEU  37  -3.525   2.902  -2.408
  293   HD21  LEU  37          HD21      LEU  37  -6.888   3.491  -3.826
  294   HD22  LEU  37          HD22      LEU  37  -7.088   1.929  -3.011
  295   HD23  LEU  37          HD23      LEU  37  -6.970   1.984  -4.777
  296    HA   PRO  38           HA       PRO  38  -1.074   5.812  -7.630
  297    HB2  PRO  38           HB2      PRO  38   0.863   3.722  -6.608
  298    HB3  PRO  38           HB3      PRO  38   1.170   5.430  -7.061
  299    HG2  PRO  38           HG2      PRO  38   0.834   4.844  -4.462
  300    HG3  PRO  38           HG3      PRO  38  -0.063   6.233  -5.148
  301    HD2  PRO  38           HD2      PRO  38  -1.056   3.400  -4.679
  302    HD3  PRO  38           HD3      PRO  38  -1.816   4.958  -4.233
  303    H    LYS  39           H        LYS  39  -0.027   5.440  -9.574
  304    HA   LYS  39           HA       LYS  39  -1.037   3.151 -11.151
  305    HB2  LYS  39           HB2      LYS  39  -1.350   5.591 -11.746
  306    HB3  LYS  39           HB3      LYS  39   0.390   5.695 -12.036
  307    HG2  LYS  39           HG2      LYS  39   0.196   4.048 -13.871
  308    HG3  LYS  39           HG3      LYS  39  -1.509   3.786 -13.476
  309    HD2  LYS  39           HD2      LYS  39  -1.364   5.199 -15.414
  310    HD3  LYS  39           HD3      LYS  39  -1.995   6.160 -14.073
  311    HE2  LYS  39           HE2      LYS  39   0.229   7.181 -13.746
  312    HE3  LYS  39           HE3      LYS  39   0.918   6.137 -14.999
  313    HZ1  LYS  39           HZ1      LYS  39  -0.488   7.225 -16.635
  314    HZ2  LYS  39           HZ2      LYS  39   0.354   8.373 -15.810
  315    HZ3  LYS  39           HZ3      LYS  39  -1.226   8.145 -15.477
  316    H    VAL  40           H        VAL  40   1.935   4.080  -9.672
  317    HA   VAL  40           HA       VAL  40   3.365   1.897 -11.067
  318    HB   VAL  40           HB       VAL  40   3.857   3.967 -12.292
  319   HG11  VAL  40          HG11      VAL  40   3.697   5.622 -10.455
  320   HG12  VAL  40          HG12      VAL  40   5.195   4.972  -9.746
  321   HG13  VAL  40          HG13      VAL  40   5.220   5.745 -11.338
  322   HG21  VAL  40          HG21      VAL  40   6.240   3.732 -12.415
  323   HG22  VAL  40          HG22      VAL  40   6.327   2.986 -10.814
  324   HG23  VAL  40          HG23      VAL  40   5.531   2.132 -12.156
  325    H    GLU  41           H        GLU  41   4.877   0.840  -9.983
  326    HA   GLU  41           HA       GLU  41   4.648   0.417  -7.299
  327    HB2  GLU  41           HB2      GLU  41   6.602  -0.951  -7.476
  328    HB3  GLU  41           HB3      GLU  41   5.659  -1.080  -8.951
  329    HG2  GLU  41           HG2      GLU  41   7.179   0.552 -10.090
  330    HG3  GLU  41           HG3      GLU  41   8.170   0.616  -8.635
  331    H    ALA  42           H        ALA  42   7.067   2.707  -8.688
  332    HA   ALA  42           HA       ALA  42   8.459   3.217  -6.268
  333    HB1  ALA  42           HB1      ALA  42   9.272   3.832  -8.525
  334    HB2  ALA  42           HB2      ALA  42   7.994   5.059  -8.666
  335    HB3  ALA  42           HB3      ALA  42   9.267   5.232  -7.441
  336    H    LYS  43           H        LYS  43   5.604   4.825  -7.655
  337    HA   LYS  43           HA       LYS  43   5.220   6.755  -5.509
  338    HB2  LYS  43           HB2      LYS  43   3.392   5.688  -7.695
  339    HB3  LYS  43           HB3      LYS  43   2.890   6.918  -6.531
  340    HG2  LYS  43           HG2      LYS  43   5.326   7.246  -8.293
  341    HG3  LYS  43           HG3      LYS  43   3.692   7.710  -8.795
  342    HD2  LYS  43           HD2      LYS  43   3.491   9.290  -6.950
  343    HD3  LYS  43           HD3      LYS  43   5.070   8.808  -6.302
  344    HE2  LYS  43           HE2      LYS  43   6.210   9.636  -8.284
  345    HE3  LYS  43           HE3      LYS  43   4.669  10.011  -9.072
  346    HZ1  LYS  43           HZ1      LYS  43   5.534  11.256  -6.519
  347    HZ2  LYS  43           HZ2      LYS  43   4.237  11.682  -7.431
  348    HZ3  LYS  43           HZ3      LYS  43   5.759  11.950  -7.994
  349    H    PHE  44           H        PHE  44   4.150   3.418  -6.098
  350    HA   PHE  44           HA       PHE  44   2.304   3.393  -3.933
  351    HB2  PHE  44           HB2      PHE  44   2.209   1.760  -5.744
  352    HB3  PHE  44           HB3      PHE  44   3.767   1.101  -5.294
  353    HD1  PHE  44           HD2      PHE  44   4.034  -0.277  -3.220
  354    HD2  PHE  44           HD1      PHE  44   0.192   1.216  -4.493
  355    HE1  PHE  44           HE2      PHE  44   2.905  -1.873  -1.689
  356    HE2  PHE  44           HE1      PHE  44  -0.935  -0.402  -2.985
  357    HZ   PHE  44           HZ       PHE  44   0.413  -1.941  -1.587
  358    H    ILE  45           H        ILE  45   5.749   2.360  -4.075
  359    HA   ILE  45           HA       ILE  45   6.091   1.687  -1.325
  360    HB   ILE  45           HB       ILE  45   7.994   2.862  -3.389
  361   HG12  ILE  45          HG12      ILE  45   7.925   0.016  -2.313
  362   HG13  ILE  45          HG13      ILE  45   6.933   0.492  -3.679
  363   HG21  ILE  45          HG21      ILE  45   9.853   2.081  -1.897
  364   HG22  ILE  45          HG22      ILE  45   8.941   3.406  -1.206
  365   HG23  ILE  45          HG23      ILE  45   8.665   1.747  -0.625
  366   HD11  ILE  45          HD11      ILE  45   8.949   1.186  -4.942
  367   HD12  ILE  45          HD12      ILE  45   9.970   0.621  -3.601
  368   HD13  ILE  45          HD13      ILE  45   8.963  -0.529  -4.493
  369    H    ASN  46           H        ASN  46   6.492   4.857  -2.956
  370    HA   ASN  46           HA       ASN  46   6.934   6.476  -0.676
  371    HB2  ASN  46           HB2      ASN  46   7.307   7.569  -2.661
  372    HB3  ASN  46           HB3      ASN  46   5.958   6.824  -3.479
  373   HD21  ASN  46          HD21      ASN  46   3.876   7.736  -3.385
  374   HD22  ASN  46          HD22      ASN  46   3.676   9.392  -2.817
  375    H    TYR  47           H        TYR  47   3.752   5.476  -2.074
  376    HA   TYR  47           HA       TYR  47   2.132   6.961  -0.280
  377    HB2  TYR  47           HB2      TYR  47   1.347   5.959  -2.389
  378    HB3  TYR  47           HB3      TYR  47   1.528   4.343  -1.721
  379    HD1  TYR  47           HD1      TYR  47   0.037   3.578   0.180
  380    HD2  TYR  47           HD2      TYR  47  -0.573   7.317  -1.895
  381    HE1  TYR  47           HE1      TYR  47  -2.220   3.800   1.230
  382    HE2  TYR  47           HE2      TYR  47  -2.844   7.487  -0.890
  383    HH   TYR  47           HH       TYR  47  -4.115   5.078   1.412
  384    H    VAL  48           H        VAL  48   3.351   3.587  -0.021
  385    HA   VAL  48           HA       VAL  48   2.060   3.028   2.474
  386    HB   VAL  48           HB       VAL  48   4.497   1.847   1.075
  387   HG11  VAL  48          HG11      VAL  48   3.234   0.907   3.676
  388   HG12  VAL  48          HG12      VAL  48   4.225  -0.125   2.634
  389   HG13  VAL  48          HG13      VAL  48   4.929   1.325   3.358
  390   HG21  VAL  48          HG21      VAL  48   3.006  -0.030   0.594
  391   HG22  VAL  48          HG22      VAL  48   1.693   0.728   1.513
  392   HG23  VAL  48          HG23      VAL  48   2.278   1.464   0.007
  393    H    LYS  49           H        LYS  49   5.348   4.249   1.803
  394    HA   LYS  49           HA       LYS  49   6.233   4.594   4.503
  395    HB2  LYS  49           HB2      LYS  49   6.900   6.015   1.897
  396    HB3  LYS  49           HB3      LYS  49   7.715   6.368   3.424
  397    HG2  LYS  49           HG2      LYS  49   8.568   4.119   3.603
  398    HG3  LYS  49           HG3      LYS  49   7.591   3.556   2.246
  399    HD2  LYS  49           HD2      LYS  49   9.919   3.844   1.585
  400    HD3  LYS  49           HD3      LYS  49   8.879   4.972   0.695
  401    HE2  LYS  49           HE2      LYS  49   9.522   6.813   2.169
  402    HE3  LYS  49           HE3      LYS  49  10.420   5.705   3.219
  403    HZ1  LYS  49           HZ1      LYS  49  11.109   6.148   0.374
  404    HZ2  LYS  49           HZ2      LYS  49  11.986   5.330   1.516
  405    HZ3  LYS  49           HZ3      LYS  49  11.812   6.964   1.651
  406    H    ASN  50           H        ASN  50   4.085   6.613   2.566
  407    HA   ASN  50           HA       ASN  50   3.971   8.774   4.548
  408    HB2  ASN  50           HB2      ASN  50   3.791   9.418   2.296
  409    HB3  ASN  50           HB3      ASN  50   2.687   8.118   1.883
  410   HD21  ASN  50          HD21      ASN  50   0.449   8.245   2.532
  411   HD22  ASN  50          HD22      ASN  50  -0.233   9.813   2.909
  412    H    CYS  51           H        CYS  51   1.879   6.009   3.688
  413    HA   CYS  51           HA       CYS  51  -0.325   7.016   5.297
  414    HB2  CYS  51           HB2      CYS  51  -0.574   6.125   3.010
  415    HB3  CYS  51           HB3      CYS  51  -0.003   4.543   3.548
  416    HG   CYS  51           HG       CYS  51  -2.652   6.240   4.642
  417    H    PHE  52           H        PHE  52   1.796   4.133   5.573
  418    HA   PHE  52           HA       PHE  52   0.866   3.866   8.409
  419    HB2  PHE  52           HB2      PHE  52  -0.216   2.140   7.037
  420    HB3  PHE  52           HB3      PHE  52   1.374   1.578   6.496
  421    HD1  PHE  52           HD1      PHE  52  -0.191   2.364   9.860
  422    HD2  PHE  52           HD2      PHE  52   1.906  -0.498   7.404
  423    HE1  PHE  52           HE1      PHE  52  -0.111   0.783  11.765
  424    HE2  PHE  52           HE2      PHE  52   1.991  -2.072   9.320
  425    HZ   PHE  52           HZ       PHE  52   0.955  -1.441  11.491
  426    H    ARG  53           H        ARG  53   3.350   4.653   6.540
  427    HA   ARG  53           HA       ARG  53   5.526   5.031   6.863
  428    HB2  ARG  53           HB2      ARG  53   6.061   6.068   8.830
  429    HB3  ARG  53           HB3      ARG  53   4.338   6.333   8.554
  430    HG2  ARG  53           HG2      ARG  53   3.678   4.975  10.352
  431    HG3  ARG  53           HG3      ARG  53   5.208   4.097  10.415
  432    HD2  ARG  53           HD2      ARG  53   4.854   7.015  11.202
  433    HD3  ARG  53           HD3      ARG  53   4.897   5.638  12.320
  434    HE   ARG  53           HE       ARG  53   7.217   5.712  10.562
  435   HH11  ARG  53          HH11      ARG  53   6.090   7.150  13.602
  436   HH12  ARG  53          HH12      ARG  53   7.748   7.275  14.168
  437   HH21  ARG  53          HH21      ARG  53   9.124   6.143  11.236
  438   HH22  ARG  53          HH22      ARG  53   9.420   7.015  12.738
  439    H    MET  54           H        MET  54   4.999   2.219   6.685
  440    HA   MET  54           HA       MET  54   7.084   0.755   8.034
  441    HB2  MET  54           HB2      MET  54   5.932   0.460   5.225
  442    HB3  MET  54           HB3      MET  54   6.943  -0.737   6.025
  443    HG2  MET  54           HG2      MET  54   5.247  -1.174   7.692
  444    HG3  MET  54           HG3      MET  54   4.271   0.183   7.135
  445    HE1  MET  54           HE1      MET  54   5.464  -3.447   6.506
  446    HE2  MET  54           HE2      MET  54   4.753  -3.858   4.928
  447    HE3  MET  54           HE3      MET  54   6.114  -2.718   5.021
  448    H    THR  55           H        THR  55   9.120   0.159   7.299
  449    HA   THR  55           HA       THR  55  10.415   1.820   5.168
  450    HB   THR  55           HB       THR  55  11.690   1.137   7.847
  451    HG1  THR  55           HG1      THR  55  10.460   2.795   8.310
  452   HG21  THR  55          HG21      THR  55  13.413   1.314   6.144
  453   HG22  THR  55          HG22      THR  55  13.407   2.804   7.091
  454   HG23  THR  55          HG23      THR  55  12.657   2.786   5.478
  455    H    ASP  56           H        ASP  56   9.914  -1.337   6.574
  456    HA   ASP  56           HA       ASP  56  12.238  -2.625   5.420
  457    HB2  ASP  56           HB2      ASP  56   9.617  -3.762   6.450
  458    HB3  ASP  56           HB3      ASP  56  11.041  -4.712   6.025
  459    H    GLN  57           H        GLN  57  12.431  -2.333   3.252
  460    HA   GLN  57           HA       GLN  57  10.421  -2.225   1.329
  461    HB2  GLN  57           HB2      GLN  57  12.758  -1.467   1.087
  462    HB3  GLN  57           HB3      GLN  57  13.291  -3.143   0.996
  463    HG2  GLN  57           HG2      GLN  57  13.207  -2.132  -1.222
  464    HG3  GLN  57           HG3      GLN  57  12.053  -3.453  -1.107
  465   HE21  GLN  57          HE21      GLN  57   9.800  -2.981  -1.254
  466   HE22  GLN  57          HE22      GLN  57   9.270  -1.390  -1.807
  467    H    GLU  58           H        GLU  58  11.867  -5.130   2.674
  468    HA   GLU  58           HA       GLU  58  10.865  -7.057   0.792
  469    HB2  GLU  58           HB2      GLU  58  11.272  -8.669   2.614
  470    HB3  GLU  58           HB3      GLU  58  12.659  -7.661   2.251
  471    HG2  GLU  58           HG2      GLU  58  10.873  -6.744   4.511
  472    HG3  GLU  58           HG3      GLU  58  11.795  -8.201   4.756
  473    H    ALA  59           H        ALA  59   9.338  -5.532   3.626
  474    HA   ALA  59           HA       ALA  59   6.947  -7.284   3.513
  475    HB1  ALA  59           HB1      ALA  59   6.178  -5.997   5.376
  476    HB2  ALA  59           HB2      ALA  59   7.814  -6.641   5.683
  477    HB3  ALA  59           HB3      ALA  59   7.593  -4.917   5.276
  478    H    ILE  60           H        ILE  60   7.971  -3.967   2.680
  479    HA   ILE  60           HA       ILE  60   5.436  -2.998   1.757
  480    HB   ILE  60           HB       ILE  60   8.267  -2.318   0.911
  481   HG12  ILE  60          HG12      ILE  60   6.435  -0.784   2.795
  482   HG13  ILE  60          HG13      ILE  60   7.657  -1.914   3.338
  483   HG21  ILE  60          HG21      ILE  60   7.290  -0.191   0.009
  484   HG22  ILE  60          HG22      ILE  60   6.667  -1.590  -0.849
  485   HG23  ILE  60          HG23      ILE  60   5.665  -0.795   0.380
  486   HD11  ILE  60          HD11      ILE  60   9.408  -0.551   2.145
  487   HD12  ILE  60          HD12      ILE  60   8.168   0.688   1.856
  488   HD13  ILE  60          HD13      ILE  60   8.618   0.258   3.511
  489    H    GLN  61           H        GLN  61   8.054  -4.776  -0.036
  490    HA   GLN  61           HA       GLN  61   6.390  -4.921  -2.412
  491    HB2  GLN  61           HB2      GLN  61   8.105  -6.094  -3.459
  492    HB3  GLN  61           HB3      GLN  61   8.868  -4.882  -2.449
  493    HG2  GLN  61           HG2      GLN  61  10.203  -6.764  -2.106
  494    HG3  GLN  61           HG3      GLN  61   9.162  -6.731  -0.696
  495   HE21  GLN  61          HE21      GLN  61   8.992  -8.953  -0.195
  496   HE22  GLN  61          HE22      GLN  61   8.406 -10.153  -1.352
  497    H    ASP  62           H        ASP  62   6.916  -7.225   0.346
  498    HA   ASP  62           HA       ASP  62   5.330  -9.342  -0.738
  499    HB2  ASP  62           HB2      ASP  62   6.555  -9.687   1.297
  500    HB3  ASP  62           HB3      ASP  62   5.731  -8.358   2.099
  501    H    LEU  63           H        LEU  63   4.385  -6.320   0.908
  502    HA   LEU  63           HA       LEU  63   1.598  -6.816   0.898
  503    HB2  LEU  63           HB2      LEU  63   2.796  -5.375   2.432
  504    HB3  LEU  63           HB3      LEU  63   3.143  -4.222   1.161
  505    HG   LEU  63           HG       LEU  63   1.348  -3.646   2.819
  506   HD11  LEU  63          HD11      LEU  63   0.323  -3.636  -0.030
  507   HD12  LEU  63          HD12      LEU  63   1.536  -2.505   0.624
  508   HD13  LEU  63          HD13      LEU  63  -0.107  -2.536   1.287
  509   HD21  LEU  63          HD21      LEU  63  -0.412  -5.577   1.266
  510   HD22  LEU  63          HD22      LEU  63  -0.870  -4.526   2.625
  511   HD23  LEU  63          HD23      LEU  63   0.233  -5.883   2.894
  512    H    TRP  64           H        TRP  64   3.752  -5.091  -1.439
  513    HA   TRP  64           HA       TRP  64   1.722  -4.256  -3.260
  514    HB2  TRP  64           HB2      TRP  64   4.153  -3.527  -3.224
  515    HB3  TRP  64           HB3      TRP  64   4.545  -5.042  -3.999
  516    HD1  TRP  64           HD1      TRP  64   1.936  -2.231  -4.774
  517    HE1  TRP  64           HE1      TRP  64   2.090  -1.636  -7.282
  518    HE3  TRP  64           HE3      TRP  64   5.635  -5.468  -6.177
  519    HZ2  TRP  64           HZ2      TRP  64   3.445  -2.607  -9.604
  520    HZ3  TRP  64           HZ3      TRP  64   6.297  -5.656  -8.562
  521    HH2  TRP  64           HH2      TRP  64   5.213  -4.232 -10.280
  522    H    GLN  65           H        GLN  65   3.635  -7.301  -3.204
  523    HA   GLN  65           HA       GLN  65   2.269  -8.654  -5.347
  524    HB2  GLN  65           HB2      GLN  65   3.962  -9.410  -2.954
  525    HB3  GLN  65           HB3      GLN  65   3.091 -10.671  -3.799
  526    HG2  GLN  65           HG2      GLN  65   5.484 -10.341  -4.496
  527    HG3  GLN  65           HG3      GLN  65   4.281 -10.437  -5.771
  528   HE21  GLN  65          HE21      GLN  65   6.635  -8.246  -4.206
  529   HE22  GLN  65          HE22      GLN  65   6.551  -7.062  -5.489
  530    H    TRP  66           H        TRP  66   1.516  -8.429  -1.838
  531    HA   TRP  66           HA       TRP  66  -0.689 -10.219  -1.820
  532    HB2  TRP  66           HB2      TRP  66   0.661  -9.230   0.087
  533    HB3  TRP  66           HB3      TRP  66  -0.311  -7.777  -0.066
  534    HD1  TRP  66           HD1      TRP  66  -2.733 -10.451  -0.400
  535    HE1  TRP  66           HE1      TRP  66  -3.844 -10.986   1.866
  536    HE3  TRP  66           HE3      TRP  66   0.735  -8.353   2.725
  537    HZ2  TRP  66           HZ2      TRP  66  -3.329 -10.496   4.655
  538    HZ3  TRP  66           HZ3      TRP  66   0.418  -8.433   5.189
  539    HH2  TRP  66           HH2      TRP  66  -1.600  -9.495   6.159
  540    H    ARG  67           H        ARG  67  -0.594  -6.693  -2.588
  541    HA   ARG  67           HA       ARG  67  -3.435  -6.795  -3.369
  542    HB2  ARG  67           HB2      ARG  67  -3.430  -4.500  -3.737
  543    HB3  ARG  67           HB3      ARG  67  -2.613  -4.841  -2.230
  544    HG2  ARG  67           HG2      ARG  67  -1.432  -3.101  -3.120
  545    HG3  ARG  67           HG3      ARG  67  -0.403  -4.473  -3.461
  546    HD2  ARG  67           HD2      ARG  67  -2.358  -3.507  -5.572
  547    HD3  ARG  67           HD3      ARG  67  -0.929  -2.529  -5.224
  548    HE   ARG  67           HE       ARG  67   0.172  -5.007  -5.620
  549   HH11  ARG  67          HH11      ARG  67  -1.874  -2.966  -7.692
  550   HH12  ARG  67          HH12      ARG  67  -1.245  -3.736  -9.118
  551   HH21  ARG  67          HH21      ARG  67   1.076  -5.686  -7.577
  552   HH22  ARG  67          HH22      ARG  67   0.351  -5.101  -9.053
  553    H    LYS  68           H        LYS  68  -0.673  -7.763  -5.039
  554    HA   LYS  68           HA       LYS  68  -1.895  -7.438  -7.688
  555    HB2  LYS  68           HB2      LYS  68   0.584  -7.904  -7.332
  556    HB3  LYS  68           HB3      LYS  68   0.142  -9.532  -6.846
  557    HG2  LYS  68           HG2      LYS  68   0.769  -9.703  -9.115
  558    HG3  LYS  68           HG3      LYS  68  -0.987  -9.836  -9.090
  559    HD2  LYS  68           HD2      LYS  68  -1.018  -7.309  -9.637
  560    HD3  LYS  68           HD3      LYS  68   0.713  -7.462  -9.960
  561    HE2  LYS  68           HE2      LYS  68   0.291  -9.088 -11.728
  562    HE3  LYS  68           HE3      LYS  68  -1.425  -9.183 -11.289
  563    HZ1  LYS  68           HZ1      LYS  68  -1.201  -7.772 -13.178
  564    HZ2  LYS  68           HZ2      LYS  68  -0.067  -6.826 -12.463
  565    HZ3  LYS  68           HZ3      LYS  68  -1.637  -6.836 -11.909
  566    H    SER  69           H        SER  69  -1.799 -10.010  -5.186
  567    HA   SER  69           HA       SER  69  -3.718 -11.705  -6.496
  568    HB2  SER  69           HB2      SER  69  -2.999 -11.564  -3.549
  569    HB3  SER  69           HB3      SER  69  -3.787 -12.915  -4.396
  570    HG   SER  69           HG       SER  69  -1.685 -13.449  -4.373
  571    H    LEU  70           H        LEU  70  -4.146  -9.386  -3.816
  572    HA   LEU  70           HA       LEU  70  -5.842  -8.282  -2.943
  573    HB2  LEU  70           HB2      LEU  70  -5.798  -7.764  -5.690
  574    HB3  LEU  70           HB3      LEU  70  -7.508  -7.945  -5.340
  575    HG   LEU  70           HG       LEU  70  -5.637  -6.112  -3.809
  576   HD11  LEU  70          HD11      LEU  70  -7.613  -5.405  -6.009
  577   HD12  LEU  70          HD12      LEU  70  -5.843  -5.424  -6.175
  578   HD13  LEU  70          HD13      LEU  70  -6.601  -4.284  -5.061
  579   HD21  LEU  70          HD21      LEU  70  -7.721  -5.052  -3.016
  580   HD22  LEU  70          HD22      LEU  70  -7.695  -6.764  -2.565
  581   HD23  LEU  70          HD23      LEU  70  -8.680  -6.229  -3.934
  Start of MODEL    3
    1    H    GLN   1           H1       GLN   1 -36.595 -16.339  31.065
    2    HA   GLN   1           HA       GLN   1 -37.303 -16.047  28.221
    3    HB2  GLN   1           HB2      GLN   1 -37.376 -14.061  30.516
    4    HB3  GLN   1           HB3      GLN   1 -37.160 -13.525  28.857
    5    HG2  GLN   1           HG2      GLN   1 -39.551 -15.204  29.709
    6    HG3  GLN   1           HG3      GLN   1 -39.513 -13.446  29.750
    7   HE21  GLN   1          HE21      GLN   1 -41.155 -13.188  28.141
    8   HE22  GLN   1          HE22      GLN   1 -40.856 -13.624  26.457
    9    H    GLU   2           H        GLU   2 -35.700 -15.231  26.881
   10    HA   GLU   2           HA       GLU   2 -32.934 -15.359  27.870
   11    HB2  GLU   2           HB2      GLU   2 -34.075 -14.940  25.087
   12    HB3  GLU   2           HB3      GLU   2 -32.364 -15.169  25.474
   13    HG2  GLU   2           HG2      GLU   2 -32.805 -17.391  26.389
   14    HG3  GLU   2           HG3      GLU   2 -34.533 -17.213  26.109
   15    H    SER   3           H        SER   3 -33.933 -13.358  29.254
   16    HA   SER   3           HA       SER   3 -33.643 -10.766  27.843
   17    HB2  SER   3           HB2      SER   3 -34.623 -11.522  30.607
   18    HB3  SER   3           HB3      SER   3 -34.560  -9.860  29.984
   19    HG   SER   3           HG       SER   3 -36.601 -10.930  29.766
   20    H    PHE   4           H        PHE   4 -31.793 -12.690  30.091
   21    HA   PHE   4           HA       PHE   4 -29.827 -12.427  31.125
   22    HB2  PHE   4           HB2      PHE   4 -29.297 -10.557  28.809
   23    HB3  PHE   4           HB3      PHE   4 -28.071 -11.307  29.814
   24    HD1  PHE   4           HD2      PHE   4 -27.575 -13.715  29.685
   25    HD2  PHE   4           HD1      PHE   4 -30.456 -11.852  27.077
   26    HE1  PHE   4           HE2      PHE   4 -27.468 -15.677  28.167
   27    HE2  PHE   4           HE1      PHE   4 -30.349 -13.815  25.562
   28    HZ   PHE   4           HZ       PHE   4 -28.866 -15.734  26.108
   29    H    LYS   5           H        LYS   5 -27.966 -10.453  31.516
   30    HA   LYS   5           HA       LYS   5 -29.253  -9.337  33.913
   31    HB2  LYS   5           HB2      LYS   5 -27.245 -10.948  33.778
   32    HB3  LYS   5           HB3      LYS   5 -26.285  -9.555  33.304
   33    HG2  LYS   5           HG2      LYS   5 -26.867  -8.463  35.477
   34    HG3  LYS   5           HG3      LYS   5 -27.862  -9.878  35.900
   35    HD2  LYS   5           HD2      LYS   5 -25.823 -11.336  35.631
   36    HD3  LYS   5           HD3      LYS   5 -24.865  -9.872  35.328
   37    HE2  LYS   5           HE2      LYS   5 -25.578  -9.027  37.592
   38    HE3  LYS   5           HE3      LYS   5 -26.369 -10.584  37.882
   39    HZ1  LYS   5           HZ1      LYS   5 -24.124 -10.517  38.798
   40    HZ2  LYS   5           HZ2      LYS   5 -23.475 -10.199  37.322
   41    HZ3  LYS   5           HZ3      LYS   5 -24.182 -11.656  37.630
   42    H    LYS   6           H        LYS   6 -27.119  -8.131  31.321
   43    HA   LYS   6           HA       LYS   6 -28.122  -5.419  31.542
   44    HB2  LYS   6           HB2      LYS   6 -26.437  -5.716  33.540
   45    HB3  LYS   6           HB3      LYS   6 -25.185  -5.651  32.311
   46    HG2  LYS   6           HG2      LYS   6 -26.247  -3.416  31.563
   47    HG3  LYS   6           HG3      LYS   6 -27.294  -3.544  32.988
   48    HD2  LYS   6           HD2      LYS   6 -25.192  -3.700  34.401
   49    HD3  LYS   6           HD3      LYS   6 -24.251  -3.361  32.947
   50    HE2  LYS   6           HE2      LYS   6 -26.268  -1.528  34.308
   51    HE3  LYS   6           HE3      LYS   6 -24.510  -1.348  34.266
   52    HZ1  LYS   6           HZ1      LYS   6 -26.416  -0.959  32.046
   53    HZ2  LYS   6           HZ2      LYS   6 -24.841  -1.202  31.727
   54    HZ3  LYS   6           HZ3      LYS   6 -25.265   0.089  32.621
   55    H    GLN   7           H        GLN   7 -28.131  -7.013  29.315
   56    HA   GLN   7           HA       GLN   7 -25.823  -6.442  27.604
   57    HB2  GLN   7           HB2      GLN   7 -28.584  -7.497  26.888
   58    HB3  GLN   7           HB3      GLN   7 -27.189  -7.397  25.803
   59    HG2  GLN   7           HG2      GLN   7 -25.905  -8.874  27.396
   60    HG3  GLN   7           HG3      GLN   7 -27.381  -9.067  28.343
   61   HE21  GLN   7          HE21      GLN   7 -26.222 -11.343  27.478
   62   HE22  GLN   7          HE22      GLN   7 -27.166 -12.029  26.165
   63    H    GLU   8           H        GLU   8 -25.416  -4.701  26.399
   64    HA   GLU   8           HA       GLU   8 -27.523  -2.583  26.114
   65    HB2  GLU   8           HB2      GLU   8 -24.558  -2.285  26.790
   66    HB3  GLU   8           HB3      GLU   8 -25.668  -0.948  26.471
   67    HG2  GLU   8           HG2      GLU   8 -27.077  -1.695  28.399
   68    HG3  GLU   8           HG3      GLU   8 -25.866  -2.910  28.779
   69    H    LYS   9           H        LYS   9 -25.418  -4.494  24.330
   70    HA   LYS   9           HA       LYS   9 -24.606  -4.447  22.248
   71    HB2  LYS   9           HB2      LYS   9 -26.134  -4.114  20.487
   72    HB3  LYS   9           HB3      LYS   9 -26.873  -4.984  21.809
   73    HG2  LYS   9           HG2      LYS   9 -28.203  -2.998  22.403
   74    HG3  LYS   9           HG3      LYS   9 -27.399  -2.056  21.126
   75    HD2  LYS   9           HD2      LYS   9 -28.278  -3.620  19.411
   76    HD3  LYS   9           HD3      LYS   9 -29.033  -4.599  20.679
   77    HE2  LYS   9           HE2      LYS   9 -30.456  -2.675  21.322
   78    HE3  LYS   9           HE3      LYS   9 -29.718  -1.700  20.051
   79    HZ1  LYS   9           HZ1      LYS   9 -31.275  -4.188  19.590
   80    HZ2  LYS   9           HZ2      LYS   9 -30.646  -3.269  18.402
   81    HZ3  LYS   9           HZ3      LYS   9 -31.840  -2.661  19.343
   82    H    THR  10           H        THR  10 -23.505  -2.450  23.711
   83    HA   THR  10           HA       THR  10 -23.278  -0.006  22.216
   84    HB   THR  10           HB       THR  10 -21.286   0.321  23.853
   85    HG1  THR  10           HG1      THR  10 -21.703  -0.986  25.762
   86   HG21  THR  10          HG21      THR  10 -23.418   1.437  24.201
   87   HG22  THR  10          HG22      THR  10 -22.884   0.778  25.743
   88   HG23  THR  10          HG23      THR  10 -24.155  -0.053  24.822
   89    HA   PRO  11           HA       PRO  11 -20.352  -1.282  19.196
   90    HB2  PRO  11           HB2      PRO  11 -19.193   1.495  19.353
   91    HB3  PRO  11           HB3      PRO  11 -19.712   0.556  17.915
   92    HG2  PRO  11           HG2      PRO  11 -21.331   2.464  18.907
   93    HG3  PRO  11           HG3      PRO  11 -22.037   0.864  18.495
   94    HD2  PRO  11           HD2      PRO  11 -21.093   1.858  21.208
   95    HD3  PRO  11           HD3      PRO  11 -22.671   1.158  20.750
   96    H    LYS  12           H        LYS  12 -18.891  -2.732  19.784
   97    HA   LYS  12           HA       LYS  12 -16.284  -1.955  21.015
   98    HB2  LYS  12           HB2      LYS  12 -18.176  -4.077  22.098
   99    HB3  LYS  12           HB3      LYS  12 -16.495  -3.844  22.619
  100    HG2  LYS  12           HG2      LYS  12 -17.039  -1.502  23.268
  101    HG3  LYS  12           HG3      LYS  12 -18.741  -1.809  22.889
  102    HD2  LYS  12           HD2      LYS  12 -18.810  -3.607  24.564
  103    HD3  LYS  12           HD3      LYS  12 -17.112  -3.271  24.993
  104    HE2  LYS  12           HE2      LYS  12 -17.701  -0.938  25.538
  105    HE3  LYS  12           HE3      LYS  12 -19.385  -1.231  25.077
  106    HZ1  LYS  12           HZ1      LYS  12 -17.967  -2.661  27.249
  107    HZ2  LYS  12           HZ2      LYS  12 -19.579  -2.810  26.890
  108    HZ3  LYS  12           HZ3      LYS  12 -18.961  -1.404  27.519
  109    H    THR  13           H        THR  13 -16.693  -2.506  18.349
  110    HA   THR  13           HA       THR  13 -14.934  -4.872  17.964
  111    HB   THR  13           HB       THR  13 -17.416  -4.408  16.274
  112    HG1  THR  13           HG1      THR  13 -18.108  -6.283  17.124
  113   HG21  THR  13          HG21      THR  13 -16.789  -6.596  15.263
  114   HG22  THR  13          HG22      THR  13 -15.283  -6.600  16.205
  115   HG23  THR  13          HG23      THR  13 -15.554  -5.383  14.941
  116    HA   PRO  14           HA       PRO  14 -13.504  -1.031  15.788
  117    HB2  PRO  14           HB2      PRO  14 -10.914  -0.999  16.623
  118    HB3  PRO  14           HB3      PRO  14 -12.267  -0.417  17.643
  119    HG2  PRO  14           HG2      PRO  14 -10.925  -3.137  17.712
  120    HG3  PRO  14           HG3      PRO  14 -11.279  -2.039  19.087
  121    HD2  PRO  14           HD2      PRO  14 -12.913  -4.112  18.389
  122    HD3  PRO  14           HD3      PRO  14 -13.565  -2.582  19.054
  123    H    LYS  15           H        LYS  15 -12.021  -0.790  14.037
  124    HA   LYS  15           HA       LYS  15 -11.396  -3.347  12.614
  125    HB2  LYS  15           HB2      LYS  15 -12.919  -0.920  11.814
  126    HB3  LYS  15           HB3      LYS  15 -11.761  -1.474  10.629
  127    HG2  LYS  15           HG2      LYS  15 -13.753  -2.579  10.067
  128    HG3  LYS  15           HG3      LYS  15 -12.709  -3.791  10.785
  129    HD2  LYS  15           HD2      LYS  15 -14.875  -4.205  11.643
  130    HD3  LYS  15           HD3      LYS  15 -14.013  -3.444  12.978
  131    HE2  LYS  15           HE2      LYS  15 -15.067  -1.241  12.313
  132    HE3  LYS  15           HE3      LYS  15 -15.929  -2.090  11.023
  133    HZ1  LYS  15           HZ1      LYS  15 -17.400  -1.980  12.872
  134    HZ2  LYS  15           HZ2      LYS  15 -16.255  -2.511  13.939
  135    HZ3  LYS  15           HZ3      LYS  15 -16.884  -3.529  12.820
  136    H    GLY  16           H        GLY  16  -9.790  -0.849  14.023
  137    HA2  GLY  16           HA2      GLY  16  -7.498  -0.791  12.113
  138    HA3  GLY  16           HA3      GLY  16  -7.801   0.300  13.454
  139    HA   PRO  17           HA       PRO  17  -5.461  -3.724  15.180
  140    HB2  PRO  17           HB2      PRO  17  -3.969  -4.129  12.590
  141    HB3  PRO  17           HB3      PRO  17  -4.370  -5.321  13.862
  142    HG2  PRO  17           HG2      PRO  17  -5.831  -5.221  11.587
  143    HG3  PRO  17           HG3      PRO  17  -6.645  -5.408  13.177
  144    HD2  PRO  17           HD2      PRO  17  -6.350  -2.898  11.515
  145    HD3  PRO  17           HD3      PRO  17  -7.751  -3.532  12.423
  146    H    SER  18           H        SER  18  -2.870  -3.999  15.259
  147    HA   SER  18           HA       SER  18  -1.742  -1.232  15.428
  148    HB2  SER  18           HB2      SER  18  -1.151  -3.778  16.959
  149    HB3  SER  18           HB3      SER  18  -0.197  -2.290  17.099
  150    HG   SER  18           HG       SER  18  -1.758  -2.436  18.692
  151    H    SER  19           H        SER  19  -1.124  -4.386  13.978
  152    HA   SER  19           HA       SER  19   1.471  -3.393  12.848
  153    HB2  SER  19           HB2      SER  19   1.375  -5.467  14.337
  154    HB3  SER  19           HB3      SER  19   0.576  -6.278  12.968
  155    HG   SER  19           HG       SER  19   3.059  -6.164  13.261
  156    H    VAL  20           H        VAL  20   1.680  -5.224  10.727
  157    HA   VAL  20           HA       VAL  20   0.780  -3.640   8.652
  158    HB   VAL  20           HB       VAL  20   1.362  -6.621   8.416
  159   HG11  VAL  20          HG11      VAL  20   0.452  -5.785   6.308
  160   HG12  VAL  20          HG12      VAL  20   1.546  -4.384   6.355
  161   HG13  VAL  20          HG13      VAL  20   2.182  -6.033   6.136
  162   HG21  VAL  20          HG21      VAL  20   3.679  -5.869   7.859
  163   HG22  VAL  20          HG22      VAL  20   3.227  -4.216   8.326
  164   HG23  VAL  20          HG23      VAL  20   3.239  -5.520   9.533
  165    H    GLU  21           H        GLU  21  -1.124  -6.244  10.084
  166    HA   GLU  21           HA       GLU  21  -3.130  -6.500   8.073
  167    HB2  GLU  21           HB2      GLU  21  -3.267  -6.748  11.097
  168    HB3  GLU  21           HB3      GLU  21  -4.609  -7.157  10.042
  169    HG2  GLU  21           HG2      GLU  21  -1.862  -8.468  10.010
  170    HG3  GLU  21           HG3      GLU  21  -3.323  -9.141  10.720
  171    H    ASP  22           H        ASP  22  -2.515  -3.771  10.177
  172    HA   ASP  22           HA       ASP  22  -5.105  -2.483   9.915
  173    HB2  ASP  22           HB2      ASP  22  -3.562  -2.009  11.769
  174    HB3  ASP  22           HB3      ASP  22  -2.358  -1.405  10.639
  175    H    ILE  23           H        ILE  23  -1.902  -1.717   8.279
  176    HA   ILE  23           HA       ILE  23  -3.202  -0.036   6.353
  177    HB   ILE  23           HB       ILE  23  -0.825   0.154   6.707
  178   HG12  ILE  23          HG12      ILE  23  -1.213  -0.736   3.830
  179   HG13  ILE  23          HG13      ILE  23  -1.960   0.723   4.476
  180   HG21  ILE  23          HG21      ILE  23  -0.181  -2.175   7.097
  181   HG22  ILE  23          HG22      ILE  23  -0.532  -2.599   5.402
  182   HG23  ILE  23          HG23      ILE  23   0.791  -1.492   5.806
  183   HD11  ILE  23          HD11      ILE  23   0.095   1.288   3.315
  184   HD12  ILE  23          HD12      ILE  23   0.263   1.643   5.043
  185   HD13  ILE  23          HD13      ILE  23   1.038   0.200   4.345
  186    H    LYS  24           H        LYS  24  -2.730  -3.550   6.399
  187    HA   LYS  24           HA       LYS  24  -3.624  -4.061   3.728
  188    HB2  LYS  24           HB2      LYS  24  -2.525  -5.624   5.488
  189    HB3  LYS  24           HB3      LYS  24  -4.140  -5.827   6.153
  190    HG2  LYS  24           HG2      LYS  24  -3.553  -7.664   4.750
  191    HG3  LYS  24           HG3      LYS  24  -4.899  -6.792   3.996
  192    HD2  LYS  24           HD2      LYS  24  -3.531  -5.935   2.273
  193    HD3  LYS  24           HD3      LYS  24  -2.032  -6.193   3.179
  194    HE2  LYS  24           HE2      LYS  24  -3.827  -8.463   2.171
  195    HE3  LYS  24           HE3      LYS  24  -2.466  -7.800   1.254
  196    HZ1  LYS  24           HZ1      LYS  24  -2.230  -9.106   3.913
  197    HZ2  LYS  24           HZ2      LYS  24  -1.006  -8.379   3.105
  198    HZ3  LYS  24           HZ3      LYS  24  -1.714  -9.726   2.506
  199    H    ALA  25           H        ALA  25  -5.525  -3.879   6.781
  200    HA   ALA  25           HA       ALA  25  -8.096  -4.158   5.546
  201    HB1  ALA  25           HB1      ALA  25  -7.218  -2.889   8.180
  202    HB2  ALA  25           HB2      ALA  25  -8.892  -3.254   7.724
  203    HB3  ALA  25           HB3      ALA  25  -7.722  -4.575   7.918
  204    H    LYS  26           H        LYS  26  -6.202  -1.218   6.412
  205    HA   LYS  26           HA       LYS  26  -8.282   0.616   5.569
  206    HB2  LYS  26           HB2      LYS  26  -5.435   0.862   6.529
  207    HB3  LYS  26           HB3      LYS  26  -6.209   2.233   5.759
  208    HG2  LYS  26           HG2      LYS  26  -6.395   2.340   8.189
  209    HG3  LYS  26           HG3      LYS  26  -7.959   2.342   7.372
  210    HD2  LYS  26           HD2      LYS  26  -8.287  -0.035   7.993
  211    HD3  LYS  26           HD3      LYS  26  -6.716  -0.045   8.811
  212    HE2  LYS  26           HE2      LYS  26  -9.023   1.811   9.519
  213    HE3  LYS  26           HE3      LYS  26  -8.699   0.265  10.317
  214    HZ1  LYS  26           HZ1      LYS  26  -7.736   2.087  11.548
  215    HZ2  LYS  26           HZ2      LYS  26  -6.838   2.588  10.288
  216    HZ3  LYS  26           HZ3      LYS  26  -6.506   1.134  10.966
  217    H    MET  27           H        MET  27  -5.517  -0.760   3.788
  218    HA   MET  27           HA       MET  27  -6.068   0.810   1.407
  219    HB2  MET  27           HB2      MET  27  -4.619  -1.821   1.822
  220    HB3  MET  27           HB3      MET  27  -4.748  -1.030   0.254
  221    HG2  MET  27           HG2      MET  27  -3.646   0.560   2.572
  222    HG3  MET  27           HG3      MET  27  -2.659  -0.688   1.833
  223    HE1  MET  27           HE1      MET  27  -4.399   2.738   1.411
  224    HE2  MET  27           HE2      MET  27  -3.866   3.297  -0.186
  225    HE3  MET  27           HE3      MET  27  -5.117   2.051  -0.070
  226    H    GLN  28           H        GLN  28  -7.252  -2.418   2.536
  227    HA   GLN  28           HA       GLN  28  -8.971  -2.869   0.245
  228    HB2  GLN  28           HB2      GLN  28  -8.846  -3.829   3.097
  229    HB3  GLN  28           HB3      GLN  28 -10.349  -4.042   2.241
  230    HG2  GLN  28           HG2      GLN  28  -8.584  -5.960   2.233
  231    HG3  GLN  28           HG3      GLN  28  -9.575  -5.630   0.826
  232   HE21  GLN  28          HE21      GLN  28  -6.314  -4.693   2.122
  233   HE22  GLN  28          HE22      GLN  28  -5.560  -4.818   0.527
  234    H    ALA  29           H        ALA  29  -9.594  -1.159   3.376
  235    HA   ALA  29           HA       ALA  29 -12.212  -0.350   2.755
  236    HB1  ALA  29           HB1      ALA  29 -11.201  -0.195   5.005
  237    HB2  ALA  29           HB2      ALA  29 -10.117   1.096   4.430
  238    HB3  ALA  29           HB3      ALA  29 -11.857   1.372   4.479
  239    H    SER  30           H        SER  30  -9.112   1.312   1.980
  240    HA   SER  30           HA       SER  30 -10.152   3.599   0.679
  241    HB2  SER  30           HB2      SER  30  -7.648   1.996   0.008
  242    HB3  SER  30           HB3      SER  30  -8.037   3.597  -0.613
  243    HG   SER  30           HG       SER  30  -7.732   2.942   2.152
  244    H    ILE  31           H        ILE  31  -9.540   0.327  -0.687
  245    HA   ILE  31           HA       ILE  31 -10.408   0.963  -3.362
  246    HB   ILE  31           HB       ILE  31 -10.129  -1.648  -1.839
  247   HG12  ILE  31          HG12      ILE  31  -8.507  -0.518  -4.167
  248   HG13  ILE  31          HG13      ILE  31  -8.075  -0.255  -2.484
  249   HG21  ILE  31          HG21      ILE  31 -11.875  -2.010  -3.549
  250   HG22  ILE  31          HG22      ILE  31 -10.809  -1.314  -4.796
  251   HG23  ILE  31          HG23      ILE  31 -10.399  -2.838  -3.992
  252   HD11  ILE  31          HD11      ILE  31  -7.902  -2.726  -2.142
  253   HD12  ILE  31          HD12      ILE  31  -8.166  -2.947  -3.890
  254   HD13  ILE  31          HD13      ILE  31  -6.746  -2.066  -3.315
  255    H    GLU  32           H        GLU  32 -12.178  -0.347  -0.513
  256    HA   GLU  32           HA       GLU  32 -14.738  -0.447  -1.854
  257    HB2  GLU  32           HB2      GLU  32 -14.055  -0.339   1.105
  258    HB3  GLU  32           HB3      GLU  32 -15.655  -0.656   0.456
  259    HG2  GLU  32           HG2      GLU  32 -13.201  -2.418   0.143
  260    HG3  GLU  32           HG3      GLU  32 -14.619  -2.737   1.130
  261    H    LYS  33           H        LYS  33 -13.053   2.200  -0.397
  262    HA   LYS  33           HA       LYS  33 -15.452   3.963  -0.558
  263    HB2  LYS  33           HB2      LYS  33 -12.857   4.190   1.010
  264    HB3  LYS  33           HB3      LYS  33 -14.083   5.460   0.935
  265    HG2  LYS  33           HG2      LYS  33 -15.789   3.978   1.832
  266    HG3  LYS  33           HG3      LYS  33 -14.665   2.625   1.904
  267    HD2  LYS  33           HD2      LYS  33 -13.364   3.592   3.630
  268    HD3  LYS  33           HD3      LYS  33 -14.089   5.199   3.414
  269    HE2  LYS  33           HE2      LYS  33 -16.245   4.438   4.203
  270    HE3  LYS  33           HE3      LYS  33 -15.708   2.753   4.231
  271    HZ1  LYS  33           HZ1      LYS  33 -14.265   3.221   6.030
  272    HZ2  LYS  33           HZ2      LYS  33 -15.723   3.834   6.430
  273    HZ3  LYS  33           HZ3      LYS  33 -14.535   4.862   5.966
  274    H    GLY  34           H        GLY  34 -13.273   3.197  -2.744
  275    HA2  GLY  34           HA2      GLY  34 -13.204   4.160  -4.850
  276    HA3  GLY  34           HA3      GLY  34 -13.976   5.606  -4.202
  277    H    GLY  35           H        GLY  35 -11.013   4.756  -2.594
  278    HA2  GLY  35           HA2      GLY  35  -9.707   7.200  -3.560
  279    HA3  GLY  35           HA3      GLY  35  -9.063   6.013  -2.429
  280    H    SER  36           H        SER  36  -7.612   7.257  -4.608
  281    HA   SER  36           HA       SER  36  -7.139   5.021  -6.516
  282    HB2  SER  36           HB2      SER  36  -5.757   6.634  -7.775
  283    HB3  SER  36           HB3      SER  36  -7.467   7.051  -7.650
  284    HG   SER  36           HG       SER  36  -5.989   8.813  -7.358
  285    H    LEU  37           H        LEU  37  -5.015   4.258  -6.984
  286    HA   LEU  37           HA       LEU  37  -2.890   4.717  -4.984
  287    HB2  LEU  37           HB2      LEU  37  -4.408   2.931  -4.113
  288    HB3  LEU  37           HB3      LEU  37  -4.150   2.011  -5.590
  289    HG   LEU  37           HG       LEU  37  -1.707   1.810  -4.955
  290   HD11  LEU  37          HD11      LEU  37  -1.084   2.263  -2.610
  291   HD12  LEU  37          HD12      LEU  37  -2.689   2.952  -2.299
  292   HD13  LEU  37          HD13      LEU  37  -1.572   3.771  -3.398
  293   HD21  LEU  37          HD21      LEU  37  -3.306   0.012  -4.490
  294   HD22  LEU  37          HD22      LEU  37  -3.800   0.803  -2.978
  295   HD23  LEU  37          HD23      LEU  37  -2.162   0.150  -3.138
  296    HA   PRO  38           HA       PRO  38  -0.692   4.361  -8.822
  297    HB2  PRO  38           HB2      PRO  38   1.778   3.651  -7.288
  298    HB3  PRO  38           HB3      PRO  38   1.515   4.964  -8.474
  299    HG2  PRO  38           HG2      PRO  38   1.586   5.533  -5.822
  300    HG3  PRO  38           HG3      PRO  38   0.338   6.285  -6.860
  301    HD2  PRO  38           HD2      PRO  38   0.075   3.813  -5.121
  302    HD3  PRO  38           HD3      PRO  38  -0.957   5.274  -5.168
  303    H    LYS  39           H        LYS  39   0.488   2.993 -10.266
  304    HA   LYS  39           HA       LYS  39   0.430   0.059  -9.663
  305    HB2  LYS  39           HB2      LYS  39  -1.171   0.784 -11.375
  306    HB3  LYS  39           HB3      LYS  39   0.125   1.544 -12.311
  307    HG2  LYS  39           HG2      LYS  39   1.148  -0.591 -12.777
  308    HG3  LYS  39           HG3      LYS  39   0.127  -1.409 -11.599
  309    HD2  LYS  39           HD2      LYS  39  -0.653  -1.981 -13.769
  310    HD3  LYS  39           HD3      LYS  39  -1.871  -0.910 -13.056
  311    HE2  LYS  39           HE2      LYS  39  -1.066   0.977 -14.378
  312    HE3  LYS  39           HE3      LYS  39   0.353   0.064 -14.905
  313    HZ1  LYS  39           HZ1      LYS  39  -1.090  -1.416 -16.150
  314    HZ2  LYS  39           HZ2      LYS  39  -1.386   0.150 -16.594
  315    HZ3  LYS  39           HZ3      LYS  39  -2.441  -0.626 -15.649
  316    H    VAL  40           H        VAL  40   2.442   2.734 -10.713
  317    HA   VAL  40           HA       VAL  40   4.739   1.009 -11.334
  318    HB   VAL  40           HB       VAL  40   4.078   3.067 -12.612
  319   HG11  VAL  40          HG11      VAL  40   5.421   4.590 -10.346
  320   HG12  VAL  40          HG12      VAL  40   4.729   5.241 -11.843
  321   HG13  VAL  40          HG13      VAL  40   3.665   4.548 -10.619
  322   HG21  VAL  40          HG21      VAL  40   6.378   3.782 -13.044
  323   HG22  VAL  40          HG22      VAL  40   6.921   2.939 -11.576
  324   HG23  VAL  40          HG23      VAL  40   6.242   2.024 -12.938
  325    H    GLU  41           H        GLU  41   6.649   0.836 -10.198
  326    HA   GLU  41           HA       GLU  41   6.101   0.424  -7.514
  327    HB2  GLU  41           HB2      GLU  41   8.253  -0.552  -7.294
  328    HB3  GLU  41           HB3      GLU  41   7.573  -0.952  -8.869
  329    HG2  GLU  41           HG2      GLU  41   9.043   0.753  -9.933
  330    HG3  GLU  41           HG3      GLU  41   9.713   1.142  -8.354
  331    H    ALA  42           H        ALA  42   8.326   3.082  -8.668
  332    HA   ALA  42           HA       ALA  42   9.044   3.721  -5.959
  333    HB1  ALA  42           HB1      ALA  42  10.444   4.321  -7.875
  334    HB2  ALA  42           HB2      ALA  42   9.206   5.471  -8.444
  335    HB3  ALA  42           HB3      ALA  42  10.032   5.736  -6.896
  336    H    LYS  43           H        LYS  43   6.553   5.135  -8.123
  337    HA   LYS  43           HA       LYS  43   5.617   7.075  -6.196
  338    HB2  LYS  43           HB2      LYS  43   4.063   5.743  -8.457
  339    HB3  LYS  43           HB3      LYS  43   3.538   7.145  -7.505
  340    HG2  LYS  43           HG2      LYS  43   5.529   8.404  -8.256
  341    HG3  LYS  43           HG3      LYS  43   5.994   7.029  -9.280
  342    HD2  LYS  43           HD2      LYS  43   3.833   7.245 -10.516
  343    HD3  LYS  43           HD3      LYS  43   3.421   8.650  -9.516
  344    HE2  LYS  43           HE2      LYS  43   5.376   9.872 -10.375
  345    HE3  LYS  43           HE3      LYS  43   5.870   8.460 -11.329
  346    HZ1  LYS  43           HZ1      LYS  43   3.832   8.649 -12.590
  347    HZ2  LYS  43           HZ2      LYS  43   4.587  10.131 -12.632
  348    HZ3  LYS  43           HZ3      LYS  43   3.281   9.871 -11.674
  349    H    PHE  44           H        PHE  44   4.793   3.642  -6.753
  350    HA   PHE  44           HA       PHE  44   2.697   3.559  -4.841
  351    HB2  PHE  44           HB2      PHE  44   2.980   1.807  -6.507
  352    HB3  PHE  44           HB3      PHE  44   4.571   1.408  -5.899
  353    HD1  PHE  44           HD2      PHE  44   0.931   1.221  -5.166
  354    HD2  PHE  44           HD1      PHE  44   4.886  -0.071  -4.024
  355    HE1  PHE  44           HE2      PHE  44  -0.052  -0.496  -3.663
  356    HE2  PHE  44           HE1      PHE  44   3.895  -1.789  -2.529
  357    HZ   PHE  44           HZ       PHE  44   1.419  -1.998  -2.351
  358    H    ILE  45           H        ILE  45   6.218   2.854  -4.454
  359    HA   ILE  45           HA       ILE  45   6.159   2.319  -1.660
  360    HB   ILE  45           HB       ILE  45   8.340   3.383  -3.485
  361   HG12  ILE  45          HG12      ILE  45   8.098   0.655  -2.148
  362   HG13  ILE  45          HG13      ILE  45   7.355   0.977  -3.702
  363   HG21  ILE  45          HG21      ILE  45   8.574   2.539  -0.558
  364   HG22  ILE  45          HG22      ILE  45   9.953   2.765  -1.644
  365   HG23  ILE  45          HG23      ILE  45   8.942   4.143  -1.238
  366   HD11  ILE  45          HD11      ILE  45   9.576   1.571  -4.660
  367   HD12  ILE  45          HD12      ILE  45  10.338   1.119  -3.117
  368   HD13  ILE  45          HD13      ILE  45   9.477  -0.097  -4.070
  369    H    ASN  46           H        ASN  46   6.761   5.502  -3.302
  370    HA   ASN  46           HA       ASN  46   6.907   7.081  -0.954
  371    HB2  ASN  46           HB2      ASN  46   7.484   8.063  -3.049
  372    HB3  ASN  46           HB3      ASN  46   5.937   7.652  -3.781
  373   HD21  ASN  46          HD21      ASN  46   4.263   9.147  -3.680
  374   HD22  ASN  46          HD22      ASN  46   4.218  10.476  -2.542
  375    H    TYR  47           H        TYR  47   3.973   6.062  -2.775
  376    HA   TYR  47           HA       TYR  47   2.243   7.574  -1.054
  377    HB2  TYR  47           HB2      TYR  47   1.895   6.969  -3.477
  378    HB3  TYR  47           HB3      TYR  47   1.330   5.386  -2.918
  379    HD1  TYR  47           HD1      TYR  47   0.739   9.027  -3.041
  380    HD2  TYR  47           HD2      TYR  47  -0.854   5.269  -1.626
  381    HE1  TYR  47           HE1      TYR  47  -1.402  10.142  -2.485
  382    HE2  TYR  47           HE2      TYR  47  -3.011   6.395  -1.097
  383    HH   TYR  47           HH       TYR  47  -3.429   9.941  -1.500
  384    H    VAL  48           H        VAL  48   3.238   4.120  -0.996
  385    HA   VAL  48           HA       VAL  48   1.585   3.379   1.257
  386    HB   VAL  48           HB       VAL  48   4.170   2.283   0.118
  387   HG11  VAL  48          HG11      VAL  48   3.848   0.333   1.691
  388   HG12  VAL  48          HG12      VAL  48   4.403   1.814   2.470
  389   HG13  VAL  48          HG13      VAL  48   2.697   1.333   2.613
  390   HG21  VAL  48          HG21      VAL  48   2.025   1.842  -1.088
  391   HG22  VAL  48          HG22      VAL  48   2.731   0.365  -0.428
  392   HG23  VAL  48          HG23      VAL  48   1.352   1.126   0.394
  393    H    LYS  49           H        LYS  49   4.880   4.815   1.076
  394    HA   LYS  49           HA       LYS  49   5.211   5.047   3.941
  395    HB2  LYS  49           HB2      LYS  49   6.483   6.508   1.597
  396    HB3  LYS  49           HB3      LYS  49   6.933   6.778   3.285
  397    HG2  LYS  49           HG2      LYS  49   7.551   4.413   3.547
  398    HG3  LYS  49           HG3      LYS  49   7.091   4.061   1.885
  399    HD2  LYS  49           HD2      LYS  49   8.846   5.481   1.014
  400    HD3  LYS  49           HD3      LYS  49   9.199   6.118   2.635
  401    HE2  LYS  49           HE2      LYS  49   9.743   3.706   3.319
  402    HE3  LYS  49           HE3      LYS  49   9.712   3.294   1.599
  403    HZ1  LYS  49           HZ1      LYS  49  11.483   5.300   2.884
  404    HZ2  LYS  49           HZ2      LYS  49  11.494   4.955   1.274
  405    HZ3  LYS  49           HZ3      LYS  49  11.959   3.820   2.370
  406    H    ASN  50           H        ASN  50   3.255   6.893   1.738
  407    HA   ASN  50           HA       ASN  50   2.570   8.933   3.762
  408    HB2  ASN  50           HB2      ASN  50   2.213   9.976   1.822
  409    HB3  ASN  50           HB3      ASN  50   2.111   8.509   0.890
  410   HD21  ASN  50          HD21      ASN  50  -0.024   7.353   0.834
  411   HD22  ASN  50          HD22      ASN  50  -1.454   8.354   0.972
  412    H    CYS  51           H        CYS  51   1.021   5.920   2.482
  413    HA   CYS  51           HA       CYS  51  -1.342   6.215   4.038
  414    HB2  CYS  51           HB2      CYS  51  -0.045   3.815   2.695
  415    HB3  CYS  51           HB3      CYS  51  -1.605   3.724   3.530
  416    HG   CYS  51           HG       CYS  51  -2.849   5.522   2.226
  417    H    PHE  52           H        PHE  52   1.750   4.659   4.899
  418    HA   PHE  52           HA       PHE  52   0.827   5.021   7.674
  419    HB2  PHE  52           HB2      PHE  52   0.409   2.699   7.470
  420    HB3  PHE  52           HB3      PHE  52   1.966   2.409   6.699
  421    HD1  PHE  52           HD1      PHE  52   0.913   4.255   9.850
  422    HD2  PHE  52           HD2      PHE  52   3.346   1.137   8.110
  423    HE1  PHE  52           HE1      PHE  52   2.091   3.959  12.008
  424    HE2  PHE  52           HE2      PHE  52   4.511   0.850  10.269
  425    HZ   PHE  52           HZ       PHE  52   3.912   2.286  12.214
  426    H    ARG  53           H        ARG  53   3.899   3.489   6.818
  427    HA   ARG  53           HA       ARG  53   5.479   5.944   7.090
  428    HB2  ARG  53           HB2      ARG  53   4.682   5.343   9.475
  429    HB3  ARG  53           HB3      ARG  53   5.694   3.905   9.359
  430    HG2  ARG  53           HG2      ARG  53   7.666   5.409   8.904
  431    HG3  ARG  53           HG3      ARG  53   6.599   6.810   9.096
  432    HD2  ARG  53           HD2      ARG  53   6.080   6.039  11.428
  433    HD3  ARG  53           HD3      ARG  53   7.232   4.714  11.211
  434    HE   ARG  53           HE       ARG  53   8.114   7.558  10.861
  435   HH11  ARG  53          HH11      ARG  53   8.795   4.443  12.435
  436   HH12  ARG  53          HH12      ARG  53  10.110   5.197  13.331
  437   HH21  ARG  53          HH21      ARG  53   9.751   8.337  12.268
  438   HH22  ARG  53          HH22      ARG  53  10.584   7.129  13.221
  439    H    MET  54           H        MET  54   5.811   2.476   7.732
  440    HA   MET  54           HA       MET  54   7.019   0.809   6.921
  441    HB2  MET  54           HB2      MET  54   6.051   2.198   4.434
  442    HB3  MET  54           HB3      MET  54   6.917   0.662   4.357
  443    HG2  MET  54           HG2      MET  54   4.409   1.097   6.010
  444    HG3  MET  54           HG3      MET  54   4.449   0.392   4.395
  445    HE1  MET  54           HE1      MET  54   3.053  -1.615   5.329
  446    HE2  MET  54           HE2      MET  54   3.588  -2.702   6.628
  447    HE3  MET  54           HE3      MET  54   3.112  -1.036   7.013
  448    H    THR  55           H        THR  55   9.015   0.530   7.451
  449    HA   THR  55           HA       THR  55  11.090   1.179   5.387
  450    HB   THR  55           HB       THR  55  12.794   0.722   7.114
  451    HG1  THR  55           HG1      THR  55  12.017   0.865   9.315
  452   HG21  THR  55          HG21      THR  55  10.869   2.952   7.870
  453   HG22  THR  55          HG22      THR  55  12.172   3.044   6.671
  454   HG23  THR  55          HG23      THR  55  12.569   2.816   8.381
  455    H    ASP  56           H        ASP  56   9.242  -1.329   6.918
  456    HA   ASP  56           HA       ASP  56  11.119  -3.495   6.533
  457    HB2  ASP  56           HB2      ASP  56   8.112  -3.433   6.966
  458    HB3  ASP  56           HB3      ASP  56   9.074  -4.911   6.941
  459    H    GLN  57           H        GLN  57  11.877  -3.704   4.425
  460    HA   GLN  57           HA       GLN  57  10.224  -3.371   2.177
  461    HB2  GLN  57           HB2      GLN  57  12.948  -3.761   2.583
  462    HB3  GLN  57           HB3      GLN  57  12.462  -5.153   1.619
  463    HG2  GLN  57           HG2      GLN  57  11.867  -2.239   0.950
  464    HG3  GLN  57           HG3      GLN  57  13.207  -3.148   0.281
  465   HE21  GLN  57          HE21      GLN  57  10.688  -1.862  -0.924
  466   HE22  GLN  57          HE22      GLN  57  10.065  -3.133  -1.966
  467    H    GLU  58           H        GLU  58  10.838  -6.390   3.970
  468    HA   GLU  58           HA       GLU  58   9.463  -8.166   2.276
  469    HB2  GLU  58           HB2      GLU  58   8.949  -9.462   4.315
  470    HB3  GLU  58           HB3      GLU  58  10.645  -9.022   4.124
  471    HG2  GLU  58           HG2      GLU  58  10.558  -7.423   5.890
  472    HG3  GLU  58           HG3      GLU  58   8.798  -7.425   5.924
  473    H    ALA  59           H        ALA  59   7.963  -5.741   4.454
  474    HA   ALA  59           HA       ALA  59   5.252  -6.771   3.866
  475    HB1  ALA  59           HB1      ALA  59   6.118  -4.261   5.338
  476    HB2  ALA  59           HB2      ALA  59   4.461  -4.887   5.161
  477    HB3  ALA  59           HB3      ALA  59   5.666  -5.819   6.083
  478    H    ILE  60           H        ILE  60   7.384  -4.064   2.888
  479    HA   ILE  60           HA       ILE  60   5.518  -2.687   1.206
  480    HB   ILE  60           HB       ILE  60   8.520  -2.923   1.088
  481   HG12  ILE  60          HG12      ILE  60   6.808  -0.617   2.103
  482   HG13  ILE  60          HG13      ILE  60   7.460  -1.869   3.150
  483   HG21  ILE  60          HG21      ILE  60   8.467  -0.887  -0.356
  484   HG22  ILE  60          HG22      ILE  60   7.670  -2.231  -1.145
  485   HG23  ILE  60          HG23      ILE  60   6.691  -0.958  -0.384
  486   HD11  ILE  60          HD11      ILE  60   8.951  -0.014   3.298
  487   HD12  ILE  60          HD12      ILE  60   9.780  -1.276   2.374
  488   HD13  ILE  60          HD13      ILE  60   9.083   0.128   1.537
  489    H    GLN  61           H        GLN  61   7.816  -5.353   0.366
  490    HA   GLN  61           HA       GLN  61   6.709  -5.572  -2.286
  491    HB2  GLN  61           HB2      GLN  61   8.194  -7.334  -2.662
  492    HB3  GLN  61           HB3      GLN  61   9.021  -6.146  -1.681
  493    HG2  GLN  61           HG2      GLN  61   9.714  -8.078  -0.669
  494    HG3  GLN  61           HG3      GLN  61   8.345  -7.651   0.338
  495   HE21  GLN  61          HE21      GLN  61   7.129  -9.491   0.861
  496   HE22  GLN  61          HE22      GLN  61   6.878 -10.837  -0.272
  497    H    ASP  62           H        ASP  62   5.819  -7.202   0.807
  498    HA   ASP  62           HA       ASP  62   4.050  -9.085  -0.480
  499    HB2  ASP  62           HB2      ASP  62   4.824  -9.129   1.918
  500    HB3  ASP  62           HB3      ASP  62   3.679  -7.841   2.279
  501    H    LEU  63           H        LEU  63   3.607  -5.741   0.622
  502    HA   LEU  63           HA       LEU  63   0.841  -5.490  -0.084
  503    HB2  LEU  63           HB2      LEU  63   3.125  -3.631   0.518
  504    HB3  LEU  63           HB3      LEU  63   1.583  -2.964  -0.032
  505    HG   LEU  63           HG       LEU  63   1.874  -4.759   2.420
  506   HD11  LEU  63          HD11      LEU  63   1.658  -1.722   2.238
  507   HD12  LEU  63          HD12      LEU  63   3.100  -2.645   2.726
  508   HD13  LEU  63          HD13      LEU  63   1.642  -2.692   3.730
  509   HD21  LEU  63          HD21      LEU  63  -0.421  -4.747   1.513
  510   HD22  LEU  63          HD22      LEU  63  -0.411  -2.968   1.478
  511   HD23  LEU  63          HD23      LEU  63  -0.347  -3.841   3.025
  512    H    TRP  64           H        TRP  64   3.885  -4.882  -1.874
  513    HA   TRP  64           HA       TRP  64   2.747  -3.794  -4.253
  514    HB2  TRP  64           HB2      TRP  64   5.199  -3.855  -3.498
  515    HB3  TRP  64           HB3      TRP  64   5.234  -5.522  -4.006
  516    HD1  TRP  64           HD1      TRP  64   3.390  -3.254  -6.409
  517    HE1  TRP  64           HE1      TRP  64   4.851  -2.898  -8.504
  518    HE3  TRP  64           HE3      TRP  64   7.776  -5.316  -4.737
  519    HZ2  TRP  64           HZ2      TRP  64   7.600  -3.205  -9.238
  520    HZ3  TRP  64           HZ3      TRP  64   9.809  -5.256  -6.170
  521    HH2  TRP  64           HH2      TRP  64   9.740  -4.179  -8.403
  522    H    GLN  65           H        GLN  65   3.675  -7.176  -3.475
  523    HA   GLN  65           HA       GLN  65   2.615  -8.371  -5.845
  524    HB2  GLN  65           HB2      GLN  65   3.450  -9.339  -3.108
  525    HB3  GLN  65           HB3      GLN  65   2.555 -10.414  -4.165
  526    HG2  GLN  65           HG2      GLN  65   4.970 -10.763  -4.367
  527    HG3  GLN  65           HG3      GLN  65   4.210 -10.334  -5.891
  528   HE21  GLN  65          HE21      GLN  65   6.729  -9.396  -3.591
  529   HE22  GLN  65          HE22      GLN  65   7.294  -8.084  -4.613
  530    H    TRP  66           H        TRP  66   1.029  -7.619  -2.706
  531    HA   TRP  66           HA       TRP  66  -1.518  -8.738  -3.360
  532    HB2  TRP  66           HB2      TRP  66  -0.831  -7.885  -1.116
  533    HB3  TRP  66           HB3      TRP  66  -0.961  -6.240  -1.716
  534    HD1  TRP  66           HD1      TRP  66  -3.419  -5.256  -2.064
  535    HE1  TRP  66           HE1      TRP  66  -5.773  -6.043  -1.300
  536    HE3  TRP  66           HE3      TRP  66  -2.261 -10.041  -0.639
  537    HZ2  TRP  66           HZ2      TRP  66  -6.924  -8.362  -0.108
  538    HZ3  TRP  66           HZ3      TRP  66  -4.008 -11.502   0.357
  539    HH2  TRP  66           HH2      TRP  66  -6.339 -10.670   0.624
  540    H    ARG  67           H        ARG  67  -0.300  -5.374  -3.932
  541    HA   ARG  67           HA       ARG  67  -2.601  -4.460  -5.334
  542    HB2  ARG  67           HB2      ARG  67  -0.852  -3.033  -4.363
  543    HB3  ARG  67           HB3      ARG  67   0.308  -3.541  -5.580
  544    HG2  ARG  67           HG2      ARG  67  -2.338  -2.262  -6.364
  545    HG3  ARG  67           HG3      ARG  67  -0.993  -1.266  -5.827
  546    HD2  ARG  67           HD2      ARG  67   0.101  -1.406  -7.768
  547    HD3  ARG  67           HD3      ARG  67  -0.075  -3.155  -7.844
  548    HE   ARG  67           HE       ARG  67  -2.390  -1.407  -8.572
  549   HH11  ARG  67          HH11      ARG  67   0.151  -3.426  -9.841
  550   HH12  ARG  67          HH12      ARG  67  -0.818  -4.064 -11.143
  551   HH21  ARG  67          HH21      ARG  67  -3.574  -2.092 -10.317
  552   HH22  ARG  67          HH22      ARG  67  -2.901  -3.260 -11.437
  553    H    LYS  68           H        LYS  68   0.262  -6.129  -6.661
  554    HA   LYS  68           HA       LYS  68  -0.590  -6.146  -9.426
  555    HB2  LYS  68           HB2      LYS  68   1.114  -8.103  -7.832
  556    HB3  LYS  68           HB3      LYS  68   0.926  -8.151  -9.582
  557    HG2  LYS  68           HG2      LYS  68   2.030  -6.012  -9.859
  558    HG3  LYS  68           HG3      LYS  68   2.075  -5.739  -8.113
  559    HD2  LYS  68           HD2      LYS  68   3.467  -7.829  -7.868
  560    HD3  LYS  68           HD3      LYS  68   3.517  -7.951  -9.633
  561    HE2  LYS  68           HE2      LYS  68   4.672  -5.796  -9.784
  562    HE3  LYS  68           HE3      LYS  68   4.502  -5.550  -8.036
  563    HZ1  LYS  68           HZ1      LYS  68   5.990  -7.814  -9.213
  564    HZ2  LYS  68           HZ2      LYS  68   5.973  -7.374  -7.631
  565    HZ3  LYS  68           HZ3      LYS  68   6.720  -6.436  -8.779
  566    H    SER  69           H        SER  69  -1.519  -8.212  -6.695
  567    HA   SER  69           HA       SER  69  -2.623 -10.272  -8.412
  568    HB2  SER  69           HB2      SER  69  -2.644 -10.027  -5.401
  569    HB3  SER  69           HB3      SER  69  -3.141 -11.450  -6.346
  570    HG   SER  69           HG       SER  69  -0.591 -10.294  -6.048
  571    H    LEU  70           H        LEU  70  -4.045  -7.377  -7.803
  572    HA   LEU  70           HA       LEU  70  -6.621  -8.506  -8.662
  573    HB2  LEU  70           HB2      LEU  70  -7.903  -7.022  -7.095
  574    HB3  LEU  70           HB3      LEU  70  -7.223  -8.472  -6.424
  575    HG   LEU  70           HG       LEU  70  -5.511  -6.032  -6.108
  576   HD11  LEU  70          HD11      LEU  70  -6.842  -5.250  -4.164
  577   HD12  LEU  70          HD12      LEU  70  -8.144  -6.376  -4.609
  578   HD13  LEU  70          HD13      LEU  70  -7.703  -5.034  -5.692
  579   HD21  LEU  70          HD21      LEU  70  -6.496  -8.147  -4.131
  580   HD22  LEU  70          HD22      LEU  70  -5.154  -7.001  -3.913
  581   HD23  LEU  70          HD23      LEU  70  -5.015  -8.295  -5.096
  Start of MODEL    4
    1    H    GLN   1           H1       GLN   1 -52.441 -14.775  19.407
    2    HA   GLN   1           HA       GLN   1 -50.582 -15.831  17.386
    3    HB2  GLN   1           HB2      GLN   1 -49.742 -13.524  17.141
    4    HB3  GLN   1           HB3      GLN   1 -51.410 -13.703  16.589
    5    HG2  GLN   1           HG2      GLN   1 -52.259 -12.682  18.630
    6    HG3  GLN   1           HG3      GLN   1 -50.635 -12.648  19.343
    7   HE21  GLN   1          HE21      GLN   1 -51.217 -10.412  19.713
    8   HE22  GLN   1          HE22      GLN   1 -50.865  -9.245  18.425
    9    H    GLU   2           H        GLU   2 -48.396 -15.793  17.918
   10    HA   GLU   2           HA       GLU   2 -47.948 -16.528  20.676
   11    HB2  GLU   2           HB2      GLU   2 -46.151 -16.384  18.228
   12    HB3  GLU   2           HB3      GLU   2 -45.585 -16.933  19.811
   13    HG2  GLU   2           HG2      GLU   2 -47.236 -18.735  19.853
   14    HG3  GLU   2           HG3      GLU   2 -47.931 -18.187  18.325
   15    H    SER   3           H        SER   3 -46.130 -15.912  21.943
   16    HA   SER   3           HA       SER   3 -45.523 -12.977  21.962
   17    HB2  SER   3           HB2      SER   3 -45.573 -14.857  24.350
   18    HB3  SER   3           HB3      SER   3 -45.411 -13.094  24.366
   19    HG   SER   3           HG       SER   3 -47.528 -12.886  23.809
   20    H    PHE   4           H        PHE   4 -43.478 -12.692  21.295
   21    HA   PHE   4           HA       PHE   4 -41.407 -14.769  21.893
   22    HB2  PHE   4           HB2      PHE   4 -40.496 -13.769  19.593
   23    HB3  PHE   4           HB3      PHE   4 -41.533 -15.158  19.729
   24    HD1  PHE   4           HD1      PHE   4 -41.782 -11.405  19.377
   25    HD2  PHE   4           HD2      PHE   4 -43.432 -15.260  18.352
   26    HE1  PHE   4           HE1      PHE   4 -43.439 -10.308  17.884
   27    HE2  PHE   4           HE2      PHE   4 -45.075 -14.154  16.853
   28    HZ   PHE   4           HZ       PHE   4 -45.081 -11.688  16.616
   29    H    LYS   5           H        LYS   5 -39.271 -14.185  21.836
   30    HA   LYS   5           HA       LYS   5 -38.424 -11.645  23.051
   31    HB2  LYS   5           HB2      LYS   5 -36.994 -14.054  21.853
   32    HB3  LYS   5           HB3      LYS   5 -36.132 -12.631  22.424
   33    HG2  LYS   5           HG2      LYS   5 -36.022 -14.359  24.070
   34    HG3  LYS   5           HG3      LYS   5 -36.898 -12.962  24.700
   35    HD2  LYS   5           HD2      LYS   5 -38.987 -14.113  24.658
   36    HD3  LYS   5           HD3      LYS   5 -38.371 -15.363  23.568
   37    HE2  LYS   5           HE2      LYS   5 -38.663 -16.216  25.841
   38    HE3  LYS   5           HE3      LYS   5 -36.986 -16.322  25.284
   39    HZ1  LYS   5           HZ1      LYS   5 -38.022 -14.224  27.118
   40    HZ2  LYS   5           HZ2      LYS   5 -36.468 -14.356  26.594
   41    HZ3  LYS   5           HZ3      LYS   5 -37.090 -15.523  27.546
   42    H    LYS   6           H        LYS   6 -36.879 -10.208  21.987
   43    HA   LYS   6           HA       LYS   6 -36.963 -10.078  19.021
   44    HB2  LYS   6           HB2      LYS   6 -37.798  -7.745  19.057
   45    HB3  LYS   6           HB3      LYS   6 -39.003  -8.932  19.555
   46    HG2  LYS   6           HG2      LYS   6 -38.852  -8.301  21.863
   47    HG3  LYS   6           HG3      LYS   6 -37.383  -7.358  21.599
   48    HD2  LYS   6           HD2      LYS   6 -38.577  -5.738  20.240
   49    HD3  LYS   6           HD3      LYS   6 -40.084  -6.657  20.377
   50    HE2  LYS   6           HE2      LYS   6 -38.622  -5.789  22.886
   51    HE3  LYS   6           HE3      LYS   6 -39.515  -4.577  21.961
   52    HZ1  LYS   6           HZ1      LYS   6 -41.510  -5.746  22.228
   53    HZ2  LYS   6           HZ2      LYS   6 -40.828  -5.640  23.721
   54    HZ3  LYS   6           HZ3      LYS   6 -40.796  -7.070  22.877
   55    H    GLN   7           H        GLN   7 -35.488  -8.699  18.047
   56    HA   GLN   7           HA       GLN   7 -33.373  -7.515  19.814
   57    HB2  GLN   7           HB2      GLN   7 -33.044  -9.190  17.308
   58    HB3  GLN   7           HB3      GLN   7 -31.763  -8.174  17.965
   59    HG2  GLN   7           HG2      GLN   7 -31.900  -9.390  20.138
   60    HG3  GLN   7           HG3      GLN   7 -33.105 -10.467  19.439
   61   HE21  GLN   7          HE21      GLN   7 -31.410 -12.086  20.134
   62   HE22  GLN   7          HE22      GLN   7 -30.112 -12.445  18.988
   63    H    GLU   8           H        GLU   8 -31.962  -5.997  18.698
   64    HA   GLU   8           HA       GLU   8 -33.235  -4.446  16.457
   65    HB2  GLU   8           HB2      GLU   8 -31.789  -3.492  18.946
   66    HB3  GLU   8           HB3      GLU   8 -31.831  -2.499  17.483
   67    HG2  GLU   8           HG2      GLU   8 -34.196  -2.300  17.506
   68    HG3  GLU   8           HG3      GLU   8 -34.380  -3.617  18.666
   69    H    LYS   9           H        LYS   9 -30.489  -6.209  17.518
   70    HA   LYS   9           HA       LYS   9 -28.435  -6.626  16.652
   71    HB2  LYS   9           HB2      LYS   9 -29.803  -6.157  13.977
   72    HB3  LYS   9           HB3      LYS   9 -28.302  -7.039  14.273
   73    HG2  LYS   9           HG2      LYS   9 -29.684  -8.575  15.816
   74    HG3  LYS   9           HG3      LYS   9 -31.124  -7.816  15.123
   75    HD2  LYS   9           HD2      LYS   9 -30.359  -8.468  12.840
   76    HD3  LYS   9           HD3      LYS   9 -28.953  -9.271  13.538
   77    HE2  LYS   9           HE2      LYS   9 -31.866 -10.035  13.981
   78    HE3  LYS   9           HE3      LYS   9 -30.718 -10.866  12.929
   79    HZ1  LYS   9           HZ1      LYS   9 -30.803 -12.059  14.998
   80    HZ2  LYS   9           HZ2      LYS   9 -30.567 -10.714  15.893
   81    HZ3  LYS   9           HZ3      LYS   9 -29.359 -11.298  14.980
   82    H    THR  10           H        THR  10 -27.566  -4.814  17.700
   83    HA   THR  10           HA       THR  10 -26.258  -2.968  15.742
   84    HB   THR  10           HB       THR  10 -27.890  -1.716  16.998
   85    HG1  THR  10           HG1      THR  10 -26.588  -0.179  16.884
   86   HG21  THR  10          HG21      THR  10 -26.379  -2.436  19.531
   87   HG22  THR  10          HG22      THR  10 -28.053  -2.855  19.119
   88   HG23  THR  10          HG23      THR  10 -27.605  -1.165  19.366
   89    HA   PRO  11           HA       PRO  11 -22.989  -5.257  18.179
   90    HB2  PRO  11           HB2      PRO  11 -22.017  -7.050  16.374
   91    HB3  PRO  11           HB3      PRO  11 -23.416  -7.397  17.435
   92    HG2  PRO  11           HG2      PRO  11 -23.475  -6.471  14.542
   93    HG3  PRO  11           HG3      PRO  11 -24.388  -7.807  15.300
   94    HD2  PRO  11           HD2      PRO  11 -25.448  -5.314  14.917
   95    HD3  PRO  11           HD3      PRO  11 -25.866  -6.339  16.329
   96    H    LYS  12           H        LYS  12 -21.357  -3.821  18.247
   97    HA   LYS  12           HA       LYS  12 -20.266  -2.412  15.902
   98    HB2  LYS  12           HB2      LYS  12 -19.580  -2.514  18.859
   99    HB3  LYS  12           HB3      LYS  12 -18.378  -1.976  17.719
  100    HG2  LYS  12           HG2      LYS  12 -19.196   0.009  18.291
  101    HG3  LYS  12           HG3      LYS  12 -20.148  -0.280  16.852
  102    HD2  LYS  12           HD2      LYS  12 -21.143  -0.841  19.684
  103    HD3  LYS  12           HD3      LYS  12 -21.280   0.739  18.905
  104    HE2  LYS  12           HE2      LYS  12 -22.555  -0.292  17.033
  105    HE3  LYS  12           HE3      LYS  12 -22.498  -1.845  17.876
  106    HZ1  LYS  12           HZ1      LYS  12 -23.720  -0.828  19.716
  107    HZ2  LYS  12           HZ2      LYS  12 -24.548  -0.717  18.317
  108    HZ3  LYS  12           HZ3      LYS  12 -23.779   0.615  18.918
  109    H    THR  13           H        THR  13 -18.209  -2.604  15.082
  110    HA   THR  13           HA       THR  13 -16.629  -5.080  15.679
  111    HB   THR  13           HB       THR  13 -17.179  -3.987  12.897
  112    HG1  THR  13           HG1      THR  13 -18.635  -5.403  12.812
  113   HG21  THR  13          HG21      THR  13 -15.483  -6.332  13.877
  114   HG22  THR  13          HG22      THR  13 -14.926  -4.926  12.949
  115   HG23  THR  13          HG23      THR  13 -16.001  -6.103  12.189
  116    HA   PRO  14           HA       PRO  14 -13.808  -1.400  15.936
  117    HB2  PRO  14           HB2      PRO  14 -12.231  -2.345  17.958
  118    HB3  PRO  14           HB3      PRO  14 -13.758  -1.454  18.247
  119    HG2  PRO  14           HG2      PRO  14 -13.329  -4.456  18.223
  120    HG3  PRO  14           HG3      PRO  14 -14.194  -3.467  19.443
  121    HD2  PRO  14           HD2      PRO  14 -15.504  -4.796  17.459
  122    HD3  PRO  14           HD3      PRO  14 -16.066  -3.196  18.028
  123    H    LYS  15           H        LYS  15 -11.873  -1.387  14.833
  124    HA   LYS  15           HA       LYS  15 -10.894  -3.975  13.732
  125    HB2  LYS  15           HB2      LYS  15 -11.390  -3.303  11.470
  126    HB3  LYS  15           HB3      LYS  15 -12.855  -3.350  12.416
  127    HG2  LYS  15           HG2      LYS  15 -11.415  -0.716  12.102
  128    HG3  LYS  15           HG3      LYS  15 -12.288  -1.379  10.718
  129    HD2  LYS  15           HD2      LYS  15 -14.354  -1.469  11.994
  130    HD3  LYS  15           HD3      LYS  15 -13.534  -0.817  13.433
  131    HE2  LYS  15           HE2      LYS  15 -12.933   1.220  12.079
  132    HE3  LYS  15           HE3      LYS  15 -13.915   0.576  10.757
  133    HZ1  LYS  15           HZ1      LYS  15 -15.165   2.138  12.123
  134    HZ2  LYS  15           HZ2      LYS  15 -14.904   1.259  13.474
  135    HZ3  LYS  15           HZ3      LYS  15 -15.846   0.650  12.260
  136    H    GLY  16           H        GLY  16  -9.333  -3.463  11.832
  137    HA2  GLY  16           HA2      GLY  16  -7.361  -2.450  11.050
  138    HA3  GLY  16           HA3      GLY  16  -7.459  -1.235  12.306
  139    HA   PRO  17           HA       PRO  17  -5.719  -5.544  14.067
  140    HB2  PRO  17           HB2      PRO  17  -3.982  -5.965  11.619
  141    HB3  PRO  17           HB3      PRO  17  -4.580  -7.185  12.790
  142    HG2  PRO  17           HG2      PRO  17  -5.905  -6.846  10.477
  143    HG3  PRO  17           HG3      PRO  17  -6.834  -6.936  12.012
  144    HD2  PRO  17           HD2      PRO  17  -6.066  -4.489  10.425
  145    HD3  PRO  17           HD3      PRO  17  -7.604  -4.872  11.208
  146    H    SER  18           H        SER  18  -3.547  -6.212  14.816
  147    HA   SER  18           HA       SER  18  -1.806  -3.849  15.280
  148    HB2  SER  18           HB2      SER  18  -2.103  -6.456  16.797
  149    HB3  SER  18           HB3      SER  18  -1.067  -5.097  17.265
  150    HG   SER  18           HG       SER  18  -3.919  -5.034  16.985
  151    H    SER  19           H        SER  19  -1.488  -4.982  12.765
  152    HA   SER  19           HA       SER  19   1.281  -5.936  12.672
  153    HB2  SER  19           HB2      SER  19  -0.141  -7.966  13.256
  154    HB3  SER  19           HB3      SER  19  -0.974  -7.744  11.707
  155    HG   SER  19           HG       SER  19   0.583  -8.721  10.796
  156    H    VAL  20           H        VAL  20   1.700  -6.626  10.206
  157    HA   VAL  20           HA       VAL  20   1.144  -4.492   8.412
  158    HB   VAL  20           HB       VAL  20   1.872  -7.374   7.772
  159   HG11  VAL  20          HG11      VAL  20   2.893  -6.418   5.705
  160   HG12  VAL  20          HG12      VAL  20   1.147  -6.240   5.727
  161   HG13  VAL  20          HG13      VAL  20   2.171  -4.837   6.100
  162   HG21  VAL  20          HG21      VAL  20   3.525  -6.330   9.292
  163   HG22  VAL  20          HG22      VAL  20   4.192  -6.546   7.685
  164   HG23  VAL  20          HG23      VAL  20   3.654  -4.932   8.204
  165    H    GLU  21           H        GLU  21  -0.710  -7.424   9.021
  166    HA   GLU  21           HA       GLU  21  -2.633  -7.515   7.035
  167    HB2  GLU  21           HB2      GLU  21  -2.939  -7.816  10.060
  168    HB3  GLU  21           HB3      GLU  21  -4.197  -8.198   8.896
  169    HG2  GLU  21           HG2      GLU  21  -3.337 -10.274   9.159
  170    HG3  GLU  21           HG3      GLU  21  -2.385  -9.744   7.776
  171    H    ASP  22           H        ASP  22  -2.369  -4.999   9.515
  172    HA   ASP  22           HA       ASP  22  -4.924  -3.700   9.030
  173    HB2  ASP  22           HB2      ASP  22  -3.694  -3.536  11.127
  174    HB3  ASP  22           HB3      ASP  22  -2.296  -2.856  10.309
  175    H    ILE  23           H        ILE  23  -1.559  -2.843   8.034
  176    HA   ILE  23           HA       ILE  23  -2.551  -0.603   6.550
  177    HB   ILE  23           HB       ILE  23  -0.292  -0.719   7.492
  178   HG12  ILE  23          HG12      ILE  23  -0.108  -0.176   4.512
  179   HG13  ILE  23          HG13      ILE  23  -1.107   0.816   5.570
  180   HG21  ILE  23          HG21      ILE  23   0.345  -2.619   5.177
  181   HG22  ILE  23          HG22      ILE  23   1.547  -1.821   6.208
  182   HG23  ILE  23          HG23      ILE  23   0.418  -2.971   6.909
  183   HD11  ILE  23          HD11      ILE  23   0.816   1.393   6.969
  184   HD12  ILE  23          HD12      ILE  23   1.877   0.387   5.967
  185   HD13  ILE  23          HD13      ILE  23   1.108   1.828   5.275
  186    H    LYS  24           H        LYS  24  -1.918  -3.981   5.549
  187    HA   LYS  24           HA       LYS  24  -2.582  -3.290   2.763
  188    HB2  LYS  24           HB2      LYS  24  -2.335  -5.530   2.178
  189    HB3  LYS  24           HB3      LYS  24  -1.021  -5.076   3.255
  190    HG2  LYS  24           HG2      LYS  24  -2.362  -6.225   5.139
  191    HG3  LYS  24           HG3      LYS  24  -3.402  -6.873   3.853
  192    HD2  LYS  24           HD2      LYS  24  -1.327  -7.779   2.731
  193    HD3  LYS  24           HD3      LYS  24  -0.378  -7.216   4.120
  194    HE2  LYS  24           HE2      LYS  24  -1.533  -8.735   5.613
  195    HE3  LYS  24           HE3      LYS  24  -2.722  -9.164   4.372
  196    HZ1  LYS  24           HZ1      LYS  24   0.175  -9.722   4.046
  197    HZ2  LYS  24           HZ2      LYS  24  -1.067 -10.335   3.166
  198    HZ3  LYS  24           HZ3      LYS  24  -0.850 -10.793   4.727
  199    H    ALA  25           H        ALA  25  -4.561  -4.605   5.480
  200    HA   ALA  25           HA       ALA  25  -6.903  -4.877   3.857
  201    HB1  ALA  25           HB1      ALA  25  -8.127  -4.737   6.007
  202    HB2  ALA  25           HB2      ALA  25  -6.757  -5.852   6.086
  203    HB3  ALA  25           HB3      ALA  25  -6.631  -4.235   6.824
  204    H    LYS  26           H        LYS  26  -5.517  -2.009   5.491
  205    HA   LYS  26           HA       LYS  26  -7.766  -0.264   4.821
  206    HB2  LYS  26           HB2      LYS  26  -5.006   0.206   5.978
  207    HB3  LYS  26           HB3      LYS  26  -6.190   1.495   5.716
  208    HG2  LYS  26           HG2      LYS  26  -7.747   0.597   7.269
  209    HG3  LYS  26           HG3      LYS  26  -6.942  -0.971   7.324
  210    HD2  LYS  26           HD2      LYS  26  -6.479   0.211   9.360
  211    HD3  LYS  26           HD3      LYS  26  -4.991   0.013   8.422
  212    HE2  LYS  26           HE2      LYS  26  -5.295   2.382   7.583
  213    HE3  LYS  26           HE3      LYS  26  -6.664   2.540   8.688
  214    HZ1  LYS  26           HZ1      LYS  26  -3.854   1.994   9.426
  215    HZ2  LYS  26           HZ2      LYS  26  -5.084   1.962  10.513
  216    HZ3  LYS  26           HZ3      LYS  26  -4.691   3.372   9.740
  217    H    MET  27           H        MET  27  -4.473  -0.643   3.399
  218    HA   MET  27           HA       MET  27  -4.837   1.310   1.336
  219    HB2  MET  27           HB2      MET  27  -3.144  -1.206   1.574
  220    HB3  MET  27           HB3      MET  27  -3.085  -0.200   0.139
  221    HG2  MET  27           HG2      MET  27  -2.621   0.888   2.939
  222    HG3  MET  27           HG3      MET  27  -1.325   0.309   1.896
  223    HE1  MET  27           HE1      MET  27  -0.490   2.801   2.810
  224    HE2  MET  27           HE2      MET  27  -1.174   4.318   2.182
  225    HE3  MET  27           HE3      MET  27  -2.091   3.347   3.354
  226    H    GLN  28           H        GLN  28  -5.577  -2.227   1.321
  227    HA   GLN  28           HA       GLN  28  -6.711  -2.194  -1.317
  228    HB2  GLN  28           HB2      GLN  28  -6.979  -4.087   1.021
  229    HB3  GLN  28           HB3      GLN  28  -7.794  -4.363  -0.500
  230    HG2  GLN  28           HG2      GLN  28  -5.331  -5.351   0.127
  231    HG3  GLN  28           HG3      GLN  28  -5.976  -5.193  -1.497
  232   HE21  GLN  28          HE21      GLN  28  -5.313  -3.216  -2.772
  233   HE22  GLN  28          HE22      GLN  28  -3.733  -2.534  -2.364
  234    H    ALA  29           H        ALA  29  -8.291  -1.708   1.898
  235    HA   ALA  29           HA       ALA  29 -10.912  -1.347   0.828
  236    HB1  ALA  29           HB1      ALA  29  -9.586  -0.064   3.257
  237    HB2  ALA  29           HB2      ALA  29 -11.323  -0.102   2.923
  238    HB3  ALA  29           HB3      ALA  29 -10.457  -1.615   3.217
  239    H    SER  30           H        SER  30  -8.224   1.038   1.235
  240    HA   SER  30           HA       SER  30  -9.670   3.293   0.387
  241    HB2  SER  30           HB2      SER  30  -7.473   3.269   1.545
  242    HB3  SER  30           HB3      SER  30  -6.698   2.766   0.037
  243    HG   SER  30           HG       SER  30  -6.688   5.064   0.531
  244    H    ILE  31           H        ILE  31  -7.852   0.958  -1.683
  245    HA   ILE  31           HA       ILE  31  -8.681   2.394  -4.106
  246    HB   ILE  31           HB       ILE  31  -6.557   1.248  -4.029
  247   HG12  ILE  31          HG12      ILE  31  -8.278  -0.034  -6.184
  248   HG13  ILE  31          HG13      ILE  31  -7.930   1.690  -6.172
  249   HG21  ILE  31          HG21      ILE  31  -7.148  -0.717  -2.726
  250   HG22  ILE  31          HG22      ILE  31  -8.138  -1.357  -4.053
  251   HG23  ILE  31          HG23      ILE  31  -6.377  -1.191  -4.236
  252   HD11  ILE  31          HD11      ILE  31  -5.499   1.229  -6.278
  253   HD12  ILE  31          HD12      ILE  31  -5.831  -0.515  -6.334
  254   HD13  ILE  31          HD13      ILE  31  -6.381   0.534  -7.650
  255    H    GLU  32           H        GLU  32 -10.144  -0.228  -2.216
  256    HA   GLU  32           HA       GLU  32 -12.090  -0.801  -4.360
  257    HB2  GLU  32           HB2      GLU  32 -11.587  -1.894  -1.591
  258    HB3  GLU  32           HB3      GLU  32 -13.042  -2.312  -2.484
  259    HG2  GLU  32           HG2      GLU  32 -10.307  -2.642  -3.775
  260    HG3  GLU  32           HG3      GLU  32 -10.985  -3.876  -2.720
  261    H    LYS  33           H        LYS  33 -12.078   1.296  -1.595
  262    HA   LYS  33           HA       LYS  33 -15.022   1.783  -1.867
  263    HB2  LYS  33           HB2      LYS  33 -13.093   2.399   0.402
  264    HB3  LYS  33           HB3      LYS  33 -14.817   2.727   0.408
  265    HG2  LYS  33           HG2      LYS  33 -15.320   0.302   0.211
  266    HG3  LYS  33           HG3      LYS  33 -13.598  -0.062   0.104
  267    HD2  LYS  33           HD2      LYS  33 -14.168  -0.559   2.311
  268    HD3  LYS  33           HD3      LYS  33 -13.295   0.978   2.389
  269    HE2  LYS  33           HE2      LYS  33 -15.465   2.190   2.532
  270    HE3  LYS  33           HE3      LYS  33 -16.327   0.642   2.441
  271    HZ1  LYS  33           HZ1      LYS  33 -14.435   1.427   4.590
  272    HZ2  LYS  33           HZ2      LYS  33 -15.207  -0.026   4.492
  273    HZ3  LYS  33           HZ3      LYS  33 -16.064   1.350   4.749
  274    H    GLY  34           H        GLY  34 -11.911   3.529  -1.723
  275    HA2  GLY  34           HA2      GLY  34 -13.220   6.089  -2.457
  276    HA3  GLY  34           HA3      GLY  34 -11.552   5.828  -1.962
  277    H    GLY  35           H        GLY  35 -11.772   3.481  -4.183
  278    HA2  GLY  35           HA2      GLY  35 -10.905   3.250  -6.305
  279    HA3  GLY  35           HA3      GLY  35 -11.568   4.839  -6.706
  280    H    SER  36           H        SER  36  -9.362   4.580  -4.024
  281    HA   SER  36           HA       SER  36  -7.632   6.597  -5.220
  282    HB2  SER  36           HB2      SER  36  -8.683   6.519  -2.877
  283    HB3  SER  36           HB3      SER  36  -7.426   5.346  -2.466
  284    HG   SER  36           HG       SER  36  -7.024   7.631  -1.997
  285    H    LEU  37           H        LEU  37  -5.287   6.150  -3.887
  286    HA   LEU  37           HA       LEU  37  -3.246   5.352  -4.016
  287    HB2  LEU  37           HB2      LEU  37  -4.600   2.711  -4.529
  288    HB3  LEU  37           HB3      LEU  37  -2.867   2.864  -4.617
  289    HG   LEU  37           HG       LEU  37  -2.678   3.527  -2.318
  290   HD11  LEU  37          HD11      LEU  37  -4.617   3.415  -0.766
  291   HD12  LEU  37          HD12      LEU  37  -5.715   3.314  -2.164
  292   HD13  LEU  37          HD13      LEU  37  -4.736   4.776  -1.877
  293   HD21  LEU  37          HD21      LEU  37  -3.404   1.425  -1.321
  294   HD22  LEU  37          HD22      LEU  37  -2.794   1.122  -2.957
  295   HD23  LEU  37          HD23      LEU  37  -4.545   1.137  -2.642
  296    HA   PRO  38           HA       PRO  38  -1.887   5.600  -8.265
  297    HB2  PRO  38           HB2      PRO  38   0.808   4.750  -7.293
  298    HB3  PRO  38           HB3      PRO  38   0.331   6.235  -8.178
  299    HG2  PRO  38           HG2      PRO  38   0.922   6.352  -5.539
  300    HG3  PRO  38           HG3      PRO  38  -0.473   7.267  -6.195
  301    HD2  PRO  38           HD2      PRO  38  -0.501   4.527  -4.868
  302    HD3  PRO  38           HD3      PRO  38  -1.448   5.995  -4.474
  303    H    LYS  39           H        LYS  39  -0.949   4.432  -9.998
  304    HA   LYS  39           HA       LYS  39  -1.300   1.513 -10.063
  305    HB2  LYS  39           HB2      LYS  39  -2.173   2.909 -11.827
  306    HB3  LYS  39           HB3      LYS  39  -0.621   3.696 -12.063
  307    HG2  LYS  39           HG2      LYS  39  -1.041   2.234 -13.882
  308    HG3  LYS  39           HG3      LYS  39   0.354   1.649 -12.978
  309    HD2  LYS  39           HD2      LYS  39  -1.077  -0.114 -11.935
  310    HD3  LYS  39           HD3      LYS  39  -2.479   0.515 -12.838
  311    HE2  LYS  39           HE2      LYS  39  -1.211   0.160 -14.974
  312    HE3  LYS  39           HE3      LYS  39   0.112  -0.562 -14.045
  313    HZ1  LYS  39           HZ1      LYS  39  -1.314  -2.285 -14.901
  314    HZ2  LYS  39           HZ2      LYS  39  -2.665  -1.598 -14.254
  315    HZ3  LYS  39           HZ3      LYS  39  -1.558  -2.236 -13.260
  316    H    VAL  40           H        VAL  40   1.412   3.794 -10.537
  317    HA   VAL  40           HA       VAL  40   3.238   1.640 -11.237
  318    HB   VAL  40           HB       VAL  40   3.668   4.628 -10.894
  319   HG11  VAL  40          HG11      VAL  40   5.815   3.513 -10.644
  320   HG12  VAL  40          HG12      VAL  40   5.504   2.517 -12.089
  321   HG13  VAL  40          HG13      VAL  40   5.723   4.270 -12.234
  322   HG21  VAL  40          HG21      VAL  40   3.693   4.639 -13.374
  323   HG22  VAL  40          HG22      VAL  40   3.327   2.898 -13.391
  324   HG23  VAL  40          HG23      VAL  40   2.142   4.067 -12.767
  325    H    GLU  41           H        GLU  41   4.803   0.672  -9.993
  326    HA   GLU  41           HA       GLU  41   4.229   0.640  -7.239
  327    HB2  GLU  41           HB2      GLU  41   6.082  -0.896  -6.937
  328    HB3  GLU  41           HB3      GLU  41   5.059  -1.298  -8.305
  329    HG2  GLU  41           HG2      GLU  41   6.785  -0.208  -9.818
  330    HG3  GLU  41           HG3      GLU  41   7.838  -0.045  -8.396
  331    H    ALA  42           H        ALA  42   7.011   2.389  -8.762
  332    HA   ALA  42           HA       ALA  42   8.160   3.269  -6.319
  333    HB1  ALA  42           HB1      ALA  42   7.969   4.727  -8.996
  334    HB2  ALA  42           HB2      ALA  42   9.104   5.101  -7.680
  335    HB3  ALA  42           HB3      ALA  42   9.217   3.549  -8.523
  336    H    LYS  43           H        LYS  43   5.362   4.572  -8.097
  337    HA   LYS  43           HA       LYS  43   4.943   6.901  -6.377
  338    HB2  LYS  43           HB2      LYS  43   2.983   5.469  -8.229
  339    HB3  LYS  43           HB3      LYS  43   2.761   7.054  -7.511
  340    HG2  LYS  43           HG2      LYS  43   4.932   6.336  -9.515
  341    HG3  LYS  43           HG3      LYS  43   3.386   7.103  -9.888
  342    HD2  LYS  43           HD2      LYS  43   3.983   9.027  -8.409
  343    HD3  LYS  43           HD3      LYS  43   5.576   8.288  -8.134
  344    HE2  LYS  43           HE2      LYS  43   6.003   8.339 -10.589
  345    HE3  LYS  43           HE3      LYS  43   4.429   9.115 -10.841
  346    HZ1  LYS  43           HZ1      LYS  43   6.630  10.220  -9.202
  347    HZ2  LYS  43           HZ2      LYS  43   5.198  10.972  -9.481
  348    HZ3  LYS  43           HZ3      LYS  43   6.275  10.730 -10.718
  349    H    PHE  44           H        PHE  44   3.666   3.563  -6.489
  350    HA   PHE  44           HA       PHE  44   1.802   3.976  -4.371
  351    HB2  PHE  44           HB2      PHE  44   1.570   2.128  -5.918
  352    HB3  PHE  44           HB3      PHE  44   3.127   1.470  -5.437
  353    HD1  PHE  44           HD2      PHE  44   0.309   2.682  -3.211
  354    HD2  PHE  44           HD1      PHE  44   2.608  -0.679  -4.646
  355    HE1  PHE  44           HE2      PHE  44  -0.762   1.220  -1.526
  356    HE2  PHE  44           HE1      PHE  44   1.519  -2.134  -2.965
  357    HZ   PHE  44           HZ       PHE  44  -0.171  -1.192  -1.401
  358    H    ILE  45           H        ILE  45   5.186   2.741  -4.314
  359    HA   ILE  45           HA       ILE  45   5.435   2.426  -1.486
  360    HB   ILE  45           HB       ILE  45   7.477   3.051  -3.651
  361   HG12  ILE  45          HG12      ILE  45   6.920   0.466  -2.126
  362   HG13  ILE  45          HG13      ILE  45   6.192   0.823  -3.675
  363   HG21  ILE  45          HG21      ILE  45   8.411   3.820  -1.496
  364   HG22  ILE  45          HG22      ILE  45   7.980   2.273  -0.735
  365   HG23  ILE  45          HG23      ILE  45   9.221   2.356  -2.003
  366   HD11  ILE  45          HD11      ILE  45   8.465   0.990  -4.709
  367   HD12  ILE  45          HD12      ILE  45   9.166   0.445  -3.163
  368   HD13  ILE  45          HD13      ILE  45   8.069  -0.613  -4.060
  369    H    ASN  46           H        ASN  46   6.150   5.343  -3.528
  370    HA   ASN  46           HA       ASN  46   6.824   7.079  -1.395
  371    HB2  ASN  46           HB2      ASN  46   7.200   7.888  -3.602
  372    HB3  ASN  46           HB3      ASN  46   5.544   7.556  -4.111
  373   HD21  ASN  46          HD21      ASN  46   4.071   9.230  -4.012
  374   HD22  ASN  46          HD22      ASN  46   4.223  10.614  -2.969
  375    H    TYR  47           H        TYR  47   3.565   6.442  -2.780
  376    HA   TYR  47           HA       TYR  47   2.167   8.228  -1.086
  377    HB2  TYR  47           HB2      TYR  47   1.317   7.405  -3.173
  378    HB3  TYR  47           HB3      TYR  47   1.286   5.739  -2.586
  379    HD1  TYR  47           HD2      TYR  47  -0.322   9.062  -2.397
  380    HD2  TYR  47           HD1      TYR  47  -0.483   4.959  -1.055
  381    HE1  TYR  47           HE2      TYR  47  -2.599   9.444  -1.496
  382    HE2  TYR  47           HE1      TYR  47  -2.764   5.356  -0.136
  383    HH   TYR  47           HH       TYR  47  -4.270   8.604  -0.265
  384    H    VAL  48           H        VAL  48   2.740   4.697  -0.667
  385    HA   VAL  48           HA       VAL  48   1.405   4.391   1.838
  386    HB   VAL  48           HB       VAL  48   3.730   2.911   0.553
  387   HG11  VAL  48          HG11      VAL  48   2.216   2.158   3.091
  388   HG12  VAL  48          HG12      VAL  48   3.290   1.080   2.172
  389   HG13  VAL  48          HG13      VAL  48   3.954   2.507   2.960
  390   HG21  VAL  48          HG21      VAL  48   0.839   2.050   1.026
  391   HG22  VAL  48          HG22      VAL  48   1.420   2.743  -0.494
  392   HG23  VAL  48          HG23      VAL  48   2.075   1.206   0.076
  393    H    LYS  49           H        LYS  49   4.844   5.300   1.177
  394    HA   LYS  49           HA       LYS  49   5.410   5.589   4.024
  395    HB2  LYS  49           HB2      LYS  49   6.979   6.380   1.542
  396    HB3  LYS  49           HB3      LYS  49   7.555   6.598   3.202
  397    HG2  LYS  49           HG2      LYS  49   7.238   4.127   3.609
  398    HG3  LYS  49           HG3      LYS  49   6.755   3.930   1.935
  399    HD2  LYS  49           HD2      LYS  49   9.066   3.238   2.221
  400    HD3  LYS  49           HD3      LYS  49   8.960   4.635   1.156
  401    HE2  LYS  49           HE2      LYS  49  10.857   4.923   2.603
  402    HE3  LYS  49           HE3      LYS  49   9.636   6.124   3.017
  403    HZ1  LYS  49           HZ1      LYS  49  10.251   3.650   4.556
  404    HZ2  LYS  49           HZ2      LYS  49   8.999   4.657   4.922
  405    HZ3  LYS  49           HZ3      LYS  49  10.542   5.184   5.003
  406    H    ASN  50           H        ASN  50   3.966   7.742   1.741
  407    HA   ASN  50           HA       ASN  50   4.113  10.091   3.489
  408    HB2  ASN  50           HB2      ASN  50   3.656  10.918   1.448
  409    HB3  ASN  50           HB3      ASN  50   3.034   9.406   0.833
  410   HD21  ASN  50          HD21      ASN  50   0.760   8.828   1.288
  411   HD22  ASN  50          HD22      ASN  50  -0.361  10.194   1.354
  412    H    CYS  51           H        CYS  51   1.983   7.251   3.252
  413    HA   CYS  51           HA       CYS  51   0.018   8.370   5.099
  414    HB2  CYS  51           HB2      CYS  51   0.421   5.584   3.942
  415    HB3  CYS  51           HB3      CYS  51  -0.943   6.058   4.969
  416    HG   CYS  51           HG       CYS  51  -1.943   7.863   3.487
  417    H    PHE  52           H        PHE  52   2.724   6.005   5.440
  418    HA   PHE  52           HA       PHE  52   2.501   6.186   8.397
  419    HB2  PHE  52           HB2      PHE  52   0.923   4.420   7.635
  420    HB3  PHE  52           HB3      PHE  52   2.241   3.617   6.792
  421    HD1  PHE  52           HD2      PHE  52   1.444   4.931  10.253
  422    HD2  PHE  52           HD1      PHE  52   3.243   1.803   7.898
  423    HE1  PHE  52           HE2      PHE  52   2.126   3.753  12.322
  424    HE2  PHE  52           HE1      PHE  52   3.918   0.624   9.977
  425    HZ   PHE  52           HZ       PHE  52   3.374   1.602  12.191
  426    H    ARG  53           H        ARG  53   4.167   5.199   9.578
  427    HA   ARG  53           HA       ARG  53   6.876   5.497   8.624
  428    HB2  ARG  53           HB2      ARG  53   5.891   6.067  10.891
  429    HB3  ARG  53           HB3      ARG  53   5.788   4.341  11.218
  430    HG2  ARG  53           HG2      ARG  53   8.377   4.311  10.839
  431    HG3  ARG  53           HG3      ARG  53   8.269   6.076  10.865
  432    HD2  ARG  53           HD2      ARG  53   7.136   5.927  13.091
  433    HD3  ARG  53           HD3      ARG  53   7.329   4.177  13.066
  434    HE   ARG  53           HE       ARG  53   9.402   6.242  13.523
  435   HH11  ARG  53          HH11      ARG  53   8.915   2.715  13.277
  436   HH12  ARG  53          HH12      ARG  53  10.086   2.502  14.576
  437   HH21  ARG  53          HH21      ARG  53  11.176   5.673  14.726
  438   HH22  ARG  53          HH22      ARG  53  11.270   4.008  15.290
  439    H    MET  54           H        MET  54   6.459   3.735   6.828
  440    HA   MET  54           HA       MET  54   6.898   0.958   7.798
  441    HB2  MET  54           HB2      MET  54   6.610   2.069   4.981
  442    HB3  MET  54           HB3      MET  54   6.984   0.390   5.376
  443    HG2  MET  54           HG2      MET  54   4.847   0.517   6.891
  444    HG3  MET  54           HG3      MET  54   4.448   1.923   5.891
  445    HE1  MET  54           HE1      MET  54   4.534  -1.913   6.260
  446    HE2  MET  54           HE2      MET  54   4.620  -2.508   4.587
  447    HE3  MET  54           HE3      MET  54   6.031  -1.713   5.318
  448    H    THR  55           H        THR  55   8.747  -0.110   7.834
  449    HA   THR  55           HA       THR  55  11.163   1.037   6.473
  450    HB   THR  55           HB       THR  55  11.102   1.451   8.901
  451    HG1  THR  55           HG1      THR  55  13.148   0.994   9.198
  452   HG21  THR  55          HG21      THR  55  11.556  -1.546   9.144
  453   HG22  THR  55          HG22      THR  55  10.107  -0.665   9.685
  454   HG23  THR  55          HG23      THR  55  11.668  -0.351  10.451
  455    H    ASP  56           H        ASP  56   9.199  -1.779   6.992
  456    HA   ASP  56           HA       ASP  56  11.285  -3.676   6.167
  457    HB2  ASP  56           HB2      ASP  56   8.366  -3.916   6.914
  458    HB3  ASP  56           HB3      ASP  56   9.315  -5.268   6.366
  459    H    GLN  57           H        GLN  57  11.803  -3.798   4.017
  460    HA   GLN  57           HA       GLN  57   9.799  -3.460   1.947
  461    HB2  GLN  57           HB2      GLN  57  12.679  -4.088   1.991
  462    HB3  GLN  57           HB3      GLN  57  11.773  -4.849   0.681
  463    HG2  GLN  57           HG2      GLN  57  11.646  -1.878   1.319
  464    HG3  GLN  57           HG3      GLN  57  12.691  -2.600   0.101
  465   HE21  GLN  57          HE21      GLN  57  10.616  -0.584  -0.366
  466   HE22  GLN  57          HE22      GLN  57   9.476  -1.360  -1.470
  467    H    GLU  58           H        GLU  58  10.630  -6.183   3.944
  468    HA   GLU  58           HA       GLU  58   9.280  -8.181   2.374
  469    HB2  GLU  58           HB2      GLU  58   9.036  -9.404   4.499
  470    HB3  GLU  58           HB3      GLU  58  10.678  -8.880   4.144
  471    HG2  GLU  58           HG2      GLU  58  10.453  -7.038   5.750
  472    HG3  GLU  58           HG3      GLU  58   8.792  -7.537   6.115
  473    H    ALA  59           H        ALA  59   7.988  -5.738   4.702
  474    HA   ALA  59           HA       ALA  59   5.254  -6.749   4.393
  475    HB1  ALA  59           HB1      ALA  59   6.329  -4.161   5.570
  476    HB2  ALA  59           HB2      ALA  59   4.648  -4.738   5.646
  477    HB3  ALA  59           HB3      ALA  59   5.948  -5.650   6.468
  478    H    ILE  60           H        ILE  60   7.275  -4.263   2.845
  479    HA   ILE  60           HA       ILE  60   5.095  -3.012   1.410
  480    HB   ILE  60           HB       ILE  60   8.066  -2.974   1.029
  481   HG12  ILE  60          HG12      ILE  60   6.273  -0.747   2.065
  482   HG13  ILE  60          HG13      ILE  60   6.979  -1.953   3.133
  483   HG21  ILE  60          HG21      ILE  60   5.881  -1.350  -0.373
  484   HG22  ILE  60          HG22      ILE  60   7.594  -0.910  -0.406
  485   HG23  ILE  60          HG23      ILE  60   7.070  -2.420  -1.146
  486   HD11  ILE  60          HD11      ILE  60   8.540  -0.020   1.392
  487   HD12  ILE  60          HD12      ILE  60   8.426  -0.049   3.162
  488   HD13  ILE  60          HD13      ILE  60   9.253  -1.368   2.309
  489    H    GLN  61           H        GLN  61   7.418  -5.641   0.455
  490    HA   GLN  61           HA       GLN  61   6.076  -6.001  -2.087
  491    HB2  GLN  61           HB2      GLN  61   7.347  -7.985  -2.382
  492    HB3  GLN  61           HB3      GLN  61   8.369  -6.733  -1.695
  493    HG2  GLN  61           HG2      GLN  61   9.015  -8.616  -0.496
  494    HG3  GLN  61           HG3      GLN  61   7.924  -7.785   0.577
  495   HE21  GLN  61          HE21      GLN  61   6.965  -9.415   1.760
  496   HE22  GLN  61          HE22      GLN  61   6.213 -10.851   1.122
  497    H    ASP  62           H        ASP  62   5.395  -7.260   1.201
  498    HA   ASP  62           HA       ASP  62   3.373  -9.121   0.330
  499    HB2  ASP  62           HB2      ASP  62   4.546  -8.902   2.613
  500    HB3  ASP  62           HB3      ASP  62   3.394  -7.616   2.967
  501    H    LEU  63           H        LEU  63   3.233  -5.663   1.286
  502    HA   LEU  63           HA       LEU  63   0.537  -5.122   0.730
  503    HB2  LEU  63           HB2      LEU  63   3.064  -3.578   0.880
  504    HB3  LEU  63           HB3      LEU  63   1.822  -2.816  -0.085
  505    HG   LEU  63           HG       LEU  63   1.294  -3.784   2.751
  506   HD11  LEU  63          HD11      LEU  63   1.652  -1.427   3.422
  507   HD12  LEU  63          HD12      LEU  63   2.148  -1.024   1.764
  508   HD13  LEU  63          HD13      LEU  63   3.128  -2.132   2.748
  509   HD21  LEU  63          HD21      LEU  63  -0.082  -1.705   0.975
  510   HD22  LEU  63          HD22      LEU  63  -0.556  -2.151   2.622
  511   HD23  LEU  63          HD23      LEU  63  -0.712  -3.327   1.301
  512    H    TRP  64           H        TRP  64   3.352  -5.043  -1.537
  513    HA   TRP  64           HA       TRP  64   1.932  -4.375  -3.907
  514    HB2  TRP  64           HB2      TRP  64   4.430  -4.418  -3.503
  515    HB3  TRP  64           HB3      TRP  64   4.380  -6.156  -3.700
  516    HD1  TRP  64           HD1      TRP  64   4.975  -3.085  -5.533
  517    HE1  TRP  64           HE1      TRP  64   5.339  -3.564  -8.038
  518    HE3  TRP  64           HE3      TRP  64   3.086  -7.852  -5.781
  519    HZ2  TRP  64           HZ2      TRP  64   4.952  -5.718  -9.858
  520    HZ3  TRP  64           HZ3      TRP  64   3.235  -9.133  -7.898
  521    HH2  TRP  64           HH2      TRP  64   4.169  -8.085  -9.938
  522    H    GLN  65           H        GLN  65   2.533  -7.655  -2.473
  523    HA   GLN  65           HA       GLN  65   1.219  -9.055  -4.620
  524    HB2  GLN  65           HB2      GLN  65   1.346  -9.954  -1.717
  525    HB3  GLN  65           HB3      GLN  65   0.947 -10.928  -3.116
  526    HG2  GLN  65           HG2      GLN  65   3.587 -10.137  -2.059
  527    HG3  GLN  65           HG3      GLN  65   3.079 -11.622  -2.814
  528   HE21  GLN  65          HE21      GLN  65   4.810  -8.747  -3.231
  529   HE22  GLN  65          HE22      GLN  65   5.164  -8.899  -4.947
  530    H    TRP  66           H        TRP  66  -0.106  -7.599  -1.601
  531    HA   TRP  66           HA       TRP  66  -2.829  -8.433  -2.192
  532    HB2  TRP  66           HB2      TRP  66  -1.474  -6.761  -0.141
  533    HB3  TRP  66           HB3      TRP  66  -3.120  -6.310  -0.517
  534    HD1  TRP  66           HD1      TRP  66  -4.934  -7.479   0.784
  535    HE1  TRP  66           HE1      TRP  66  -5.223  -9.669   2.079
  536    HE3  TRP  66           HE3      TRP  66  -0.303  -9.539  -0.017
  537    HZ2  TRP  66           HZ2      TRP  66  -3.672 -11.996   2.694
  538    HZ3  TRP  66           HZ3      TRP  66   0.255 -11.752   0.943
  539    HH2  TRP  66           HH2      TRP  66  -1.424 -13.009   2.277
  540    H    ARG  67           H        ARG  67  -1.007  -5.462  -3.004
  541    HA   ARG  67           HA       ARG  67  -3.335  -4.182  -4.184
  542    HB2  ARG  67           HB2      ARG  67  -1.456  -3.014  -3.029
  543    HB3  ARG  67           HB3      ARG  67  -0.396  -3.392  -4.381
  544    HG2  ARG  67           HG2      ARG  67  -2.997  -1.990  -5.006
  545    HG3  ARG  67           HG3      ARG  67  -1.794  -1.068  -4.111
  546    HD2  ARG  67           HD2      ARG  67  -0.150  -1.285  -5.819
  547    HD3  ARG  67           HD3      ARG  67  -1.088  -2.471  -6.714
  548    HE   ARG  67           HE       ARG  67  -1.415   0.445  -6.729
  549   HH11  ARG  67          HH11      ARG  67  -3.064  -2.574  -7.621
  550   HH12  ARG  67          HH12      ARG  67  -3.885  -1.737  -8.935
  551   HH21  ARG  67          HH21      ARG  67  -2.644   1.358  -8.210
  552   HH22  ARG  67          HH22      ARG  67  -3.718   0.420  -9.223
  553    H    LYS  68           H        LYS  68  -0.963  -6.331  -5.530
  554    HA   LYS  68           HA       LYS  68  -2.109  -5.917  -8.255
  555    HB2  LYS  68           HB2      LYS  68   0.127  -7.721  -7.251
  556    HB3  LYS  68           HB3      LYS  68  -0.433  -7.631  -8.914
  557    HG2  LYS  68           HG2      LYS  68   0.861  -5.377  -7.330
  558    HG3  LYS  68           HG3      LYS  68   1.599  -6.325  -8.607
  559    HD2  LYS  68           HD2      LYS  68  -0.636  -4.294  -8.909
  560    HD3  LYS  68           HD3      LYS  68   1.021  -4.158  -9.470
  561    HE2  LYS  68           HE2      LYS  68  -1.094  -6.082 -10.536
  562    HE3  LYS  68           HE3      LYS  68  -0.486  -4.624 -11.322
  563    HZ1  LYS  68           HZ1      LYS  68   0.695  -6.369 -12.291
  564    HZ2  LYS  68           HZ2      LYS  68   0.998  -7.158 -10.874
  565    HZ3  LYS  68           HZ3      LYS  68   1.759  -5.732 -11.249
  566    H    SER  69           H        SER  69  -2.472  -8.204  -5.599
  567    HA   SER  69           HA       SER  69  -4.109 -10.019  -7.249
  568    HB2  SER  69           HB2      SER  69  -3.784  -9.958  -4.236
  569    HB3  SER  69           HB3      SER  69  -4.533 -11.243  -5.201
  570    HG   SER  69           HG       SER  69  -1.866 -10.428  -4.991
  571    H    LEU  70           H        LEU  70  -5.119  -7.746  -7.845
  572    HA   LEU  70           HA       LEU  70  -7.372  -7.007  -6.048
  573    HB2  LEU  70           HB2      LEU  70  -5.663  -5.319  -6.650
  574    HB3  LEU  70           HB3      LEU  70  -6.137  -5.477  -8.342
  575    HG   LEU  70           HG       LEU  70  -8.399  -4.642  -7.820
  576   HD11  LEU  70          HD11      LEU  70  -8.841  -3.656  -5.557
  577   HD12  LEU  70          HD12      LEU  70  -7.376  -4.458  -4.945
  578   HD13  LEU  70          HD13      LEU  70  -8.764  -5.413  -5.529
  579   HD21  LEU  70          HD21      LEU  70  -7.709  -2.357  -7.210
  580   HD22  LEU  70          HD22      LEU  70  -6.542  -3.090  -8.321
  581   HD23  LEU  70          HD23      LEU  70  -6.162  -2.992  -6.584
  Start of MODEL    5
    1    H    GLN   1           H1       GLN   1 -44.523   0.381  26.407
    2    HA   GLN   1           HA       GLN   1 -44.038  -1.234  28.040
    3    HB2  GLN   1           HB2      GLN   1 -45.160  -3.154  27.070
    4    HB3  GLN   1           HB3      GLN   1 -44.031  -3.190  25.720
    5    HG2  GLN   1           HG2      GLN   1 -43.463  -4.935  27.325
    6    HG3  GLN   1           HG3      GLN   1 -42.166  -3.767  27.257
    7   HE21  GLN   1          HE21      GLN   1 -41.738  -5.037  29.384
    8   HE22  GLN   1          HE22      GLN   1 -42.511  -4.411  30.828
    9    H    GLU   2           H        GLU   2 -42.292  -1.923  24.892
   10    HA   GLU   2           HA       GLU   2 -39.775  -1.233  26.275
   11    HB2  GLU   2           HB2      GLU   2 -39.970  -2.059  23.381
   12    HB3  GLU   2           HB3      GLU   2 -38.634  -2.171  24.499
   13    HG2  GLU   2           HG2      GLU   2 -39.282  -4.376  24.327
   14    HG3  GLU   2           HG3      GLU   2 -40.087  -3.888  25.816
   15    H    SER   3           H        SER   3 -38.684   0.639  26.029
   16    HA   SER   3           HA       SER   3 -38.970   2.265  23.618
   17    HB2  SER   3           HB2      SER   3 -40.779   3.038  25.290
   18    HB3  SER   3           HB3      SER   3 -39.434   3.643  26.271
   19    HG   SER   3           HG       SER   3 -39.782   5.326  25.020
   20    H    PHE   4           H        PHE   4 -37.209   3.680  23.294
   21    HA   PHE   4           HA       PHE   4 -34.993   3.694  25.235
   22    HB2  PHE   4           HB2      PHE   4 -33.501   2.590  23.353
   23    HB3  PHE   4           HB3      PHE   4 -34.395   1.664  24.516
   24    HD1  PHE   4           HD2      PHE   4 -35.010   3.216  21.109
   25    HD2  PHE   4           HD1      PHE   4 -35.560  -0.201  23.680
   26    HE1  PHE   4           HE2      PHE   4 -36.179   2.023  19.274
   27    HE2  PHE   4           HE1      PHE   4 -36.727  -1.394  21.844
   28    HZ   PHE   4           HZ       PHE   4 -37.050  -0.278  19.644
   29    H    LYS   5           H        LYS   5 -33.044   4.566  24.449
   30    HA   LYS   5           HA       LYS   5 -33.349   6.893  22.608
   31    HB2  LYS   5           HB2      LYS   5 -33.889   7.144  25.141
   32    HB3  LYS   5           HB3      LYS   5 -32.165   6.935  25.410
   33    HG2  LYS   5           HG2      LYS   5 -31.842   8.922  23.753
   34    HG3  LYS   5           HG3      LYS   5 -33.590   9.152  23.856
   35    HD2  LYS   5           HD2      LYS   5 -31.570   9.296  26.129
   36    HD3  LYS   5           HD3      LYS   5 -32.414  10.648  25.376
   37    HE2  LYS   5           HE2      LYS   5 -34.572   9.852  26.225
   38    HE3  LYS   5           HE3      LYS   5 -33.814   8.411  26.916
   39    HZ1  LYS   5           HZ1      LYS   5 -32.686   9.722  28.497
   40    HZ2  LYS   5           HZ2      LYS   5 -34.210  10.328  28.497
   41    HZ3  LYS   5           HZ3      LYS   5 -33.028  11.143  27.714
   42    H    LYS   6           H        LYS   6 -32.064   4.675  21.755
   43    HA   LYS   6           HA       LYS   6 -29.324   4.460  22.859
   44    HB2  LYS   6           HB2      LYS   6 -29.424   2.157  22.082
   45    HB3  LYS   6           HB3      LYS   6 -30.805   2.561  23.094
   46    HG2  LYS   6           HG2      LYS   6 -32.209   2.841  21.016
   47    HG3  LYS   6           HG3      LYS   6 -30.816   2.331  20.048
   48    HD2  LYS   6           HD2      LYS   6 -30.815   0.138  21.196
   49    HD3  LYS   6           HD3      LYS   6 -32.170   0.660  22.217
   50    HE2  LYS   6           HE2      LYS   6 -33.567   0.966  20.184
   51    HE3  LYS   6           HE3      LYS   6 -32.221   0.439  19.174
   52    HZ1  LYS   6           HZ1      LYS   6 -33.475  -1.271  21.265
   53    HZ2  LYS   6           HZ2      LYS   6 -32.326  -1.721  20.187
   54    HZ3  LYS   6           HZ3      LYS   6 -33.829  -1.333  19.650
   55    H    GLN   7           H        GLN   7 -30.706   5.380  19.796
   56    HA   GLN   7           HA       GLN   7 -28.745   4.493  18.019
   57    HB2  GLN   7           HB2      GLN   7 -29.528   6.177  16.494
   58    HB3  GLN   7           HB3      GLN   7 -30.891   5.559  17.418
   59    HG2  GLN   7           HG2      GLN   7 -30.692   7.594  18.936
   60    HG3  GLN   7           HG3      GLN   7 -29.454   8.222  17.848
   61   HE21  GLN   7          HE21      GLN   7 -32.790   8.153  18.457
   62   HE22  GLN   7          HE22      GLN   7 -33.231   8.989  16.978
   63    H    GLU   8           H        GLU   8 -26.937   5.459  16.932
   64    HA   GLU   8           HA       GLU   8 -25.519   7.454  18.593
   65    HB2  GLU   8           HB2      GLU   8 -23.493   6.878  17.608
   66    HB3  GLU   8           HB3      GLU   8 -24.331   5.351  17.892
   67    HG2  GLU   8           HG2      GLU   8 -25.119   5.519  15.444
   68    HG3  GLU   8           HG3      GLU   8 -23.952   6.834  15.260
   69    H    LYS   9           H        LYS   9 -24.699   9.351  17.895
   70    HA   LYS   9           HA       LYS   9 -25.459  10.379  15.201
   71    HB2  LYS   9           HB2      LYS   9 -25.660  11.881  17.843
   72    HB3  LYS   9           HB3      LYS   9 -25.794  12.633  16.260
   73    HG2  LYS   9           HG2      LYS   9 -27.711  10.515  17.342
   74    HG3  LYS   9           HG3      LYS   9 -27.968  12.259  17.369
   75    HD2  LYS   9           HD2      LYS   9 -27.783  12.261  14.844
   76    HD3  LYS   9           HD3      LYS   9 -27.791  10.484  14.897
   77    HE2  LYS   9           HE2      LYS   9 -29.978  10.486  16.008
   78    HE3  LYS   9           HE3      LYS   9 -29.926  12.241  16.174
   79    HZ1  LYS   9           HZ1      LYS   9 -31.307  11.666  14.317
   80    HZ2  LYS   9           HZ2      LYS   9 -30.127  10.786  13.589
   81    HZ3  LYS   9           HZ3      LYS   9 -29.968  12.413  13.745
   82    H    THR  10           H        THR  10 -23.924  11.506  14.181
   83    HA   THR  10           HA       THR  10 -21.773  11.959  13.519
   84    HB   THR  10           HB       THR  10 -20.740  13.851  14.814
   85    HG1  THR  10           HG1      THR  10 -21.656  13.230  16.837
   86   HG21  THR  10          HG21      THR  10 -22.387  14.184  12.980
   87   HG22  THR  10          HG22      THR  10 -22.486  15.428  14.233
   88   HG23  THR  10          HG23      THR  10 -23.706  14.134  14.172
   89    HA   PRO  11           HA       PRO  11 -19.581   9.103  16.458
   90    HB2  PRO  11           HB2      PRO  11 -19.312   6.840  14.975
   91    HB3  PRO  11           HB3      PRO  11 -20.854   7.279  15.776
   92    HG2  PRO  11           HG2      PRO  11 -20.064   7.818  12.891
   93    HG3  PRO  11           HG3      PRO  11 -21.553   7.021  13.501
   94    HD2  PRO  11           HD2      PRO  11 -21.501   9.679  12.902
   95    HD3  PRO  11           HD3      PRO  11 -22.437   9.047  14.290
   96    H    LYS  12           H        LYS  12 -17.428   8.543  16.592
   97    HA   LYS  12           HA       LYS  12 -15.662   8.623  14.209
   98    HB2  LYS  12           HB2      LYS  12 -15.711  10.916  15.224
   99    HB3  LYS  12           HB3      LYS  12 -15.139  10.247  16.741
  100    HG2  LYS  12           HG2      LYS  12 -13.371  11.363  15.415
  101    HG3  LYS  12           HG3      LYS  12 -12.986   9.695  15.787
  102    HD2  LYS  12           HD2      LYS  12 -12.328  10.293  13.513
  103    HD3  LYS  12           HD3      LYS  12 -13.515   8.990  13.511
  104    HE2  LYS  12           HE2      LYS  12 -15.310  10.730  13.039
  105    HE3  LYS  12           HE3      LYS  12 -14.023  11.940  12.904
  106    HZ1  LYS  12           HZ1      LYS  12 -14.330   9.515  11.228
  107    HZ2  LYS  12           HZ2      LYS  12 -13.071  10.567  11.093
  108    HZ3  LYS  12           HZ3      LYS  12 -14.627  11.041  10.731
  109    H    THR  13           H        THR  13 -16.068   6.299  14.734
  110    HA   THR  13           HA       THR  13 -15.088   5.224  17.236
  111    HB   THR  13           HB       THR  13 -16.110   3.855  14.723
  112    HG1  THR  13           HG1      THR  13 -18.044   3.881  15.901
  113   HG21  THR  13          HG21      THR  13 -14.982   2.212  16.215
  114   HG22  THR  13          HG22      THR  13 -16.734   1.994  16.202
  115   HG23  THR  13          HG23      THR  13 -15.963   2.801  17.583
  116    HA   PRO  14           HA       PRO  14 -10.991   4.427  15.751
  117    HB2  PRO  14           HB2      PRO  14  -9.861   3.045  17.801
  118    HB3  PRO  14           HB3      PRO  14 -10.350   4.764  17.907
  119    HG2  PRO  14           HG2      PRO  14 -11.884   2.327  18.850
  120    HG3  PRO  14           HG3      PRO  14 -11.577   3.852  19.734
  121    HD2  PRO  14           HD2      PRO  14 -13.913   3.393  18.388
  122    HD3  PRO  14           HD3      PRO  14 -13.179   5.019  18.491
  123    H    LYS  15           H        LYS  15 -10.220   3.195  14.273
  124    HA   LYS  15           HA       LYS  15  -9.712   0.340  14.731
  125    HB2  LYS  15           HB2      LYS  15 -10.755   1.246  12.005
  126    HB3  LYS  15           HB3      LYS  15 -10.120  -0.333  12.437
  127    HG2  LYS  15           HG2      LYS  15 -12.296  -0.889  12.595
  128    HG3  LYS  15           HG3      LYS  15 -12.112  -0.289  14.225
  129    HD2  LYS  15           HD2      LYS  15 -14.049   0.840  13.562
  130    HD3  LYS  15           HD3      LYS  15 -12.836   2.036  13.155
  131    HE2  LYS  15           HE2      LYS  15 -14.227   1.964  11.262
  132    HE3  LYS  15           HE3      LYS  15 -12.810   1.024  10.778
  133    HZ1  LYS  15           HZ1      LYS  15 -14.101  -1.008  11.266
  134    HZ2  LYS  15           HZ2      LYS  15 -14.890  -0.064  10.173
  135    HZ3  LYS  15           HZ3      LYS  15 -15.388  -0.091  11.743
  136    H    GLY  16           H        GLY  16  -7.623  -0.173  14.175
  137    HA2  GLY  16           HA2      GLY  16  -6.001   0.857  12.161
  138    HA3  GLY  16           HA3      GLY  16  -5.871   2.036  13.456
  139    HA   PRO  17           HA       PRO  17  -3.744  -2.051  15.134
  140    HB2  PRO  17           HB2      PRO  17  -2.772  -3.117  12.499
  141    HB3  PRO  17           HB3      PRO  17  -3.298  -4.004  13.954
  142    HG2  PRO  17           HG2      PRO  17  -4.893  -3.778  11.737
  143    HG3  PRO  17           HG3      PRO  17  -5.575  -3.756  13.389
  144    HD2  PRO  17           HD2      PRO  17  -5.104  -1.453  11.541
  145    HD3  PRO  17           HD3      PRO  17  -6.431  -1.737  12.691
  146    H    SER  18           H        SER  18  -1.339  -2.622  15.192
  147    HA   SER  18           HA       SER  18   0.352  -0.322  14.333
  148    HB2  SER  18           HB2      SER  18   0.891  -2.485  16.402
  149    HB3  SER  18           HB3      SER  18   1.961  -1.127  16.013
  150    HG   SER  18           HG       SER  18   0.716  -0.666  17.841
  151    H    SER  19           H        SER  19  -0.414  -2.935  12.729
  152    HA   SER  19           HA       SER  19   2.349  -3.730  11.880
  153    HB2  SER  19           HB2      SER  19  -0.017  -5.606  12.185
  154    HB3  SER  19           HB3      SER  19   1.654  -6.032  11.793
  155    HG   SER  19           HG       SER  19   1.318  -6.508  13.869
  156    H    VAL  20           H        VAL  20   2.190  -5.049   9.691
  157    HA   VAL  20           HA       VAL  20   1.177  -3.431   7.681
  158    HB   VAL  20           HB       VAL  20   1.453  -6.422   7.274
  159   HG11  VAL  20          HG11      VAL  20   2.216  -5.670   4.968
  160   HG12  VAL  20          HG12      VAL  20   0.556  -5.222   5.316
  161   HG13  VAL  20          HG13      VAL  20   1.832  -4.008   5.421
  162   HG21  VAL  20          HG21      VAL  20   3.833  -5.960   6.637
  163   HG22  VAL  20          HG22      VAL  20   3.649  -4.317   7.300
  164   HG23  VAL  20          HG23      VAL  20   3.524  -5.738   8.359
  165    H    GLU  21           H        GLU  21  -0.624  -5.952   9.355
  166    HA   GLU  21           HA       GLU  21  -3.021  -6.263   8.011
  167    HB2  GLU  21           HB2      GLU  21  -2.526  -5.622  10.961
  168    HB3  GLU  21           HB3      GLU  21  -4.059  -6.161  10.309
  169    HG2  GLU  21           HG2      GLU  21  -3.320  -8.178  10.951
  170    HG3  GLU  21           HG3      GLU  21  -2.615  -8.176   9.341
  171    H    ASP  22           H        ASP  22  -2.012  -3.266   9.683
  172    HA   ASP  22           HA       ASP  22  -4.564  -1.915   9.522
  173    HB2  ASP  22           HB2      ASP  22  -2.796  -1.297  11.142
  174    HB3  ASP  22           HB3      ASP  22  -1.709  -0.864   9.831
  175    H    ILE  23           H        ILE  23  -1.525  -1.460   7.664
  176    HA   ILE  23           HA       ILE  23  -2.708   0.428   5.888
  177    HB   ILE  23           HB       ILE  23  -0.368   0.426   6.269
  178   HG12  ILE  23          HG12      ILE  23  -0.843  -0.264   3.355
  179   HG13  ILE  23          HG13      ILE  23  -1.351   1.250   4.107
  180   HG21  ILE  23          HG21      ILE  23   0.124  -1.923   6.583
  181   HG22  ILE  23          HG22      ILE  23  -0.176  -2.273   4.867
  182   HG23  ILE  23          HG23      ILE  23   1.198  -1.265   5.370
  183   HD11  ILE  23          HD11      ILE  23   1.035   1.766   4.654
  184   HD12  ILE  23          HD12      ILE  23   1.525   0.286   3.798
  185   HD13  ILE  23          HD13      ILE  23   0.716   1.594   2.928
  186    H    LYS  24           H        LYS  24  -2.398  -3.152   5.577
  187    HA   LYS  24           HA       LYS  24  -3.485  -3.044   2.885
  188    HB2  LYS  24           HB2      LYS  24  -3.600  -5.395   2.896
  189    HB3  LYS  24           HB3      LYS  24  -2.080  -4.841   3.563
  190    HG2  LYS  24           HG2      LYS  24  -3.060  -5.342   5.891
  191    HG3  LYS  24           HG3      LYS  24  -4.355  -6.185   5.035
  192    HD2  LYS  24           HD2      LYS  24  -2.606  -7.484   3.787
  193    HD3  LYS  24           HD3      LYS  24  -1.356  -6.718   4.782
  194    HE2  LYS  24           HE2      LYS  24  -2.261  -7.847   6.776
  195    HE3  LYS  24           HE3      LYS  24  -3.614  -8.480   5.816
  196    HZ1  LYS  24           HZ1      LYS  24  -1.926 -10.167   5.968
  197    HZ2  LYS  24           HZ2      LYS  24  -0.742  -9.152   5.438
  198    HZ3  LYS  24           HZ3      LYS  24  -1.947  -9.635   4.422
  199    H    ALA  25           H        ALA  25  -5.125  -3.557   6.060
  200    HA   ALA  25           HA       ALA  25  -7.722  -3.845   4.890
  201    HB1  ALA  25           HB1      ALA  25  -6.871  -2.727   7.590
  202    HB2  ALA  25           HB2      ALA  25  -8.530  -3.189   7.141
  203    HB3  ALA  25           HB3      ALA  25  -7.257  -4.420   7.195
  204    H    LYS  26           H        LYS  26  -5.973  -0.895   5.964
  205    HA   LYS  26           HA       LYS  26  -8.037   0.974   5.256
  206    HB2  LYS  26           HB2      LYS  26  -5.072   1.251   5.834
  207    HB3  LYS  26           HB3      LYS  26  -6.100   2.630   5.438
  208    HG2  LYS  26           HG2      LYS  26  -7.601   2.037   7.374
  209    HG3  LYS  26           HG3      LYS  26  -6.541   0.683   7.728
  210    HD2  LYS  26           HD2      LYS  26  -6.052   2.496   9.217
  211    HD3  LYS  26           HD3      LYS  26  -4.673   2.243   8.133
  212    HE2  LYS  26           HE2      LYS  26  -5.319   4.187   6.797
  213    HE3  LYS  26           HE3      LYS  26  -6.825   4.371   7.711
  214    HZ1  LYS  26           HZ1      LYS  26  -5.552   4.945   9.660
  215    HZ2  LYS  26           HZ2      LYS  26  -5.025   5.891   8.431
  216    HZ3  LYS  26           HZ3      LYS  26  -4.128   4.601   8.926
  217    H    MET  27           H        MET  27  -5.381  -0.378   3.301
  218    HA   MET  27           HA       MET  27  -5.791   1.203   0.959
  219    HB2  MET  27           HB2      MET  27  -4.706  -1.581   1.421
  220    HB3  MET  27           HB3      MET  27  -4.942  -0.965  -0.209
  221    HG2  MET  27           HG2      MET  27  -3.426   0.827   0.103
  222    HG3  MET  27           HG3      MET  27  -3.328   0.571   1.843
  223    HE1  MET  27           HE1      MET  27  -0.719   0.633  -0.515
  224    HE2  MET  27           HE2      MET  27  -0.763   0.947   1.234
  225    HE3  MET  27           HE3      MET  27   0.288  -0.333   0.576
  226    H    GLN  28           H        GLN  28  -7.345  -2.026   1.780
  227    HA   GLN  28           HA       GLN  28  -9.032  -1.762  -0.575
  228    HB2  GLN  28           HB2      GLN  28  -9.256  -3.545   1.831
  229    HB3  GLN  28           HB3      GLN  28 -10.534  -3.468   0.624
  230    HG2  GLN  28           HG2      GLN  28  -9.154  -5.317   0.009
  231    HG3  GLN  28           HG3      GLN  28  -8.896  -4.046  -1.184
  232   HE21  GLN  28          HE21      GLN  28  -7.579  -5.421   1.831
  233   HE22  GLN  28          HE22      GLN  28  -6.061  -4.606   1.715
  234    H    ALA  29           H        ALA  29  -9.463  -0.560   2.762
  235    HA   ALA  29           HA       ALA  29 -12.165   0.265   2.414
  236    HB1  ALA  29           HB1      ALA  29 -11.713   1.830   4.236
  237    HB2  ALA  29           HB2      ALA  29 -10.972   0.257   4.587
  238    HB3  ALA  29           HB3      ALA  29  -9.967   1.619   4.036
  239    H    SER  30           H        SER  30  -9.088   1.931   1.417
  240    HA   SER  30           HA       SER  30 -10.479   4.149   0.190
  241    HB2  SER  30           HB2      SER  30  -7.693   3.017  -0.143
  242    HB3  SER  30           HB3      SER  30  -8.297   4.369  -1.124
  243    HG   SER  30           HG       SER  30  -7.231   5.062   0.762
  244    H    ILE  31           H        ILE  31  -9.614   0.917  -1.129
  245    HA   ILE  31           HA       ILE  31 -10.420   1.502  -3.834
  246    HB   ILE  31           HB       ILE  31 -10.331  -1.113  -2.296
  247   HG12  ILE  31          HG12      ILE  31  -8.495   0.048  -4.445
  248   HG13  ILE  31          HG13      ILE  31  -8.163   0.111  -2.720
  249   HG21  ILE  31          HG21      ILE  31 -11.955  -1.377  -4.145
  250   HG22  ILE  31          HG22      ILE  31 -10.757  -0.736  -5.290
  251   HG23  ILE  31          HG23      ILE  31 -10.488  -2.284  -4.464
  252   HD11  ILE  31          HD11      ILE  31  -6.861  -1.658  -3.649
  253   HD12  ILE  31          HD12      ILE  31  -8.128  -2.393  -2.655
  254   HD13  ILE  31          HD13      ILE  31  -8.261  -2.394  -4.431
  255    H    GLU  32           H        GLU  32 -12.341   0.465  -1.001
  256    HA   GLU  32           HA       GLU  32 -14.852   0.411  -2.497
  257    HB2  GLU  32           HB2      GLU  32 -14.224   0.372   0.477
  258    HB3  GLU  32           HB3      GLU  32 -15.840   0.186  -0.199
  259    HG2  GLU  32           HG2      GLU  32 -13.496  -1.693  -0.751
  260    HG3  GLU  32           HG3      GLU  32 -14.784  -1.977   0.414
  261    H    LYS  33           H        LYS  33 -13.198   2.940  -0.651
  262    HA   LYS  33           HA       LYS  33 -15.604   4.672  -0.774
  263    HB2  LYS  33           HB2      LYS  33 -12.921   5.050   0.571
  264    HB3  LYS  33           HB3      LYS  33 -14.268   6.203   0.630
  265    HG2  LYS  33           HG2      LYS  33 -15.727   4.455   1.637
  266    HG3  LYS  33           HG3      LYS  33 -14.367   3.358   1.710
  267    HD2  LYS  33           HD2      LYS  33 -14.709   5.966   3.243
  268    HD3  LYS  33           HD3      LYS  33 -14.646   4.324   3.868
  269    HE2  LYS  33           HE2      LYS  33 -12.507   4.863   4.369
  270    HE3  LYS  33           HE3      LYS  33 -12.226   4.332   2.710
  271    HZ1  LYS  33           HZ1      LYS  33 -11.177   6.465   3.095
  272    HZ2  LYS  33           HZ2      LYS  33 -12.566   7.137   3.651
  273    HZ3  LYS  33           HZ3      LYS  33 -12.408   6.749   2.064
  274    H    GLY  34           H        GLY  34 -12.583   4.501  -2.597
  275    HA2  GLY  34           HA2      GLY  34 -13.618   6.695  -4.290
  276    HA3  GLY  34           HA3      GLY  34 -12.181   7.086  -3.357
  277    H    GLY  35           H        GLY  35 -11.457   3.981  -4.055
  278    HA2  GLY  35           HA2      GLY  35 -10.459   2.802  -5.761
  279    HA3  GLY  35           HA3      GLY  35 -11.355   3.811  -6.892
  280    H    SER  36           H        SER  36  -9.151   5.520  -4.802
  281    HA   SER  36           HA       SER  36  -7.447   6.093  -7.178
  282    HB2  SER  36           HB2      SER  36  -8.966   7.833  -6.083
  283    HB3  SER  36           HB3      SER  36  -7.808   7.848  -4.744
  284    HG   SER  36           HG       SER  36  -7.073   9.361  -6.091
  285    H    LEU  37           H        LEU  37  -6.266   4.067  -6.620
  286    HA   LEU  37           HA       LEU  37  -4.052   4.636  -4.693
  287    HB2  LEU  37           HB2      LEU  37  -5.266   1.936  -5.411
  288    HB3  LEU  37           HB3      LEU  37  -3.751   2.172  -4.560
  289    HG   LEU  37           HG       LEU  37  -5.068   3.434  -2.764
  290   HD11  LEU  37          HD11      LEU  37  -7.379   2.185  -4.295
  291   HD12  LEU  37          HD12      LEU  37  -7.220   3.856  -3.701
  292   HD13  LEU  37          HD13      LEU  37  -7.470   2.542  -2.561
  293   HD21  LEU  37          HD21      LEU  37  -4.159   1.154  -2.503
  294   HD22  LEU  37          HD22      LEU  37  -5.624   0.475  -3.251
  295   HD23  LEU  37          HD23      LEU  37  -5.713   1.313  -1.681
  296    HA   PRO  38           HA       PRO  38  -1.612   4.303  -8.433
  297    HB2  PRO  38           HB2      PRO  38   0.910   4.435  -7.439
  298    HB3  PRO  38           HB3      PRO  38  -0.232   5.806  -7.302
  299    HG2  PRO  38           HG2      PRO  38   0.333   3.655  -5.235
  300    HG3  PRO  38           HG3      PRO  38   0.391   5.438  -5.012
  301    HD2  PRO  38           HD2      PRO  38  -1.805   3.949  -4.364
  302    HD3  PRO  38           HD3      PRO  38  -1.957   5.589  -5.061
  303    H    LYS  39           H        LYS  39   0.029   3.039  -9.492
  304    HA   LYS  39           HA       LYS  39   0.487   0.260  -8.463
  305    HB2  LYS  39           HB2      LYS  39   0.043  -0.648 -10.679
  306    HB3  LYS  39           HB3      LYS  39  -1.379   0.179 -10.035
  307    HG2  LYS  39           HG2      LYS  39  -0.907   2.154 -11.440
  308    HG3  LYS  39           HG3      LYS  39   0.580   1.397 -12.038
  309    HD2  LYS  39           HD2      LYS  39  -0.760  -0.422 -13.067
  310    HD3  LYS  39           HD3      LYS  39  -2.256   0.375 -12.506
  311    HE2  LYS  39           HE2      LYS  39  -1.664   2.414 -13.756
  312    HE3  LYS  39           HE3      LYS  39  -0.121   1.701 -14.234
  313    HZ1  LYS  39           HZ1      LYS  39  -1.678   1.528 -16.004
  314    HZ2  LYS  39           HZ2      LYS  39  -2.796   0.749 -15.079
  315    HZ3  LYS  39           HZ3      LYS  39  -1.367   0.001 -15.451
  316    H    VAL  40           H        VAL  40   1.897   3.008 -10.127
  317    HA   VAL  40           HA       VAL  40   4.251   1.608 -11.116
  318    HB   VAL  40           HB       VAL  40   3.742   4.525 -10.436
  319   HG11  VAL  40          HG11      VAL  40   5.708   5.038 -11.856
  320   HG12  VAL  40          HG12      VAL  40   6.177   4.134 -10.415
  321   HG13  VAL  40          HG13      VAL  40   6.068   3.304 -11.982
  322   HG21  VAL  40          HG21      VAL  40   3.554   4.841 -12.865
  323   HG22  VAL  40          HG22      VAL  40   3.759   3.103 -13.127
  324   HG23  VAL  40          HG23      VAL  40   2.329   3.716 -12.283
  325    H    GLU  41           H        GLU  41   6.122   1.006 -10.012
  326    HA   GLU  41           HA       GLU  41   5.665   0.459  -7.349
  327    HB2  GLU  41           HB2      GLU  41   7.701  -0.657  -7.245
  328    HB3  GLU  41           HB3      GLU  41   7.128  -0.817  -8.891
  329    HG2  GLU  41           HG2      GLU  41   8.730   0.927  -9.646
  330    HG3  GLU  41           HG3      GLU  41   9.308   1.117  -7.991
  331    H    ALA  42           H        ALA  42   7.874   3.106  -8.422
  332    HA   ALA  42           HA       ALA  42   8.607   3.879  -5.768
  333    HB1  ALA  42           HB1      ALA  42   8.520   5.515  -8.344
  334    HB2  ALA  42           HB2      ALA  42   9.415   5.931  -6.867
  335    HB3  ALA  42           HB3      ALA  42   9.869   4.491  -7.798
  336    H    LYS  43           H        LYS  43   5.786   4.707  -7.724
  337    HA   LYS  43           HA       LYS  43   4.809   6.886  -6.020
  338    HB2  LYS  43           HB2      LYS  43   3.186   5.187  -7.951
  339    HB3  LYS  43           HB3      LYS  43   2.782   6.772  -7.315
  340    HG2  LYS  43           HG2      LYS  43   4.978   6.103  -9.299
  341    HG3  LYS  43           HG3      LYS  43   3.440   6.906  -9.627
  342    HD2  LYS  43           HD2      LYS  43   4.217   8.805  -8.116
  343    HD3  LYS  43           HD3      LYS  43   5.805   8.003  -8.050
  344    HE2  LYS  43           HE2      LYS  43   5.807   8.033 -10.606
  345    HE3  LYS  43           HE3      LYS  43   4.343   9.030 -10.524
  346    HZ1  LYS  43           HZ1      LYS  43   7.013   9.709  -9.456
  347    HZ2  LYS  43           HZ2      LYS  43   5.673  10.616  -9.165
  348    HZ3  LYS  43           HZ3      LYS  43   6.232  10.456 -10.704
  349    H    PHE  44           H        PHE  44   4.197   3.386  -6.345
  350    HA   PHE  44           HA       PHE  44   2.197   3.252  -4.317
  351    HB2  PHE  44           HB2      PHE  44   2.536   1.494  -6.001
  352    HB3  PHE  44           HB3      PHE  44   4.110   1.109  -5.321
  353    HD1  PHE  44           HD2      PHE  44   0.435   1.071  -4.669
  354    HD2  PHE  44           HD1      PHE  44   4.302  -0.292  -3.336
  355    HE1  PHE  44           HE2      PHE  44  -0.659  -0.454  -3.053
  356    HE2  PHE  44           HE1      PHE  44   3.202  -1.817  -1.715
  357    HZ   PHE  44           HZ       PHE  44   0.722  -1.910  -1.573
  358    H    ILE  45           H        ILE  45   5.779   2.852  -4.090
  359    HA   ILE  45           HA       ILE  45   5.788   2.447  -1.242
  360    HB   ILE  45           HB       ILE  45   7.919   3.408  -3.166
  361   HG12  ILE  45          HG12      ILE  45   7.470   0.729  -1.748
  362   HG13  ILE  45          HG13      ILE  45   6.966   1.050  -3.397
  363   HG21  ILE  45          HG21      ILE  45   8.491   4.231  -0.900
  364   HG22  ILE  45          HG22      ILE  45   8.201   2.614  -0.221
  365   HG23  ILE  45          HG23      ILE  45   9.538   2.902  -1.351
  366   HD11  ILE  45          HD11      ILE  45   9.000  -0.163  -3.514
  367   HD12  ILE  45          HD12      ILE  45   9.355   1.500  -4.020
  368   HD13  ILE  45          HD13      ILE  45   9.822   0.931  -2.394
  369    H    ASN  46           H        ASN  46   6.008   5.494  -3.152
  370    HA   ASN  46           HA       ASN  46   6.196   7.330  -0.986
  371    HB2  ASN  46           HB2      ASN  46   6.508   8.171  -3.174
  372    HB3  ASN  46           HB3      ASN  46   5.074   7.391  -3.801
  373   HD21  ASN  46          HD21      ASN  46   3.097   8.506  -3.823
  374   HD22  ASN  46          HD22      ASN  46   2.973  10.123  -3.165
  375    H    TYR  47           H        TYR  47   3.304   5.848  -2.449
  376    HA   TYR  47           HA       TYR  47   1.370   7.099  -0.742
  377    HB2  TYR  47           HB2      TYR  47   0.744   6.398  -2.870
  378    HB3  TYR  47           HB3      TYR  47   1.415   4.782  -2.667
  379    HD1  TYR  47           HD1      TYR  47  -1.260   7.028  -1.308
  380    HD2  TYR  47           HD2      TYR  47   0.046   2.977  -2.030
  381    HE1  TYR  47           HE1      TYR  47  -3.419   6.188  -0.474
  382    HE2  TYR  47           HE2      TYR  47  -2.174   2.139  -1.238
  383    HH   TYR  47           HH       TYR  47  -4.708   4.341  -0.024
  384    H    VAL  48           H        VAL  48   3.045   3.927  -0.531
  385    HA   VAL  48           HA       VAL  48   1.850   3.003   1.875
  386    HB   VAL  48           HB       VAL  48   4.563   2.530   0.624
  387   HG11  VAL  48          HG11      VAL  48   4.916   0.680   2.264
  388   HG12  VAL  48          HG12      VAL  48   5.052   2.280   2.989
  389   HG13  VAL  48          HG13      VAL  48   3.581   1.323   3.242
  390   HG21  VAL  48          HG21      VAL  48   3.694   0.315   0.205
  391   HG22  VAL  48          HG22      VAL  48   2.262   0.628   1.205
  392   HG23  VAL  48          HG23      VAL  48   2.473   1.470  -0.343
  393    H    LYS  49           H        LYS  49   4.818   5.043   1.500
  394    HA   LYS  49           HA       LYS  49   5.133   5.555   4.294
  395    HB2  LYS  49           HB2      LYS  49   5.852   7.237   1.868
  396    HB3  LYS  49           HB3      LYS  49   6.344   7.630   3.510
  397    HG2  LYS  49           HG2      LYS  49   7.107   5.014   2.137
  398    HG3  LYS  49           HG3      LYS  49   8.059   6.489   2.058
  399    HD2  LYS  49           HD2      LYS  49   8.120   6.467   4.622
  400    HD3  LYS  49           HD3      LYS  49   7.475   4.810   4.517
  401    HE2  LYS  49           HE2      LYS  49   9.407   4.180   3.060
  402    HE3  LYS  49           HE3      LYS  49  10.020   5.833   3.170
  403    HZ1  LYS  49           HZ1      LYS  49  10.177   5.481   5.624
  404    HZ2  LYS  49           HZ2      LYS  49  11.155   4.463   4.754
  405    HZ3  LYS  49           HZ3      LYS  49   9.770   3.895   5.387
  406    H    ASN  50           H        ASN  50   2.909   7.092   2.010
  407    HA   ASN  50           HA       ASN  50   1.997   9.116   3.877
  408    HB2  ASN  50           HB2      ASN  50   1.332   9.854   1.875
  409    HB3  ASN  50           HB3      ASN  50   1.419   8.276   1.128
  410   HD21  ASN  50          HD21      ASN  50  -0.487   6.808   1.370
  411   HD22  ASN  50          HD22      ASN  50  -2.069   7.589   1.525
  412    H    CYS  51           H        CYS  51   1.202   5.694   3.641
  413    HA   CYS  51           HA       CYS  51  -1.237   6.145   5.318
  414    HB2  CYS  51           HB2      CYS  51  -1.386   5.096   2.999
  415    HB3  CYS  51           HB3      CYS  51  -0.570   3.679   3.687
  416    HG   CYS  51           HG       CYS  51  -3.354   5.211   4.622
  417    H    PHE  52           H        PHE  52   1.674   4.059   5.195
  418    HA   PHE  52           HA       PHE  52   1.791   4.118   8.085
  419    HB2  PHE  52           HB2      PHE  52   0.311   2.112   7.574
  420    HB3  PHE  52           HB3      PHE  52   1.717   1.351   6.836
  421    HD1  PHE  52           HD2      PHE  52   3.883   1.179   8.394
  422    HD2  PHE  52           HD1      PHE  52  -0.130   1.804   9.829
  423    HE1  PHE  52           HE2      PHE  52   4.550   0.347  10.635
  424    HE2  PHE  52           HE1      PHE  52   0.526   0.939  12.056
  425    HZ   PHE  52           HZ       PHE  52   2.880   0.242  12.469
  426    H    ARG  53           H        ARG  53   3.775   4.924   8.130
  427    HA   ARG  53           HA       ARG  53   5.667   4.543   6.042
  428    HB2  ARG  53           HB2      ARG  53   7.050   6.136   7.247
  429    HB3  ARG  53           HB3      ARG  53   5.370   6.639   7.063
  430    HG2  ARG  53           HG2      ARG  53   4.907   6.002   9.434
  431    HG3  ARG  53           HG3      ARG  53   6.598   5.526   9.631
  432    HD2  ARG  53           HD2      ARG  53   7.304   7.825   9.045
  433    HD3  ARG  53           HD3      ARG  53   5.600   8.313   8.920
  434    HE   ARG  53           HE       ARG  53   5.750   7.195  11.441
  435   HH11  ARG  53          HH11      ARG  53   7.513   9.796   9.909
  436   HH12  ARG  53          HH12      ARG  53   7.951  10.514  11.444
  437   HH21  ARG  53          HH21      ARG  53   6.410   8.096  13.359
  438   HH22  ARG  53          HH22      ARG  53   7.478   9.465  13.335
  439    H    MET  54           H        MET  54   5.688   2.223   6.184
  440    HA   MET  54           HA       MET  54   7.323   0.733   7.956
  441    HB2  MET  54           HB2      MET  54   6.723   0.335   4.994
  442    HB3  MET  54           HB3      MET  54   7.455  -0.884   6.042
  443    HG2  MET  54           HG2      MET  54   5.437  -0.945   7.440
  444    HG3  MET  54           HG3      MET  54   4.706   0.333   6.469
  445    HE1  MET  54           HE1      MET  54   5.324  -4.021   5.063
  446    HE2  MET  54           HE2      MET  54   6.722  -2.952   5.304
  447    HE3  MET  54           HE3      MET  54   5.711  -3.406   6.688
  448    H    THR  55           H        THR  55   9.370  -0.186   7.679
  449    HA   THR  55           HA       THR  55  11.261   0.946   5.670
  450    HB   THR  55           HB       THR  55  13.108   0.681   7.264
  451    HG1  THR  55           HG1      THR  55  11.888   0.784   9.556
  452   HG21  THR  55          HG21      THR  55  12.719   2.630   8.616
  453   HG22  THR  55          HG22      THR  55  10.953   2.488   8.433
  454   HG23  THR  55          HG23      THR  55  11.972   2.895   7.037
  455    H    ASP  56           H        ASP  56   9.893  -1.853   7.178
  456    HA   ASP  56           HA       ASP  56  11.841  -3.849   6.510
  457    HB2  ASP  56           HB2      ASP  56   8.828  -3.983   6.946
  458    HB3  ASP  56           HB3      ASP  56   9.853  -5.398   6.728
  459    H    GLN  57           H        GLN  57  12.528  -3.498   4.310
  460    HA   GLN  57           HA       GLN  57  10.724  -3.078   2.203
  461    HB2  GLN  57           HB2      GLN  57  13.299  -2.669   2.361
  462    HB3  GLN  57           HB3      GLN  57  13.443  -4.310   1.745
  463    HG2  GLN  57           HG2      GLN  57  13.531  -2.749  -0.130
  464    HG3  GLN  57           HG3      GLN  57  12.014  -3.634  -0.234
  465   HE21  GLN  57          HE21      GLN  57  10.610  -2.063  -1.191
  466   HE22  GLN  57          HE22      GLN  57  10.231  -0.579  -0.322
  467    H    GLU  58           H        GLU  58  11.839  -6.205   3.477
  468    HA   GLU  58           HA       GLU  58  10.829  -7.781   1.299
  469    HB2  GLU  58           HB2      GLU  58  10.886  -9.678   2.817
  470    HB3  GLU  58           HB3      GLU  58  12.376  -8.751   2.853
  471    HG2  GLU  58           HG2      GLU  58  11.732  -7.733   5.006
  472    HG3  GLU  58           HG3      GLU  58  10.189  -8.582   4.958
  473    H    ALA  59           H        ALA  59   9.210  -6.370   4.113
  474    HA   ALA  59           HA       ALA  59   6.633  -7.712   3.639
  475    HB1  ALA  59           HB1      ALA  59   7.341  -7.211   5.903
  476    HB2  ALA  59           HB2      ALA  59   7.403  -5.473   5.517
  477    HB3  ALA  59           HB3      ALA  59   5.854  -6.351   5.457
  478    H    ILE  60           H        ILE  60   8.112  -4.508   2.942
  479    HA   ILE  60           HA       ILE  60   5.801  -3.265   1.781
  480    HB   ILE  60           HB       ILE  60   8.740  -2.877   1.208
  481   HG12  ILE  60          HG12      ILE  60   6.762  -1.167   2.792
  482   HG13  ILE  60          HG13      ILE  60   7.884  -2.309   3.518
  483   HG21  ILE  60          HG21      ILE  60   6.336  -1.230   0.271
  484   HG22  ILE  60          HG22      ILE  60   8.027  -0.722   0.115
  485   HG23  ILE  60          HG23      ILE  60   7.467  -2.122  -0.770
  486   HD11  ILE  60          HD11      ILE  60   8.627   0.214   2.013
  487   HD12  ILE  60          HD12      ILE  60   8.885  -0.165   3.722
  488   HD13  ILE  60          HD13      ILE  60   9.794  -1.048   2.484
  489    H    GLN  61           H        GLN  61   8.375  -5.264   0.187
  490    HA   GLN  61           HA       GLN  61   6.941  -5.146  -2.306
  491    HB2  GLN  61           HB2      GLN  61   8.645  -6.463  -3.252
  492    HB3  GLN  61           HB3      GLN  61   9.371  -5.308  -2.151
  493    HG2  GLN  61           HG2      GLN  61  10.566  -7.269  -1.739
  494    HG3  GLN  61           HG3      GLN  61   9.426  -7.188  -0.413
  495   HE21  GLN  61          HE21      GLN  61   8.697  -9.240   0.068
  496   HE22  GLN  61          HE22      GLN  61   8.360 -10.490  -1.129
  497    H    ASP  62           H        ASP  62   6.754  -7.454   0.368
  498    HA   ASP  62           HA       ASP  62   5.144  -9.431  -1.020
  499    HB2  ASP  62           HB2      ASP  62   6.348  -9.859   1.051
  500    HB3  ASP  62           HB3      ASP  62   5.420  -8.629   1.900
  501    H    LEU  63           H        LEU  63   4.350  -6.546   0.941
  502    HA   LEU  63           HA       LEU  63   1.530  -6.666   0.810
  503    HB2  LEU  63           HB2      LEU  63   2.851  -5.367   2.398
  504    HB3  LEU  63           HB3      LEU  63   3.501  -4.370   1.105
  505    HG   LEU  63           HG       LEU  63   1.236  -3.454   0.696
  506   HD11  LEU  63          HD11      LEU  63   0.439  -5.013   3.139
  507   HD12  LEU  63          HD12      LEU  63  -0.177  -5.229   1.502
  508   HD13  LEU  63          HD13      LEU  63  -0.513  -3.720   2.366
  509   HD21  LEU  63          HD21      LEU  63   2.326  -3.123   3.484
  510   HD22  LEU  63          HD22      LEU  63   1.166  -2.032   2.690
  511   HD23  LEU  63          HD23      LEU  63   2.802  -2.223   2.039
  512    H    TRP  64           H        TRP  64   3.905  -5.123  -1.344
  513    HA   TRP  64           HA       TRP  64   2.168  -3.973  -3.306
  514    HB2  TRP  64           HB2      TRP  64   4.512  -3.366  -3.027
  515    HB3  TRP  64           HB3      TRP  64   5.010  -5.008  -3.342
  516    HD1  TRP  64           HD1      TRP  64   2.639  -3.084  -5.701
  517    HE1  TRP  64           HE1      TRP  64   3.804  -2.852  -7.984
  518    HE3  TRP  64           HE3      TRP  64   7.253  -4.983  -4.501
  519    HZ2  TRP  64           HZ2      TRP  64   6.370  -3.409  -9.136
  520    HZ3  TRP  64           HZ3      TRP  64   9.015  -5.186  -6.236
  521    HH2  TRP  64           HH2      TRP  64   8.588  -4.387  -8.552
  522    H    GLN  65           H        GLN  65   3.816  -7.198  -3.289
  523    HA   GLN  65           HA       GLN  65   2.737  -8.067  -5.780
  524    HB2  GLN  65           HB2      GLN  65   4.279  -9.231  -3.552
  525    HB3  GLN  65           HB3      GLN  65   3.191 -10.382  -4.287
  526    HG2  GLN  65           HG2      GLN  65   5.497 -10.338  -5.259
  527    HG3  GLN  65           HG3      GLN  65   4.173 -10.209  -6.416
  528   HE21  GLN  65          HE21      GLN  65   5.940  -7.686  -4.444
  529   HE22  GLN  65          HE22      GLN  65   6.348  -6.752  -5.887
  530    H    TRP  66           H        TRP  66   1.457  -8.577  -2.434
  531    HA   TRP  66           HA       TRP  66  -0.872 -10.013  -3.319
  532    HB2  TRP  66           HB2      TRP  66   0.012  -9.854  -0.966
  533    HB3  TRP  66           HB3      TRP  66  -0.678  -8.240  -0.874
  534    HD1  TRP  66           HD1      TRP  66  -3.446  -8.143  -1.084
  535    HE1  TRP  66           HE1      TRP  66  -5.228  -9.794  -0.224
  536    HE3  TRP  66           HE3      TRP  66  -0.542 -12.346  -0.699
  537    HZ2  TRP  66           HZ2      TRP  66  -5.375 -12.566   0.489
  538    HZ3  TRP  66           HZ3      TRP  66  -1.533 -14.478   0.102
  539    HH2  TRP  66           HH2      TRP  66  -3.943 -14.603   0.691
  540    H    ARG  67           H        ARG  67  -0.289  -6.465  -2.951
  541    HA   ARG  67           HA       ARG  67  -2.966  -5.657  -3.553
  542    HB2  ARG  67           HB2      ARG  67  -0.719  -4.259  -2.864
  543    HB3  ARG  67           HB3      ARG  67  -0.705  -3.969  -4.587
  544    HG2  ARG  67           HG2      ARG  67  -2.002  -2.216  -3.975
  545    HG3  ARG  67           HG3      ARG  67  -3.314  -3.372  -4.146
  546    HD2  ARG  67           HD2      ARG  67  -1.846  -2.767  -1.527
  547    HD3  ARG  67           HD3      ARG  67  -3.298  -1.928  -2.049
  548    HE   ARG  67           HE       ARG  67  -4.629  -3.723  -1.471
  549   HH11  ARG  67          HH11      ARG  67  -1.268  -4.897  -1.041
  550   HH12  ARG  67          HH12      ARG  67  -1.861  -6.072   0.109
  551   HH21  ARG  67          HH21      ARG  67  -5.140  -5.275  -0.115
  552   HH22  ARG  67          HH22      ARG  67  -3.940  -6.335   0.581
  553    H    LYS  68           H        LYS  68  -0.229  -6.189  -5.822
  554    HA   LYS  68           HA       LYS  68  -1.974  -5.780  -8.108
  555    HB2  LYS  68           HB2      LYS  68  -0.141  -6.185  -9.530
  556    HB3  LYS  68           HB3      LYS  68   0.328  -5.152  -8.205
  557    HG2  LYS  68           HG2      LYS  68   2.171  -6.477  -8.353
  558    HG3  LYS  68           HG3      LYS  68   1.270  -7.265  -7.075
  559    HD2  LYS  68           HD2      LYS  68   2.278  -8.901  -8.557
  560    HD3  LYS  68           HD3      LYS  68   0.524  -9.019  -8.695
  561    HE2  LYS  68           HE2      LYS  68   0.531  -7.805 -10.792
  562    HE3  LYS  68           HE3      LYS  68   2.236  -7.369 -10.613
  563    HZ1  LYS  68           HZ1      LYS  68   1.373 -10.193 -10.792
  564    HZ2  LYS  68           HZ2      LYS  68   2.874  -9.584 -11.000
  565    HZ3  LYS  68           HZ3      LYS  68   1.711  -9.303 -12.138
  566    H    SER  69           H        SER  69  -1.832  -8.393  -6.061
  567    HA   SER  69           HA       SER  69  -2.800 -10.326  -8.085
  568    HB2  SER  69           HB2      SER  69  -2.522 -10.690  -5.082
  569    HB3  SER  69           HB3      SER  69  -2.862 -11.943  -6.279
  570    HG   SER  69           HG       SER  69  -0.472 -10.389  -6.059
  571    H    LEU  70           H        LEU  70  -4.248  -7.901  -6.144
  572    HA   LEU  70           HA       LEU  70  -6.824  -9.063  -5.659
  573    HB2  LEU  70           HB2      LEU  70  -6.008  -6.193  -6.246
  574    HB3  LEU  70           HB3      LEU  70  -7.579  -6.679  -5.630
  575    HG   LEU  70           HG       LEU  70  -4.928  -6.948  -4.155
  576   HD11  LEU  70          HD11      LEU  70  -5.762  -4.638  -4.389
  577   HD12  LEU  70          HD12      LEU  70  -5.895  -5.204  -2.714
  578   HD13  LEU  70          HD13      LEU  70  -7.342  -5.130  -3.741
  579   HD21  LEU  70          HD21      LEU  70  -6.332  -7.535  -2.194
  580   HD22  LEU  70          HD22      LEU  70  -6.428  -8.755  -3.466
  581   HD23  LEU  70          HD23      LEU  70  -7.761  -7.601  -3.250
  Start of MODEL    6
    1    H    GLN   1           H1       GLN   1 -40.619   4.599  26.526
    2    HA   GLN   1           HA       GLN   1 -39.824   6.503  25.404
    3    HB2  GLN   1           HB2      GLN   1 -37.508   6.029  25.374
    4    HB3  GLN   1           HB3      GLN   1 -38.221   5.030  26.627
    5    HG2  GLN   1           HG2      GLN   1 -38.142   3.075  25.021
    6    HG3  GLN   1           HG3      GLN   1 -37.306   4.111  23.863
    7   HE21  GLN   1          HE21      GLN   1 -35.975   1.864  24.539
    8   HE22  GLN   1          HE22      GLN   1 -34.755   2.168  25.763
    9    H    GLU   2           H        GLU   2 -38.949   7.503  23.536
   10    HA   GLU   2           HA       GLU   2 -39.833   6.243  20.952
   11    HB2  GLU   2           HB2      GLU   2 -39.326   9.141  21.745
   12    HB3  GLU   2           HB3      GLU   2 -39.733   8.590  20.117
   13    HG2  GLU   2           HG2      GLU   2 -41.926   7.806  20.872
   14    HG3  GLU   2           HG3      GLU   2 -41.535   8.212  22.549
   15    H    SER   3           H        SER   3 -37.174   7.950  22.541
   16    HA   SER   3           HA       SER   3 -35.045   8.389  22.115
   17    HB2  SER   3           HB2      SER   3 -35.009   5.969  20.306
   18    HB3  SER   3           HB3      SER   3 -33.604   6.815  20.980
   19    HG   SER   3           HG       SER   3 -35.033   4.883  22.082
   20    H    PHE   4           H        PHE   4 -34.011   9.932  21.022
   21    HA   PHE   4           HA       PHE   4 -35.705  11.221  19.081
   22    HB2  PHE   4           HB2      PHE   4 -33.187  12.003  20.554
   23    HB3  PHE   4           HB3      PHE   4 -33.861  13.019  19.299
   24    HD1  PHE   4           HD2      PHE   4 -34.963  11.262  22.477
   25    HD2  PHE   4           HD1      PHE   4 -35.412  14.666  19.861
   26    HE1  PHE   4           HE2      PHE   4 -36.547  12.285  24.076
   27    HE2  PHE   4           HE1      PHE   4 -36.973  15.700  21.487
   28    HZ   PHE   4           HZ       PHE   4 -37.549  14.511  23.596
   29    H    LYS   5           H        LYS   5 -32.675   9.510  18.648
   30    HA   LYS   5           HA       LYS   5 -31.492   8.944  16.756
   31    HB2  LYS   5           HB2      LYS   5 -33.968   9.849  15.236
   32    HB3  LYS   5           HB3      LYS   5 -32.692   8.819  14.624
   33    HG2  LYS   5           HG2      LYS   5 -33.245   7.090  16.336
   34    HG3  LYS   5           HG3      LYS   5 -34.613   8.097  16.863
   35    HD2  LYS   5           HD2      LYS   5 -35.523   8.051  14.545
   36    HD3  LYS   5           HD3      LYS   5 -34.184   6.991  14.065
   37    HE2  LYS   5           HE2      LYS   5 -34.965   5.344  15.824
   38    HE3  LYS   5           HE3      LYS   5 -36.381   6.383  16.097
   39    HZ1  LYS   5           HZ1      LYS   5 -35.600   5.099  13.541
   40    HZ2  LYS   5           HZ2      LYS   5 -36.894   6.110  13.709
   41    HZ3  LYS   5           HZ3      LYS   5 -36.879   4.642  14.442
   42    H    LYS   6           H        LYS   6 -31.312  10.094  14.205
   43    HA   LYS   6           HA       LYS   6 -30.406  11.689  12.944
   44    HB2  LYS   6           HB2      LYS   6 -32.378  12.957  13.635
   45    HB3  LYS   6           HB3      LYS   6 -31.469  13.672  14.969
   46    HG2  LYS   6           HG2      LYS   6 -29.945  14.768  13.395
   47    HG3  LYS   6           HG3      LYS   6 -30.752  13.982  12.031
   48    HD2  LYS   6           HD2      LYS   6 -31.493  16.247  12.160
   49    HD3  LYS   6           HD3      LYS   6 -32.850  15.216  12.617
   50    HE2  LYS   6           HE2      LYS   6 -32.522  15.750  14.988
   51    HE3  LYS   6           HE3      LYS   6 -31.007  16.599  14.625
   52    HZ1  LYS   6           HZ1      LYS   6 -33.694  17.453  13.703
   53    HZ2  LYS   6           HZ2      LYS   6 -32.274  18.221  13.365
   54    HZ3  LYS   6           HZ3      LYS   6 -32.843  18.166  14.901
   55    H    GLN   7           H        GLN   7 -28.503  12.313  12.432
   56    HA   GLN   7           HA       GLN   7 -26.315  12.608  12.400
   57    HB2  GLN   7           HB2      GLN   7 -26.632  14.071  15.025
   58    HB3  GLN   7           HB3      GLN   7 -25.152  13.991  14.063
   59    HG2  GLN   7           HG2      GLN   7 -26.349  14.993  12.122
   60    HG3  GLN   7           HG3      GLN   7 -27.810  15.132  13.095
   61   HE21  GLN   7          HE21      GLN   7 -27.640  16.535  15.149
   62   HE22  GLN   7          HE22      GLN   7 -26.647  17.975  14.909
   63    H    GLU   8           H        GLU   8 -26.749  11.842  15.838
   64    HA   GLU   8           HA       GLU   8 -25.908  10.321  17.230
   65    HB2  GLU   8           HB2      GLU   8 -26.209   8.453  14.864
   66    HB3  GLU   8           HB3      GLU   8 -26.040   7.980  16.558
   67    HG2  GLU   8           HG2      GLU   8 -28.112   9.307  17.095
   68    HG3  GLU   8           HG3      GLU   8 -28.339   9.590  15.364
   69    H    LYS   9           H        LYS   9 -23.836  10.566  14.427
   70    HA   LYS   9           HA       LYS   9 -21.563  10.456  14.189
   71    HB2  LYS   9           HB2      LYS   9 -21.697  11.820  16.897
   72    HB3  LYS   9           HB3      LYS   9 -20.429  11.983  15.671
   73    HG2  LYS   9           HG2      LYS   9 -22.257  12.819  14.072
   74    HG3  LYS   9           HG3      LYS   9 -23.319  12.936  15.479
   75    HD2  LYS   9           HD2      LYS   9 -20.683  14.407  15.090
   76    HD3  LYS   9           HD3      LYS   9 -22.304  15.092  14.892
   77    HE2  LYS   9           HE2      LYS   9 -22.796  14.713  17.278
   78    HE3  LYS   9           HE3      LYS   9 -21.211  13.955  17.490
   79    HZ1  LYS   9           HZ1      LYS   9 -20.203  16.101  16.831
   80    HZ2  LYS   9           HZ2      LYS   9 -21.098  16.253  18.189
   81    HZ3  LYS   9           HZ3      LYS   9 -21.693  16.789  16.763
   82    H    THR  10           H        THR  10 -22.186   7.954  14.820
   83    HA   THR  10           HA       THR  10 -19.896   6.950  16.435
   84    HB   THR  10           HB       THR  10 -21.635   5.304  17.520
   85    HG1  THR  10           HG1      THR  10 -23.199   7.635  17.214
   86   HG21  THR  10          HG21      THR  10 -20.275   6.901  18.802
   87   HG22  THR  10          HG22      THR  10 -21.917   6.744  19.444
   88   HG23  THR  10          HG23      THR  10 -21.469   8.178  18.498
   89    HA   PRO  11           HA       PRO  11 -20.515   4.448  12.504
   90    HB2  PRO  11           HB2      PRO  11 -17.509   4.653  12.753
   91    HB3  PRO  11           HB3      PRO  11 -18.519   4.642  11.276
   92    HG2  PRO  11           HG2      PRO  11 -17.481   6.958  12.242
   93    HG3  PRO  11           HG3      PRO  11 -19.150   6.904  11.599
   94    HD2  PRO  11           HD2      PRO  11 -18.236   6.903  14.474
   95    HD3  PRO  11           HD3      PRO  11 -19.614   7.738  13.721
   96    H    LYS  12           H        LYS  12 -18.301   4.171  15.242
   97    HA   LYS  12           HA       LYS  12 -17.446   2.560  16.517
   98    HB2  LYS  12           HB2      LYS  12 -19.943   1.027  15.746
   99    HB3  LYS  12           HB3      LYS  12 -18.873   0.567  17.052
  100    HG2  LYS  12           HG2      LYS  12 -20.253   3.293  17.045
  101    HG3  LYS  12           HG3      LYS  12 -21.043   1.830  17.596
  102    HD2  LYS  12           HD2      LYS  12 -20.295   2.719  19.562
  103    HD3  LYS  12           HD3      LYS  12 -19.098   1.486  19.202
  104    HE2  LYS  12           HE2      LYS  12 -17.658   3.427  18.221
  105    HE3  LYS  12           HE3      LYS  12 -18.860   4.518  18.928
  106    HZ1  LYS  12           HZ1      LYS  12 -18.378   3.344  21.086
  107    HZ2  LYS  12           HZ2      LYS  12 -17.121   4.229  20.492
  108    HZ3  LYS  12           HZ3      LYS  12 -17.136   2.577  20.327
  109    H    THR  13           H        THR  13 -16.841   0.130  16.647
  110    HA   THR  13           HA       THR  13 -15.284  -1.374  15.948
  111    HB   THR  13           HB       THR  13 -16.850  -1.510  13.362
  112    HG1  THR  13           HG1      THR  13 -18.363  -2.618  14.387
  113   HG21  THR  13          HG21      THR  13 -15.564  -3.647  15.132
  114   HG22  THR  13          HG22      THR  13 -14.916  -3.086  13.576
  115   HG23  THR  13          HG23      THR  13 -16.464  -3.940  13.629
  116    HA   PRO  14           HA       PRO  14 -12.856   1.513  13.169
  117    HB2  PRO  14           HB2      PRO  14 -10.883   2.350  14.853
  118    HB3  PRO  14           HB3      PRO  14 -12.505   3.107  14.823
  119    HG2  PRO  14           HG2      PRO  14 -11.504   0.939  16.707
  120    HG3  PRO  14           HG3      PRO  14 -12.320   2.477  17.129
  121    HD2  PRO  14           HD2      PRO  14 -13.700   0.135  16.923
  122    HD3  PRO  14           HD3      PRO  14 -14.412   1.684  16.379
  123    H    LYS  15           H        LYS  15 -10.948   0.951  12.049
  124    HA   LYS  15           HA       LYS  15  -9.672  -1.651  12.855
  125    HB2  LYS  15           HB2      LYS  15 -10.437  -0.550  10.142
  126    HB3  LYS  15           HB3      LYS  15  -9.121  -1.696  10.311
  127    HG2  LYS  15           HG2      LYS  15 -10.944  -3.016   9.798
  128    HG3  LYS  15           HG3      LYS  15 -10.631  -3.292  11.498
  129    HD2  LYS  15           HD2      LYS  15 -13.011  -3.218  11.070
  130    HD3  LYS  15           HD3      LYS  15 -12.557  -1.855  12.086
  131    HE2  LYS  15           HE2      LYS  15 -12.608  -0.356  10.086
  132    HE3  LYS  15           HE3      LYS  15 -12.994  -1.753   9.063
  133    HZ1  LYS  15           HZ1      LYS  15 -15.043  -2.023  10.425
  134    HZ2  LYS  15           HZ2      LYS  15 -15.029  -0.611   9.611
  135    HZ3  LYS  15           HZ3      LYS  15 -14.703  -0.636  11.222
  136    H    GLY  16           H        GLY  16  -7.660  -1.815  13.200
  137    HA2  GLY  16           HA2      GLY  16  -5.684  -0.888  11.405
  138    HA3  GLY  16           HA3      GLY  16  -5.571   0.101  12.851
  139    HA   PRO  17           HA       PRO  17  -4.859  -4.325  14.505
  140    HB2  PRO  17           HB2      PRO  17  -4.375  -5.979  12.052
  141    HB3  PRO  17           HB3      PRO  17  -5.183  -6.446  13.575
  142    HG2  PRO  17           HG2      PRO  17  -6.667  -5.863  11.396
  143    HG3  PRO  17           HG3      PRO  17  -7.149  -5.202  12.995
  144    HD2  PRO  17           HD2      PRO  17  -5.578  -3.837  10.794
  145    HD3  PRO  17           HD3      PRO  17  -6.992  -3.242  11.687
  146    H    SER  18           H        SER  18  -2.991  -5.069  15.376
  147    HA   SER  18           HA       SER  18  -1.068  -3.158  15.009
  148    HB2  SER  18           HB2      SER  18  -0.055  -4.057  17.048
  149    HB3  SER  18           HB3      SER  18  -1.818  -4.029  17.130
  150    HG   SER  18           HG       SER  18  -1.195  -5.987  17.870
  151    H    SER  19           H        SER  19  -0.732  -5.201  12.739
  152    HA   SER  19           HA       SER  19   2.224  -4.982  12.757
  153    HB2  SER  19           HB2      SER  19   0.888  -7.593  12.023
  154    HB3  SER  19           HB3      SER  19   2.597  -7.199  11.813
  155    HG   SER  19           HG       SER  19   2.096  -8.431  13.656
  156    H    VAL  20           H        VAL  20   0.125  -6.637  10.346
  157    HA   VAL  20           HA       VAL  20   0.799  -4.479   8.359
  158    HB   VAL  20           HB       VAL  20   0.900  -7.483   7.906
  159   HG11  VAL  20          HG11      VAL  20   1.435  -5.184   5.967
  160   HG12  VAL  20          HG12      VAL  20   1.803  -6.892   5.656
  161   HG13  VAL  20          HG13      VAL  20   0.131  -6.387   5.848
  162   HG21  VAL  20          HG21      VAL  20   3.316  -7.069   7.426
  163   HG22  VAL  20          HG22      VAL  20   3.114  -5.377   7.917
  164   HG23  VAL  20          HG23      VAL  20   2.907  -6.692   9.098
  165    H    GLU  21           H        GLU  21  -1.614  -6.833   9.497
  166    HA   GLU  21           HA       GLU  21  -3.544  -6.372   7.469
  167    HB2  GLU  21           HB2      GLU  21  -3.787  -7.210  10.359
  168    HB3  GLU  21           HB3      GLU  21  -5.207  -6.984   9.324
  169    HG2  GLU  21           HG2      GLU  21  -4.174  -8.583   7.671
  170    HG3  GLU  21           HG3      GLU  21  -2.913  -8.934   8.853
  171    H    ASP  22           H        ASP  22  -2.502  -4.163   9.970
  172    HA   ASP  22           HA       ASP  22  -4.554  -2.172   9.799
  173    HB2  ASP  22           HB2      ASP  22  -2.829  -2.034  11.465
  174    HB3  ASP  22           HB3      ASP  22  -1.544  -2.042  10.253
  175    H    ILE  23           H        ILE  23  -1.453  -2.279   7.918
  176    HA   ILE  23           HA       ILE  23  -2.360  -0.090   6.315
  177    HB   ILE  23           HB       ILE  23   0.031  -0.705   6.904
  178   HG12  ILE  23          HG12      ILE  23  -0.584   0.095   4.041
  179   HG13  ILE  23          HG13      ILE  23  -0.657   1.150   5.454
  180   HG21  ILE  23          HG21      ILE  23  -0.155  -2.459   4.415
  181   HG22  ILE  23          HG22      ILE  23   1.308  -2.084   5.346
  182   HG23  ILE  23          HG23      ILE  23   0.036  -3.042   6.082
  183   HD11  ILE  23          HD11      ILE  23   1.834   0.661   5.835
  184   HD12  ILE  23          HD12      ILE  23   1.835  -0.080   4.224
  185   HD13  ILE  23          HD13      ILE  23   1.431   1.635   4.419
  186    H    LYS  24           H        LYS  24  -2.519  -3.583   5.841
  187    HA   LYS  24           HA       LYS  24  -3.776  -3.660   3.215
  188    HB2  LYS  24           HB2      LYS  24  -4.176  -5.337   5.725
  189    HB3  LYS  24           HB3      LYS  24  -4.881  -5.718   4.174
  190    HG2  LYS  24           HG2      LYS  24  -1.866  -5.552   4.549
  191    HG3  LYS  24           HG3      LYS  24  -2.812  -6.997   4.907
  192    HD2  LYS  24           HD2      LYS  24  -3.742  -6.824   2.504
  193    HD3  LYS  24           HD3      LYS  24  -2.479  -5.627   2.215
  194    HE2  LYS  24           HE2      LYS  24  -1.736  -7.787   1.428
  195    HE3  LYS  24           HE3      LYS  24  -0.751  -7.355   2.831
  196    HZ1  LYS  24           HZ1      LYS  24  -1.633  -9.703   2.783
  197    HZ2  LYS  24           HZ2      LYS  24  -3.148  -9.097   3.041
  198    HZ3  LYS  24           HZ3      LYS  24  -1.970  -8.893   4.159
  199    H    ALA  25           H        ALA  25  -5.432  -3.540   6.476
  200    HA   ALA  25           HA       ALA  25  -8.010  -3.313   5.316
  201    HB1  ALA  25           HB1      ALA  25  -8.720  -2.619   7.588
  202    HB2  ALA  25           HB2      ALA  25  -7.640  -4.019   7.634
  203    HB3  ALA  25           HB3      ALA  25  -7.017  -2.406   8.054
  204    H    LYS  26           H        LYS  26  -5.718  -0.764   6.240
  205    HA   LYS  26           HA       LYS  26  -7.450   1.494   5.709
  206    HB2  LYS  26           HB2      LYS  26  -4.449   1.114   6.008
  207    HB3  LYS  26           HB3      LYS  26  -5.170   2.708   5.714
  208    HG2  LYS  26           HG2      LYS  26  -6.327   2.711   7.795
  209    HG3  LYS  26           HG3      LYS  26  -6.209   0.976   7.973
  210    HD2  LYS  26           HD2      LYS  26  -4.809   1.971   9.575
  211    HD3  LYS  26           HD3      LYS  26  -3.828   1.111   8.395
  212    HE2  LYS  26           HE2      LYS  26  -3.115   3.223   7.375
  213    HE3  LYS  26           HE3      LYS  26  -4.152   4.135   8.492
  214    HZ1  LYS  26           HZ1      LYS  26  -1.790   3.961   9.282
  215    HZ2  LYS  26           HZ2      LYS  26  -1.997   2.305   9.415
  216    HZ3  LYS  26           HZ3      LYS  26  -2.869   3.330  10.326
  217    H    MET  27           H        MET  27  -5.153  -0.288   3.591
  218    HA   MET  27           HA       MET  27  -5.696   1.417   1.275
  219    HB2  MET  27           HB2      MET  27  -4.342  -1.279   1.584
  220    HB3  MET  27           HB3      MET  27  -4.580  -0.463   0.030
  221    HG2  MET  27           HG2      MET  27  -3.390   1.535   0.885
  222    HG3  MET  27           HG3      MET  27  -3.062   0.697   2.397
  223    HE1  MET  27           HE1      MET  27  -0.906   2.141   0.616
  224    HE2  MET  27           HE2      MET  27  -0.446   1.284   2.098
  225    HE3  MET  27           HE3      MET  27   0.430   0.973   0.583
  226    H    GLN  28           H        GLN  28  -7.040  -1.752   2.367
  227    HA   GLN  28           HA       GLN  28  -8.763  -2.029   0.092
  228    HB2  GLN  28           HB2      GLN  28  -9.155  -3.104   2.897
  229    HB3  GLN  28           HB3      GLN  28 -10.023  -3.607   1.458
  230    HG2  GLN  28           HG2      GLN  28  -7.504  -4.575   2.501
  231    HG3  GLN  28           HG3      GLN  28  -8.566  -5.280   1.301
  232   HE21  GLN  28          HE21      GLN  28  -8.276  -4.232  -1.075
  233   HE22  GLN  28          HE22      GLN  28  -6.597  -3.738  -1.392
  234    H    ALA  29           H        ALA  29  -9.335  -0.418   3.258
  235    HA   ALA  29           HA       ALA  29 -11.952   0.566   2.675
  236    HB1  ALA  29           HB1      ALA  29  -9.712   1.798   4.336
  237    HB2  ALA  29           HB2      ALA  29 -11.429   2.252   4.394
  238    HB3  ALA  29           HB3      ALA  29 -10.924   0.642   4.917
  239    H    SER  30           H        SER  30  -8.709   1.951   1.919
  240    HA   SER  30           HA       SER  30  -9.534   4.382   0.769
  241    HB2  SER  30           HB2      SER  30  -7.164   3.597   1.263
  242    HB3  SER  30           HB3      SER  30  -7.239   2.672  -0.244
  243    HG   SER  30           HG       SER  30  -7.467   5.468   0.124
  244    H    ILE  31           H        ILE  31  -9.057   1.219  -0.978
  245    HA   ILE  31           HA       ILE  31 -10.025   2.288  -3.455
  246    HB   ILE  31           HB       ILE  31  -8.698   0.353  -3.553
  247   HG12  ILE  31          HG12      ILE  31 -11.540  -0.189  -4.504
  248   HG13  ILE  31          HG13      ILE  31 -10.241   0.631  -5.377
  249   HG21  ILE  31          HG21      ILE  31  -9.267  -0.701  -1.443
  250   HG22  ILE  31          HG22      ILE  31 -10.829  -1.249  -2.099
  251   HG23  ILE  31          HG23      ILE  31  -9.284  -1.856  -2.744
  252   HD11  ILE  31          HD11      ILE  31 -10.477  -1.590  -6.257
  253   HD12  ILE  31          HD12      ILE  31  -8.975  -1.584  -5.301
  254   HD13  ILE  31          HD13      ILE  31 -10.472  -2.305  -4.637
  255    H    GLU  32           H        GLU  32 -11.953   0.560  -0.839
  256    HA   GLU  32           HA       GLU  32 -14.304   0.915  -2.536
  257    HB2  GLU  32           HB2      GLU  32 -15.697   0.188  -0.746
  258    HB3  GLU  32           HB3      GLU  32 -14.378  -0.925  -1.076
  259    HG2  GLU  32           HG2      GLU  32 -13.229  -0.340   0.889
  260    HG3  GLU  32           HG3      GLU  32 -14.246   1.087   1.196
  261    H    LYS  33           H        LYS  33 -12.754   3.122  -0.342
  262    HA   LYS  33           HA       LYS  33 -14.990   5.052  -0.465
  263    HB2  LYS  33           HB2      LYS  33 -12.197   5.181   0.738
  264    HB3  LYS  33           HB3      LYS  33 -13.346   6.508   0.817
  265    HG2  LYS  33           HG2      LYS  33 -13.935   3.746   1.958
  266    HG3  LYS  33           HG3      LYS  33 -13.220   5.068   2.881
  267    HD2  LYS  33           HD2      LYS  33 -15.204   6.450   2.579
  268    HD3  LYS  33           HD3      LYS  33 -15.930   5.242   1.493
  269    HE2  LYS  33           HE2      LYS  33 -15.926   3.573   3.272
  270    HE3  LYS  33           HE3      LYS  33 -15.208   4.728   4.409
  271    HZ1  LYS  33           HZ1      LYS  33 -17.191   5.861   4.575
  272    HZ2  LYS  33           HZ2      LYS  33 -17.776   4.369   4.277
  273    HZ3  LYS  33           HZ3      LYS  33 -17.721   5.455   3.056
  274    H    GLY  34           H        GLY  34 -12.755   4.185  -2.734
  275    HA2  GLY  34           HA2      GLY  34 -12.956   5.138  -4.891
  276    HA3  GLY  34           HA3      GLY  34 -13.329   6.712  -4.197
  277    H    GLY  35           H        GLY  35 -10.576   5.275  -2.753
  278    HA2  GLY  35           HA2      GLY  35  -8.608   6.931  -4.201
  279    HA3  GLY  35           HA3      GLY  35  -8.339   5.828  -2.854
  280    H    SER  36           H        SER  36  -6.446   5.339  -4.357
  281    HA   SER  36           HA       SER  36  -7.074   2.985  -6.060
  282    HB2  SER  36           HB2      SER  36  -5.636   3.818  -7.874
  283    HB3  SER  36           HB3      SER  36  -7.039   4.862  -7.607
  284    HG   SER  36           HG       SER  36  -5.191   6.110  -7.852
  285    H    LEU  37           H        LEU  37  -5.292   1.662  -6.577
  286    HA   LEU  37           HA       LEU  37  -3.115   1.593  -4.523
  287    HB2  LEU  37           HB2      LEU  37  -4.803  -0.557  -5.791
  288    HB3  LEU  37           HB3      LEU  37  -3.167  -0.916  -5.263
  289    HG   LEU  37           HG       LEU  37  -3.667  -0.210  -2.968
  290   HD11  LEU  37          HD11      LEU  37  -6.487   0.222  -4.021
  291   HD12  LEU  37          HD12      LEU  37  -5.446   1.403  -3.189
  292   HD13  LEU  37          HD13      LEU  37  -6.095   0.038  -2.294
  293   HD21  LEU  37          HD21      LEU  37  -3.964  -2.565  -3.669
  294   HD22  LEU  37          HD22      LEU  37  -5.663  -2.227  -4.068
  295   HD23  LEU  37          HD23      LEU  37  -5.093  -2.110  -2.384
  296    HA   PRO  38           HA       PRO  38  -1.192   2.828  -8.446
  297    HB2  PRO  38           HB2      PRO  38   1.214   3.131  -6.652
  298    HB3  PRO  38           HB3      PRO  38   0.613   4.250  -7.905
  299    HG2  PRO  38           HG2      PRO  38   0.115   4.798  -5.340
  300    HG3  PRO  38           HG3      PRO  38  -1.227   4.920  -6.530
  301    HD2  PRO  38           HD2      PRO  38  -0.596   2.604  -4.676
  302    HD3  PRO  38           HD3      PRO  38  -2.145   3.448  -4.937
  303    H    LYS  39           H        LYS  39   0.162   1.992  -9.978
  304    HA   LYS  39           HA       LYS  39   1.485  -0.616  -9.424
  305    HB2  LYS  39           HB2      LYS  39   1.238  -1.106 -11.695
  306    HB3  LYS  39           HB3      LYS  39  -0.258  -0.285 -11.256
  307    HG2  LYS  39           HG2      LYS  39   0.879   1.880 -12.165
  308    HG3  LYS  39           HG3      LYS  39   2.126   0.799 -12.808
  309    HD2  LYS  39           HD2      LYS  39   0.180  -0.442 -13.963
  310    HD3  LYS  39           HD3      LYS  39  -0.800   0.984 -13.579
  311    HE2  LYS  39           HE2      LYS  39   0.865   2.430 -14.747
  312    HE3  LYS  39           HE3      LYS  39   1.865   1.005 -15.080
  313    HZ1  LYS  39           HZ1      LYS  39  -0.049   0.102 -16.339
  314    HZ2  LYS  39           HZ2      LYS  39   0.609   1.454 -16.990
  315    HZ3  LYS  39           HZ3      LYS  39  -0.817   1.568 -16.172
  316    H    VAL  40           H        VAL  40   2.369   2.690 -10.294
  317    HA   VAL  40           HA       VAL  40   5.068   1.887 -11.197
  318    HB   VAL  40           HB       VAL  40   3.811   4.637 -10.913
  319   HG11  VAL  40          HG11      VAL  40   6.273   4.808 -10.801
  320   HG12  VAL  40          HG12      VAL  40   6.426   3.777 -12.241
  321   HG13  VAL  40          HG13      VAL  40   5.694   5.387 -12.363
  322   HG21  VAL  40          HG21      VAL  40   4.264   2.866 -13.356
  323   HG22  VAL  40          HG22      VAL  40   2.697   3.358 -12.664
  324   HG23  VAL  40          HG23      VAL  40   3.741   4.562 -13.406
  325    H    GLU  41           H        GLU  41   6.906   1.960 -10.008
  326    HA   GLU  41           HA       GLU  41   6.545   1.528  -7.318
  327    HB2  GLU  41           HB2      GLU  41   8.830   1.118  -7.113
  328    HB3  GLU  41           HB3      GLU  41   8.368   0.617  -8.732
  329    HG2  GLU  41           HG2      GLU  41   9.916   3.131  -7.973
  330    HG3  GLU  41           HG3      GLU  41  10.566   1.672  -8.689
  331    H    ALA  42           H        ALA  42   8.004   4.563  -8.607
  332    HA   ALA  42           HA       ALA  42   8.471   5.777  -6.098
  333    HB1  ALA  42           HB1      ALA  42   8.485   7.858  -7.460
  334    HB2  ALA  42           HB2      ALA  42   9.362   6.547  -8.258
  335    HB3  ALA  42           HB3      ALA  42   7.729   6.990  -8.807
  336    H    LYS  43           H        LYS  43   5.459   5.445  -7.868
  337    HA   LYS  43           HA       LYS  43   3.948   7.414  -6.255
  338    HB2  LYS  43           HB2      LYS  43   2.749   5.417  -8.183
  339    HB3  LYS  43           HB3      LYS  43   2.132   6.989  -7.694
  340    HG2  LYS  43           HG2      LYS  43   4.482   6.402  -9.534
  341    HG3  LYS  43           HG3      LYS  43   2.902   7.018 -10.003
  342    HD2  LYS  43           HD2      LYS  43   3.344   9.155  -8.889
  343    HD3  LYS  43           HD3      LYS  43   4.884   8.539  -8.247
  344    HE2  LYS  43           HE2      LYS  43   5.669   8.161 -10.597
  345    HE3  LYS  43           HE3      LYS  43   4.184   8.918 -11.189
  346    HZ1  LYS  43           HZ1      LYS  43   6.163  10.310  -9.442
  347    HZ2  LYS  43           HZ2      LYS  43   4.859  10.984 -10.162
  348    HZ3  LYS  43           HZ3      LYS  43   6.116  10.413 -11.066
  349    H    PHE  44           H        PHE  44   4.196   3.869  -6.624
  350    HA   PHE  44           HA       PHE  44   2.344   3.188  -4.574
  351    HB2  PHE  44           HB2      PHE  44   3.248   1.618  -6.274
  352    HB3  PHE  44           HB3      PHE  44   4.827   1.695  -5.507
  353    HD1  PHE  44           HD1      PHE  44   1.241   0.790  -4.854
  354    HD2  PHE  44           HD2      PHE  44   5.361   0.167  -3.744
  355    HE1  PHE  44           HE1      PHE  44   0.561  -1.091  -3.382
  356    HE2  PHE  44           HE2      PHE  44   4.678  -1.739  -2.302
  357    HZ   PHE  44           HZ       PHE  44   2.285  -2.367  -2.122
  358    H    ILE  45           H        ILE  45   5.893   3.824  -4.369
  359    HA   ILE  45           HA       ILE  45   6.033   3.447  -1.525
  360    HB   ILE  45           HB       ILE  45   7.840   4.963  -3.433
  361   HG12  ILE  45          HG12      ILE  45   8.259   2.272  -2.030
  362   HG13  ILE  45          HG13      ILE  45   7.561   2.389  -3.634
  363   HG21  ILE  45          HG21      ILE  45   8.142   5.850  -1.133
  364   HG22  ILE  45          HG22      ILE  45   8.323   4.189  -0.509
  365   HG23  ILE  45          HG23      ILE  45   9.531   4.892  -1.606
  366   HD11  ILE  45          HD11      ILE  45   9.616   3.533  -4.461
  367   HD12  ILE  45          HD12      ILE  45  10.370   3.272  -2.866
  368   HD13  ILE  45          HD13      ILE  45   9.894   1.889  -3.855
  369    H    ASN  46           H        ASN  46   5.329   6.462  -3.454
  370    HA   ASN  46           HA       ASN  46   5.010   8.135  -1.134
  371    HB2  ASN  46           HB2      ASN  46   4.976   9.293  -3.182
  372    HB3  ASN  46           HB3      ASN  46   3.790   8.205  -3.912
  373   HD21  ASN  46          HD21      ASN  46   1.597   8.759  -3.792
  374   HD22  ASN  46          HD22      ASN  46   0.978   9.956  -2.677
  375    H    TYR  47           H        TYR  47   2.564   6.068  -2.803
  376    HA   TYR  47           HA       TYR  47   0.453   6.712  -1.039
  377    HB2  TYR  47           HB2      TYR  47   0.190   5.798  -3.257
  378    HB3  TYR  47           HB3      TYR  47   0.923   4.270  -2.771
  379    HD1  TYR  47           HD2      TYR  47  -1.974   6.555  -1.997
  380    HD2  TYR  47           HD1      TYR  47  -0.466   2.507  -2.045
  381    HE1  TYR  47           HE2      TYR  47  -4.235   5.703  -1.394
  382    HE2  TYR  47           HE1      TYR  47  -2.746   1.666  -1.476
  383    HH   TYR  47           HH       TYR  47  -5.529   3.839  -1.021
  384    H    VAL  48           H        VAL  48   2.863   4.063  -0.778
  385    HA   VAL  48           HA       VAL  48   1.882   2.947   1.688
  386    HB   VAL  48           HB       VAL  48   4.665   3.009   0.475
  387   HG11  VAL  48          HG11      VAL  48   3.715   1.559   2.992
  388   HG12  VAL  48          HG12      VAL  48   5.230   1.210   2.128
  389   HG13  VAL  48          HG13      VAL  48   4.999   2.778   2.895
  390   HG21  VAL  48          HG21      VAL  48   2.696   0.707   0.869
  391   HG22  VAL  48          HG22      VAL  48   2.879   1.601  -0.651
  392   HG23  VAL  48          HG23      VAL  48   4.234   0.667  -0.017
  393    H    LYS  49           H        LYS  49   4.437   5.506   1.194
  394    HA   LYS  49           HA       LYS  49   4.753   6.008   4.012
  395    HB2  LYS  49           HB2      LYS  49   5.341   7.678   1.534
  396    HB3  LYS  49           HB3      LYS  49   5.760   8.205   3.168
  397    HG2  LYS  49           HG2      LYS  49   7.215   6.280   3.508
  398    HG3  LYS  49           HG3      LYS  49   6.742   5.589   1.947
  399    HD2  LYS  49           HD2      LYS  49   7.673   7.572   0.784
  400    HD3  LYS  49           HD3      LYS  49   8.205   8.240   2.341
  401    HE2  LYS  49           HE2      LYS  49   9.689   6.320   2.710
  402    HE3  LYS  49           HE3      LYS  49   9.044   5.512   1.273
  403    HZ1  LYS  49           HZ1      LYS  49   9.902   7.426  -0.043
  404    HZ2  LYS  49           HZ2      LYS  49  11.079   6.533   0.623
  405    HZ3  LYS  49           HZ3      LYS  49  10.676   7.996   1.272
  406    H    ASN  50           H        ASN  50   2.416   7.310   1.732
  407    HA   ASN  50           HA       ASN  50   1.201   9.230   3.514
  408    HB2  ASN  50           HB2      ASN  50   0.726   9.498   1.237
  409    HB3  ASN  50           HB3      ASN  50   0.451   7.787   0.971
  410   HD21  ASN  50          HD21      ASN  50  -1.547   6.839   1.452
  411   HD22  ASN  50          HD22      ASN  50  -2.958   7.816   1.815
  412    H    CYS  51           H        CYS  51   0.592   5.707   2.987
  413    HA   CYS  51           HA       CYS  51  -1.630   5.668   4.863
  414    HB2  CYS  51           HB2      CYS  51  -0.068   3.437   3.502
  415    HB3  CYS  51           HB3      CYS  51  -1.492   3.202   4.535
  416    HG   CYS  51           HG       CYS  51  -1.147   4.609   1.596
  417    H    PHE  52           H        PHE  52   1.749   4.434   5.075
  418    HA   PHE  52           HA       PHE  52   2.122   5.240   7.766
  419    HB2  PHE  52           HB2      PHE  52   0.752   3.368   8.457
  420    HB3  PHE  52           HB3      PHE  52   1.538   2.291   7.324
  421    HD1  PHE  52           HD1      PHE  52   2.670   4.628  10.076
  422    HD2  PHE  52           HD2      PHE  52   2.866   0.674   8.367
  423    HE1  PHE  52           HE1      PHE  52   4.306   3.957  11.813
  424    HE2  PHE  52           HE2      PHE  52   4.474  -0.004  10.132
  425    HZ   PHE  52           HZ       PHE  52   5.219   1.641  11.837
  426    H    ARG  53           H        ARG  53   4.310   5.420   8.110
  427    HA   ARG  53           HA       ARG  53   6.235   4.589   6.080
  428    HB2  ARG  53           HB2      ARG  53   6.194   6.725   7.334
  429    HB3  ARG  53           HB3      ARG  53   6.640   5.848   8.798
  430    HG2  ARG  53           HG2      ARG  53   8.457   5.478   6.437
  431    HG3  ARG  53           HG3      ARG  53   8.357   7.122   7.040
  432    HD2  ARG  53           HD2      ARG  53   9.258   4.705   8.648
  433    HD3  ARG  53           HD3      ARG  53  10.263   6.001   8.000
  434    HE   ARG  53           HE       ARG  53   8.128   6.931   9.781
  435   HH11  ARG  53          HH11      ARG  53  11.581   6.157   9.688
  436   HH12  ARG  53          HH12      ARG  53  11.780   6.716  11.332
  437   HH21  ARG  53          HH21      ARG  53   8.613   7.713  11.845
  438   HH22  ARG  53          HH22      ARG  53  10.247   7.536  12.430
  439    H    MET  54           H        MET  54   5.626   2.373   6.258
  440    HA   MET  54           HA       MET  54   6.244   0.699   8.476
  441    HB2  MET  54           HB2      MET  54   4.626   0.331   6.599
  442    HB3  MET  54           HB3      MET  54   5.984   0.030   5.512
  443    HG2  MET  54           HG2      MET  54   6.576  -1.980   6.727
  444    HG3  MET  54           HG3      MET  54   5.453  -1.580   8.031
  445    HE1  MET  54           HE1      MET  54   4.510  -1.208   4.111
  446    HE2  MET  54           HE2      MET  54   5.736  -2.495   4.222
  447    HE3  MET  54           HE3      MET  54   4.059  -2.896   3.793
  448    H    THR  55           H        THR  55   8.234   1.708   5.765
  449    HA   THR  55           HA       THR  55  10.229   1.284   4.947
  450    HB   THR  55           HB       THR  55  10.806   2.664   6.810
  451    HG1  THR  55           HG1      THR  55  12.682   2.550   6.008
  452   HG21  THR  55          HG21      THR  55  11.528   0.067   8.204
  453   HG22  THR  55          HG22      THR  55  10.414   1.339   8.767
  454   HG23  THR  55          HG23      THR  55  12.147   1.665   8.678
  455    H    ASP  56           H        ASP  56   9.177  -1.401   6.832
  456    HA   ASP  56           HA       ASP  56  11.185  -3.305   6.263
  457    HB2  ASP  56           HB2      ASP  56   8.183  -3.659   6.576
  458    HB3  ASP  56           HB3      ASP  56   9.364  -4.967   6.620
  459    H    GLN  57           H        GLN  57  12.013  -3.401   4.211
  460    HA   GLN  57           HA       GLN  57  10.491  -3.213   1.844
  461    HB2  GLN  57           HB2      GLN  57  13.254  -3.728   2.521
  462    HB3  GLN  57           HB3      GLN  57  12.758  -4.884   1.293
  463    HG2  GLN  57           HG2      GLN  57  12.426  -1.863   1.110
  464    HG3  GLN  57           HG3      GLN  57  13.697  -2.792   0.325
  465   HE21  GLN  57          HE21      GLN  57  11.107  -1.147  -0.590
  466   HE22  GLN  57          HE22      GLN  57  10.351  -2.241  -1.743
  467    H    GLU  58           H        GLU  58  11.272  -6.127   3.737
  468    HA   GLU  58           HA       GLU  58  10.100  -8.081   2.066
  469    HB2  GLU  58           HB2      GLU  58   9.808  -9.405   4.117
  470    HB3  GLU  58           HB3      GLU  58  11.411  -8.693   3.953
  471    HG2  GLU  58           HG2      GLU  58  10.688  -6.871   5.572
  472    HG3  GLU  58           HG3      GLU  58   9.192  -7.771   5.817
  473    H    ALA  59           H        ALA  59   8.418  -5.794   4.260
  474    HA   ALA  59           HA       ALA  59   5.802  -7.054   3.710
  475    HB1  ALA  59           HB1      ALA  59   6.192  -6.117   5.922
  476    HB2  ALA  59           HB2      ALA  59   6.473  -4.511   5.203
  477    HB3  ALA  59           HB3      ALA  59   4.877  -5.290   5.056
  478    H    ILE  60           H        ILE  60   7.617  -4.122   2.661
  479    HA   ILE  60           HA       ILE  60   5.579  -2.999   0.998
  480    HB   ILE  60           HB       ILE  60   8.594  -2.933   0.772
  481   HG12  ILE  60          HG12      ILE  60   6.626  -0.810   1.748
  482   HG13  ILE  60          HG13      ILE  60   7.516  -1.888   2.812
  483   HG21  ILE  60          HG21      ILE  60   7.615  -2.453  -1.466
  484   HG22  ILE  60          HG22      ILE  60   6.528  -1.250  -0.737
  485   HG23  ILE  60          HG23      ILE  60   8.283  -0.993  -0.775
  486   HD11  ILE  60          HD11      ILE  60   8.714   0.156   2.797
  487   HD12  ILE  60          HD12      ILE  60   9.668  -0.999   1.843
  488   HD13  ILE  60          HD13      ILE  60   8.702   0.264   1.031
  489    H    GLN  61           H        GLN  61   8.091  -5.450   0.153
  490    HA   GLN  61           HA       GLN  61   6.997  -5.792  -2.483
  491    HB2  GLN  61           HB2      GLN  61   8.612  -7.484  -2.823
  492    HB3  GLN  61           HB3      GLN  61   9.343  -6.162  -1.931
  493    HG2  GLN  61           HG2      GLN  61  10.200  -7.996  -0.809
  494    HG3  GLN  61           HG3      GLN  61   8.844  -7.550   0.198
  495   HE21  GLN  61          HE21      GLN  61   8.127  -9.476   1.060
  496   HE22  GLN  61          HE22      GLN  61   7.835 -10.936   0.140
  497    H    ASP  62           H        ASP  62   6.260  -7.499   0.620
  498    HA   ASP  62           HA       ASP  62   4.636  -9.485  -0.730
  499    HB2  ASP  62           HB2      ASP  62   5.640  -9.506   1.667
  500    HB3  ASP  62           HB3      ASP  62   4.150  -8.675   2.118
  501    H    LEU  63           H        LEU  63   4.012  -6.218   0.430
  502    HA   LEU  63           HA       LEU  63   1.197  -6.198  -0.059
  503    HB2  LEU  63           HB2      LEU  63   2.873  -4.555   1.259
  504    HB3  LEU  63           HB3      LEU  63   2.772  -3.657  -0.240
  505    HG   LEU  63           HG       LEU  63   0.529  -4.469   1.668
  506   HD11  LEU  63          HD11      LEU  63   1.952  -2.601   2.411
  507   HD12  LEU  63          HD12      LEU  63   0.319  -2.038   2.021
  508   HD13  LEU  63          HD13      LEU  63   1.648  -1.745   0.881
  509   HD21  LEU  63          HD21      LEU  63  -0.433  -4.489  -0.584
  510   HD22  LEU  63          HD22      LEU  63   0.266  -2.890  -0.928
  511   HD23  LEU  63          HD23      LEU  63  -0.998  -3.076   0.305
  512    H    TRP  64           H        TRP  64   4.063  -5.415  -2.117
  513    HA   TRP  64           HA       TRP  64   2.656  -4.763  -4.535
  514    HB2  TRP  64           HB2      TRP  64   5.352  -5.848  -3.861
  515    HB3  TRP  64           HB3      TRP  64   4.767  -6.246  -5.448
  516    HD1  TRP  64           HD1      TRP  64   3.537  -2.892  -5.275
  517    HE1  TRP  64           HE1      TRP  64   5.194  -1.299  -6.436
  518    HE3  TRP  64           HE3      TRP  64   7.735  -5.847  -5.288
  519    HZ2  TRP  64           HZ2      TRP  64   8.002  -1.163  -6.946
  520    HZ3  TRP  64           HZ3      TRP  64   9.884  -4.950  -6.152
  521    HH2  TRP  64           HH2      TRP  64  10.042  -2.608  -6.956
  522    H    GLN  65           H        GLN  65   3.623  -8.027  -3.261
  523    HA   GLN  65           HA       GLN  65   2.505  -9.460  -5.461
  524    HB2  GLN  65           HB2      GLN  65   2.486 -10.555  -2.634
  525    HB3  GLN  65           HB3      GLN  65   2.499 -11.429  -4.150
  526    HG2  GLN  65           HG2      GLN  65   4.769 -10.102  -2.714
  527    HG3  GLN  65           HG3      GLN  65   4.623 -11.742  -3.264
  528   HE21  GLN  65          HE21      GLN  65   5.801  -8.597  -4.026
  529   HE22  GLN  65          HE22      GLN  65   6.501  -9.060  -5.585
  530    H    TRP  66           H        TRP  66   1.012  -8.465  -2.363
  531    HA   TRP  66           HA       TRP  66  -1.610  -9.463  -2.781
  532    HB2  TRP  66           HB2      TRP  66  -0.836  -8.617  -0.644
  533    HB3  TRP  66           HB3      TRP  66  -0.606  -7.012  -1.298
  534    HD1  TRP  66           HD1      TRP  66  -2.517  -5.366  -0.975
  535    HE1  TRP  66           HE1      TRP  66  -4.903  -5.473  -0.041
  536    HE3  TRP  66           HE3      TRP  66  -3.058 -10.460  -0.738
  537    HZ2  TRP  66           HZ2      TRP  66  -6.852  -7.511   0.586
  538    HZ3  TRP  66           HZ3      TRP  66  -5.185 -11.451   0.058
  539    HH2  TRP  66           HH2      TRP  66  -7.081  -9.994   0.725
  540    H    ARG  67           H        ARG  67  -0.393  -6.139  -3.593
  541    HA   ARG  67           HA       ARG  67  -2.917  -5.417  -4.722
  542    HB2  ARG  67           HB2      ARG  67  -2.083  -3.338  -5.164
  543    HB3  ARG  67           HB3      ARG  67  -1.159  -3.850  -3.777
  544    HG2  ARG  67           HG2      ARG  67   0.737  -3.359  -4.846
  545    HG3  ARG  67           HG3      ARG  67   0.424  -4.563  -6.077
  546    HD2  ARG  67           HD2      ARG  67  -0.504  -1.659  -6.105
  547    HD3  ARG  67           HD3      ARG  67   0.815  -2.322  -7.051
  548    HE   ARG  67           HE       ARG  67  -2.098  -2.657  -7.526
  549   HH11  ARG  67          HH11      ARG  67   1.101  -3.655  -8.656
  550   HH12  ARG  67          HH12      ARG  67   0.415  -4.232 -10.169
  551   HH21  ARG  67          HH21      ARG  67  -2.812  -3.405  -9.361
  552   HH22  ARG  67          HH22      ARG  67  -1.761  -4.126 -10.561
  553    H    LYS  68           H        LYS  68  -0.090  -6.838  -6.339
  554    HA   LYS  68           HA       LYS  68  -1.427  -6.542  -8.953
  555    HB2  LYS  68           HB2      LYS  68   0.506  -7.300  -9.963
  556    HB3  LYS  68           HB3      LYS  68   1.038  -6.295  -8.618
  557    HG2  LYS  68           HG2      LYS  68   1.327  -8.518  -7.307
  558    HG3  LYS  68           HG3      LYS  68   1.166  -9.317  -8.868
  559    HD2  LYS  68           HD2      LYS  68   3.233  -7.169  -8.177
  560    HD3  LYS  68           HD3      LYS  68   3.545  -8.909  -8.223
  561    HE2  LYS  68           HE2      LYS  68   3.021  -8.999 -10.610
  562    HE3  LYS  68           HE3      LYS  68   2.588  -7.280 -10.628
  563    HZ1  LYS  68           HZ1      LYS  68   5.285  -8.268  -9.892
  564    HZ2  LYS  68           HZ2      LYS  68   4.869  -6.715 -10.170
  565    HZ3  LYS  68           HZ3      LYS  68   4.872  -7.796 -11.416
  566    H    SER  69           H        SER  69  -1.681  -8.848  -6.463
  567    HA   SER  69           HA       SER  69  -2.696 -10.934  -8.298
  568    HB2  SER  69           HB2      SER  69  -2.577 -10.934  -5.274
  569    HB3  SER  69           HB3      SER  69  -3.005 -12.304  -6.318
  570    HG   SER  69           HG       SER  69  -0.561 -10.988  -5.901
  571    H    LEU  70           H        LEU  70  -3.997  -8.135  -7.008
  572    HA   LEU  70           HA       LEU  70  -6.796  -8.891  -6.807
  573    HB2  LEU  70           HB2      LEU  70  -5.421  -6.245  -7.411
  574    HB3  LEU  70           HB3      LEU  70  -7.136  -6.423  -7.082
  575    HG   LEU  70           HG       LEU  70  -4.890  -6.938  -5.103
  576   HD11  LEU  70          HD11      LEU  70  -6.990  -4.744  -5.243
  577   HD12  LEU  70          HD12      LEU  70  -5.263  -4.557  -5.607
  578   HD13  LEU  70          HD13      LEU  70  -5.778  -4.958  -3.959
  579   HD21  LEU  70          HD21      LEU  70  -7.905  -7.019  -4.702
  580   HD22  LEU  70          HD22      LEU  70  -6.680  -7.148  -3.419
  581   HD23  LEU  70          HD23      LEU  70  -6.803  -8.413  -4.647
  Start of MODEL    7
    1    H    GLN   1           H1       GLN   1 -41.957  -2.103  23.674
    2    HA   GLN   1           HA       GLN   1 -41.426  -3.666  22.007
    3    HB2  GLN   1           HB2      GLN   1 -42.584  -1.148  20.750
    4    HB3  GLN   1           HB3      GLN   1 -42.618  -2.726  20.000
    5    HG2  GLN   1           HG2      GLN   1 -43.926  -2.286  22.712
    6    HG3  GLN   1           HG3      GLN   1 -44.721  -1.840  21.221
    7   HE21  GLN   1          HE21      GLN   1 -45.774  -3.398  20.028
    8   HE22  GLN   1          HE22      GLN   1 -45.778  -5.102  20.470
    9    H    GLU   2           H        GLU   2 -40.275  -4.264  20.178
   10    HA   GLU   2           HA       GLU   2 -38.361  -4.462  18.980
   11    HB2  GLU   2           HB2      GLU   2 -39.235  -1.693  18.107
   12    HB3  GLU   2           HB3      GLU   2 -38.046  -2.688  17.259
   13    HG2  GLU   2           HG2      GLU   2 -39.738  -4.492  16.989
   14    HG3  GLU   2           HG3      GLU   2 -40.950  -3.437  17.734
   15    H    SER   3           H        SER   3 -37.809  -3.318  21.718
   16    HA   SER   3           HA       SER   3 -35.297  -1.832  21.242
   17    HB2  SER   3           HB2      SER   3 -35.157  -1.629  23.618
   18    HB3  SER   3           HB3      SER   3 -36.781  -1.173  23.092
   19    HG   SER   3           HG       SER   3 -36.437  -2.653  24.986
   20    H    PHE   4           H        PHE   4 -33.265  -2.557  22.210
   21    HA   PHE   4           HA       PHE   4 -31.522  -3.984  22.146
   22    HB2  PHE   4           HB2      PHE   4 -32.691  -4.406  24.348
   23    HB3  PHE   4           HB3      PHE   4 -33.408  -5.830  23.600
   24    HD1  PHE   4           HD1      PHE   4 -29.875  -4.407  23.663
   25    HD2  PHE   4           HD2      PHE   4 -32.457  -7.733  24.591
   26    HE1  PHE   4           HE1      PHE   4 -27.920  -5.734  24.390
   27    HE2  PHE   4           HE2      PHE   4 -30.495  -9.043  25.356
   28    HZ   PHE   4           HZ       PHE   4 -28.215  -8.053  25.232
   29    H    LYS   5           H        LYS   5 -33.165  -4.210  19.740
   30    HA   LYS   5           HA       LYS   5 -32.917  -7.098  19.033
   31    HB2  LYS   5           HB2      LYS   5 -34.415  -6.821  17.344
   32    HB3  LYS   5           HB3      LYS   5 -35.061  -5.863  18.674
   33    HG2  LYS   5           HG2      LYS   5 -34.327  -3.777  17.545
   34    HG3  LYS   5           HG3      LYS   5 -33.553  -4.731  16.264
   35    HD2  LYS   5           HD2      LYS   5 -35.801  -5.734  15.723
   36    HD3  LYS   5           HD3      LYS   5 -36.541  -4.584  16.852
   37    HE2  LYS   5           HE2      LYS   5 -35.722  -2.687  15.517
   38    HE3  LYS   5           HE3      LYS   5 -34.772  -3.778  14.503
   39    HZ1  LYS   5           HZ1      LYS   5 -36.672  -3.260  13.297
   40    HZ2  LYS   5           HZ2      LYS   5 -37.735  -3.569  14.521
   41    HZ3  LYS   5           HZ3      LYS   5 -36.913  -4.795  13.779
   42    H    LYS   6           H        LYS   6 -31.494  -3.984  18.246
   43    HA   LYS   6           HA       LYS   6 -29.533  -5.233  16.384
   44    HB2  LYS   6           HB2      LYS   6 -29.932  -2.362  17.306
   45    HB3  LYS   6           HB3      LYS   6 -28.572  -2.913  16.312
   46    HG2  LYS   6           HG2      LYS   6 -30.238  -3.866  14.665
   47    HG3  LYS   6           HG3      LYS   6 -31.525  -3.063  15.567
   48    HD2  LYS   6           HD2      LYS   6 -29.150  -1.655  14.254
   49    HD3  LYS   6           HD3      LYS   6 -30.752  -1.855  13.538
   50    HE2  LYS   6           HE2      LYS   6 -31.711  -0.642  15.565
   51    HE3  LYS   6           HE3      LYS   6 -30.050  -0.245  16.031
   52    HZ1  LYS   6           HZ1      LYS   6 -31.355   0.468  13.458
   53    HZ2  LYS   6           HZ2      LYS   6 -29.810   0.886  13.864
   54    HZ3  LYS   6           HZ3      LYS   6 -31.086   1.516  14.690
   55    H    GLN   7           H        GLN   7 -28.967  -6.773  17.987
   56    HA   GLN   7           HA       GLN   7 -26.910  -5.781  19.918
   57    HB2  GLN   7           HB2      GLN   7 -27.334  -7.728  21.294
   58    HB3  GLN   7           HB3      GLN   7 -28.748  -6.695  21.142
   59    HG2  GLN   7           HG2      GLN   7 -29.810  -8.258  19.591
   60    HG3  GLN   7           HG3      GLN   7 -28.340  -9.242  19.503
   61   HE21  GLN   7          HE21      GLN   7 -31.012  -8.251  21.675
   62   HE22  GLN   7          HE22      GLN   7 -30.753  -9.581  22.794
   63    H    GLU   8           H        GLU   8 -25.062  -7.046  20.299
   64    HA   GLU   8           HA       GLU   8 -24.316  -9.172  18.425
   65    HB2  GLU   8           HB2      GLU   8 -22.426  -7.990  17.460
   66    HB3  GLU   8           HB3      GLU   8 -23.880  -7.040  17.156
   67    HG2  GLU   8           HG2      GLU   8 -23.307  -5.552  19.077
   68    HG3  GLU   8           HG3      GLU   8 -21.893  -6.545  19.406
   69    H    LYS   9           H        LYS   9 -21.866  -9.746  18.846
   70    HA   LYS   9           HA       LYS   9 -21.038  -9.109  21.669
   71    HB2  LYS   9           HB2      LYS   9 -20.524 -11.719  20.196
   72    HB3  LYS   9           HB3      LYS   9 -19.935 -11.270  21.803
   73    HG2  LYS   9           HG2      LYS   9 -22.321 -11.080  22.585
   74    HG3  LYS   9           HG3      LYS   9 -22.849 -11.665  20.993
   75    HD2  LYS   9           HD2      LYS   9 -21.442 -13.737  21.375
   76    HD3  LYS   9           HD3      LYS   9 -21.161 -13.167  23.035
   77    HE2  LYS   9           HE2      LYS   9 -23.653 -13.098  23.375
   78    HE3  LYS   9           HE3      LYS   9 -23.863 -13.766  21.746
   79    HZ1  LYS   9           HZ1      LYS   9 -23.944 -15.551  23.312
   80    HZ2  LYS   9           HZ2      LYS   9 -22.554 -15.096  24.052
   81    HZ3  LYS   9           HZ3      LYS   9 -22.502 -15.701  22.532
   82    H    THR  10           H        THR  10 -19.840 -10.055  18.450
   83    HA   THR  10           HA       THR  10 -17.775  -9.901  17.487
   84    HB   THR  10           HB       THR  10 -16.933  -7.617  17.128
   85    HG1  THR  10           HG1      THR  10 -19.036  -6.272  18.011
   86   HG21  THR  10          HG21      THR  10 -18.894  -6.829  15.906
   87   HG22  THR  10          HG22      THR  10 -19.940  -7.957  16.794
   88   HG23  THR  10          HG23      THR  10 -18.685  -8.575  15.699
   89    HA   PRO  11           HA       PRO  11 -16.080 -10.275  21.693
   90    HB2  PRO  11           HB2      PRO  11 -14.869 -12.856  20.706
   91    HB3  PRO  11           HB3      PRO  11 -15.713 -12.520  22.251
   92    HG2  PRO  11           HG2      PRO  11 -17.026 -13.782  20.259
   93    HG3  PRO  11           HG3      PRO  11 -17.847 -12.454  21.148
   94    HD2  PRO  11           HD2      PRO  11 -16.388 -12.320  18.486
   95    HD3  PRO  11           HD3      PRO  11 -18.017 -11.732  18.893
   96    H    LYS  12           H        LYS  12 -14.042 -10.333  18.857
   97    HA   LYS  12           HA       LYS  12 -11.862  -9.097  20.419
   98    HB2  LYS  12           HB2      LYS  12 -11.598 -11.724  20.240
   99    HB3  LYS  12           HB3      LYS  12 -11.212 -11.428  18.562
  100    HG2  LYS  12           HG2      LYS  12  -9.192 -11.664  19.871
  101    HG3  LYS  12           HG3      LYS  12  -9.287 -10.028  19.229
  102    HD2  LYS  12           HD2      LYS  12  -8.441 -10.186  21.583
  103    HD3  LYS  12           HD3      LYS  12  -9.823  -9.116  21.381
  104    HE2  LYS  12           HE2      LYS  12 -11.342 -10.849  22.264
  105    HE3  LYS  12           HE3      LYS  12  -9.991 -11.979  22.426
  106    HZ1  LYS  12           HZ1      LYS  12 -10.106  -9.368  23.841
  107    HZ2  LYS  12           HZ2      LYS  12  -9.015 -10.582  24.067
  108    HZ3  LYS  12           HZ3      LYS  12 -10.574 -10.800  24.526
  109    H    THR  13           H        THR  13 -11.490  -7.241  19.385
  110    HA   THR  13           HA       THR  13 -11.742  -7.115  16.404
  111    HB   THR  13           HB       THR  13 -12.970  -4.909  16.808
  112    HG1  THR  13           HG1      THR  13 -14.368  -5.268  18.743
  113   HG21  THR  13          HG21      THR  13 -13.961  -7.001  15.875
  114   HG22  THR  13          HG22      THR  13 -15.104  -6.019  16.796
  115   HG23  THR  13          HG23      THR  13 -14.407  -7.486  17.524
  116    HA   PRO  14           HA       PRO  14  -7.990  -4.639  17.263
  117    HB2  PRO  14           HB2      PRO  14  -6.237  -5.934  15.653
  118    HB3  PRO  14           HB3      PRO  14  -6.639  -6.519  17.292
  119    HG2  PRO  14           HG2      PRO  14  -7.806  -7.456  14.655
  120    HG3  PRO  14           HG3      PRO  14  -7.161  -8.454  15.987
  121    HD2  PRO  14           HD2      PRO  14  -9.837  -7.907  15.675
  122    HD3  PRO  14           HD3      PRO  14  -9.089  -8.135  17.282
  123    H    LYS  15           H        LYS  15  -9.726  -3.288  16.206
  124    HA   LYS  15           HA       LYS  15  -9.276  -2.704  13.333
  125    HB2  LYS  15           HB2      LYS  15 -10.951  -1.356  15.487
  126    HB3  LYS  15           HB3      LYS  15 -10.580  -0.572  13.960
  127    HG2  LYS  15           HG2      LYS  15 -12.646  -1.489  13.543
  128    HG3  LYS  15           HG3      LYS  15 -11.533  -2.614  12.764
  129    HD2  LYS  15           HD2      LYS  15 -11.768  -4.154  14.735
  130    HD3  LYS  15           HD3      LYS  15 -12.835  -2.965  15.499
  131    HE2  LYS  15           HE2      LYS  15 -14.265  -4.603  14.561
  132    HE3  LYS  15           HE3      LYS  15 -14.395  -3.188  13.510
  133    HZ1  LYS  15           HZ1      LYS  15 -14.145  -5.392  12.382
  134    HZ2  LYS  15           HZ2      LYS  15 -12.598  -5.485  12.929
  135    HZ3  LYS  15           HZ3      LYS  15 -13.035  -4.284  11.890
  136    H    GLY  16           H        GLY  16  -8.332  -0.832  12.579
  137    HA2  GLY  16           HA2      GLY  16  -6.523   0.497  12.277
  138    HA3  GLY  16           HA3      GLY  16  -6.972   1.213  13.817
  139    HA   PRO  17           HA       PRO  17  -3.829  -2.044  15.405
  140    HB2  PRO  17           HB2      PRO  17  -2.664  -3.271  12.910
  141    HB3  PRO  17           HB3      PRO  17  -3.003  -4.031  14.490
  142    HG2  PRO  17           HG2      PRO  17  -4.667  -4.442  12.412
  143    HG3  PRO  17           HG3      PRO  17  -5.334  -4.115  14.050
  144    HD2  PRO  17           HD2      PRO  17  -4.957  -2.183  11.751
  145    HD3  PRO  17           HD3      PRO  17  -6.387  -2.469  12.755
  146    H    SER  18           H        SER  18  -1.375  -2.371  15.500
  147    HA   SER  18           HA       SER  18   0.086   0.030  14.550
  148    HB2  SER  18           HB2      SER  18   1.753  -0.618  16.213
  149    HB3  SER  18           HB3      SER  18   0.144  -0.461  16.930
  150    HG   SER  18           HG       SER  18   1.740  -2.504  17.099
  151    H    SER  19           H        SER  19  -0.435  -2.852  13.150
  152    HA   SER  19           HA       SER  19   2.385  -3.375  12.282
  153    HB2  SER  19           HB2      SER  19   0.130  -5.389  12.469
  154    HB3  SER  19           HB3      SER  19   1.869  -5.697  12.279
  155    HG   SER  19           HG       SER  19   2.179  -4.845  14.368
  156    H    VAL  20           H        VAL  20   2.335  -4.871  10.166
  157    HA   VAL  20           HA       VAL  20   1.596  -3.218   8.039
  158    HB   VAL  20           HB       VAL  20   1.725  -6.196   7.577
  159   HG11  VAL  20          HG11      VAL  20   2.975  -3.834   6.093
  160   HG12  VAL  20          HG12      VAL  20   2.870  -5.525   5.541
  161   HG13  VAL  20          HG13      VAL  20   1.413  -4.547   5.672
  162   HG21  VAL  20          HG21      VAL  20   4.197  -6.086   7.516
  163   HG22  VAL  20          HG22      VAL  20   4.138  -4.474   8.258
  164   HG23  VAL  20          HG23      VAL  20   3.563  -5.906   9.146
  165    H    GLU  21           H        GLU  21  -0.349  -5.862   9.442
  166    HA   GLU  21           HA       GLU  21  -2.424  -5.927   7.500
  167    HB2  GLU  21           HB2      GLU  21  -2.331  -6.520  10.467
  168    HB3  GLU  21           HB3      GLU  21  -3.822  -6.692   9.517
  169    HG2  GLU  21           HG2      GLU  21  -2.816  -8.274   8.017
  170    HG3  GLU  21           HG3      GLU  21  -1.222  -8.029   8.723
  171    H    ASP  22           H        ASP  22  -1.735  -3.328   9.745
  172    HA   ASP  22           HA       ASP  22  -4.388  -2.179   9.753
  173    HB2  ASP  22           HB2      ASP  22  -2.670  -1.534  11.417
  174    HB3  ASP  22           HB3      ASP  22  -1.659  -0.870  10.134
  175    H    ILE  23           H        ILE  23  -1.433  -1.379   7.903
  176    HA   ILE  23           HA       ILE  23  -2.833   0.475   6.194
  177    HB   ILE  23           HB       ILE  23  -0.501   0.792   6.659
  178   HG12  ILE  23          HG12      ILE  23  -0.844   0.192   3.696
  179   HG13  ILE  23          HG13      ILE  23  -1.610   1.555   4.506
  180   HG21  ILE  23          HG21      ILE  23   0.305  -1.516   6.848
  181   HG22  ILE  23          HG22      ILE  23   0.063  -1.789   5.114
  182   HG23  ILE  23          HG23      ILE  23   1.285  -0.641   5.689
  183   HD11  ILE  23          HD11      ILE  23   1.409   1.156   4.410
  184   HD12  ILE  23          HD12      ILE  23   0.465   2.186   3.316
  185   HD13  ILE  23          HD13      ILE  23   0.519   2.556   5.037
  186    H    LYS  24           H        LYS  24  -2.007  -2.992   5.845
  187    HA   LYS  24           HA       LYS  24  -2.925  -3.259   3.126
  188    HB2  LYS  24           HB2      LYS  24  -2.844  -5.231   5.445
  189    HB3  LYS  24           HB3      LYS  24  -3.315  -5.683   3.800
  190    HG2  LYS  24           HG2      LYS  24  -1.175  -5.112   2.898
  191    HG3  LYS  24           HG3      LYS  24  -0.686  -4.310   4.392
  192    HD2  LYS  24           HD2      LYS  24   0.480  -6.416   4.154
  193    HD3  LYS  24           HD3      LYS  24  -0.578  -6.444   5.569
  194    HE2  LYS  24           HE2      LYS  24  -2.226  -7.802   4.353
  195    HE3  LYS  24           HE3      LYS  24  -1.323  -7.609   2.845
  196    HZ1  LYS  24           HZ1      LYS  24   0.480  -8.933   3.778
  197    HZ2  LYS  24           HZ2      LYS  24  -0.927  -9.770   3.948
  198    HZ3  LYS  24           HZ3      LYS  24  -0.259  -9.001   5.235
  199    H    ALA  25           H        ALA  25  -4.793  -3.842   6.179
  200    HA   ALA  25           HA       ALA  25  -7.243  -4.189   4.838
  201    HB1  ALA  25           HB1      ALA  25  -6.703  -3.187   7.661
  202    HB2  ALA  25           HB2      ALA  25  -8.215  -3.927   7.072
  203    HB3  ALA  25           HB3      ALA  25  -6.720  -4.886   7.139
  204    H    LYS  26           H        LYS  26  -5.779  -1.122   5.975
  205    HA   LYS  26           HA       LYS  26  -8.139   0.477   5.327
  206    HB2  LYS  26           HB2      LYS  26  -5.294   1.100   6.121
  207    HB3  LYS  26           HB3      LYS  26  -6.413   2.385   5.636
  208    HG2  LYS  26           HG2      LYS  26  -7.857   2.027   7.487
  209    HG3  LYS  26           HG3      LYS  26  -7.286   0.387   7.730
  210    HD2  LYS  26           HD2      LYS  26  -6.536   1.951   9.487
  211    HD3  LYS  26           HD3      LYS  26  -5.220   1.137   8.634
  212    HE2  LYS  26           HE2      LYS  26  -4.791   3.144   7.287
  213    HE3  LYS  26           HE3      LYS  26  -6.083   4.004   8.153
  214    HZ1  LYS  26           HZ1      LYS  26  -4.862   3.857  10.149
  215    HZ2  LYS  26           HZ2      LYS  26  -3.703   4.255   9.039
  216    HZ3  LYS  26           HZ3      LYS  26  -3.821   2.720   9.577
  217    H    MET  27           H        MET  27  -5.188  -0.354   3.476
  218    HA   MET  27           HA       MET  27  -5.822   1.335   1.217
  219    HB2  MET  27           HB2      MET  27  -4.143  -1.177   1.489
  220    HB3  MET  27           HB3      MET  27  -4.344  -0.311  -0.036
  221    HG2  MET  27           HG2      MET  27  -3.281   0.983   2.500
  222    HG3  MET  27           HG3      MET  27  -2.271   0.291   1.233
  223    HE1  MET  27           HE1      MET  27  -1.629   4.113   0.874
  224    HE2  MET  27           HE2      MET  27  -1.982   3.265   2.394
  225    HE3  MET  27           HE3      MET  27  -0.927   2.509   1.176
  226    H    GLN  28           H        GLN  28  -6.511  -2.178   1.804
  227    HA   GLN  28           HA       GLN  28  -8.110  -2.519  -0.532
  228    HB2  GLN  28           HB2      GLN  28  -7.884  -3.927   2.119
  229    HB3  GLN  28           HB3      GLN  28  -9.281  -4.277   1.122
  230    HG2  GLN  28           HG2      GLN  28  -7.446  -5.871   0.664
  231    HG3  GLN  28           HG3      GLN  28  -7.994  -4.981  -0.752
  232   HE21  GLN  28          HE21      GLN  28  -5.338  -5.039   1.701
  233   HE22  GLN  28          HE22      GLN  28  -4.209  -4.267   0.563
  234    H    ALA  29           H        ALA  29  -9.087  -1.326   2.711
  235    HA   ALA  29           HA       ALA  29 -11.829  -1.054   2.173
  236    HB1  ALA  29           HB1      ALA  29  -9.992   0.530   4.000
  237    HB2  ALA  29           HB2      ALA  29 -11.756   0.585   4.067
  238    HB3  ALA  29           HB3      ALA  29 -10.909  -0.927   4.395
  239    H    SER  30           H        SER  30  -9.192   1.334   1.517
  240    HA   SER  30           HA       SER  30 -11.020   3.300   0.410
  241    HB2  SER  30           HB2      SER  30  -8.019   2.973   0.387
  242    HB3  SER  30           HB3      SER  30  -8.817   4.207  -0.611
  243    HG   SER  30           HG       SER  30  -9.657   5.175   1.124
  244    H    ILE  31           H        ILE  31  -9.353   0.508  -1.033
  245    HA   ILE  31           HA       ILE  31  -9.987   1.218  -3.769
  246    HB   ILE  31           HB       ILE  31  -9.336  -1.447  -2.485
  247   HG12  ILE  31          HG12      ILE  31  -7.648   0.346  -4.296
  248   HG13  ILE  31          HG13      ILE  31  -7.598   0.449  -2.543
  249   HG21  ILE  31          HG21      ILE  31  -9.594  -0.746  -5.449
  250   HG22  ILE  31          HG22      ILE  31  -8.927  -2.261  -4.814
  251   HG23  ILE  31          HG23      ILE  31 -10.618  -1.882  -4.543
  252   HD11  ILE  31          HD11      ILE  31  -6.957  -1.964  -2.429
  253   HD12  ILE  31          HD12      ILE  31  -6.784  -1.957  -4.201
  254   HD13  ILE  31          HD13      ILE  31  -5.759  -0.910  -3.205
  255    H    GLU  32           H        GLU  32 -11.794  -0.713  -1.315
  256    HA   GLU  32           HA       GLU  32 -14.028  -1.040  -3.171
  257    HB2  GLU  32           HB2      GLU  32 -15.262  -2.020  -1.318
  258    HB3  GLU  32           HB3      GLU  32 -13.700  -2.765  -1.637
  259    HG2  GLU  32           HG2      GLU  32 -12.743  -1.398   0.237
  260    HG3  GLU  32           HG3      GLU  32 -14.376  -0.857   0.633
  261    H    LYS  33           H        LYS  33 -13.099   1.611  -1.158
  262    HA   LYS  33           HA       LYS  33 -15.687   3.001  -1.614
  263    HB2  LYS  33           HB2      LYS  33 -13.008   3.911  -0.526
  264    HB3  LYS  33           HB3      LYS  33 -14.390   4.994  -0.730
  265    HG2  LYS  33           HG2      LYS  33 -14.438   2.475   0.955
  266    HG3  LYS  33           HG3      LYS  33 -14.027   4.075   1.581
  267    HD2  LYS  33           HD2      LYS  33 -16.307   4.871   0.923
  268    HD3  LYS  33           HD3      LYS  33 -16.723   3.213   0.428
  269    HE2  LYS  33           HE2      LYS  33 -16.305   2.364   2.677
  270    HE3  LYS  33           HE3      LYS  33 -15.639   3.919   3.183
  271    HZ1  LYS  33           HZ1      LYS  33 -18.502   3.497   2.485
  272    HZ2  LYS  33           HZ2      LYS  33 -17.817   4.912   2.906
  273    HZ3  LYS  33           HZ3      LYS  33 -17.871   3.676   3.979
  274    H    GLY  34           H        GLY  34 -12.923   2.372  -3.523
  275    HA2  GLY  34           HA2      GLY  34 -13.842   2.921  -5.908
  276    HA3  GLY  34           HA3      GLY  34 -13.538   4.588  -5.421
  277    H    GLY  35           H        GLY  35 -11.026   3.741  -3.916
  278    HA2  GLY  35           HA2      GLY  35  -8.888   2.682  -5.011
  279    HA3  GLY  35           HA3      GLY  35  -9.234   3.825  -6.306
  280    H    SER  36           H        SER  36  -6.831   3.883  -4.954
  281    HA   SER  36           HA       SER  36  -6.735   6.694  -4.275
  282    HB2  SER  36           HB2      SER  36  -6.266   4.703  -2.021
  283    HB3  SER  36           HB3      SER  36  -5.570   6.329  -1.997
  284    HG   SER  36           HG       SER  36  -8.286   6.059  -2.576
  285    H    LEU  37           H        LEU  37  -5.151   3.902  -5.410
  286    HA   LEU  37           HA       LEU  37  -2.449   4.843  -4.671
  287    HB2  LEU  37           HB2      LEU  37  -3.497   2.216  -5.779
  288    HB3  LEU  37           HB3      LEU  37  -1.800   2.571  -5.624
  289    HG   LEU  37           HG       LEU  37  -2.465   1.151  -3.855
  290   HD11  LEU  37          HD11      LEU  37  -2.016   3.913  -2.674
  291   HD12  LEU  37          HD12      LEU  37  -0.744   2.878  -3.375
  292   HD13  LEU  37          HD13      LEU  37  -1.627   2.347  -1.938
  293   HD21  LEU  37          HD21      LEU  37  -4.882   1.830  -3.725
  294   HD22  LEU  37          HD22      LEU  37  -4.367   3.237  -2.756
  295   HD23  LEU  37          HD23      LEU  37  -4.069   1.594  -2.171
  296    HA   PRO  38           HA       PRO  38  -1.467   5.748  -9.015
  297    HB2  PRO  38           HB2      PRO  38   1.173   6.173  -8.852
  298    HB3  PRO  38           HB3      PRO  38   0.022   7.245  -7.995
  299    HG2  PRO  38           HG2      PRO  38   1.539   4.877  -6.877
  300    HG3  PRO  38           HG3      PRO  38   1.469   6.545  -6.209
  301    HD2  PRO  38           HD2      PRO  38  -0.178   4.498  -5.356
  302    HD3  PRO  38           HD3      PRO  38  -0.694   6.212  -5.372
  303    H    LYS  39           H        LYS  39   0.292   4.849 -10.635
  304    HA   LYS  39           HA       LYS  39   0.089   1.909 -10.566
  305    HB2  LYS  39           HB2      LYS  39  -0.527   3.388 -12.519
  306    HB3  LYS  39           HB3      LYS  39   1.181   3.669 -12.805
  307    HG2  LYS  39           HG2      LYS  39   0.111   0.835 -12.590
  308    HG3  LYS  39           HG3      LYS  39  -0.198   1.767 -14.051
  309    HD2  LYS  39           HD2      LYS  39   2.157   2.012 -14.528
  310    HD3  LYS  39           HD3      LYS  39   2.606   1.258 -12.983
  311    HE2  LYS  39           HE2      LYS  39   1.522  -0.838 -13.637
  312    HE3  LYS  39           HE3      LYS  39   0.988  -0.132 -15.169
  313    HZ1  LYS  39           HZ1      LYS  39   3.200   0.001 -15.907
  314    HZ2  LYS  39           HZ2      LYS  39   3.091  -1.495 -15.265
  315    HZ3  LYS  39           HZ3      LYS  39   3.854  -0.289 -14.428
  316    H    VAL  40           H        VAL  40   2.755   4.220 -10.995
  317    HA   VAL  40           HA       VAL  40   4.658   2.089 -11.309
  318    HB   VAL  40           HB       VAL  40   5.300   5.047 -11.131
  319   HG11  VAL  40          HG11      VAL  40   7.061   4.373 -12.785
  320   HG12  VAL  40          HG12      VAL  40   7.277   3.591 -11.223
  321   HG13  VAL  40          HG13      VAL  40   6.574   2.693 -12.587
  322   HG21  VAL  40          HG21      VAL  40   4.277   3.475 -13.531
  323   HG22  VAL  40          HG22      VAL  40   3.491   4.878 -12.763
  324   HG23  VAL  40          HG23      VAL  40   5.015   5.086 -13.610
  325    H    GLU  41           H        GLU  41   6.504   1.546 -10.143
  326    HA   GLU  41           HA       GLU  41   5.843   1.107  -7.530
  327    HB2  GLU  41           HB2      GLU  41   7.972  -0.022  -7.229
  328    HB3  GLU  41           HB3      GLU  41   7.147  -0.430  -8.700
  329    HG2  GLU  41           HG2      GLU  41   9.297  -0.355  -9.440
  330    HG3  GLU  41           HG3      GLU  41   8.714   1.230  -9.916
  331    H    ALA  42           H        ALA  42   8.447   3.546  -8.354
  332    HA   ALA  42           HA       ALA  42   8.963   3.917  -5.548
  333    HB1  ALA  42           HB1      ALA  42  10.649   4.402  -7.196
  334    HB2  ALA  42           HB2      ALA  42   9.662   5.681  -7.913
  335    HB3  ALA  42           HB3      ALA  42  10.287   5.864  -6.265
  336    H    LYS  43           H        LYS  43   6.689   5.605  -7.746
  337    HA   LYS  43           HA       LYS  43   5.914   7.469  -5.630
  338    HB2  LYS  43           HB2      LYS  43   4.191   8.261  -7.111
  339    HB3  LYS  43           HB3      LYS  43   5.774   8.212  -7.871
  340    HG2  LYS  43           HG2      LYS  43   5.123   6.222  -9.167
  341    HG3  LYS  43           HG3      LYS  43   3.581   6.132  -8.304
  342    HD2  LYS  43           HD2      LYS  43   3.175   7.152 -10.465
  343    HD3  LYS  43           HD3      LYS  43   2.957   8.368  -9.203
  344    HE2  LYS  43           HE2      LYS  43   5.463   8.983  -9.687
  345    HE3  LYS  43           HE3      LYS  43   5.258   8.058 -11.177
  346    HZ1  LYS  43           HZ1      LYS  43   4.813  10.459 -11.393
  347    HZ2  LYS  43           HZ2      LYS  43   3.577  10.367 -10.332
  348    HZ3  LYS  43           HZ3      LYS  43   3.468   9.603 -11.794
  349    H    PHE  44           H        PHE  44   4.661   4.317  -6.663
  350    HA   PHE  44           HA       PHE  44   2.392   4.228  -4.886
  351    HB2  PHE  44           HB2      PHE  44   2.798   2.636  -6.723
  352    HB3  PHE  44           HB3      PHE  44   4.238   2.042  -5.930
  353    HD1  PHE  44           HD2      PHE  44   4.048   0.751  -3.748
  354    HD2  PHE  44           HD1      PHE  44   0.636   1.756  -6.185
  355    HE1  PHE  44           HE2      PHE  44   2.720  -1.017  -2.619
  356    HE2  PHE  44           HE1      PHE  44  -0.679  -0.020  -5.068
  357    HZ   PHE  44           HZ       PHE  44   0.351  -1.403  -3.276
  358    H    ILE  45           H        ILE  45   5.805   3.218  -4.449
  359    HA   ILE  45           HA       ILE  45   5.657   2.473  -1.718
  360    HB   ILE  45           HB       ILE  45   7.913   3.376  -3.529
  361   HG12  ILE  45          HG12      ILE  45   7.315   0.655  -2.284
  362   HG13  ILE  45          HG13      ILE  45   6.673   1.131  -3.838
  363   HG21  ILE  45          HG21      ILE  45   8.166   2.395  -0.658
  364   HG22  ILE  45          HG22      ILE  45   9.513   2.524  -1.804
  365   HG23  ILE  45          HG23      ILE  45   8.679   3.979  -1.315
  366   HD11  ILE  45          HD11      ILE  45   9.609   0.743  -3.154
  367   HD12  ILE  45          HD12      ILE  45   8.603  -0.190  -4.268
  368   HD13  ILE  45          HD13      ILE  45   9.034   1.480  -4.670
  369    H    ASN  46           H        ASN  46   6.585   5.729  -3.085
  370    HA   ASN  46           HA       ASN  46   6.821   7.012  -0.575
  371    HB2  ASN  46           HB2      ASN  46   7.511   8.226  -2.499
  372    HB3  ASN  46           HB3      ASN  46   5.938   8.054  -3.287
  373   HD21  ASN  46          HD21      ASN  46   4.419   9.705  -2.961
  374   HD22  ASN  46          HD22      ASN  46   4.446  10.775  -1.566
  375    H    TYR  47           H        TYR  47   3.771   6.506  -2.476
  376    HA   TYR  47           HA       TYR  47   2.219   8.069  -0.621
  377    HB2  TYR  47           HB2      TYR  47   1.608   7.767  -2.925
  378    HB3  TYR  47           HB3      TYR  47   1.343   6.033  -2.685
  379    HD1  TYR  47           HD1      TYR  47  -0.566   5.253  -1.210
  380    HD2  TYR  47           HD2      TYR  47  -0.047   9.403  -2.275
  381    HE1  TYR  47           HE1      TYR  47  -2.867   5.752  -0.399
  382    HE2  TYR  47           HE2      TYR  47  -2.354   9.889  -1.470
  383    HH   TYR  47           HH       TYR  47  -4.390   7.377   0.077
  384    H    VAL  48           H        VAL  48   2.769   4.538  -0.869
  385    HA   VAL  48           HA       VAL  48   1.297   3.655   1.422
  386    HB   VAL  48           HB       VAL  48   3.856   2.719   0.078
  387   HG11  VAL  48          HG11      VAL  48   2.435   1.262   2.334
  388   HG12  VAL  48          HG12      VAL  48   3.757   0.630   1.337
  389   HG13  VAL  48          HG13      VAL  48   4.057   1.976   2.433
  390   HG21  VAL  48          HG21      VAL  48   1.694   2.407  -1.133
  391   HG22  VAL  48          HG22      VAL  48   2.445   0.874  -0.688
  392   HG23  VAL  48          HG23      VAL  48   1.069   1.488   0.250
  393    H    LYS  49           H        LYS  49   4.683   4.857   1.245
  394    HA   LYS  49           HA       LYS  49   5.118   4.750   4.087
  395    HB2  LYS  49           HB2      LYS  49   6.543   6.186   1.811
  396    HB3  LYS  49           HB3      LYS  49   7.143   6.151   3.473
  397    HG2  LYS  49           HG2      LYS  49   7.414   3.774   3.458
  398    HG3  LYS  49           HG3      LYS  49   6.516   3.584   1.971
  399    HD2  LYS  49           HD2      LYS  49   8.792   3.287   1.437
  400    HD3  LYS  49           HD3      LYS  49   8.277   4.830   0.731
  401    HE2  LYS  49           HE2      LYS  49   9.411   6.059   2.528
  402    HE3  LYS  49           HE3      LYS  49   9.824   4.530   3.325
  403    HZ1  LYS  49           HZ1      LYS  49  10.827   5.427   0.686
  404    HZ2  LYS  49           HZ2      LYS  49  11.078   3.924   1.309
  405    HZ3  LYS  49           HZ3      LYS  49  11.708   5.218   2.072
  406    H    ASN  50           H        ASN  50   3.627   7.230   2.137
  407    HA   ASN  50           HA       ASN  50   3.562   9.275   4.218
  408    HB2  ASN  50           HB2      ASN  50   3.163  10.247   2.181
  409    HB3  ASN  50           HB3      ASN  50   2.383   8.838   1.501
  410   HD21  ASN  50          HD21      ASN  50   0.105   8.499   1.810
  411   HD22  ASN  50          HD22      ASN  50  -0.902   9.775   2.474
  412    H    CYS  51           H        CYS  51   1.320   6.625   3.238
  413    HA   CYS  51           HA       CYS  51  -0.676   7.320   5.205
  414    HB2  CYS  51           HB2      CYS  51  -0.154   4.776   3.609
  415    HB3  CYS  51           HB3      CYS  51  -1.593   5.052   4.616
  416    HG   CYS  51           HG       CYS  51  -2.500   7.116   3.407
  417    H    PHE  52           H        PHE  52   1.767   4.659   5.154
  418    HA   PHE  52           HA       PHE  52   2.134   4.952   8.026
  419    HB2  PHE  52           HB2      PHE  52   0.171   3.289   7.575
  420    HB3  PHE  52           HB3      PHE  52   1.428   2.176   7.071
  421    HD1  PHE  52           HD1      PHE  52   3.316   3.490   9.559
  422    HD2  PHE  52           HD2      PHE  52  -0.514   1.539   9.141
  423    HE1  PHE  52           HE1      PHE  52   3.463   2.704  11.876
  424    HE2  PHE  52           HE2      PHE  52  -0.345   0.742  11.480
  425    HZ   PHE  52           HZ       PHE  52   1.645   1.327  12.856
  426    H    ARG  53           H        ARG  53   4.265   5.093   8.155
  427    HA   ARG  53           HA       ARG  53   6.189   4.001   6.296
  428    HB2  ARG  53           HB2      ARG  53   6.664   5.944   7.570
  429    HB3  ARG  53           HB3      ARG  53   6.317   5.141   9.108
  430    HG2  ARG  53           HG2      ARG  53   8.302   3.805   8.973
  431    HG3  ARG  53           HG3      ARG  53   8.570   4.236   7.300
  432    HD2  ARG  53           HD2      ARG  53  10.143   5.420   8.680
  433    HD3  ARG  53           HD3      ARG  53   9.058   6.559   7.882
  434    HE   ARG  53           HE       ARG  53   9.215   5.896  10.768
  435   HH11  ARG  53          HH11      ARG  53   7.459   7.880   8.335
  436   HH12  ARG  53          HH12      ARG  53   6.977   8.954   9.635
  437   HH21  ARG  53          HH21      ARG  53   8.517   7.391  12.161
  438   HH22  ARG  53          HH22      ARG  53   7.495   8.727  11.600
  439    H    MET  54           H        MET  54   7.216   2.096   6.229
  440    HA   MET  54           HA       MET  54   6.570   0.031   8.316
  441    HB2  MET  54           HB2      MET  54   6.095  -0.048   5.327
  442    HB3  MET  54           HB3      MET  54   6.335  -1.541   6.244
  443    HG2  MET  54           HG2      MET  54   4.262   0.543   7.001
  444    HG3  MET  54           HG3      MET  54   3.922  -0.836   5.960
  445    HE1  MET  54           HE1      MET  54   2.027  -0.550   8.251
  446    HE2  MET  54           HE2      MET  54   2.493  -1.158   9.857
  447    HE3  MET  54           HE3      MET  54   3.172   0.366   9.255
  448    H    THR  55           H        THR  55   8.911   1.176   6.015
  449    HA   THR  55           HA       THR  55  10.984   0.773   5.509
  450    HB   THR  55           HB       THR  55  11.067   1.706   7.747
  451    HG1  THR  55           HG1      THR  55  12.950   1.923   7.127
  452   HG21  THR  55          HG21      THR  55  11.773  -1.118   8.579
  453   HG22  THR  55          HG22      THR  55  10.467  -0.082   9.198
  454   HG23  THR  55          HG23      THR  55  12.140   0.346   9.530
  455    H    ASP  56           H        ASP  56   9.712  -2.237   6.823
  456    HA   ASP  56           HA       ASP  56  11.742  -3.959   5.636
  457    HB2  ASP  56           HB2      ASP  56   8.821  -4.410   6.363
  458    HB3  ASP  56           HB3      ASP  56   9.884  -5.668   5.764
  459    H    GLN  57           H        GLN  57  12.167  -3.773   3.445
  460    HA   GLN  57           HA       GLN  57  10.238  -3.161   1.416
  461    HB2  GLN  57           HB2      GLN  57  12.647  -2.879   1.123
  462    HB3  GLN  57           HB3      GLN  57  12.884  -4.620   1.291
  463    HG2  GLN  57           HG2      GLN  57  13.043  -3.991  -1.042
  464    HG3  GLN  57           HG3      GLN  57  11.635  -5.011  -0.793
  465   HE21  GLN  57          HE21      GLN  57   9.523  -4.083  -0.940
  466   HE22  GLN  57          HE22      GLN  57   9.355  -2.698  -2.021
  467    H    GLU  58           H        GLU  58  11.170  -6.176   2.973
  468    HA   GLU  58           HA       GLU  58   9.796  -8.189   1.579
  469    HB2  GLU  58           HB2      GLU  58  11.228  -8.550   3.545
  470    HB3  GLU  58           HB3      GLU  58  10.162  -7.582   4.536
  471    HG2  GLU  58           HG2      GLU  58   9.775  -9.764   5.206
  472    HG3  GLU  58           HG3      GLU  58   8.361  -9.325   4.273
  473    H    ALA  59           H        ALA  59   8.438  -5.922   4.036
  474    HA   ALA  59           HA       ALA  59   5.749  -7.031   3.750
  475    HB1  ALA  59           HB1      ALA  59   6.749  -4.582   5.251
  476    HB2  ALA  59           HB2      ALA  59   5.139  -5.311   5.368
  477    HB3  ALA  59           HB3      ALA  59   6.560  -6.225   5.926
  478    H    ILE  60           H        ILE  60   7.497  -4.158   2.558
  479    HA   ILE  60           HA       ILE  60   5.241  -2.805   1.403
  480    HB   ILE  60           HB       ILE  60   8.193  -2.855   0.752
  481   HG12  ILE  60          HG12      ILE  60   6.539  -0.673   2.083
  482   HG13  ILE  60          HG13      ILE  60   7.404  -1.917   2.974
  483   HG21  ILE  60          HG21      ILE  60   7.868  -0.818  -0.607
  484   HG22  ILE  60          HG22      ILE  60   6.991  -2.159  -1.313
  485   HG23  ILE  60          HG23      ILE  60   6.105  -0.932  -0.379
  486   HD11  ILE  60          HD11      ILE  60   8.791   0.028   2.970
  487   HD12  ILE  60          HD12      ILE  60   9.553  -1.162   1.897
  488   HD13  ILE  60          HD13      ILE  60   8.664   0.217   1.214
  489    H    GLN  61           H        GLN  61   7.420  -5.342   0.024
  490    HA   GLN  61           HA       GLN  61   5.822  -5.399  -2.418
  491    HB2  GLN  61           HB2      GLN  61   7.313  -6.983  -3.278
  492    HB3  GLN  61           HB3      GLN  61   8.228  -5.737  -2.454
  493    HG2  GLN  61           HG2      GLN  61   9.346  -7.683  -1.846
  494    HG3  GLN  61           HG3      GLN  61   8.342  -7.357  -0.444
  495   HE21  GLN  61          HE21      GLN  61   7.332  -9.201   0.352
  496   HE22  GLN  61          HE22      GLN  61   6.913 -10.585  -0.678
  497    H    ASP  62           H        ASP  62   5.672  -7.211   0.635
  498    HA   ASP  62           HA       ASP  62   3.744  -9.170  -0.260
  499    HB2  ASP  62           HB2      ASP  62   5.000  -9.317   1.873
  500    HB3  ASP  62           HB3      ASP  62   4.150  -7.895   2.475
  501    H    LEU  63           H        LEU  63   3.408  -5.843   1.037
  502    HA   LEU  63           HA       LEU  63   0.587  -5.645   0.952
  503    HB2  LEU  63           HB2      LEU  63   2.279  -4.185   2.082
  504    HB3  LEU  63           HB3      LEU  63   2.652  -3.451   0.532
  505    HG   LEU  63           HG       LEU  63  -0.024  -3.324   1.984
  506   HD11  LEU  63          HD11      LEU  63   1.785  -2.121   3.131
  507   HD12  LEU  63          HD12      LEU  63   0.636  -0.981   2.414
  508   HD13  LEU  63          HD13      LEU  63   2.197  -1.277   1.623
  509   HD21  LEU  63          HD21      LEU  63  -0.479  -2.976  -0.380
  510   HD22  LEU  63          HD22      LEU  63   0.938  -1.909  -0.546
  511   HD23  LEU  63          HD23      LEU  63  -0.479  -1.404   0.400
  512    H    TRP  64           H        TRP  64   3.069  -4.858  -1.544
  513    HA   TRP  64           HA       TRP  64   1.298  -4.140  -3.657
  514    HB2  TRP  64           HB2      TRP  64   3.866  -3.935  -3.441
  515    HB3  TRP  64           HB3      TRP  64   3.936  -5.575  -4.049
  516    HD1  TRP  64           HD1      TRP  64   3.900  -2.076  -5.088
  517    HE1  TRP  64           HE1      TRP  64   3.840  -1.831  -7.643
  518    HE3  TRP  64           HE3      TRP  64   2.537  -6.871  -6.345
  519    HZ2  TRP  64           HZ2      TRP  64   3.172  -3.457  -9.908
  520    HZ3  TRP  64           HZ3      TRP  64   2.228  -7.490  -8.720
  521    HH2  TRP  64           HH2      TRP  64   2.513  -5.792 -10.512
  522    H    GLN  65           H        GLN  65   2.575  -7.424  -2.786
  523    HA   GLN  65           HA       GLN  65   1.119  -8.780  -4.874
  524    HB2  GLN  65           HB2      GLN  65   2.076  -9.856  -2.194
  525    HB3  GLN  65           HB3      GLN  65   1.441 -10.812  -3.519
  526    HG2  GLN  65           HG2      GLN  65   4.153  -9.823  -3.094
  527    HG3  GLN  65           HG3      GLN  65   3.573 -11.175  -4.027
  528   HE21  GLN  65          HE21      GLN  65   4.771  -7.961  -4.173
  529   HE22  GLN  65          HE22      GLN  65   4.726  -7.831  -5.942
  530    H    TRP  66           H        TRP  66   0.163  -7.816  -1.566
  531    HA   TRP  66           HA       TRP  66  -2.365  -9.113  -1.525
  532    HB2  TRP  66           HB2      TRP  66  -0.931  -7.331   0.137
  533    HB3  TRP  66           HB3      TRP  66  -2.409  -6.476  -0.245
  534    HD1  TRP  66           HD1      TRP  66  -4.505  -7.193   1.097
  535    HE1  TRP  66           HE1      TRP  66  -5.063  -9.020   2.792
  536    HE3  TRP  66           HE3      TRP  66  -0.231  -9.980   0.675
  537    HZ2  TRP  66           HZ2      TRP  66  -3.878 -11.508   3.711
  538    HZ3  TRP  66           HZ3      TRP  66   0.016 -12.092   1.957
  539    HH2  TRP  66           HH2      TRP  66  -1.799 -12.868   3.468
  540    H    ARG  67           H        ARG  67  -1.462  -5.904  -2.819
  541    HA   ARG  67           HA       ARG  67  -4.118  -5.245  -3.778
  542    HB2  ARG  67           HB2      ARG  67  -2.173  -3.706  -3.198
  543    HB3  ARG  67           HB3      ARG  67  -1.444  -4.130  -4.733
  544    HG2  ARG  67           HG2      ARG  67  -4.180  -2.810  -4.337
  545    HG3  ARG  67           HG3      ARG  67  -2.683  -1.952  -4.669
  546    HD2  ARG  67           HD2      ARG  67  -4.223  -3.753  -6.551
  547    HD3  ARG  67           HD3      ARG  67  -3.906  -2.033  -6.705
  548    HE   ARG  67           HE       ARG  67  -1.372  -2.893  -6.731
  549   HH11  ARG  67          HH11      ARG  67  -4.060  -4.163  -8.640
  550   HH12  ARG  67          HH12      ARG  67  -2.953  -4.840  -9.810
  551   HH21  ARG  67          HH21      ARG  67  -0.123  -3.746  -8.173
  552   HH22  ARG  67          HH22      ARG  67  -0.771  -4.587  -9.583
  553    H    LYS  68           H        LYS  68  -1.310  -6.807  -5.369
  554    HA   LYS  68           HA       LYS  68  -2.631  -7.237  -7.895
  555    HB2  LYS  68           HB2      LYS  68  -0.161  -7.421  -7.488
  556    HB3  LYS  68           HB3      LYS  68  -0.448  -8.888  -6.554
  557    HG2  LYS  68           HG2      LYS  68   0.308  -9.521  -8.740
  558    HG3  LYS  68           HG3      LYS  68  -1.375  -9.992  -8.589
  559    HD2  LYS  68           HD2      LYS  68  -1.974  -7.826  -9.863
  560    HD3  LYS  68           HD3      LYS  68  -0.235  -7.597 -10.074
  561    HE2  LYS  68           HE2      LYS  68  -1.003  -8.569 -12.080
  562    HE3  LYS  68           HE3      LYS  68  -0.162  -9.860 -11.225
  563    HZ1  LYS  68           HZ1      LYS  68  -2.282 -10.570 -12.163
  564    HZ2  LYS  68           HZ2      LYS  68  -3.122  -9.479 -11.247
  565    HZ3  LYS  68           HZ3      LYS  68  -2.311 -10.742 -10.542
  566    H    SER  69           H        SER  69  -2.956  -8.893  -4.842
  567    HA   SER  69           HA       SER  69  -4.457 -11.138  -5.979
  568    HB2  SER  69           HB2      SER  69  -3.982 -10.465  -3.067
  569    HB3  SER  69           HB3      SER  69  -4.621 -11.979  -3.730
  570    HG   SER  69           HG       SER  69  -2.040 -10.850  -3.982
  571    H    LEU  70           H        LEU  70  -5.691  -8.841  -6.770
  572    HA   LEU  70           HA       LEU  70  -8.360  -8.934  -5.420
  573    HB2  LEU  70           HB2      LEU  70  -7.035  -6.425  -6.534
  574    HB3  LEU  70           HB3      LEU  70  -8.645  -6.527  -5.855
  575    HG   LEU  70           HG       LEU  70  -6.069  -6.913  -4.279
  576   HD11  LEU  70          HD11      LEU  70  -6.346  -4.620  -5.175
  577   HD12  LEU  70          HD12      LEU  70  -6.549  -4.659  -3.420
  578   HD13  LEU  70          HD13      LEU  70  -7.975  -4.541  -4.471
  579   HD21  LEU  70          HD21      LEU  70  -8.921  -6.470  -3.295
  580   HD22  LEU  70          HD22      LEU  70  -7.450  -6.660  -2.307
  581   HD23  LEU  70          HD23      LEU  70  -8.067  -8.025  -3.261
  Start of MODEL    8
    1    H    GLN   1           H1       GLN   1 -36.223  -1.835  34.026
    2    HA   GLN   1           HA       GLN   1 -33.802  -0.968  32.608
    3    HB2  GLN   1           HB2      GLN   1 -32.506  -2.142  34.272
    4    HB3  GLN   1           HB3      GLN   1 -33.486  -0.883  34.994
    5    HG2  GLN   1           HG2      GLN   1 -35.094  -2.619  35.808
    6    HG3  GLN   1           HG3      GLN   1 -34.062  -3.880  35.116
    7   HE21  GLN   1          HE21      GLN   1 -34.026  -1.170  37.477
    8   HE22  GLN   1          HE22      GLN   1 -32.808  -1.901  38.511
    9    H    GLU   2           H        GLU   2 -33.236  -2.105  30.931
   10    HA   GLU   2           HA       GLU   2 -34.101  -4.963  30.671
   11    HB2  GLU   2           HB2      GLU   2 -34.175  -2.939  28.398
   12    HB3  GLU   2           HB3      GLU   2 -34.593  -4.640  28.337
   13    HG2  GLU   2           HG2      GLU   2 -36.672  -3.707  28.397
   14    HG3  GLU   2           HG3      GLU   2 -36.427  -4.071  30.102
   15    H    SER   3           H        SER   3 -31.477  -2.832  30.638
   16    HA   SER   3           HA       SER   3 -29.336  -2.885  29.984
   17    HB2  SER   3           HB2      SER   3 -29.690  -5.860  29.541
   18    HB3  SER   3           HB3      SER   3 -28.153  -4.995  29.656
   19    HG   SER   3           HG       SER   3 -30.104  -4.768  31.704
   20    H    PHE   4           H        PHE   4 -31.417  -2.376  27.917
   21    HA   PHE   4           HA       PHE   4 -30.270  -3.372  25.393
   22    HB2  PHE   4           HB2      PHE   4 -32.657  -3.404  25.664
   23    HB3  PHE   4           HB3      PHE   4 -32.689  -1.711  26.128
   24    HD1  PHE   4           HD2      PHE   4 -31.794  -3.962  23.245
   25    HD2  PHE   4           HD1      PHE   4 -33.081  -0.040  24.510
   26    HE1  PHE   4           HE2      PHE   4 -32.108  -3.296  20.877
   27    HE2  PHE   4           HE1      PHE   4 -33.436   0.606  22.140
   28    HZ   PHE   4           HZ       PHE   4 -32.922  -1.003  20.321
   29    H    LYS   5           H        LYS   5 -29.244  -2.219  23.867
   30    HA   LYS   5           HA       LYS   5 -27.669  -0.884  23.027
   31    HB2  LYS   5           HB2      LYS   5 -29.556   1.285  23.949
   32    HB3  LYS   5           HB3      LYS   5 -28.060   1.633  23.074
   33    HG2  LYS   5           HG2      LYS   5 -28.793   0.020  21.270
   34    HG3  LYS   5           HG3      LYS   5 -30.321  -0.158  22.119
   35    HD2  LYS   5           HD2      LYS   5 -30.688   1.356  20.343
   36    HD3  LYS   5           HD3      LYS   5 -30.696   2.336  21.817
   37    HE2  LYS   5           HE2      LYS   5 -28.452   3.154  21.364
   38    HE3  LYS   5           HE3      LYS   5 -28.222   1.965  20.069
   39    HZ1  LYS   5           HZ1      LYS   5 -30.143   4.226  19.992
   40    HZ2  LYS   5           HZ2      LYS   5 -29.988   3.090  18.817
   41    HZ3  LYS   5           HZ3      LYS   5 -28.753   4.115  19.111
   42    H    LYS   6           H        LYS   6 -26.004   0.874  23.413
   43    HA   LYS   6           HA       LYS   6 -24.041   1.392  24.455
   44    HB2  LYS   6           HB2      LYS   6 -25.886   1.840  26.814
   45    HB3  LYS   6           HB3      LYS   6 -24.244   2.467  26.675
   46    HG2  LYS   6           HG2      LYS   6 -24.822   3.844  24.768
   47    HG3  LYS   6           HG3      LYS   6 -26.475   3.195  24.749
   48    HD2  LYS   6           HD2      LYS   6 -26.789   4.025  27.098
   49    HD3  LYS   6           HD3      LYS   6 -25.178   4.769  27.024
   50    HE2  LYS   6           HE2      LYS   6 -25.862   6.234  25.223
   51    HE3  LYS   6           HE3      LYS   6 -27.413   5.390  25.052
   52    HZ1  LYS   6           HZ1      LYS   6 -27.556   7.472  26.344
   53    HZ2  LYS   6           HZ2      LYS   6 -26.585   6.832  27.502
   54    HZ3  LYS   6           HZ3      LYS   6 -28.061   6.173  27.225
   55    H    GLN   7           H        GLN   7 -24.535  -1.530  24.578
   56    HA   GLN   7           HA       GLN   7 -22.451  -2.009  26.680
   57    HB2  GLN   7           HB2      GLN   7 -24.817  -3.872  26.317
   58    HB3  GLN   7           HB3      GLN   7 -23.453  -4.063  27.414
   59    HG2  GLN   7           HG2      GLN   7 -24.144  -1.961  28.599
   60    HG3  GLN   7           HG3      GLN   7 -25.586  -1.899  27.591
   61   HE21  GLN   7          HE21      GLN   7 -26.468  -1.865  29.905
   62   HE22  GLN   7          HE22      GLN   7 -26.566  -3.396  30.780
   63    H    GLU   8           H        GLU   8 -24.008  -3.163  23.729
   64    HA   GLU   8           HA       GLU   8 -23.409  -4.396  22.022
   65    HB2  GLU   8           HB2      GLU   8 -20.505  -3.791  22.589
   66    HB3  GLU   8           HB3      GLU   8 -21.275  -4.202  21.049
   67    HG2  GLU   8           HG2      GLU   8 -22.718  -2.087  21.382
   68    HG3  GLU   8           HG3      GLU   8 -21.620  -1.652  22.686
   69    H    LYS   9           H        LYS   9 -22.897  -6.466  21.228
   70    HA   LYS   9           HA       LYS   9 -22.547  -8.467  23.433
   71    HB2  LYS   9           HB2      LYS   9 -23.915  -8.679  20.729
   72    HB3  LYS   9           HB3      LYS   9 -23.734  -9.996  21.889
   73    HG2  LYS   9           HG2      LYS   9 -25.075  -8.752  23.551
   74    HG3  LYS   9           HG3      LYS   9 -25.289  -7.421  22.395
   75    HD2  LYS   9           HD2      LYS   9 -26.447  -8.904  20.832
   76    HD3  LYS   9           HD3      LYS   9 -26.149 -10.304  21.879
   77    HE2  LYS   9           HE2      LYS   9 -27.538  -9.347  23.650
   78    HE3  LYS   9           HE3      LYS   9 -27.771  -7.865  22.715
   79    HZ1  LYS   9           HZ1      LYS   9 -28.955  -9.123  21.054
   80    HZ2  LYS   9           HZ2      LYS   9 -29.642  -9.414  22.535
   81    HZ3  LYS   9           HZ3      LYS   9 -28.691 -10.551  21.817
   82    H    THR  10           H        THR  10 -21.170  -7.583  20.316
   83    HA   THR  10           HA       THR  10 -18.756  -9.020  20.977
   84    HB   THR  10           HB       THR  10 -19.828 -10.951  20.107
   85    HG1  THR  10           HG1      THR  10 -18.610 -11.429  18.339
   86   HG21  THR  10          HG21      THR  10 -20.755 -11.113  17.820
   87   HG22  THR  10          HG22      THR  10 -20.620  -9.355  17.633
   88   HG23  THR  10          HG23      THR  10 -21.704 -10.050  18.855
   89    HA   PRO  11           HA       PRO  11 -17.426  -5.737  18.152
   90    HB2  PRO  11           HB2      PRO  11 -14.733  -6.044  18.220
   91    HB3  PRO  11           HB3      PRO  11 -15.658  -5.455  19.639
   92    HG2  PRO  11           HG2      PRO  11 -14.698  -8.281  19.083
   93    HG3  PRO  11           HG3      PRO  11 -14.526  -7.325  20.587
   94    HD2  PRO  11           HD2      PRO  11 -16.542  -9.154  20.209
   95    HD3  PRO  11           HD3      PRO  11 -16.761  -7.673  21.182
   96    H    LYS  12           H        LYS  12 -17.074  -5.601  15.968
   97    HA   LYS  12           HA       LYS  12 -16.454  -8.147  14.469
   98    HB2  LYS  12           HB2      LYS  12 -18.238  -5.844  13.640
   99    HB3  LYS  12           HB3      LYS  12 -17.900  -7.275  12.676
  100    HG2  LYS  12           HG2      LYS  12 -19.376  -7.308  15.356
  101    HG3  LYS  12           HG3      LYS  12 -20.113  -7.250  13.767
  102    HD2  LYS  12           HD2      LYS  12 -20.340  -9.445  14.257
  103    HD3  LYS  12           HD3      LYS  12 -18.892  -9.466  13.255
  104    HE2  LYS  12           HE2      LYS  12 -17.487  -9.712  15.259
  105    HE3  LYS  12           HE3      LYS  12 -18.888  -9.485  16.316
  106    HZ1  LYS  12           HZ1      LYS  12 -19.830 -11.535  15.334
  107    HZ2  LYS  12           HZ2      LYS  12 -18.383 -11.860  16.031
  108    HZ3  LYS  12           HZ3      LYS  12 -18.528 -11.705  14.384
  109    H    THR  13           H        THR  13 -15.140  -5.151  15.136
  110    HA   THR  13           HA       THR  13 -13.001  -5.715  13.227
  111    HB   THR  13           HB       THR  13 -14.050  -4.129  11.827
  112    HG1  THR  13           HG1      THR  13 -12.619  -2.340  11.985
  113   HG21  THR  13          HG21      THR  13 -14.443  -2.293  14.231
  114   HG22  THR  13          HG22      THR  13 -15.722  -3.112  13.308
  115   HG23  THR  13          HG23      THR  13 -14.747  -1.861  12.535
  116    HA   PRO  14           HA       PRO  14 -10.946  -4.256  16.974
  117    HB2  PRO  14           HB2      PRO  14  -8.338  -4.364  16.285
  118    HB3  PRO  14           HB3      PRO  14  -9.331  -5.847  16.425
  119    HG2  PRO  14           HG2      PRO  14  -8.634  -4.299  13.916
  120    HG3  PRO  14           HG3      PRO  14  -8.513  -6.068  14.197
  121    HD2  PRO  14           HD2      PRO  14 -10.658  -4.856  12.950
  122    HD3  PRO  14           HD3      PRO  14 -10.801  -6.359  13.893
  123    H    LYS  15           H        LYS  15 -11.110  -2.519  14.026
  124    HA   LYS  15           HA       LYS  15 -10.620  -0.460  13.261
  125    HB2  LYS  15           HB2      LYS  15 -10.657   0.473  16.151
  126    HB3  LYS  15           HB3      LYS  15 -10.715   1.471  14.710
  127    HG2  LYS  15           HG2      LYS  15 -12.940   1.427  15.053
  128    HG3  LYS  15           HG3      LYS  15 -12.837  -0.056  14.119
  129    HD2  LYS  15           HD2      LYS  15 -14.250  -0.499  15.990
  130    HD3  LYS  15           HD3      LYS  15 -12.727  -1.319  16.344
  131    HE2  LYS  15           HE2      LYS  15 -12.063   0.696  17.744
  132    HE3  LYS  15           HE3      LYS  15 -13.665   1.376  17.446
  133    HZ1  LYS  15           HZ1      LYS  15 -14.621  -0.595  18.536
  134    HZ2  LYS  15           HZ2      LYS  15 -13.583   0.173  19.547
  135    HZ3  LYS  15           HZ3      LYS  15 -13.108  -1.203  18.803
  136    H    GLY  16           H        GLY  16  -8.670  -1.533  12.556
  137    HA2  GLY  16           HA2      GLY  16  -6.431  -1.090  11.932
  138    HA3  GLY  16           HA3      GLY  16  -6.261   0.005  13.291
  139    HA   PRO  17           HA       PRO  17  -5.285  -4.698  14.733
  140    HB2  PRO  17           HB2      PRO  17  -3.956  -5.207  12.066
  141    HB3  PRO  17           HB3      PRO  17  -4.661  -6.386  13.217
  142    HG2  PRO  17           HG2      PRO  17  -6.034  -5.630  11.003
  143    HG3  PRO  17           HG3      PRO  17  -6.871  -5.823  12.571
  144    HD2  PRO  17           HD2      PRO  17  -6.019  -3.292  11.191
  145    HD3  PRO  17           HD3      PRO  17  -7.474  -3.610  12.150
  146    H    SER  18           H        SER  18  -3.114  -5.428  15.382
  147    HA   SER  18           HA       SER  18  -1.167  -3.208  15.462
  148    HB2  SER  18           HB2      SER  18  -1.324  -5.824  17.000
  149    HB3  SER  18           HB3      SER  18  -0.085  -4.590  17.225
  150    HG   SER  18           HG       SER  18  -2.882  -4.335  17.604
  151    H    SER  19           H        SER  19  -1.587  -5.662  13.346
  152    HA   SER  19           HA       SER  19   1.314  -6.031  12.742
  153    HB2  SER  19           HB2      SER  19   0.074  -8.079  13.522
  154    HB3  SER  19           HB3      SER  19  -0.963  -7.928  12.094
  155    HG   SER  19           HG       SER  19   0.779  -9.387  11.800
  156    H    VAL  20           H        VAL  20   1.324  -6.915  10.289
  157    HA   VAL  20           HA       VAL  20   0.849  -4.734   8.520
  158    HB   VAL  20           HB       VAL  20   1.407  -7.674   7.978
  159   HG11  VAL  20          HG11      VAL  20   2.289  -6.927   5.760
  160   HG12  VAL  20          HG12      VAL  20   0.543  -6.788   5.908
  161   HG13  VAL  20          HG13      VAL  20   1.557  -5.327   6.040
  162   HG21  VAL  20          HG21      VAL  20   3.235  -5.229   7.996
  163   HG22  VAL  20          HG22      VAL  20   3.200  -6.508   9.225
  164   HG23  VAL  20          HG23      VAL  20   3.722  -6.889   7.588
  165    H    GLU  21           H        GLU  21  -1.398  -7.245   9.510
  166    HA   GLU  21           HA       GLU  21  -3.307  -7.255   7.460
  167    HB2  GLU  21           HB2      GLU  21  -3.770  -7.108  10.473
  168    HB3  GLU  21           HB3      GLU  21  -5.021  -7.447   9.275
  169    HG2  GLU  21           HG2      GLU  21  -3.621  -9.447   8.538
  170    HG3  GLU  21           HG3      GLU  21  -2.657  -9.194  10.005
  171    H    ASP  22           H        ASP  22  -2.697  -4.661   9.825
  172    HA   ASP  22           HA       ASP  22  -5.010  -3.042   9.231
  173    HB2  ASP  22           HB2      ASP  22  -4.011  -2.566  11.279
  174    HB3  ASP  22           HB3      ASP  22  -2.391  -2.663  10.652
  175    H    ILE  23           H        ILE  23  -1.555  -2.576   8.098
  176    HA   ILE  23           HA       ILE  23  -2.427  -0.520   6.333
  177    HB   ILE  23           HB       ILE  23  -0.135  -0.846   7.290
  178   HG12  ILE  23          HG12      ILE  23  -0.342  -0.207   4.326
  179   HG13  ILE  23          HG13      ILE  23  -0.752   0.868   5.666
  180   HG21  ILE  23          HG21      ILE  23   0.286  -2.734   4.922
  181   HG22  ILE  23          HG22      ILE  23   1.510  -2.161   6.081
  182   HG23  ILE  23          HG23      ILE  23   0.217  -3.206   6.634
  183   HD11  ILE  23          HD11      ILE  23   1.406   1.544   5.052
  184   HD12  ILE  23          HD12      ILE  23   1.680   0.540   6.482
  185   HD13  ILE  23          HD13      ILE  23   1.987  -0.122   4.859
  186    H    LYS  24           H        LYS  24  -2.131  -4.013   5.800
  187    HA   LYS  24           HA       LYS  24  -2.660  -4.110   2.975
  188    HB2  LYS  24           HB2      LYS  24  -3.547  -5.912   5.262
  189    HB3  LYS  24           HB3      LYS  24  -3.794  -6.322   3.574
  190    HG2  LYS  24           HG2      LYS  24  -1.001  -5.746   4.600
  191    HG3  LYS  24           HG3      LYS  24  -1.791  -7.291   4.950
  192    HD2  LYS  24           HD2      LYS  24  -2.124  -7.612   2.467
  193    HD3  LYS  24           HD3      LYS  24  -1.191  -6.121   2.217
  194    HE2  LYS  24           HE2      LYS  24   0.263  -8.043   1.903
  195    HE3  LYS  24           HE3      LYS  24   0.769  -7.159   3.344
  196    HZ1  LYS  24           HZ1      LYS  24   0.762  -9.537   3.674
  197    HZ2  LYS  24           HZ2      LYS  24  -0.864  -9.654   3.391
  198    HZ3  LYS  24           HZ3      LYS  24  -0.296  -8.865   4.709
  199    H    ALA  25           H        ALA  25  -4.978  -4.078   5.728
  200    HA   ALA  25           HA       ALA  25  -7.295  -4.015   4.020
  201    HB1  ALA  25           HB1      ALA  25  -8.497  -3.860   6.131
  202    HB2  ALA  25           HB2      ALA  25  -7.209  -5.061   6.253
  203    HB3  ALA  25           HB3      ALA  25  -6.996  -3.460   7.000
  204    H    LYS  26           H        LYS  26  -5.490  -1.449   5.724
  205    HA   LYS  26           HA       LYS  26  -7.370   0.680   5.111
  206    HB2  LYS  26           HB2      LYS  26  -4.576   0.499   6.243
  207    HB3  LYS  26           HB3      LYS  26  -5.116   2.038   5.590
  208    HG2  LYS  26           HG2      LYS  26  -5.511   1.964   7.955
  209    HG3  LYS  26           HG3      LYS  26  -7.038   2.092   7.072
  210    HD2  LYS  26           HD2      LYS  26  -7.388  -0.381   7.448
  211    HD3  LYS  26           HD3      LYS  26  -5.913  -0.400   8.423
  212    HE2  LYS  26           HE2      LYS  26  -8.407   1.252   8.982
  213    HE3  LYS  26           HE3      LYS  26  -7.983  -0.265   9.776
  214    HZ1  LYS  26           HZ1      LYS  26  -5.908   0.863  10.532
  215    HZ2  LYS  26           HZ2      LYS  26  -7.326   1.549  11.128
  216    HZ3  LYS  26           HZ3      LYS  26  -6.489   2.287   9.932
  217    H    MET  27           H        MET  27  -4.513  -0.586   3.354
  218    HA   MET  27           HA       MET  27  -4.856   1.285   1.142
  219    HB2  MET  27           HB2      MET  27  -3.483  -1.415   1.311
  220    HB3  MET  27           HB3      MET  27  -3.486  -0.384  -0.121
  221    HG2  MET  27           HG2      MET  27  -2.332   0.404   2.585
  222    HG3  MET  27           HG3      MET  27  -1.427  -0.161   1.192
  223    HE1  MET  27           HE1      MET  27  -2.232   2.833   3.197
  224    HE2  MET  27           HE2      MET  27  -2.781   4.097   2.072
  225    HE3  MET  27           HE3      MET  27  -3.854   2.746   2.472
  226    H    GLN  28           H        GLN  28  -6.404  -1.854   1.957
  227    HA   GLN  28           HA       GLN  28  -7.829  -1.956  -0.564
  228    HB2  GLN  28           HB2      GLN  28  -8.732  -3.169   2.068
  229    HB3  GLN  28           HB3      GLN  28  -9.418  -3.437   0.477
  230    HG2  GLN  28           HG2      GLN  28  -6.955  -4.584   1.665
  231    HG3  GLN  28           HG3      GLN  28  -8.127  -5.305   0.590
  232   HE21  GLN  28          HE21      GLN  28  -5.035  -3.776   0.782
  233   HE22  GLN  28          HE22      GLN  28  -4.773  -3.684  -0.977
  234    H    ALA  29           H        ALA  29  -8.611  -0.348   2.566
  235    HA   ALA  29           HA       ALA  29 -11.062   0.790   1.651
  236    HB1  ALA  29           HB1      ALA  29 -10.315   0.821   4.015
  237    HB2  ALA  29           HB2      ALA  29  -9.054   2.001   3.599
  238    HB3  ALA  29           HB3      ALA  29 -10.761   2.432   3.423
  239    H    SER  30           H        SER  30  -7.651   2.002   1.199
  240    HA   SER  30           HA       SER  30  -8.307   4.348  -0.208
  241    HB2  SER  30           HB2      SER  30  -5.987   2.587  -1.035
  242    HB3  SER  30           HB3      SER  30  -6.131   4.343  -1.129
  243    HG   SER  30           HG       SER  30  -6.247   4.224   1.278
  244    H    ILE  31           H        ILE  31  -7.874   1.039  -1.665
  245    HA   ILE  31           HA       ILE  31  -8.594   2.151  -4.263
  246    HB   ILE  31           HB       ILE  31  -6.908   0.432  -4.074
  247   HG12  ILE  31          HG12      ILE  31  -9.287  -0.348  -5.809
  248   HG13  ILE  31          HG13      ILE  31  -8.112   0.923  -6.171
  249   HG21  ILE  31          HG21      ILE  31  -7.371  -1.890  -3.687
  250   HG22  ILE  31          HG22      ILE  31  -8.033  -0.974  -2.341
  251   HG23  ILE  31          HG23      ILE  31  -9.121  -1.605  -3.595
  252   HD11  ILE  31          HD11      ILE  31  -7.531  -1.023  -7.450
  253   HD12  ILE  31          HD12      ILE  31  -6.302  -0.835  -6.181
  254   HD13  ILE  31          HD13      ILE  31  -7.584  -2.062  -6.018
  255    H    GLU  32           H        GLU  32 -10.415  -0.126  -2.075
  256    HA   GLU  32           HA       GLU  32 -12.623   0.045  -4.036
  257    HB2  GLU  32           HB2      GLU  32 -13.681  -1.774  -2.967
  258    HB3  GLU  32           HB3      GLU  32 -12.026  -2.164  -3.417
  259    HG2  GLU  32           HG2      GLU  32 -11.302  -2.218  -1.170
  260    HG3  GLU  32           HG3      GLU  32 -12.738  -1.357  -0.580
  261    H    LYS  33           H        LYS  33 -11.901   1.837  -1.272
  262    HA   LYS  33           HA       LYS  33 -14.749   2.827  -1.313
  263    HB2  LYS  33           HB2      LYS  33 -12.861   3.161   1.035
  264    HB3  LYS  33           HB3      LYS  33 -14.553   3.611   0.928
  265    HG2  LYS  33           HG2      LYS  33 -15.194   1.207   0.793
  266    HG3  LYS  33           HG3      LYS  33 -13.479   0.755   0.916
  267    HD2  LYS  33           HD2      LYS  33 -13.381   2.057   3.091
  268    HD3  LYS  33           HD3      LYS  33 -15.136   2.213   3.025
  269    HE2  LYS  33           HE2      LYS  33 -13.616  -0.439   3.024
  270    HE3  LYS  33           HE3      LYS  33 -14.236   0.350   4.477
  271    HZ1  LYS  33           HZ1      LYS  33 -15.733  -1.326   3.684
  272    HZ2  LYS  33           HZ2      LYS  33 -15.885  -0.630   2.230
  273    HZ3  LYS  33           HZ3      LYS  33 -16.476   0.141   3.599
  274    H    GLY  34           H        GLY  34 -11.308   3.829  -1.116
  275    HA2  GLY  34           HA2      GLY  34 -11.949   6.651  -1.437
  276    HA3  GLY  34           HA3      GLY  34 -10.351   5.905  -1.428
  277    H    GLY  35           H        GLY  35 -10.924   4.084  -3.687
  278    HA2  GLY  35           HA2      GLY  35 -10.729   4.034  -5.978
  279    HA3  GLY  35           HA3      GLY  35 -11.621   5.558  -6.074
  280    H    SER  36           H        SER  36  -8.649   5.382  -4.159
  281    HA   SER  36           HA       SER  36  -7.378   7.261  -6.119
  282    HB2  SER  36           HB2      SER  36  -6.678   8.543  -4.153
  283    HB3  SER  36           HB3      SER  36  -8.440   8.387  -4.256
  284    HG   SER  36           HG       SER  36  -7.168   7.933  -2.185
  285    H    LEU  37           H        LEU  37  -6.685   4.254  -4.862
  286    HA   LEU  37           HA       LEU  37  -3.988   4.636  -3.967
  287    HB2  LEU  37           HB2      LEU  37  -5.466   2.729  -3.371
  288    HB3  LEU  37           HB3      LEU  37  -5.406   2.171  -5.037
  289    HG   LEU  37           HG       LEU  37  -2.915   1.821  -4.776
  290   HD11  LEU  37          HD11      LEU  37  -3.522   2.343  -1.831
  291   HD12  LEU  37          HD12      LEU  37  -2.501   3.355  -2.867
  292   HD13  LEU  37          HD13      LEU  37  -1.997   1.707  -2.484
  293   HD21  LEU  37          HD21      LEU  37  -4.499  -0.037  -4.522
  294   HD22  LEU  37          HD22      LEU  37  -4.704   0.351  -2.795
  295   HD23  LEU  37          HD23      LEU  37  -3.135  -0.218  -3.414
  296    HA   PRO  38           HA       PRO  38  -2.143   4.803  -8.086
  297    HB2  PRO  38           HB2      PRO  38   0.480   4.361  -6.710
  298    HB3  PRO  38           HB3      PRO  38   0.001   5.640  -7.872
  299    HG2  PRO  38           HG2      PRO  38   0.189   6.197  -5.235
  300    HG3  PRO  38           HG3      PRO  38  -1.200   6.830  -6.180
  301    HD2  PRO  38           HD2      PRO  38  -1.107   4.336  -4.441
  302    HD3  PRO  38           HD3      PRO  38  -2.292   5.680  -4.430
  303    H    LYS  39           H        LYS  39  -0.885   3.602  -9.628
  304    HA   LYS  39           HA       LYS  39  -1.028   0.649  -9.288
  305    HB2  LYS  39           HB2      LYS  39  -2.225   1.652 -11.140
  306    HB3  LYS  39           HB3      LYS  39  -0.796   2.528 -11.666
  307    HG2  LYS  39           HG2      LYS  39   0.297   0.278 -12.165
  308    HG3  LYS  39           HG3      LYS  39  -1.284  -0.466 -11.856
  309    HD2  LYS  39           HD2      LYS  39  -2.276   0.931 -13.672
  310    HD3  LYS  39           HD3      LYS  39  -0.733   1.773 -13.866
  311    HE2  LYS  39           HE2      LYS  39  -0.716   0.243 -15.618
  312    HE3  LYS  39           HE3      LYS  39   0.332  -0.478 -14.391
  313    HZ1  LYS  39           HZ1      LYS  39  -1.222  -2.111 -15.318
  314    HZ2  LYS  39           HZ2      LYS  39  -2.506  -1.191 -14.900
  315    HZ3  LYS  39           HZ3      LYS  39  -1.571  -1.896 -13.738
  316    H    VAL  40           H        VAL  40   1.318   3.100 -10.457
  317    HA   VAL  40           HA       VAL  40   3.294   1.049 -10.977
  318    HB   VAL  40           HB       VAL  40   2.909   3.107 -12.341
  319   HG11  VAL  40          HG11      VAL  40   4.687   4.513 -10.316
  320   HG12  VAL  40          HG12      VAL  40   3.989   5.171 -11.813
  321   HG13  VAL  40          HG13      VAL  40   2.931   4.752 -10.456
  322   HG21  VAL  40          HG21      VAL  40   5.768   2.582 -11.470
  323   HG22  VAL  40          HG22      VAL  40   4.844   1.689 -12.707
  324   HG23  VAL  40          HG23      VAL  40   5.252   3.388 -12.966
  325    H    GLU  41           H        GLU  41   5.162   0.506  -9.927
  326    HA   GLU  41           HA       GLU  41   4.959   0.255  -7.218
  327    HB2  GLU  41           HB2      GLU  41   6.389  -1.068  -8.792
  328    HB3  GLU  41           HB3      GLU  41   7.573   0.237  -8.749
  329    HG2  GLU  41           HG2      GLU  41   7.651  -0.116  -6.213
  330    HG3  GLU  41           HG3      GLU  41   6.719  -1.591  -6.472
  331    H    ALA  42           H        ALA  42   7.185   2.728  -8.714
  332    HA   ALA  42           HA       ALA  42   8.148   3.750  -6.287
  333    HB1  ALA  42           HB1      ALA  42   7.663   5.306  -8.860
  334    HB2  ALA  42           HB2      ALA  42   8.840   5.682  -7.590
  335    HB3  ALA  42           HB3      ALA  42   9.047   4.222  -8.572
  336    H    LYS  43           H        LYS  43   5.183   4.754  -8.032
  337    HA   LYS  43           HA       LYS  43   4.488   6.945  -6.209
  338    HB2  LYS  43           HB2      LYS  43   2.817   5.350  -8.200
  339    HB3  LYS  43           HB3      LYS  43   2.184   6.637  -7.176
  340    HG2  LYS  43           HG2      LYS  43   3.781   8.246  -8.195
  341    HG3  LYS  43           HG3      LYS  43   4.275   6.970  -9.342
  342    HD2  LYS  43           HD2      LYS  43   1.869   6.717 -10.016
  343    HD3  LYS  43           HD3      LYS  43   1.433   8.026  -8.914
  344    HE2  LYS  43           HE2      LYS  43   2.699   9.632 -10.220
  345    HE3  LYS  43           HE3      LYS  43   3.331   8.354 -11.272
  346    HZ1  LYS  43           HZ1      LYS  43   1.123   7.932 -12.081
  347    HZ2  LYS  43           HZ2      LYS  43   1.335   9.556 -12.170
  348    HZ3  LYS  43           HZ3      LYS  43   0.434   8.901 -10.967
  349    H    PHE  44           H        PHE  44   3.581   3.525  -6.540
  350    HA   PHE  44           HA       PHE  44   1.608   3.442  -4.518
  351    HB2  PHE  44           HB2      PHE  44   1.804   1.721  -6.178
  352    HB3  PHE  44           HB3      PHE  44   3.468   1.391  -5.760
  353    HD1  PHE  44           HD2      PHE  44  -0.051   0.962  -4.620
  354    HD2  PHE  44           HD1      PHE  44   4.075  -0.181  -4.075
  355    HE1  PHE  44           HE2      PHE  44  -0.760  -0.962  -3.214
  356    HE2  PHE  44           HE1      PHE  44   3.361  -2.106  -2.680
  357    HZ   PHE  44           HZ       PHE  44   0.941  -2.514  -2.274
  358    H    ILE  45           H        ILE  45   5.137   2.701  -4.292
  359    HA   ILE  45           HA       ILE  45   5.257   2.378  -1.458
  360    HB   ILE  45           HB       ILE  45   7.318   3.358  -3.470
  361   HG12  ILE  45          HG12      ILE  45   7.136   0.652  -2.070
  362   HG13  ILE  45          HG13      ILE  45   6.345   0.948  -3.611
  363   HG21  ILE  45          HG21      ILE  45   9.024   2.817  -1.715
  364   HG22  ILE  45          HG22      ILE  45   8.005   4.153  -1.236
  365   HG23  ILE  45          HG23      ILE  45   7.719   2.534  -0.553
  366   HD11  ILE  45          HD11      ILE  45   8.526   1.570  -4.633
  367   HD12  ILE  45          HD12      ILE  45   9.328   1.146  -3.105
  368   HD13  ILE  45          HD13      ILE  45   8.469  -0.095  -4.024
  369    H    ASN  46           H        ASN  46   5.736   5.378  -3.429
  370    HA   ASN  46           HA       ASN  46   6.179   7.131  -1.260
  371    HB2  ASN  46           HB2      ASN  46   6.672   8.088  -3.297
  372    HB3  ASN  46           HB3      ASN  46   5.273   7.398  -4.102
  373   HD21  ASN  46          HD21      ASN  46   3.345   8.511  -4.201
  374   HD22  ASN  46          HD22      ASN  46   3.209  10.180  -3.706
  375    H    TYR  47           H        TYR  47   3.030   6.157  -2.662
  376    HA   TYR  47           HA       TYR  47   1.418   7.835  -0.978
  377    HB2  TYR  47           HB2      TYR  47   0.723   6.949  -3.143
  378    HB3  TYR  47           HB3      TYR  47   0.779   5.301  -2.535
  379    HD1  TYR  47           HD1      TYR  47  -0.968   4.473  -0.945
  380    HD2  TYR  47           HD2      TYR  47  -1.124   8.449  -2.634
  381    HE1  TYR  47           HE1      TYR  47  -3.376   4.657  -0.324
  382    HE2  TYR  47           HE2      TYR  47  -3.524   8.608  -2.020
  383    HH   TYR  47           HH       TYR  47  -5.302   7.579  -1.072
  384    H    VAL  48           H        VAL  48   2.308   4.341  -0.741
  385    HA   VAL  48           HA       VAL  48   0.900   3.793   1.675
  386    HB   VAL  48           HB       VAL  48   3.418   2.549   0.500
  387   HG11  VAL  48          HG11      VAL  48   2.971   0.620   2.006
  388   HG12  VAL  48          HG12      VAL  48   3.388   2.070   2.928
  389   HG13  VAL  48          HG13      VAL  48   1.694   1.563   2.808
  390   HG21  VAL  48          HG21      VAL  48   1.974   0.778  -0.256
  391   HG22  VAL  48          HG22      VAL  48   0.599   1.403   0.672
  392   HG23  VAL  48          HG23      VAL  48   1.179   2.277  -0.747
  393    H    LYS  49           H        LYS  49   4.357   4.777   1.259
  394    HA   LYS  49           HA       LYS  49   4.882   4.992   4.084
  395    HB2  LYS  49           HB2      LYS  49   6.303   6.198   1.685
  396    HB3  LYS  49           HB3      LYS  49   6.892   6.281   3.353
  397    HG2  LYS  49           HG2      LYS  49   6.941   3.797   3.483
  398    HG3  LYS  49           HG3      LYS  49   6.363   3.698   1.819
  399    HD2  LYS  49           HD2      LYS  49   8.663   3.399   1.593
  400    HD3  LYS  49           HD3      LYS  49   8.427   5.093   1.167
  401    HE2  LYS  49           HE2      LYS  49  10.275   5.222   2.568
  402    HE3  LYS  49           HE3      LYS  49   8.962   5.556   3.705
  403    HZ1  LYS  49           HZ1      LYS  49  10.483   3.906   4.619
  404    HZ2  LYS  49           HZ2      LYS  49  10.328   2.945   3.297
  405    HZ3  LYS  49           HZ3      LYS  49   9.058   3.143   4.307
  406    H    ASN  50           H        ASN  50   3.419   7.273   1.852
  407    HA   ASN  50           HA       ASN  50   3.459   9.533   3.690
  408    HB2  ASN  50           HB2      ASN  50   3.256  10.104   1.426
  409    HB3  ASN  50           HB3      ASN  50   2.099   8.832   1.082
  410   HD21  ASN  50          HD21      ASN  50  -0.104   9.084   1.581
  411   HD22  ASN  50          HD22      ASN  50  -0.767  10.667   1.918
  412    H    CYS  51           H        CYS  51   1.359   6.689   3.348
  413    HA   CYS  51           HA       CYS  51  -0.774   7.869   5.002
  414    HB2  CYS  51           HB2      CYS  51  -0.470   5.152   3.676
  415    HB3  CYS  51           HB3      CYS  51  -1.868   5.671   4.641
  416    HG   CYS  51           HG       CYS  51  -0.708   6.709   1.754
  417    H    PHE  52           H        PHE  52   1.645   5.238   5.390
  418    HA   PHE  52           HA       PHE  52   1.684   5.690   8.268
  419    HB2  PHE  52           HB2      PHE  52  -0.129   3.943   7.884
  420    HB3  PHE  52           HB3      PHE  52   1.108   2.899   7.211
  421    HD1  PHE  52           HD2      PHE  52   0.628   5.046  10.300
  422    HD2  PHE  52           HD1      PHE  52   1.867   1.233   8.704
  423    HE1  PHE  52           HE2      PHE  52   1.100   4.228  12.594
  424    HE2  PHE  52           HE1      PHE  52   2.330   0.424  10.997
  425    HZ   PHE  52           HZ       PHE  52   1.951   1.913  12.951
  426    H    ARG  53           H        ARG  53   3.623   4.543   9.268
  427    HA   ARG  53           HA       ARG  53   5.734   5.600   7.897
  428    HB2  ARG  53           HB2      ARG  53   7.236   4.770   9.492
  429    HB3  ARG  53           HB3      ARG  53   5.732   5.106  10.334
  430    HG2  ARG  53           HG2      ARG  53   5.249   2.671  10.462
  431    HG3  ARG  53           HG3      ARG  53   6.690   2.324   9.492
  432    HD2  ARG  53           HD2      ARG  53   8.051   3.535  11.262
  433    HD3  ARG  53           HD3      ARG  53   6.619   3.418  12.303
  434    HE   ARG  53           HE       ARG  53   7.107   0.825  11.287
  435   HH11  ARG  53          HH11      ARG  53   8.748   3.067  13.424
  436   HH12  ARG  53          HH12      ARG  53   9.715   1.805  14.161
  437   HH21  ARG  53          HH21      ARG  53   8.523  -0.709  12.118
  438   HH22  ARG  53          HH22      ARG  53   9.459  -0.290  13.527
  439    H    MET  54           H        MET  54   5.018   2.150   7.813
  440    HA   MET  54           HA       MET  54   5.915   0.423   6.761
  441    HB2  MET  54           HB2      MET  54   4.222   1.266   5.280
  442    HB3  MET  54           HB3      MET  54   5.401   2.250   4.408
  443    HG2  MET  54           HG2      MET  54   4.781   0.010   3.344
  444    HG3  MET  54           HG3      MET  54   6.487   0.373   3.520
  445    HE1  MET  54           HE1      MET  54   3.501  -1.902   4.824
  446    HE2  MET  54           HE2      MET  54   4.282  -2.750   6.176
  447    HE3  MET  54           HE3      MET  54   3.964  -1.008   6.296
  448    H    THR  55           H        THR  55   7.903   0.534   7.835
  449    HA   THR  55           HA       THR  55  10.235   1.718   6.535
  450    HB   THR  55           HB       THR  55  11.328   0.756   8.678
  451    HG1  THR  55           HG1      THR  55   9.777  -0.799   9.171
  452   HG21  THR  55          HG21      THR  55   8.981   2.687   8.937
  453   HG22  THR  55          HG22      THR  55  10.659   3.108   8.547
  454   HG23  THR  55          HG23      THR  55  10.267   2.441  10.141
  455    H    ASP  56           H        ASP  56   8.818  -1.364   6.202
  456    HA   ASP  56           HA       ASP  56  11.461  -2.769   6.109
  457    HB2  ASP  56           HB2      ASP  56   8.661  -3.668   6.825
  458    HB3  ASP  56           HB3      ASP  56  10.010  -4.769   6.605
  459    H    GLN  57           H        GLN  57  12.145  -3.168   4.079
  460    HA   GLN  57           HA       GLN  57  10.596  -3.093   1.747
  461    HB2  GLN  57           HB2      GLN  57  12.995  -2.813   1.761
  462    HB3  GLN  57           HB3      GLN  57  13.226  -4.473   2.315
  463    HG2  GLN  57           HG2      GLN  57  13.733  -4.335  -0.024
  464    HG3  GLN  57           HG3      GLN  57  12.302  -5.328   0.185
  465   HE21  GLN  57          HE21      GLN  57  10.240  -4.492  -0.590
  466   HE22  GLN  57          HE22      GLN  57  10.255  -3.236  -1.838
  467    H    GLU  58           H        GLU  58  11.214  -5.849   3.857
  468    HA   GLU  58           HA       GLU  58  10.124  -7.926   2.203
  469    HB2  GLU  58           HB2      GLU  58  10.011  -9.184   4.354
  470    HB3  GLU  58           HB3      GLU  58  11.581  -8.474   3.981
  471    HG2  GLU  58           HG2      GLU  58  11.035  -6.561   5.546
  472    HG3  GLU  58           HG3      GLU  58   9.547  -7.401   5.981
  473    H    ALA  59           H        ALA  59   8.524  -5.597   4.401
  474    HA   ALA  59           HA       ALA  59   5.898  -6.898   4.008
  475    HB1  ALA  59           HB1      ALA  59   5.027  -5.095   5.373
  476    HB2  ALA  59           HB2      ALA  59   6.359  -5.937   6.195
  477    HB3  ALA  59           HB3      ALA  59   6.637  -4.337   5.454
  478    H    ILE  60           H        ILE  60   7.707  -4.033   2.826
  479    HA   ILE  60           HA       ILE  60   5.683  -2.879   1.201
  480    HB   ILE  60           HB       ILE  60   8.682  -3.056   0.924
  481   HG12  ILE  60          HG12      ILE  60   6.870  -0.729   1.629
  482   HG13  ILE  60          HG13      ILE  60   7.709  -1.751   2.798
  483   HG21  ILE  60          HG21      ILE  60   6.776  -1.421  -0.824
  484   HG22  ILE  60          HG22      ILE  60   8.547  -1.263  -0.829
  485   HG23  ILE  60          HG23      ILE  60   7.811  -2.746  -1.388
  486   HD11  ILE  60          HD11      ILE  60   8.970   0.188   0.853
  487   HD12  ILE  60          HD12      ILE  60   9.006   0.205   2.623
  488   HD13  ILE  60          HD13      ILE  60   9.904  -1.044   1.735
  489    H    GLN  61           H        GLN  61   8.031  -5.481   0.282
  490    HA   GLN  61           HA       GLN  61   6.726  -5.887  -2.263
  491    HB2  GLN  61           HB2      GLN  61   8.182  -7.751  -2.585
  492    HB3  GLN  61           HB3      GLN  61   9.062  -6.378  -1.943
  493    HG2  GLN  61           HG2      GLN  61  10.003  -8.005  -0.647
  494    HG3  GLN  61           HG3      GLN  61   8.668  -7.574   0.390
  495   HE21  GLN  61          HE21      GLN  61   7.863  -9.409   1.334
  496   HE22  GLN  61          HE22      GLN  61   7.839 -10.987   0.536
  497    H    ASP  62           H        ASP  62   6.205  -7.439   0.952
  498    HA   ASP  62           HA       ASP  62   4.336  -9.390  -0.037
  499    HB2  ASP  62           HB2      ASP  62   5.359  -9.436   2.199
  500    HB3  ASP  62           HB3      ASP  62   4.487  -7.966   2.641
  501    H    LEU  63           H        LEU  63   3.862  -5.956   0.945
  502    HA   LEU  63           HA       LEU  63   1.038  -5.943   0.495
  503    HB2  LEU  63           HB2      LEU  63   2.861  -4.194   1.594
  504    HB3  LEU  63           HB3      LEU  63   2.476  -3.375   0.091
  505    HG   LEU  63           HG       LEU  63   0.543  -4.256   2.284
  506   HD11  LEU  63          HD11      LEU  63   1.930  -2.295   2.842
  507   HD12  LEU  63          HD12      LEU  63   0.231  -1.833   2.624
  508   HD13  LEU  63          HD13      LEU  63   1.413  -1.490   1.344
  509   HD21  LEU  63          HD21      LEU  63  -1.212  -2.998   1.107
  510   HD22  LEU  63          HD22      LEU  63  -0.650  -4.352   0.119
  511   HD23  LEU  63          HD23      LEU  63  -0.110  -2.700  -0.250
  512    H    TRP  64           H        TRP  64   3.842  -5.329  -1.627
  513    HA   TRP  64           HA       TRP  64   2.361  -4.448  -3.917
  514    HB2  TRP  64           HB2      TRP  64   4.850  -4.160  -3.396
  515    HB3  TRP  64           HB3      TRP  64   5.062  -5.822  -3.911
  516    HD1  TRP  64           HD1      TRP  64   3.020  -2.973  -5.586
  517    HE1  TRP  64           HE1      TRP  64   3.779  -2.735  -8.029
  518    HE3  TRP  64           HE3      TRP  64   6.868  -6.364  -5.590
  519    HZ2  TRP  64           HZ2      TRP  64   5.867  -3.747  -9.710
  520    HZ3  TRP  64           HZ3      TRP  64   8.242  -6.683  -7.636
  521    HH2  TRP  64           HH2      TRP  64   7.744  -5.393  -9.700
  522    H    GLN  65           H        GLN  65   3.433  -7.741  -2.937
  523    HA   GLN  65           HA       GLN  65   2.183  -9.103  -5.156
  524    HB2  GLN  65           HB2      GLN  65   3.033  -9.926  -2.362
  525    HB3  GLN  65           HB3      GLN  65   1.965 -10.966  -3.297
  526    HG2  GLN  65           HG2      GLN  65   4.068 -11.810  -3.771
  527    HG3  GLN  65           HG3      GLN  65   3.651 -10.883  -5.205
  528   HE21  GLN  65          HE21      GLN  65   4.794  -8.738  -5.505
  529   HE22  GLN  65          HE22      GLN  65   6.343  -8.551  -4.672
  530    H    TRP  66           H        TRP  66   0.861  -8.032  -1.970
  531    HA   TRP  66           HA       TRP  66  -1.754  -9.096  -2.447
  532    HB2  TRP  66           HB2      TRP  66  -0.773  -8.298  -0.258
  533    HB3  TRP  66           HB3      TRP  66  -1.105  -6.650  -0.780
  534    HD1  TRP  66           HD1      TRP  66  -3.626  -5.881  -0.813
  535    HE1  TRP  66           HE1      TRP  66  -5.845  -6.908  -0.058
  536    HE3  TRP  66           HE3      TRP  66  -2.063 -10.649   0.152
  537    HZ2  TRP  66           HZ2      TRP  66  -6.780  -9.365   1.120
  538    HZ3  TRP  66           HZ3      TRP  66  -3.667 -12.341   1.014
  539    HH2  TRP  66           HH2      TRP  66  -6.013 -11.703   1.520
  540    H    ARG  67           H        ARG  67  -0.270  -6.120  -3.609
  541    HA   ARG  67           HA       ARG  67  -2.679  -5.037  -4.865
  542    HB2  ARG  67           HB2      ARG  67  -0.472  -3.826  -4.156
  543    HB3  ARG  67           HB3      ARG  67   0.206  -4.484  -5.637
  544    HG2  ARG  67           HG2      ARG  67  -2.161  -3.280  -6.537
  545    HG3  ARG  67           HG3      ARG  67  -1.674  -2.245  -5.204
  546    HD2  ARG  67           HD2      ARG  67  -0.533  -1.252  -6.988
  547    HD3  ARG  67           HD3      ARG  67   0.707  -2.292  -6.320
  548    HE   ARG  67           HE       ARG  67   0.604  -3.667  -8.228
  549   HH11  ARG  67          HH11      ARG  67  -2.225  -1.553  -8.291
  550   HH12  ARG  67          HH12      ARG  67  -2.591  -1.936  -9.951
  551   HH21  ARG  67          HH21      ARG  67   0.207  -3.913 -10.408
  552   HH22  ARG  67          HH22      ARG  67  -1.272  -3.269 -11.100
  553    H    LYS  68           H        LYS  68  -0.198  -7.344  -5.841
  554    HA   LYS  68           HA       LYS  68  -0.990  -7.418  -8.638
  555    HB2  LYS  68           HB2      LYS  68   1.285  -7.972  -7.677
  556    HB3  LYS  68           HB3      LYS  68   0.636  -9.509  -7.121
  557    HG2  LYS  68           HG2      LYS  68   0.332  -8.677 -10.024
  558    HG3  LYS  68           HG3      LYS  68   1.891  -9.243  -9.449
  559    HD2  LYS  68           HD2      LYS  68   1.079 -11.392  -8.866
  560    HD3  LYS  68           HD3      LYS  68  -0.613 -10.943  -9.078
  561    HE2  LYS  68           HE2      LYS  68   1.428 -10.840 -11.332
  562    HE3  LYS  68           HE3      LYS  68   0.485 -12.289 -10.970
  563    HZ1  LYS  68           HZ1      LYS  68  -0.468 -10.769 -12.713
  564    HZ2  LYS  68           HZ2      LYS  68  -0.836  -9.694 -11.546
  565    HZ3  LYS  68           HZ3      LYS  68  -1.509 -11.191 -11.511
  566    H    SER  69           H        SER  69  -1.828  -9.361  -5.759
  567    HA   SER  69           HA       SER  69  -3.418 -11.246  -7.252
  568    HB2  SER  69           HB2      SER  69  -3.927 -12.224  -5.088
  569    HB3  SER  69           HB3      SER  69  -2.202 -11.894  -5.276
  570    HG   SER  69           HG       SER  69  -2.623 -11.146  -3.328
  571    H    LEU  70           H        LEU  70  -4.261  -8.220  -7.069
  572    HA   LEU  70           HA       LEU  70  -7.035  -8.328  -6.227
  573    HB2  LEU  70           HB2      LEU  70  -5.485  -6.356  -7.955
  574    HB3  LEU  70           HB3      LEU  70  -7.131  -6.105  -7.389
  575    HG   LEU  70           HG       LEU  70  -4.673  -6.357  -5.602
  576   HD11  LEU  70          HD11      LEU  70  -5.048  -3.936  -5.225
  577   HD12  LEU  70          HD12      LEU  70  -6.359  -3.964  -6.424
  578   HD13  LEU  70          HD13      LEU  70  -4.690  -4.286  -6.925
  579   HD21  LEU  70          HD21      LEU  70  -6.704  -7.107  -4.429
  580   HD22  LEU  70          HD22      LEU  70  -7.561  -5.635  -4.942
  581   HD23  LEU  70          HD23      LEU  70  -6.184  -5.539  -3.820
  Start of MODEL    9
    1    H    GLN   1           H1       GLN   1 -46.922  -9.013  10.628
    2    HA   GLN   1           HA       GLN   1 -47.715  -7.528  13.025
    3    HB2  GLN   1           HB2      GLN   1 -45.829  -8.319  14.223
    4    HB3  GLN   1           HB3      GLN   1 -46.730  -9.680  13.617
    5    HG2  GLN   1           HG2      GLN   1 -44.699 -10.478  13.078
    6    HG3  GLN   1           HG3      GLN   1 -44.926  -9.554  11.607
    7   HE21  GLN   1          HE21      GLN   1 -42.423 -10.126  12.027
    8   HE22  GLN   1          HE22      GLN   1 -41.529  -8.745  12.673
    9    H    GLU   2           H        GLU   2 -45.835  -5.986  13.709
   10    HA   GLU   2           HA       GLU   2 -45.814  -4.198  11.382
   11    HB2  GLU   2           HB2      GLU   2 -45.715  -2.424  12.956
   12    HB3  GLU   2           HB3      GLU   2 -46.987  -3.537  13.413
   13    HG2  GLU   2           HG2      GLU   2 -44.254  -3.698  14.753
   14    HG3  GLU   2           HG3      GLU   2 -45.417  -2.465  15.207
   15    H    SER   3           H        SER   3 -43.306  -5.818  13.181
   16    HA   SER   3           HA       SER   3 -41.081  -5.605  13.370
   17    HB2  SER   3           HB2      SER   3 -41.215  -4.288  10.647
   18    HB3  SER   3           HB3      SER   3 -39.768  -4.963  11.410
   19    HG   SER   3           HG       SER   3 -40.781  -6.990  11.454
   20    H    PHE   4           H        PHE   4 -39.162  -4.303  13.677
   21    HA   PHE   4           HA       PHE   4 -39.733  -1.480  14.516
   22    HB2  PHE   4           HB2      PHE   4 -38.562  -3.759  16.154
   23    HB3  PHE   4           HB3      PHE   4 -38.453  -2.072  16.614
   24    HD1  PHE   4           HD1      PHE   4 -40.839  -4.896  16.106
   25    HD2  PHE   4           HD2      PHE   4 -40.295  -0.886  17.599
   26    HE1  PHE   4           HE1      PHE   4 -43.066  -4.998  17.190
   27    HE2  PHE   4           HE2      PHE   4 -42.511  -1.005  18.717
   28    HZ   PHE   4           HZ       PHE   4 -43.912  -3.053  18.491
   29    H    LYS   5           H        LYS   5 -37.143  -3.842  13.649
   30    HA   LYS   5           HA       LYS   5 -35.618  -1.745  12.401
   31    HB2  LYS   5           HB2      LYS   5 -33.637  -1.714  13.764
   32    HB3  LYS   5           HB3      LYS   5 -35.002  -1.293  14.771
   33    HG2  LYS   5           HG2      LYS   5 -35.028  -3.786  15.514
   34    HG3  LYS   5           HG3      LYS   5 -33.438  -3.896  14.734
   35    HD2  LYS   5           HD2      LYS   5 -32.764  -1.849  16.171
   36    HD3  LYS   5           HD3      LYS   5 -34.305  -2.076  17.009
   37    HE2  LYS   5           HE2      LYS   5 -32.938  -3.237  18.395
   38    HE3  LYS   5           HE3      LYS   5 -33.487  -4.551  17.357
   39    HZ1  LYS   5           HZ1      LYS   5 -31.021  -4.462  17.761
   40    HZ2  LYS   5           HZ2      LYS   5 -30.944  -3.056  16.939
   41    HZ3  LYS   5           HZ3      LYS   5 -31.394  -4.419  16.155
   42    H    LYS   6           H        LYS   6 -33.829  -2.376  11.213
   43    HA   LYS   6           HA       LYS   6 -33.288  -5.292  10.861
   44    HB2  LYS   6           HB2      LYS   6 -34.580  -3.382   8.937
   45    HB3  LYS   6           HB3      LYS   6 -33.317  -4.383   8.259
   46    HG2  LYS   6           HG2      LYS   6 -35.654  -5.542   9.829
   47    HG3  LYS   6           HG3      LYS   6 -35.659  -5.279   8.085
   48    HD2  LYS   6           HD2      LYS   6 -33.515  -6.698   7.985
   49    HD3  LYS   6           HD3      LYS   6 -33.873  -7.175   9.652
   50    HE2  LYS   6           HE2      LYS   6 -36.068  -8.051   8.944
   51    HE3  LYS   6           HE3      LYS   6 -35.793  -7.474   7.294
   52    HZ1  LYS   6           HZ1      LYS   6 -33.953  -8.985   7.091
   53    HZ2  LYS   6           HZ2      LYS   6 -35.296  -9.849   7.580
   54    HZ3  LYS   6           HZ3      LYS   6 -34.101  -9.494   8.647
   55    H    GLN   7           H        GLN   7 -31.262  -5.826  10.264
   56    HA   GLN   7           HA       GLN   7 -29.357  -3.635   9.542
   57    HB2  GLN   7           HB2      GLN   7 -29.456  -4.110  11.998
   58    HB3  GLN   7           HB3      GLN   7 -28.885  -5.746  11.677
   59    HG2  GLN   7           HG2      GLN   7 -26.766  -4.857  10.803
   60    HG3  GLN   7           HG3      GLN   7 -27.377  -3.194  10.926
   61   HE21  GLN   7          HE21      GLN   7 -27.607  -2.228  13.054
   62   HE22  GLN   7          HE22      GLN   7 -26.993  -3.048  14.495
   63    H    GLU   8           H        GLU   8 -29.433  -7.196   9.974
   64    HA   GLU   8           HA       GLU   8 -28.551  -8.945   8.902
   65    HB2  GLU   8           HB2      GLU   8 -29.005  -7.338   6.380
   66    HB3  GLU   8           HB3      GLU   8 -28.800  -9.083   6.497
   67    HG2  GLU   8           HG2      GLU   8 -30.865  -9.291   7.797
   68    HG3  GLU   8           HG3      GLU   8 -31.083  -7.537   7.802
   69    H    LYS   9           H        LYS   9 -26.889  -6.042   7.693
   70    HA   LYS   9           HA       LYS   9 -24.335  -7.570   7.372
   71    HB2  LYS   9           HB2      LYS   9 -25.462  -5.417   5.532
   72    HB3  LYS   9           HB3      LYS   9 -23.902  -6.231   5.349
   73    HG2  LYS   9           HG2      LYS   9 -25.125  -8.419   5.089
   74    HG3  LYS   9           HG3      LYS   9 -26.644  -7.541   5.184
   75    HD2  LYS   9           HD2      LYS   9 -26.224  -7.975   2.899
   76    HD3  LYS   9           HD3      LYS   9 -26.026  -6.241   3.156
   77    HE2  LYS   9           HE2      LYS   9 -23.603  -6.463   3.043
   78    HE3  LYS   9           HE3      LYS   9 -23.719  -8.233   3.020
   79    HZ1  LYS   9           HZ1      LYS   9 -23.466  -7.135   0.751
   80    HZ2  LYS   9           HZ2      LYS   9 -24.988  -6.546   0.939
   81    HZ3  LYS   9           HZ3      LYS   9 -24.760  -8.148   0.884
   82    H    THR  10           H        THR  10 -22.488  -5.899   7.064
   83    HA   THR  10           HA       THR  10 -21.150  -4.247   7.879
   84    HB   THR  10           HB       THR  10 -22.148  -3.411   5.941
   85    HG1  THR  10           HG1      THR  10 -22.246  -1.114   7.447
   86   HG21  THR  10          HG21      THR  10 -23.949  -1.705   5.937
   87   HG22  THR  10          HG22      THR  10 -24.323  -2.121   7.624
   88   HG23  THR  10          HG23      THR  10 -24.516  -3.322   6.338
   89    HA   PRO  11           HA       PRO  11 -22.227  -2.944  12.161
   90    HB2  PRO  11           HB2      PRO  11 -20.220  -4.337  13.374
   91    HB3  PRO  11           HB3      PRO  11 -21.859  -5.019  13.145
   92    HG2  PRO  11           HG2      PRO  11 -19.409  -5.433  11.385
   93    HG3  PRO  11           HG3      PRO  11 -20.497  -6.684  12.069
   94    HD2  PRO  11           HD2      PRO  11 -20.805  -5.764   9.537
   95    HD3  PRO  11           HD3      PRO  11 -22.220  -6.138  10.568
   96    H    LYS  12           H        LYS  12 -20.645  -1.511  13.226
   97    HA   LYS  12           HA       LYS  12 -18.341  -0.690  11.483
   98    HB2  LYS  12           HB2      LYS  12 -20.248   0.947  13.179
   99    HB3  LYS  12           HB3      LYS  12 -18.634   1.519  12.825
  100    HG2  LYS  12           HG2      LYS  12 -20.101   2.511  11.255
  101    HG3  LYS  12           HG3      LYS  12 -19.028   1.412  10.415
  102    HD2  LYS  12           HD2      LYS  12 -21.242   1.335   9.473
  103    HD3  LYS  12           HD3      LYS  12 -20.857  -0.229  10.175
  104    HE2  LYS  12           HE2      LYS  12 -22.192   0.419  12.223
  105    HE3  LYS  12           HE3      LYS  12 -22.583   1.955  11.432
  106    HZ1  LYS  12           HZ1      LYS  12 -23.356  -0.749  10.492
  107    HZ2  LYS  12           HZ2      LYS  12 -23.579   0.603   9.612
  108    HZ3  LYS  12           HZ3      LYS  12 -24.358   0.418  11.073
  109    H    THR  13           H        THR  13 -16.415  -0.136  12.329
  110    HA   THR  13           HA       THR  13 -15.933   0.032  15.172
  111    HB   THR  13           HB       THR  13 -15.727  -2.372  15.023
  112    HG1  THR  13           HG1      THR  13 -13.079  -1.448  15.087
  113   HG21  THR  13          HG21      THR  13 -15.089  -2.655  12.631
  114   HG22  THR  13          HG22      THR  13 -14.021  -3.517  13.741
  115   HG23  THR  13          HG23      THR  13 -13.477  -2.001  12.994
  116    HA   PRO  14           HA       PRO  14 -12.555   2.525  13.378
  117    HB2  PRO  14           HB2      PRO  14 -11.281   2.268  16.071
  118    HB3  PRO  14           HB3      PRO  14 -11.638   3.744  15.118
  119    HG2  PRO  14           HG2      PRO  14 -13.114   3.050  17.299
  120    HG3  PRO  14           HG3      PRO  14 -13.880   3.773  15.840
  121    HD2  PRO  14           HD2      PRO  14 -13.731   0.859  16.650
  122    HD3  PRO  14           HD3      PRO  14 -15.142   1.810  16.076
  123    H    LYS  15           H        LYS  15 -10.358   2.082  12.748
  124    HA   LYS  15           HA       LYS  15  -8.893  -0.095  13.983
  125    HB2  LYS  15           HB2      LYS  15  -8.380  -1.312  11.841
  126    HB3  LYS  15           HB3      LYS  15  -9.963  -1.598  12.527
  127    HG2  LYS  15           HG2      LYS  15  -9.690   0.537  10.407
  128    HG3  LYS  15           HG3      LYS  15  -9.601  -1.151   9.914
  129    HD2  LYS  15           HD2      LYS  15 -11.800  -1.641  10.559
  130    HD3  LYS  15           HD3      LYS  15 -11.895  -0.286  11.672
  131    HE2  LYS  15           HE2      LYS  15 -11.758   1.293   9.717
  132    HE3  LYS  15           HE3      LYS  15 -11.872  -0.114   8.645
  133    HZ1  LYS  15           HZ1      LYS  15 -14.024  -0.618   9.647
  134    HZ2  LYS  15           HZ2      LYS  15 -14.047   0.925   9.074
  135    HZ3  LYS  15           HZ3      LYS  15 -13.911   0.626  10.685
  136    H    GLY  16           H        GLY  16  -6.774   0.014  13.822
  137    HA2  GLY  16           HA2      GLY  16  -5.204   1.098  11.733
  138    HA3  GLY  16           HA3      GLY  16  -5.376   2.345  12.970
  139    HA   PRO  17           HA       PRO  17  -3.349  -1.138  15.463
  140    HB2  PRO  17           HB2      PRO  17  -2.766  -3.623  14.454
  141    HB3  PRO  17           HB3      PRO  17  -4.410  -3.120  14.936
  142    HG2  PRO  17           HG2      PRO  17  -3.173  -3.030  12.163
  143    HG3  PRO  17           HG3      PRO  17  -4.729  -3.786  12.650
  144    HD2  PRO  17           HD2      PRO  17  -4.711  -1.279  11.637
  145    HD3  PRO  17           HD3      PRO  17  -5.752  -1.697  13.008
  146    H    SER  18           H        SER  18  -1.283  -2.280  15.985
  147    HA   SER  18           HA       SER  18   1.059  -1.124  14.624
  148    HB2  SER  18           HB2      SER  18   0.862  -2.985  17.020
  149    HB3  SER  18           HB3      SER  18   2.344  -2.202  16.433
  150    HG   SER  18           HG       SER  18   1.311  -0.191  16.750
  151    H    SER  19           H        SER  19  -0.392  -2.885  12.957
  152    HA   SER  19           HA       SER  19   1.556  -5.042  12.393
  153    HB2  SER  19           HB2      SER  19  -1.446  -5.476  12.742
  154    HB3  SER  19           HB3      SER  19  -0.330  -6.644  12.018
  155    HG   SER  19           HG       SER  19  -0.383  -5.704  14.707
  156    H    VAL  20           H        VAL  20   1.296  -5.935  10.194
  157    HA   VAL  20           HA       VAL  20   0.840  -3.958   8.210
  158    HB   VAL  20           HB       VAL  20   0.836  -6.976   7.819
  159   HG11  VAL  20          HG11      VAL  20   0.085  -5.865   5.790
  160   HG12  VAL  20          HG12      VAL  20   1.405  -4.675   5.903
  161   HG13  VAL  20          HG13      VAL  20   1.750  -6.387   5.566
  162   HG21  VAL  20          HG21      VAL  20   2.925  -6.318   8.931
  163   HG22  VAL  20          HG22      VAL  20   3.267  -6.663   7.240
  164   HG23  VAL  20          HG23      VAL  20   3.151  -4.978   7.792
  165    H    GLU  21           H        GLU  21  -1.478  -6.023   9.764
  166    HA   GLU  21           HA       GLU  21  -3.732  -5.933   8.110
  167    HB2  GLU  21           HB2      GLU  21  -3.760  -5.356  11.082
  168    HB3  GLU  21           HB3      GLU  21  -5.044  -6.066  10.115
  169    HG2  GLU  21           HG2      GLU  21  -2.399  -7.342  10.902
  170    HG3  GLU  21           HG3      GLU  21  -3.979  -7.716  11.552
  171    H    ASP  22           H        ASP  22  -2.232  -3.190   9.796
  172    HA   ASP  22           HA       ASP  22  -4.394  -1.281   9.628
  173    HB2  ASP  22           HB2      ASP  22  -2.484  -0.972  11.140
  174    HB3  ASP  22           HB3      ASP  22  -1.353  -1.031   9.791
  175    H    ILE  23           H        ILE  23  -1.429  -1.459   7.640
  176    HA   ILE  23           HA       ILE  23  -2.544   0.238   5.648
  177    HB   ILE  23           HB       ILE  23  -0.179   0.080   6.168
  178   HG12  ILE  23          HG12      ILE  23  -0.438  -0.593   3.237
  179   HG13  ILE  23          HG13      ILE  23  -1.207   0.857   3.885
  180   HG21  ILE  23          HG21      ILE  23   1.221  -1.745   5.206
  181   HG22  ILE  23          HG22      ILE  23   0.114  -2.336   6.440
  182   HG23  ILE  23          HG23      ILE  23  -0.247  -2.608   4.723
  183   HD11  ILE  23          HD11      ILE  23   1.767   0.291   4.240
  184   HD12  ILE  23          HD12      ILE  23   1.064   1.280   2.947
  185   HD13  ILE  23          HD13      ILE  23   0.890   1.782   4.626
  186    H    LYS  24           H        LYS  24  -2.670  -3.275   5.972
  187    HA   LYS  24           HA       LYS  24  -3.833  -3.908   3.412
  188    HB2  LYS  24           HB2      LYS  24  -4.311  -5.013   6.206
  189    HB3  LYS  24           HB3      LYS  24  -5.174  -5.629   4.818
  190    HG2  LYS  24           HG2      LYS  24  -2.145  -5.712   5.099
  191    HG3  LYS  24           HG3      LYS  24  -3.260  -7.010   5.535
  192    HD2  LYS  24           HD2      LYS  24  -4.112  -6.786   3.050
  193    HD3  LYS  24           HD3      LYS  24  -2.599  -5.898   2.797
  194    HE2  LYS  24           HE2      LYS  24  -2.185  -8.166   2.196
  195    HE3  LYS  24           HE3      LYS  24  -1.358  -7.911   3.730
  196    HZ1  LYS  24           HZ1      LYS  24  -2.731 -10.011   3.504
  197    HZ2  LYS  24           HZ2      LYS  24  -4.096  -9.087   3.608
  198    HZ3  LYS  24           HZ3      LYS  24  -3.041  -9.146   4.850
  199    H    ALA  25           H        ALA  25  -5.665  -3.213   6.468
  200    HA   ALA  25           HA       ALA  25  -8.155  -3.073   5.137
  201    HB1  ALA  25           HB1      ALA  25  -8.938  -2.009   7.241
  202    HB2  ALA  25           HB2      ALA  25  -7.915  -3.426   7.542
  203    HB3  ALA  25           HB3      ALA  25  -7.248  -1.788   7.754
  204    H    LYS  26           H        LYS  26  -5.899  -0.419   5.952
  205    HA   LYS  26           HA       LYS  26  -7.572   1.696   4.960
  206    HB2  LYS  26           HB2      LYS  26  -4.591   1.506   5.501
  207    HB3  LYS  26           HB3      LYS  26  -5.410   3.018   5.084
  208    HG2  LYS  26           HG2      LYS  26  -6.672   3.041   7.132
  209    HG3  LYS  26           HG3      LYS  26  -6.393   1.340   7.425
  210    HD2  LYS  26           HD2      LYS  26  -5.103   2.697   8.959
  211    HD3  LYS  26           HD3      LYS  26  -4.101   1.698   7.917
  212    HE2  LYS  26           HE2      LYS  26  -3.605   3.660   6.489
  213    HE3  LYS  26           HE3      LYS  26  -4.524   4.698   7.595
  214    HZ1  LYS  26           HZ1      LYS  26  -2.042   4.566   7.994
  215    HZ2  LYS  26           HZ2      LYS  26  -2.255   3.000   8.482
  216    HZ3  LYS  26           HZ3      LYS  26  -2.957   4.212   9.320
  217    H    MET  27           H        MET  27  -5.278  -0.425   3.217
  218    HA   MET  27           HA       MET  27  -5.540   1.073   0.722
  219    HB2  MET  27           HB2      MET  27  -4.369  -1.638   1.367
  220    HB3  MET  27           HB3      MET  27  -4.639  -1.091  -0.288
  221    HG2  MET  27           HG2      MET  27  -3.330   0.983   0.192
  222    HG3  MET  27           HG3      MET  27  -2.895   0.305   1.763
  223    HE1  MET  27           HE1      MET  27  -0.399   0.712   1.195
  224    HE2  MET  27           HE2      MET  27   0.477  -0.002  -0.176
  225    HE3  MET  27           HE3      MET  27  -0.703   1.294  -0.455
  226    H    GLN  28           H        GLN  28  -7.187  -1.908   1.989
  227    HA   GLN  28           HA       GLN  28  -8.776  -2.206  -0.393
  228    HB2  GLN  28           HB2      GLN  28  -9.120  -3.173   2.433
  229    HB3  GLN  28           HB3      GLN  28 -10.451  -3.285   1.292
  230    HG2  GLN  28           HG2      GLN  28  -9.255  -5.377   1.209
  231    HG3  GLN  28           HG3      GLN  28  -9.083  -4.538  -0.331
  232   HE21  GLN  28          HE21      GLN  28  -7.416  -5.157   2.763
  233   HE22  GLN  28          HE22      GLN  28  -5.845  -4.650   2.137
  234    H    ALA  29           H        ALA  29  -9.458  -0.362   2.647
  235    HA   ALA  29           HA       ALA  29 -11.897   0.753   1.787
  236    HB1  ALA  29           HB1      ALA  29  -9.705   1.951   3.537
  237    HB2  ALA  29           HB2      ALA  29 -11.373   2.555   3.426
  238    HB3  ALA  29           HB3      ALA  29 -11.056   0.935   4.079
  239    H    SER  30           H        SER  30  -8.547   1.912   1.126
  240    HA   SER  30           HA       SER  30  -9.218   4.260  -0.316
  241    HB2  SER  30           HB2      SER  30  -6.843   2.421  -0.810
  242    HB3  SER  30           HB3      SER  30  -7.039   4.050  -1.444
  243    HG   SER  30           HG       SER  30  -6.936   3.330   1.311
  244    H    ILE  31           H        ILE  31  -9.008   0.874  -1.594
  245    HA   ILE  31           HA       ILE  31  -9.590   1.880  -4.287
  246    HB   ILE  31           HB       ILE  31  -7.986   0.104  -3.975
  247   HG12  ILE  31          HG12      ILE  31 -10.401  -0.757  -5.618
  248   HG13  ILE  31          HG13      ILE  31  -9.173   0.418  -6.117
  249   HG21  ILE  31          HG21      ILE  31  -8.599  -2.180  -3.405
  250   HG22  ILE  31          HG22      ILE  31  -9.059  -1.093  -2.118
  251   HG23  ILE  31          HG23      ILE  31 -10.307  -1.722  -3.214
  252   HD11  ILE  31          HD11      ILE  31  -8.691  -1.694  -7.157
  253   HD12  ILE  31          HD12      ILE  31  -7.445  -1.414  -5.921
  254   HD13  ILE  31          HD13      ILE  31  -8.781  -2.557  -5.615
  255    H    GLU  32           H        GLU  32 -11.579   0.110  -1.827
  256    HA   GLU  32           HA       GLU  32 -13.808   0.144  -3.795
  257    HB2  GLU  32           HB2      GLU  32 -15.041  -1.247  -2.324
  258    HB3  GLU  32           HB3      GLU  32 -13.487  -1.944  -2.740
  259    HG2  GLU  32           HG2      GLU  32 -12.762  -1.999  -0.613
  260    HG3  GLU  32           HG3      GLU  32 -13.451  -0.417  -0.194
  261    H    LYS  33           H        LYS  33 -12.880   2.181  -1.167
  262    HA   LYS  33           HA       LYS  33 -15.447   3.675  -1.580
  263    HB2  LYS  33           HB2      LYS  33 -14.056   3.179   1.078
  264    HB3  LYS  33           HB3      LYS  33 -15.400   4.290   0.838
  265    HG2  LYS  33           HG2      LYS  33 -15.548   1.289   0.343
  266    HG3  LYS  33           HG3      LYS  33 -16.064   2.093   1.816
  267    HD2  LYS  33           HD2      LYS  33 -17.802   3.319   0.674
  268    HD3  LYS  33           HD3      LYS  33 -17.283   2.744  -0.910
  269    HE2  LYS  33           HE2      LYS  33 -18.291   0.929   1.315
  270    HE3  LYS  33           HE3      LYS  33 -19.306   1.591   0.028
  271    HZ1  LYS  33           HZ1      LYS  33 -18.536  -0.636  -0.546
  272    HZ2  LYS  33           HZ2      LYS  33 -16.982  -0.221  -0.364
  273    HZ3  LYS  33           HZ3      LYS  33 -17.884   0.447  -1.588
  274    H    GLY  34           H        GLY  34 -11.955   3.977  -1.205
  275    HA2  GLY  34           HA2      GLY  34 -12.123   6.910  -1.592
  276    HA3  GLY  34           HA3      GLY  34 -10.670   5.915  -1.574
  277    H    GLY  35           H        GLY  35 -12.008   4.065  -3.626
  278    HA2  GLY  35           HA2      GLY  35 -12.411   3.829  -5.871
  279    HA3  GLY  35           HA3      GLY  35 -12.481   5.580  -6.052
  280    H    SER  36           H        SER  36  -9.480   4.794  -4.618
  281    HA   SER  36           HA       SER  36  -8.075   4.511  -7.225
  282    HB2  SER  36           HB2      SER  36  -7.622   6.881  -5.385
  283    HB3  SER  36           HB3      SER  36  -6.696   6.497  -6.838
  284    HG   SER  36           HG       SER  36  -8.450   8.096  -7.021
  285    H    LEU  37           H        LEU  37  -6.272   3.373  -7.087
  286    HA   LEU  37           HA       LEU  37  -4.553   3.505  -4.682
  287    HB2  LEU  37           HB2      LEU  37  -6.103   1.486  -4.629
  288    HB3  LEU  37           HB3      LEU  37  -5.332   0.925  -6.106
  289    HG   LEU  37           HG       LEU  37  -3.144   0.800  -4.832
  290   HD11  LEU  37          HD11      LEU  37  -3.699   2.385  -2.965
  291   HD12  LEU  37          HD12      LEU  37  -3.241   0.784  -2.365
  292   HD13  LEU  37          HD13      LEU  37  -4.952   1.260  -2.410
  293   HD21  LEU  37          HD21      LEU  37  -4.570  -1.185  -5.169
  294   HD22  LEU  37          HD22      LEU  37  -5.482  -0.797  -3.698
  295   HD23  LEU  37          HD23      LEU  37  -3.768  -1.244  -3.591
  296    HA   PRO  38           HA       PRO  38  -1.573   4.318  -7.820
  297    HB2  PRO  38           HB2      PRO  38   0.483   2.895  -6.132
  298    HB3  PRO  38           HB3      PRO  38   0.580   4.509  -6.902
  299    HG2  PRO  38           HG2      PRO  38   0.027   4.326  -4.274
  300    HG3  PRO  38           HG3      PRO  38  -0.936   5.445  -5.293
  301    HD2  PRO  38           HD2      PRO  38  -1.650   2.641  -4.383
  302    HD3  PRO  38           HD3      PRO  38  -2.622   4.139  -4.326
  303    H    LYS  39           H        LYS  39  -0.250   3.564  -9.491
  304    HA   LYS  39           HA       LYS  39  -0.383   0.621 -10.102
  305    HB2  LYS  39           HB2      LYS  39  -1.875   2.010 -11.452
  306    HB3  LYS  39           HB3      LYS  39  -0.520   3.027 -11.959
  307    HG2  LYS  39           HG2      LYS  39   0.491   1.154 -13.186
  308    HG3  LYS  39           HG3      LYS  39  -0.694   0.030 -12.508
  309    HD2  LYS  39           HD2      LYS  39  -1.301   0.518 -14.788
  310    HD3  LYS  39           HD3      LYS  39  -2.499   1.215 -13.696
  311    HE2  LYS  39           HE2      LYS  39  -1.287   3.441 -13.934
  312    HE3  LYS  39           HE3      LYS  39  -0.269   2.691 -15.164
  313    HZ1  LYS  39           HZ1      LYS  39  -2.164   3.842 -16.179
  314    HZ2  LYS  39           HZ2      LYS  39  -3.222   2.949 -15.276
  315    HZ3  LYS  39           HZ3      LYS  39  -2.309   2.239 -16.452
  316    H    VAL  40           H        VAL  40   1.783   3.441 -10.171
  317    HA   VAL  40           HA       VAL  40   4.003   1.740 -11.186
  318    HB   VAL  40           HB       VAL  40   3.758   3.790 -12.368
  319   HG11  VAL  40          HG11      VAL  40   4.193   5.243  -9.740
  320   HG12  VAL  40          HG12      VAL  40   4.111   5.998 -11.345
  321   HG13  VAL  40          HG13      VAL  40   2.677   5.220 -10.674
  322   HG21  VAL  40          HG21      VAL  40   6.206   4.104 -10.588
  323   HG22  VAL  40          HG22      VAL  40   6.078   2.954 -11.936
  324   HG23  VAL  40          HG23      VAL  40   5.974   4.692 -12.241
  325    H    GLU  41           H        GLU  41   5.833   1.281 -10.100
  326    HA   GLU  41           HA       GLU  41   5.657   0.694  -7.399
  327    HB2  GLU  41           HB2      GLU  41   7.979   0.056  -7.546
  328    HB3  GLU  41           HB3      GLU  41   7.146  -0.337  -9.048
  329    HG2  GLU  41           HG2      GLU  41   8.114   1.900  -9.967
  330    HG3  GLU  41           HG3      GLU  41   9.160   1.882  -8.549
  331    H    ALA  42           H        ALA  42   7.284   3.601  -8.740
  332    HA   ALA  42           HA       ALA  42   8.334   4.474  -6.242
  333    HB1  ALA  42           HB1      ALA  42   7.783   5.952  -8.846
  334    HB2  ALA  42           HB2      ALA  42   8.756   6.590  -7.500
  335    HB3  ALA  42           HB3      ALA  42   9.285   5.135  -8.366
  336    H    LYS  43           H        LYS  43   5.258   5.338  -7.884
  337    HA   LYS  43           HA       LYS  43   4.375   7.186  -5.808
  338    HB2  LYS  43           HB2      LYS  43   2.756   5.648  -7.878
  339    HB3  LYS  43           HB3      LYS  43   2.101   6.888  -6.815
  340    HG2  LYS  43           HG2      LYS  43   4.341   7.382  -8.784
  341    HG3  LYS  43           HG3      LYS  43   2.642   7.606  -9.171
  342    HD2  LYS  43           HD2      LYS  43   3.905   9.102  -6.838
  343    HD3  LYS  43           HD3      LYS  43   4.086   9.659  -8.498
  344    HE2  LYS  43           HE2      LYS  43   1.591   9.644  -8.753
  345    HE3  LYS  43           HE3      LYS  43   1.439   9.265  -7.031
  346    HZ1  LYS  43           HZ1      LYS  43   1.300  11.700  -7.512
  347    HZ2  LYS  43           HZ2      LYS  43   2.841  11.663  -8.109
  348    HZ3  LYS  43           HZ3      LYS  43   2.552  11.355  -6.533
  349    H    PHE  44           H        PHE  44   3.998   3.666  -6.354
  350    HA   PHE  44           HA       PHE  44   2.151   3.279  -4.247
  351    HB2  PHE  44           HB2      PHE  44   2.595   1.582  -5.951
  352    HB3  PHE  44           HB3      PHE  44   4.248   1.396  -5.401
  353    HD1  PHE  44           HD1      PHE  44   0.683   0.953  -4.331
  354    HD2  PHE  44           HD2      PHE  44   4.800  -0.151  -3.675
  355    HE1  PHE  44           HE1      PHE  44  -0.042  -0.838  -2.763
  356    HE2  PHE  44           HE2      PHE  44   4.070  -1.942  -2.117
  357    HZ   PHE  44           HZ       PHE  44   1.650  -2.296  -1.677
  358    H    ILE  45           H        ILE  45   5.768   3.080  -4.163
  359    HA   ILE  45           HA       ILE  45   6.029   2.723  -1.324
  360    HB   ILE  45           HB       ILE  45   7.878   3.886  -3.428
  361   HG12  ILE  45          HG12      ILE  45   7.894   1.228  -1.908
  362   HG13  ILE  45          HG13      ILE  45   7.201   1.433  -3.511
  363   HG21  ILE  45          HG21      ILE  45   9.711   3.658  -1.753
  364   HG22  ILE  45          HG22      ILE  45   8.544   4.868  -1.256
  365   HG23  ILE  45          HG23      ILE  45   8.518   3.257  -0.503
  366   HD11  ILE  45          HD11      ILE  45   9.360   0.467  -3.782
  367   HD12  ILE  45          HD12      ILE  45   9.442   2.138  -4.374
  368   HD13  ILE  45          HD13      ILE  45  10.134   1.707  -2.786
  369    H    ASN  46           H        ASN  46   5.884   5.799  -3.252
  370    HA   ASN  46           HA       ASN  46   6.018   7.561  -1.043
  371    HB2  ASN  46           HB2      ASN  46   6.037   8.926  -2.814
  372    HB3  ASN  46           HB3      ASN  46   5.309   7.738  -3.867
  373   HD21  ASN  46          HD21      ASN  46   2.904   7.583  -3.880
  374   HD22  ASN  46          HD22      ASN  46   1.983   9.037  -3.563
  375    H    TYR  47           H        TYR  47   3.166   5.790  -2.266
  376    HA   TYR  47           HA       TYR  47   1.374   7.071  -0.412
  377    HB2  TYR  47           HB2      TYR  47   0.674   6.129  -2.593
  378    HB3  TYR  47           HB3      TYR  47   0.956   4.505  -1.961
  379    HD1  TYR  47           HD2      TYR  47  -0.806   7.701  -0.978
  380    HD2  TYR  47           HD1      TYR  47  -0.969   3.394  -1.133
  381    HE1  TYR  47           HE2      TYR  47  -3.037   7.742   0.117
  382    HE2  TYR  47           HE1      TYR  47  -3.223   3.444  -0.061
  383    HH   TYR  47           HH       TYR  47  -4.964   4.826   0.705
  384    H    VAL  48           H        VAL  48   3.210   3.997  -0.327
  385    HA   VAL  48           HA       VAL  48   2.163   3.020   2.144
  386    HB   VAL  48           HB       VAL  48   4.817   2.644   0.710
  387   HG11  VAL  48          HG11      VAL  48   3.971   1.297   3.301
  388   HG12  VAL  48          HG12      VAL  48   5.278   0.727   2.240
  389   HG13  VAL  48          HG13      VAL  48   5.423   2.296   3.022
  390   HG21  VAL  48          HG21      VAL  48   3.975   0.423   0.226
  391   HG22  VAL  48          HG22      VAL  48   2.557   0.675   1.259
  392   HG23  VAL  48          HG23      VAL  48   2.740   1.591  -0.250
  393    H    LYS  49           H        LYS  49   4.947   5.230   1.562
  394    HA   LYS  49           HA       LYS  49   5.494   5.648   4.368
  395    HB2  LYS  49           HB2      LYS  49   6.109   7.281   1.876
  396    HB3  LYS  49           HB3      LYS  49   6.606   7.772   3.502
  397    HG2  LYS  49           HG2      LYS  49   7.833   5.647   3.801
  398    HG3  LYS  49           HG3      LYS  49   7.387   5.133   2.166
  399    HD2  LYS  49           HD2      LYS  49   8.653   6.921   1.170
  400    HD3  LYS  49           HD3      LYS  49   8.882   7.716   2.742
  401    HE2  LYS  49           HE2      LYS  49  10.174   5.692   3.514
  402    HE3  LYS  49           HE3      LYS  49  10.084   5.049   1.872
  403    HZ1  LYS  49           HZ1      LYS  49  12.167   6.315   2.315
  404    HZ2  LYS  49           HZ2      LYS  49  11.275   7.690   2.553
  405    HZ3  LYS  49           HZ3      LYS  49  11.307   6.973   1.092
  406    H    ASN  50           H        ASN  50   3.476   7.556   2.106
  407    HA   ASN  50           HA       ASN  50   2.453   9.430   3.975
  408    HB2  ASN  50           HB2      ASN  50   2.103   9.820   1.681
  409    HB3  ASN  50           HB3      ASN  50   1.498   8.198   1.385
  410   HD21  ASN  50          HD21      ASN  50  -0.683   7.638   2.006
  411   HD22  ASN  50          HD22      ASN  50  -1.841   8.956   2.247
  412    H    CYS  51           H        CYS  51   1.399   6.062   3.421
  413    HA   CYS  51           HA       CYS  51  -0.989   6.431   5.063
  414    HB2  CYS  51           HB2      CYS  51  -0.820   5.184   2.858
  415    HB3  CYS  51           HB3      CYS  51   0.063   3.912   3.718
  416    HG   CYS  51           HG       CYS  51  -2.966   5.151   4.162
  417    H    PHE  52           H        PHE  52   2.116   4.657   5.490
  418    HA   PHE  52           HA       PHE  52   1.441   4.284   8.361
  419    HB2  PHE  52           HB2      PHE  52   0.441   2.391   7.016
  420    HB3  PHE  52           HB3      PHE  52   2.073   1.967   6.506
  421    HD1  PHE  52           HD1      PHE  52   1.140   2.922  10.039
  422    HD2  PHE  52           HD2      PHE  52   1.994  -0.276   7.271
  423    HE1  PHE  52           HE1      PHE  52   1.219   1.315  11.911
  424    HE2  PHE  52           HE2      PHE  52   2.028  -1.889   9.158
  425    HZ   PHE  52           HZ       PHE  52   1.633  -1.096  11.478
  426    H    ARG  53           H        ARG  53   3.951   4.213   5.868
  427    HA   ARG  53           HA       ARG  53   6.221   3.899   5.876
  428    HB2  ARG  53           HB2      ARG  53   5.979   5.103   8.638
  429    HB3  ARG  53           HB3      ARG  53   7.520   4.627   7.919
  430    HG2  ARG  53           HG2      ARG  53   7.093   6.141   5.993
  431    HG3  ARG  53           HG3      ARG  53   5.610   6.693   6.790
  432    HD2  ARG  53           HD2      ARG  53   8.389   6.930   7.995
  433    HD3  ARG  53           HD3      ARG  53   7.610   8.205   7.063
  434    HE   ARG  53           HE       ARG  53   6.917   7.305   9.795
  435   HH11  ARG  53          HH11      ARG  53   6.064   9.592   7.190
  436   HH12  ARG  53          HH12      ARG  53   5.026  10.449   8.333
  437   HH21  ARG  53          HH21      ARG  53   5.349   8.382  10.944
  438   HH22  ARG  53          HH22      ARG  53   4.666   9.845  10.247
  439    H    MET  54           H        MET  54   6.448   1.819   5.540
  440    HA   MET  54           HA       MET  54   6.281  -0.163   7.767
  441    HB2  MET  54           HB2      MET  54   6.516  -0.463   4.742
  442    HB3  MET  54           HB3      MET  54   6.454  -1.813   5.881
  443    HG2  MET  54           HG2      MET  54   4.199  -1.184   6.577
  444    HG3  MET  54           HG3      MET  54   4.257   0.264   5.567
  445    HE1  MET  54           HE1      MET  54   3.897  -3.589   5.726
  446    HE2  MET  54           HE2      MET  54   3.868  -4.084   4.019
  447    HE3  MET  54           HE3      MET  54   5.381  -3.514   4.746
  448    H    THR  55           H        THR  55   8.615   1.157   5.495
  449    HA   THR  55           HA       THR  55  10.856   1.195   5.421
  450    HB   THR  55           HB       THR  55  10.444   0.658   8.364
  451    HG1  THR  55           HG1      THR  55  10.411   2.792   8.466
  452   HG21  THR  55          HG21      THR  55  12.629   1.683   8.728
  453   HG22  THR  55          HG22      THR  55  12.964   1.602   6.975
  454   HG23  THR  55          HG23      THR  55  12.752   0.111   7.937
  455    H    ASP  56           H        ASP  56   9.825  -1.902   6.861
  456    HA   ASP  56           HA       ASP  56  12.318  -3.250   6.099
  457    HB2  ASP  56           HB2      ASP  56   9.687  -4.465   6.963
  458    HB3  ASP  56           HB3      ASP  56  11.256  -5.265   6.911
  459    H    GLN  57           H        GLN  57  12.724  -3.623   3.999
  460    HA   GLN  57           HA       GLN  57  10.807  -3.369   1.998
  461    HB2  GLN  57           HB2      GLN  57  13.236  -3.007   1.728
  462    HB3  GLN  57           HB3      GLN  57  13.494  -4.755   1.772
  463    HG2  GLN  57           HG2      GLN  57  13.480  -3.894  -0.545
  464    HG3  GLN  57           HG3      GLN  57  12.176  -5.038  -0.278
  465   HE21  GLN  57          HE21      GLN  57  10.720  -4.284  -1.885
  466   HE22  GLN  57          HE22      GLN  57  10.061  -2.657  -1.829
  467    H    GLU  58           H        GLU  58  11.701  -6.335   3.699
  468    HA   GLU  58           HA       GLU  58  10.522  -8.212   1.909
  469    HB2  GLU  58           HB2      GLU  58  10.559  -9.749   3.799
  470    HB3  GLU  58           HB3      GLU  58  12.053  -8.847   3.634
  471    HG2  GLU  58           HG2      GLU  58  11.068  -7.240   5.465
  472    HG3  GLU  58           HG3      GLU  58   9.918  -8.542   5.759
  473    H    ALA  59           H        ALA  59   8.964  -6.348   4.587
  474    HA   ALA  59           HA       ALA  59   6.329  -7.573   4.109
  475    HB1  ALA  59           HB1      ALA  59   6.852  -6.661   6.312
  476    HB2  ALA  59           HB2      ALA  59   7.056  -5.036   5.602
  477    HB3  ALA  59           HB3      ALA  59   5.470  -5.855   5.540
  478    H    ILE  60           H        ILE  60   8.112  -4.645   3.009
  479    HA   ILE  60           HA       ILE  60   5.884  -3.463   1.637
  480    HB   ILE  60           HB       ILE  60   8.862  -3.224   1.255
  481   HG12  ILE  60          HG12      ILE  60   6.805  -1.316   2.453
  482   HG13  ILE  60          HG13      ILE  60   7.834  -2.397   3.393
  483   HG21  ILE  60          HG21      ILE  60   6.691  -1.537  -0.084
  484   HG22  ILE  60          HG22      ILE  60   8.439  -1.221  -0.161
  485   HG23  ILE  60          HG23      ILE  60   7.788  -2.654  -0.924
  486   HD11  ILE  60          HD11      ILE  60   8.923  -0.303   3.448
  487   HD12  ILE  60          HD12      ILE  60   9.843  -1.297   2.292
  488   HD13  ILE  60          HD13      ILE  60   8.703  -0.044   1.709
  489    H    GLN  61           H        GLN  61   8.359  -5.801   0.365
  490    HA   GLN  61           HA       GLN  61   7.028  -5.908  -2.200
  491    HB2  GLN  61           HB2      GLN  61   8.463  -7.753  -2.761
  492    HB3  GLN  61           HB3      GLN  61   9.346  -6.412  -2.049
  493    HG2  GLN  61           HG2      GLN  61  10.388  -8.137  -1.003
  494    HG3  GLN  61           HG3      GLN  61   9.161  -7.760   0.178
  495   HE21  GLN  61          HE21      GLN  61   8.123  -9.578   0.991
  496   HE22  GLN  61          HE22      GLN  61   8.086 -11.138   0.195
  497    H    ASP  62           H        ASP  62   6.511  -7.765   0.823
  498    HA   ASP  62           HA       ASP  62   4.606  -9.568  -0.398
  499    HB2  ASP  62           HB2      ASP  62   5.654  -9.936   1.825
  500    HB3  ASP  62           HB3      ASP  62   4.759  -8.560   2.465
  501    H    LEU  63           H        LEU  63   4.344  -6.242   0.853
  502    HA   LEU  63           HA       LEU  63   1.509  -6.081   0.473
  503    HB2  LEU  63           HB2      LEU  63   3.423  -4.539   1.766
  504    HB3  LEU  63           HB3      LEU  63   2.971  -3.515   0.428
  505    HG   LEU  63           HG       LEU  63   1.678  -3.010   2.422
  506   HD11  LEU  63          HD11      LEU  63   0.500  -2.742   0.270
  507   HD12  LEU  63          HD12      LEU  63  -0.602  -3.126   1.599
  508   HD13  LEU  63          HD13      LEU  63  -0.165  -4.380   0.422
  509   HD21  LEU  63          HD21      LEU  63   0.183  -4.541   3.506
  510   HD22  LEU  63          HD22      LEU  63   1.789  -5.294   3.424
  511   HD23  LEU  63          HD23      LEU  63   0.490  -5.812   2.320
  512    H    TRP  64           H        TRP  64   4.302  -5.339  -1.583
  513    HA   TRP  64           HA       TRP  64   2.881  -4.049  -3.704
  514    HB2  TRP  64           HB2      TRP  64   5.348  -3.966  -3.267
  515    HB3  TRP  64           HB3      TRP  64   5.462  -5.633  -3.790
  516    HD1  TRP  64           HD1      TRP  64   7.035  -5.292  -5.702
  517    HE1  TRP  64           HE1      TRP  64   7.068  -4.040  -7.919
  518    HE3  TRP  64           HE3      TRP  64   2.704  -2.544  -5.177
  519    HZ2  TRP  64           HZ2      TRP  64   5.426  -2.147  -9.324
  520    HZ3  TRP  64           HZ3      TRP  64   1.993  -1.019  -6.985
  521    HH2  TRP  64           HH2      TRP  64   3.340  -0.800  -9.056
  522    H    GLN  65           H        GLN  65   3.901  -7.513  -3.326
  523    HA   GLN  65           HA       GLN  65   2.284  -8.316  -5.604
  524    HB2  GLN  65           HB2      GLN  65   3.664  -9.867  -3.406
  525    HB3  GLN  65           HB3      GLN  65   2.560 -10.632  -4.551
  526    HG2  GLN  65           HG2      GLN  65   4.435 -10.933  -5.767
  527    HG3  GLN  65           HG3      GLN  65   4.037  -9.351  -6.382
  528   HE21  GLN  65          HE21      GLN  65   5.642  -7.752  -6.174
  529   HE22  GLN  65          HE22      GLN  65   7.102  -7.989  -5.212
  530    H    TRP  66           H        TRP  66   1.380  -7.740  -2.201
  531    HA   TRP  66           HA       TRP  66  -1.269  -8.852  -2.510
  532    HB2  TRP  66           HB2      TRP  66  -0.462  -8.191  -0.316
  533    HB3  TRP  66           HB3      TRP  66  -0.362  -6.511  -0.813
  534    HD1  TRP  66           HD1      TRP  66  -2.596  -5.112  -0.994
  535    HE1  TRP  66           HE1      TRP  66  -5.016  -5.493  -0.193
  536    HE3  TRP  66           HE3      TRP  66  -2.270 -10.091   0.155
  537    HZ2  TRP  66           HZ2      TRP  66  -6.550  -7.656   0.941
  538    HZ3  TRP  66           HZ3      TRP  66  -4.228 -11.282   1.123
  539    HH2  TRP  66           HH2      TRP  66  -6.364 -10.072   1.515
  540    H    ARG  67           H        ARG  67   0.018  -5.566  -3.309
  541    HA   ARG  67           HA       ARG  67  -2.379  -4.511  -4.436
  542    HB2  ARG  67           HB2      ARG  67  -0.175  -3.335  -3.875
  543    HB3  ARG  67           HB3      ARG  67   0.450  -3.904  -5.409
  544    HG2  ARG  67           HG2      ARG  67  -1.969  -2.079  -5.110
  545    HG3  ARG  67           HG3      ARG  67  -0.314  -1.550  -5.346
  546    HD2  ARG  67           HD2      ARG  67  -0.913  -1.418  -7.503
  547    HD3  ARG  67           HD3      ARG  67  -0.429  -3.103  -7.511
  548    HE   ARG  67           HE       ARG  67  -2.720  -3.778  -7.532
  549   HH11  ARG  67          HH11      ARG  67  -2.506  -0.270  -7.880
  550   HH12  ARG  67          HH12      ARG  67  -4.136  -0.206  -8.476
  551   HH21  ARG  67          HH21      ARG  67  -4.706  -3.550  -8.329
  552   HH22  ARG  67          HH22      ARG  67  -5.425  -1.968  -8.505
  553    H    LYS  68           H        LYS  68   0.201  -6.422  -6.071
  554    HA   LYS  68           HA       LYS  68  -1.129  -6.572  -8.628
  555    HB2  LYS  68           HB2      LYS  68   0.615  -8.742  -7.387
  556    HB3  LYS  68           HB3      LYS  68   0.261  -8.501  -9.088
  557    HG2  LYS  68           HG2      LYS  68   2.042  -6.804  -7.319
  558    HG3  LYS  68           HG3      LYS  68   2.487  -7.800  -8.689
  559    HD2  LYS  68           HD2      LYS  68   1.201  -6.255 -10.181
  560    HD3  LYS  68           HD3      LYS  68   0.896  -5.194  -8.790
  561    HE2  LYS  68           HE2      LYS  68   3.270  -4.809  -8.449
  562    HE3  LYS  68           HE3      LYS  68   3.694  -6.073  -9.609
  563    HZ1  LYS  68           HZ1      LYS  68   3.918  -3.961 -10.673
  564    HZ2  LYS  68           HZ2      LYS  68   2.373  -3.500 -10.290
  565    HZ3  LYS  68           HZ3      LYS  68   2.637  -4.724 -11.347
  566    H    SER  69           H        SER  69  -1.774  -8.294  -5.660
  567    HA   SER  69           HA       SER  69  -3.503 -10.289  -6.967
  568    HB2  SER  69           HB2      SER  69  -2.762 -10.038  -4.041
  569    HB3  SER  69           HB3      SER  69  -3.546 -11.411  -4.843
  570    HG   SER  69           HG       SER  69  -0.907 -10.432  -5.117
  571    H    LEU  70           H        LEU  70  -4.399  -7.514  -7.025
  572    HA   LEU  70           HA       LEU  70  -7.090  -7.853  -5.754
  573    HB2  LEU  70           HB2      LEU  70  -5.488  -5.314  -6.272
  574    HB3  LEU  70           HB3      LEU  70  -7.188  -5.319  -5.832
  575    HG   LEU  70           HG       LEU  70  -4.959  -6.412  -4.069
  576   HD11  LEU  70          HD11      LEU  70  -4.838  -3.968  -4.343
  577   HD12  LEU  70          HD12      LEU  70  -5.370  -4.403  -2.706
  578   HD13  LEU  70          HD13      LEU  70  -6.554  -3.826  -3.897
  579   HD21  LEU  70          HD21      LEU  70  -7.916  -5.933  -3.521
  580   HD22  LEU  70          HD22      LEU  70  -6.701  -6.361  -2.298
  581   HD23  LEU  70          HD23      LEU  70  -7.099  -7.510  -3.581
  Start of MODEL   10
    1    H    GLN   1           H1       GLN   1 -38.332 -10.271   9.857
    2    HA   GLN   1           HA       GLN   1 -37.801 -11.221  12.579
    3    HB2  GLN   1           HB2      GLN   1 -38.291 -12.966  10.749
    4    HB3  GLN   1           HB3      GLN   1 -36.739 -12.501  10.053
    5    HG2  GLN   1           HG2      GLN   1 -36.338 -14.406  11.428
    6    HG3  GLN   1           HG3      GLN   1 -35.673 -13.045  12.315
    7   HE21  GLN   1          HE21      GLN   1 -37.957 -15.668  12.419
    8   HE22  GLN   1          HE22      GLN   1 -38.578 -15.309  14.030
    9    H    GLU   2           H        GLU   2 -36.154 -10.037   9.567
   10    HA   GLU   2           HA       GLU   2 -34.207  -8.649  11.349
   11    HB2  GLU   2           HB2      GLU   2 -32.336  -9.350  10.051
   12    HB3  GLU   2           HB3      GLU   2 -33.184 -10.779  10.617
   13    HG2  GLU   2           HG2      GLU   2 -34.084 -11.252   8.441
   14    HG3  GLU   2           HG3      GLU   2 -33.668  -9.652   7.821
   15    H    SER   3           H        SER   3 -36.497  -8.061   9.111
   16    HA   SER   3           HA       SER   3 -35.059  -6.473   7.188
   17    HB2  SER   3           HB2      SER   3 -38.035  -6.521   7.739
   18    HB3  SER   3           HB3      SER   3 -37.234  -5.923   6.273
   19    HG   SER   3           HG       SER   3 -36.398  -8.063   5.962
   20    H    PHE   4           H        PHE   4 -35.785  -5.632  10.369
   21    HA   PHE   4           HA       PHE   4 -36.621  -2.982  10.257
   22    HB2  PHE   4           HB2      PHE   4 -35.760  -2.695  12.414
   23    HB3  PHE   4           HB3      PHE   4 -36.229  -4.364  12.320
   24    HD1  PHE   4           HD1      PHE   4 -34.299  -6.121  11.791
   25    HD2  PHE   4           HD2      PHE   4 -33.671  -2.147  13.334
   26    HE1  PHE   4           HE1      PHE   4 -32.113  -6.826  12.711
   27    HE2  PHE   4           HE2      PHE   4 -31.503  -2.865  14.290
   28    HZ   PHE   4           HZ       PHE   4 -30.717  -5.206  13.984
   29    H    LYS   5           H        LYS   5 -33.422  -4.211   9.465
   30    HA   LYS   5           HA       LYS   5 -32.650  -1.549   8.463
   31    HB2  LYS   5           HB2      LYS   5 -30.718  -1.310   9.671
   32    HB3  LYS   5           HB3      LYS   5 -31.898  -1.874  10.869
   33    HG2  LYS   5           HG2      LYS   5 -30.933  -4.127  10.824
   34    HG3  LYS   5           HG3      LYS   5 -29.815  -3.656   9.528
   35    HD2  LYS   5           HD2      LYS   5 -28.788  -1.951  10.994
   36    HD3  LYS   5           HD3      LYS   5 -29.908  -2.360  12.290
   37    HE2  LYS   5           HE2      LYS   5 -27.731  -3.343  12.699
   38    HE3  LYS   5           HE3      LYS   5 -28.938  -4.617  12.460
   39    HZ1  LYS   5           HZ1      LYS   5 -27.131  -3.668  10.297
   40    HZ2  LYS   5           HZ2      LYS   5 -28.109  -4.989  10.271
   41    HZ3  LYS   5           HZ3      LYS   5 -26.812  -4.978  11.266
   42    H    LYS   6           H        LYS   6 -30.972  -1.526   7.000
   43    HA   LYS   6           HA       LYS   6 -30.535  -4.030   5.407
   44    HB2  LYS   6           HB2      LYS   6 -31.767  -1.438   4.368
   45    HB3  LYS   6           HB3      LYS   6 -31.436  -2.895   3.429
   46    HG2  LYS   6           HG2      LYS   6 -33.081  -4.155   4.823
   47    HG3  LYS   6           HG3      LYS   6 -33.454  -2.661   5.702
   48    HD2  LYS   6           HD2      LYS   6 -34.162  -1.604   3.541
   49    HD3  LYS   6           HD3      LYS   6 -33.876  -3.151   2.735
   50    HE2  LYS   6           HE2      LYS   6 -36.218  -3.017   3.199
   51    HE3  LYS   6           HE3      LYS   6 -35.531  -4.239   4.270
   52    HZ1  LYS   6           HZ1      LYS   6 -35.610  -2.615   6.082
   53    HZ2  LYS   6           HZ2      LYS   6 -37.087  -2.724   5.394
   54    HZ3  LYS   6           HZ3      LYS   6 -36.125  -1.433   5.060
   55    H    GLN   7           H        GLN   7 -29.444  -0.754   6.144
   56    HA   GLN   7           HA       GLN   7 -27.201  -1.083   4.187
   57    HB2  GLN   7           HB2      GLN   7 -27.414   1.172   3.623
   58    HB3  GLN   7           HB3      GLN   7 -29.060   0.569   3.775
   59    HG2  GLN   7           HG2      GLN   7 -28.962   1.537   6.213
   60    HG3  GLN   7           HG3      GLN   7 -27.516   2.371   5.671
   61   HE21  GLN   7          HE21      GLN   7 -28.880   4.248   6.330
   62   HE22  GLN   7          HE22      GLN   7 -29.965   4.928   5.093
   63    H    GLU   8           H        GLU   8 -27.601  -0.975   7.526
   64    HA   GLU   8           HA       GLU   8 -24.868   0.089   7.836
   65    HB2  GLU   8           HB2      GLU   8 -25.376   1.204   9.894
   66    HB3  GLU   8           HB3      GLU   8 -26.348   1.850   8.578
   67    HG2  GLU   8           HG2      GLU   8 -28.327   0.615   9.410
   68    HG3  GLU   8           HG3      GLU   8 -27.343  -0.125  10.678
   69    H    LYS   9           H        LYS   9 -23.505  -1.012   9.099
   70    HA   LYS   9           HA       LYS   9 -24.474  -3.528  10.417
   71    HB2  LYS   9           HB2      LYS   9 -22.249  -4.415  10.131
   72    HB3  LYS   9           HB3      LYS   9 -22.937  -3.927   8.583
   73    HG2  LYS   9           HG2      LYS   9 -21.557  -1.849   8.614
   74    HG3  LYS   9           HG3      LYS   9 -20.937  -2.292  10.208
   75    HD2  LYS   9           HD2      LYS   9 -19.261  -2.839   8.600
   76    HD3  LYS   9           HD3      LYS   9 -19.928  -4.350   9.230
   77    HE2  LYS   9           HE2      LYS   9 -21.420  -4.455   7.178
   78    HE3  LYS   9           HE3      LYS   9 -20.594  -3.012   6.567
   79    HZ1  LYS   9           HZ1      LYS   9 -19.366  -5.645   7.136
   80    HZ2  LYS   9           HZ2      LYS   9 -18.499  -4.313   6.747
   81    HZ3  LYS   9           HZ3      LYS   9 -19.543  -4.956   5.650
   82    H    THR  10           H        THR  10 -23.035  -0.460  11.031
   83    HA   THR  10           HA       THR  10 -22.176   0.538  12.894
   84    HB   THR  10           HB       THR  10 -23.626   0.315  14.933
   85    HG1  THR  10           HG1      THR  10 -24.313  -1.851  14.360
   86   HG21  THR  10          HG21      THR  10 -24.034   1.983  13.147
   87   HG22  THR  10          HG22      THR  10 -25.535   1.384  13.869
   88   HG23  THR  10          HG23      THR  10 -25.030   0.798  12.271
   89    HA   PRO  11           HA       PRO  11 -19.615  -3.111  14.070
   90    HB2  PRO  11           HB2      PRO  11 -17.537  -0.932  13.829
   91    HB3  PRO  11           HB3      PRO  11 -17.398  -2.661  13.348
   92    HG2  PRO  11           HG2      PRO  11 -17.841  -0.807  11.456
   93    HG3  PRO  11           HG3      PRO  11 -18.870  -2.282  11.460
   94    HD2  PRO  11           HD2      PRO  11 -19.484   0.448  12.651
   95    HD3  PRO  11           HD3      PRO  11 -20.490  -0.534  11.559
   96    H    LYS  12           H        LYS  12 -19.681   0.109  15.528
   97    HA   LYS  12           HA       LYS  12 -18.745   1.040  17.391
   98    HB2  LYS  12           HB2      LYS  12 -19.896  -1.457  18.682
   99    HB3  LYS  12           HB3      LYS  12 -19.546   0.070  19.501
  100    HG2  LYS  12           HG2      LYS  12 -21.572  -0.253  17.253
  101    HG3  LYS  12           HG3      LYS  12 -21.963  -0.262  18.964
  102    HD2  LYS  12           HD2      LYS  12 -21.482   2.022  19.256
  103    HD3  LYS  12           HD3      LYS  12 -20.495   2.126  17.789
  104    HE2  LYS  12           HE2      LYS  12 -22.427   1.742  16.370
  105    HE3  LYS  12           HE3      LYS  12 -23.487   1.621  17.793
  106    HZ1  LYS  12           HZ1      LYS  12 -21.921   4.029  17.032
  107    HZ2  LYS  12           HZ2      LYS  12 -22.917   3.909  18.339
  108    HZ3  LYS  12           HZ3      LYS  12 -23.539   3.824  16.804
  109    H    THR  13           H        THR  13 -16.884  -0.066  15.929
  110    HA   THR  13           HA       THR  13 -14.648  -0.921  17.658
  111    HB   THR  13           HB       THR  13 -15.812  -2.617  15.391
  112    HG1  THR  13           HG1      THR  13 -16.946  -3.057  17.135
  113   HG21  THR  13          HG21      THR  13 -13.446  -2.895  15.275
  114   HG22  THR  13          HG22      THR  13 -14.104  -4.311  16.087
  115   HG23  THR  13          HG23      THR  13 -13.308  -3.059  17.056
  116    HA   PRO  14           HA       PRO  14 -13.041   1.525  14.229
  117    HB2  PRO  14           HB2      PRO  14 -10.379   1.632  14.760
  118    HB3  PRO  14           HB3      PRO  14 -11.613   2.414  15.795
  119    HG2  PRO  14           HG2      PRO  14 -10.260  -0.259  16.215
  120    HG3  PRO  14           HG3      PRO  14 -10.507   1.055  17.401
  121    HD2  PRO  14           HD2      PRO  14 -12.180  -1.117  17.221
  122    HD3  PRO  14           HD3      PRO  14 -12.756   0.502  17.702
  123    H    LYS  15           H        LYS  15 -12.133  -1.780  14.570
  124    HA   LYS  15           HA       LYS  15 -11.123  -3.333  13.326
  125    HB2  LYS  15           HB2      LYS  15 -12.026  -3.832  11.200
  126    HB3  LYS  15           HB3      LYS  15 -13.277  -3.409  12.336
  127    HG2  LYS  15           HG2      LYS  15 -12.283  -1.266  10.440
  128    HG3  LYS  15           HG3      LYS  15 -13.255  -2.593   9.807
  129    HD2  LYS  15           HD2      LYS  15 -15.040  -2.093  11.498
  130    HD3  LYS  15           HD3      LYS  15 -14.102  -0.712  12.044
  131    HE2  LYS  15           HE2      LYS  15 -15.768   0.109  10.529
  132    HE3  LYS  15           HE3      LYS  15 -14.206   0.251   9.715
  133    HZ1  LYS  15           HZ1      LYS  15 -14.750  -1.634   8.356
  134    HZ2  LYS  15           HZ2      LYS  15 -16.116  -0.722   8.377
  135    HZ3  LYS  15           HZ3      LYS  15 -16.021  -2.067   9.287
  136    H    GLY  16           H        GLY  16  -9.412  -1.462  13.838
  137    HA2  GLY  16           HA2      GLY  16  -7.590  -1.128  11.443
  138    HA3  GLY  16           HA3      GLY  16  -7.947   0.158  12.592
  139    HA   PRO  17           HA       PRO  17  -5.424  -3.339  15.011
  140    HB2  PRO  17           HB2      PRO  17  -3.894  -4.270  12.580
  141    HB3  PRO  17           HB3      PRO  17  -4.370  -5.191  14.044
  142    HG2  PRO  17           HG2      PRO  17  -5.766  -5.499  11.758
  143    HG3  PRO  17           HG3      PRO  17  -6.628  -5.350  13.324
  144    HD2  PRO  17           HD2      PRO  17  -6.174  -3.233  11.228
  145    HD3  PRO  17           HD3      PRO  17  -7.642  -3.617  12.159
  146    H    SER  18           H        SER  18  -2.702  -3.692  15.009
  147    HA   SER  18           HA       SER  18  -1.640  -0.902  14.772
  148    HB2  SER  18           HB2      SER  18  -0.136  -1.509  16.608
  149    HB3  SER  18           HB3      SER  18  -1.854  -1.620  17.026
  150    HG   SER  18           HG       SER  18  -1.091  -3.420  17.817
  151    H    SER  19           H        SER  19  -1.002  -4.216  13.766
  152    HA   SER  19           HA       SER  19   1.606  -3.432  12.584
  153    HB2  SER  19           HB2      SER  19   1.152  -5.605  13.826
  154    HB3  SER  19           HB3      SER  19   0.272  -6.133  12.376
  155    HG   SER  19           HG       SER  19   2.997  -5.360  12.679
  156    H    VAL  20           H        VAL  20   1.530  -5.207  10.325
  157    HA   VAL  20           HA       VAL  20   0.629  -3.386   8.291
  158    HB   VAL  20           HB       VAL  20   1.297  -6.308   7.808
  159   HG11  VAL  20          HG11      VAL  20   0.472  -5.097   5.835
  160   HG12  VAL  20          HG12      VAL  20   1.669  -3.809   6.099
  161   HG13  VAL  20          HG13      VAL  20   2.184  -5.454   5.669
  162   HG21  VAL  20          HG21      VAL  20   3.655  -5.590   7.499
  163   HG22  VAL  20          HG22      VAL  20   3.240  -3.986   8.126
  164   HG23  VAL  20          HG23      VAL  20   3.143  -5.428   9.170
  165    H    GLU  21           H        GLU  21  -1.004  -6.040   9.899
  166    HA   GLU  21           HA       GLU  21  -3.133  -6.572   8.137
  167    HB2  GLU  21           HB2      GLU  21  -3.432  -6.206  11.137
  168    HB3  GLU  21           HB3      GLU  21  -4.436  -7.188  10.078
  169    HG2  GLU  21           HG2      GLU  21  -1.567  -7.705  10.920
  170    HG3  GLU  21           HG3      GLU  21  -2.994  -8.586  11.431
  171    H    ASP  22           H        ASP  22  -2.626  -3.644  10.073
  172    HA   ASP  22           HA       ASP  22  -5.254  -2.441   9.558
  173    HB2  ASP  22           HB2      ASP  22  -3.919  -1.929  11.526
  174    HB3  ASP  22           HB3      ASP  22  -2.596  -1.342  10.538
  175    H    ILE  23           H        ILE  23  -1.978  -2.176   8.121
  176    HA   ILE  23           HA       ILE  23  -2.702  -0.166   6.177
  177    HB   ILE  23           HB       ILE  23  -0.465  -2.238   6.140
  178   HG12  ILE  23          HG12      ILE  23  -0.488   0.697   6.989
  179   HG13  ILE  23          HG13      ILE  23  -0.399  -0.679   8.086
  180   HG21  ILE  23          HG21      ILE  23  -0.945  -1.380   3.864
  181   HG22  ILE  23          HG22      ILE  23  -0.823   0.286   4.465
  182   HG23  ILE  23          HG23      ILE  23   0.602  -0.782   4.446
  183   HD11  ILE  23          HD11      ILE  23   1.794  -1.328   7.046
  184   HD12  ILE  23          HD12      ILE  23   1.757   0.217   6.153
  185   HD13  ILE  23          HD13      ILE  23   1.787   0.216   7.919
  186    H    LYS  24           H        LYS  24  -2.826  -3.744   6.148
  187    HA   LYS  24           HA       LYS  24  -3.945  -4.007   3.487
  188    HB2  LYS  24           HB2      LYS  24  -4.303  -5.757   5.956
  189    HB3  LYS  24           HB3      LYS  24  -4.821  -6.188   4.334
  190    HG2  LYS  24           HG2      LYS  24  -1.917  -5.694   5.094
  191    HG3  LYS  24           HG3      LYS  24  -2.740  -7.254   5.103
  192    HD2  LYS  24           HD2      LYS  24  -3.236  -6.961   2.644
  193    HD3  LYS  24           HD3      LYS  24  -2.284  -5.465   2.679
  194    HE2  LYS  24           HE2      LYS  24  -0.921  -7.300   1.827
  195    HE3  LYS  24           HE3      LYS  24  -0.277  -6.738   3.375
  196    HZ1  LYS  24           HZ1      LYS  24  -1.307  -8.649   4.438
  197    HZ2  LYS  24           HZ2      LYS  24  -0.331  -9.138   3.227
  198    HZ3  LYS  24           HZ3      LYS  24  -1.973  -9.150   3.027
  199    H    ALA  25           H        ALA  25  -5.634  -3.854   6.691
  200    HA   ALA  25           HA       ALA  25  -8.242  -3.949   5.615
  201    HB1  ALA  25           HB1      ALA  25  -7.261  -2.607   8.173
  202    HB2  ALA  25           HB2      ALA  25  -8.931  -3.098   7.818
  203    HB3  ALA  25           HB3      ALA  25  -7.669  -4.329   7.986
  204    H    LYS  26           H        LYS  26  -6.186  -1.111   6.237
  205    HA   LYS  26           HA       LYS  26  -8.106   0.879   5.399
  206    HB2  LYS  26           HB2      LYS  26  -5.122   0.880   5.904
  207    HB3  LYS  26           HB3      LYS  26  -6.039   2.335   5.458
  208    HG2  LYS  26           HG2      LYS  26  -7.438   2.107   7.472
  209    HG3  LYS  26           HG3      LYS  26  -6.665   0.580   7.874
  210    HD2  LYS  26           HD2      LYS  26  -5.697   2.285   9.234
  211    HD3  LYS  26           HD3      LYS  26  -4.472   1.726   8.090
  212    HE2  LYS  26           HE2      LYS  26  -4.885   3.736   6.680
  213    HE3  LYS  26           HE3      LYS  26  -6.225   4.207   7.740
  214    HZ1  LYS  26           HZ1      LYS  26  -3.349   4.300   8.325
  215    HZ2  LYS  26           HZ2      LYS  26  -4.446   4.228   9.556
  216    HZ3  LYS  26           HZ3      LYS  26  -4.516   5.475   8.492
  217    H    MET  27           H        MET  27  -5.530  -0.883   3.627
  218    HA   MET  27           HA       MET  27  -5.950   0.470   1.106
  219    HB2  MET  27           HB2      MET  27  -4.896  -2.274   1.821
  220    HB3  MET  27           HB3      MET  27  -5.133  -1.771   0.148
  221    HG2  MET  27           HG2      MET  27  -3.491  -0.141   2.111
  222    HG3  MET  27           HG3      MET  27  -2.810  -1.434   1.128
  223    HE1  MET  27           HE1      MET  27  -0.997   0.357   0.341
  224    HE2  MET  27           HE2      MET  27  -1.415   1.902  -0.437
  225    HE3  MET  27           HE3      MET  27  -1.821   1.631   1.272
  226    H    GLN  28           H        GLN  28  -7.452  -2.565   2.403
  227    HA   GLN  28           HA       GLN  28  -9.346  -2.916   0.331
  228    HB2  GLN  28           HB2      GLN  28  -9.143  -3.705   3.219
  229    HB3  GLN  28           HB3      GLN  28 -10.739  -3.762   2.512
  230    HG2  GLN  28           HG2      GLN  28  -9.477  -5.934   2.379
  231    HG3  GLN  28           HG3      GLN  28 -10.198  -5.341   0.889
  232   HE21  GLN  28          HE21      GLN  28  -7.090  -5.506   2.647
  233   HE22  GLN  28          HE22      GLN  28  -6.102  -5.415   1.179
  234    H    ALA  29           H        ALA  29  -9.737  -0.952   3.322
  235    HA   ALA  29           HA       ALA  29 -12.340  -0.052   2.771
  236    HB1  ALA  29           HB1      ALA  29 -11.827   1.761   4.357
  237    HB2  ALA  29           HB2      ALA  29 -11.239   0.199   4.948
  238    HB3  ALA  29           HB3      ALA  29 -10.097   1.375   4.261
  239    H    SER  30           H        SER  30  -9.188   1.446   1.874
  240    HA   SER  30           HA       SER  30 -10.247   3.720   0.508
  241    HB2  SER  30           HB2      SER  30  -7.617   2.261   0.048
  242    HB3  SER  30           HB3      SER  30  -8.020   3.901  -0.500
  243    HG   SER  30           HG       SER  30  -7.680   2.921   2.135
  244    H    ILE  31           H        ILE  31  -9.679   0.403  -0.610
  245    HA   ILE  31           HA       ILE  31 -10.195   0.867  -3.409
  246    HB   ILE  31           HB       ILE  31 -10.237  -1.622  -1.697
  247   HG12  ILE  31          HG12      ILE  31  -8.320  -0.750  -3.892
  248   HG13  ILE  31          HG13      ILE  31  -8.084  -0.342  -2.201
  249   HG21  ILE  31          HG21      ILE  31 -11.787  -2.015  -3.571
  250   HG22  ILE  31          HG22      ILE  31 -10.564  -1.417  -4.723
  251   HG23  ILE  31          HG23      ILE  31 -10.309  -2.921  -3.815
  252   HD11  ILE  31          HD11      ILE  31  -8.047  -2.758  -1.606
  253   HD12  ILE  31          HD12      ILE  31  -8.130  -3.164  -3.337
  254   HD13  ILE  31          HD13      ILE  31  -6.736  -2.275  -2.701
  255    H    GLU  32           H        GLU  32 -12.396  -0.329  -0.768
  256    HA   GLU  32           HA       GLU  32 -14.670  -0.234  -2.565
  257    HB2  GLU  32           HB2      GLU  32 -16.059  -0.530  -0.608
  258    HB3  GLU  32           HB3      GLU  32 -14.761  -1.724  -0.718
  259    HG2  GLU  32           HG2      GLU  32 -13.464  -0.538   0.960
  260    HG3  GLU  32           HG3      GLU  32 -14.701   0.727   1.087
  261    H    LYS  33           H        LYS  33 -13.235   2.228  -0.473
  262    HA   LYS  33           HA       LYS  33 -15.253   4.256  -0.981
  263    HB2  LYS  33           HB2      LYS  33 -12.374   4.389  -0.053
  264    HB3  LYS  33           HB3      LYS  33 -13.385   5.804  -0.240
  265    HG2  LYS  33           HG2      LYS  33 -13.988   3.518   1.673
  266    HG3  LYS  33           HG3      LYS  33 -13.232   5.057   2.083
  267    HD2  LYS  33           HD2      LYS  33 -15.384   6.182   1.196
  268    HD3  LYS  33           HD3      LYS  33 -16.085   4.546   1.186
  269    HE2  LYS  33           HE2      LYS  33 -15.373   4.338   3.623
  270    HE3  LYS  33           HE3      LYS  33 -14.897   6.040   3.572
  271    HZ1  LYS  33           HZ1      LYS  33 -17.264   6.546   2.999
  272    HZ2  LYS  33           HZ2      LYS  33 -17.073   5.855   4.472
  273    HZ3  LYS  33           HZ3      LYS  33 -17.634   4.962   3.194
  274    H    GLY  34           H        GLY  34 -12.926   2.924  -3.112
  275    HA2  GLY  34           HA2      GLY  34 -13.904   3.842  -5.368
  276    HA3  GLY  34           HA3      GLY  34 -13.001   5.287  -4.934
  277    H    GLY  35           H        GLY  35 -10.848   3.276  -3.789
  278    HA2  GLY  35           HA2      GLY  35  -8.965   2.180  -4.517
  279    HA3  GLY  35           HA3      GLY  35  -9.782   1.844  -6.045
  280    H    SER  36           H        SER  36  -9.360   5.187  -5.095
  281    HA   SER  36           HA       SER  36  -7.766   5.767  -7.460
  282    HB2  SER  36           HB2      SER  36  -8.718   7.587  -5.225
  283    HB3  SER  36           HB3      SER  36  -8.087   8.094  -6.807
  284    HG   SER  36           HG       SER  36 -10.458   7.938  -6.497
  285    H    LEU  37           H        LEU  37  -6.046   4.367  -6.756
  286    HA   LEU  37           HA       LEU  37  -4.056   5.515  -4.849
  287    HB2  LEU  37           HB2      LEU  37  -4.997   2.667  -5.371
  288    HB3  LEU  37           HB3      LEU  37  -3.589   3.021  -4.391
  289    HG   LEU  37           HG       LEU  37  -6.386   4.037  -3.717
  290   HD11  LEU  37          HD11      LEU  37  -6.345   1.577  -3.717
  291   HD12  LEU  37          HD12      LEU  37  -6.456   2.214  -2.067
  292   HD13  LEU  37          HD13      LEU  37  -4.909   1.590  -2.673
  293   HD21  LEU  37          HD21      LEU  37  -5.437   4.366  -1.473
  294   HD22  LEU  37          HD22      LEU  37  -4.519   5.299  -2.656
  295   HD23  LEU  37          HD23      LEU  37  -3.855   3.776  -2.026
  296    HA   PRO  38           HA       PRO  38  -0.990   5.373  -7.887
  297    HB2  PRO  38           HB2      PRO  38   0.870   3.702  -6.247
  298    HB3  PRO  38           HB3      PRO  38   1.130   5.324  -6.950
  299    HG2  PRO  38           HG2      PRO  38   0.636   4.996  -4.286
  300    HG3  PRO  38           HG3      PRO  38  -0.073   6.365  -5.188
  301    HD2  PRO  38           HD2      PRO  38  -1.357   3.737  -4.420
  302    HD3  PRO  38           HD3      PRO  38  -2.015   5.394  -4.303
  303    H    LYS  39           H        LYS  39  -0.087   4.315  -9.624
  304    HA   LYS  39           HA       LYS  39  -0.443   1.362  -9.861
  305    HB2  LYS  39           HB2      LYS  39  -1.550   1.658 -12.001
  306    HB3  LYS  39           HB3      LYS  39  -2.430   2.340 -10.655
  307    HG2  LYS  39           HG2      LYS  39  -2.744   3.871 -12.339
  308    HG3  LYS  39           HG3      LYS  39  -1.531   4.643 -11.351
  309    HD2  LYS  39           HD2      LYS  39   0.223   4.070 -12.939
  310    HD3  LYS  39           HD3      LYS  39  -0.872   3.039 -13.876
  311    HE2  LYS  39           HE2      LYS  39  -1.316   6.023 -13.442
  312    HE3  LYS  39           HE3      LYS  39  -0.385   5.380 -14.797
  313    HZ1  LYS  39           HZ1      LYS  39  -3.223   4.662 -14.289
  314    HZ2  LYS  39           HZ2      LYS  39  -2.326   4.199 -15.560
  315    HZ3  LYS  39           HZ3      LYS  39  -2.718   5.776 -15.403
  316    H    VAL  40           H        VAL  40   1.935   3.240  -9.647
  317    HA   VAL  40           HA       VAL  40   3.592   1.600 -11.432
  318    HB   VAL  40           HB       VAL  40   3.097   3.845 -12.550
  319   HG11  VAL  40          HG11      VAL  40   3.344   5.291 -10.550
  320   HG12  VAL  40          HG12      VAL  40   5.093   4.935 -10.532
  321   HG13  VAL  40          HG13      VAL  40   4.367   5.788 -11.903
  322   HG21  VAL  40          HG21      VAL  40   5.973   3.052 -12.068
  323   HG22  VAL  40          HG22      VAL  40   4.883   2.451 -13.340
  324   HG23  VAL  40          HG23      VAL  40   5.408   4.138 -13.350
  325    H    GLU  41           H        GLU  41   5.609   1.066 -10.487
  326    HA   GLU  41           HA       GLU  41   5.266   0.745  -7.741
  327    HB2  GLU  41           HB2      GLU  41   7.276  -0.483  -7.628
  328    HB3  GLU  41           HB3      GLU  41   6.486  -0.838  -9.157
  329    HG2  GLU  41           HG2      GLU  41   8.077   0.682 -10.310
  330    HG3  GLU  41           HG3      GLU  41   8.886   1.010  -8.773
  331    H    ALA  42           H        ALA  42   7.552   3.128  -9.211
  332    HA   ALA  42           HA       ALA  42   8.756   3.868  -6.763
  333    HB1  ALA  42           HB1      ALA  42   9.423   5.930  -7.960
  334    HB2  ALA  42           HB2      ALA  42   9.647   4.487  -8.965
  335    HB3  ALA  42           HB3      ALA  42   8.259   5.562  -9.251
  336    H    LYS  43           H        LYS  43   5.860   5.301  -8.321
  337    HA   LYS  43           HA       LYS  43   5.244   7.248  -6.281
  338    HB2  LYS  43           HB2      LYS  43   3.397   5.733  -8.186
  339    HB3  LYS  43           HB3      LYS  43   2.883   7.074  -7.176
  340    HG2  LYS  43           HG2      LYS  43   4.995   7.275  -9.349
  341    HG3  LYS  43           HG3      LYS  43   3.286   7.633  -9.573
  342    HD2  LYS  43           HD2      LYS  43   5.168   9.120  -7.697
  343    HD3  LYS  43           HD3      LYS  43   4.672   9.666  -9.290
  344    HE2  LYS  43           HE2      LYS  43   2.788   9.277  -6.914
  345    HE3  LYS  43           HE3      LYS  43   3.485  10.803  -7.441
  346    HZ1  LYS  43           HZ1      LYS  43   1.498   9.182  -8.929
  347    HZ2  LYS  43           HZ2      LYS  43   2.336  10.416  -9.627
  348    HZ3  LYS  43           HZ3      LYS  43   1.346  10.701  -8.360
  349    H    PHE  44           H        PHE  44   4.301   3.810  -6.674
  350    HA   PHE  44           HA       PHE  44   2.500   3.780  -4.473
  351    HB2  PHE  44           HB2      PHE  44   2.531   2.071  -6.268
  352    HB3  PHE  44           HB3      PHE  44   4.081   1.486  -5.690
  353    HD1  PHE  44           HD2      PHE  44   0.537   2.060  -4.540
  354    HD2  PHE  44           HD1      PHE  44   4.145  -0.260  -4.085
  355    HE1  PHE  44           HE2      PHE  44  -0.626   0.568  -2.934
  356    HE2  PHE  44           HE1      PHE  44   2.972  -1.768  -2.504
  357    HZ   PHE  44           HZ       PHE  44   0.584  -1.353  -1.922
  358    H    ILE  45           H        ILE  45   5.954   2.768  -4.584
  359    HA   ILE  45           HA       ILE  45   6.221   2.098  -1.825
  360    HB   ILE  45           HB       ILE  45   8.205   3.085  -3.908
  361   HG12  ILE  45          HG12      ILE  45   7.819   0.300  -2.722
  362   HG13  ILE  45          HG13      ILE  45   7.004   0.825  -4.185
  363   HG21  ILE  45          HG21      ILE  45   8.791   2.021  -1.107
  364   HG22  ILE  45          HG22      ILE  45  10.007   2.230  -2.383
  365   HG23  ILE  45          HG23      ILE  45   9.186   3.638  -1.746
  366   HD11  ILE  45          HD11      ILE  45  10.010   0.536  -3.840
  367   HD12  ILE  45          HD12      ILE  45   8.924  -0.445  -4.832
  368   HD13  ILE  45          HD13      ILE  45   9.217   1.249  -5.268
  369    H    ASN  46           H        ASN  46   6.855   5.220  -3.475
  370    HA   ASN  46           HA       ASN  46   7.452   6.830  -1.236
  371    HB2  ASN  46           HB2      ASN  46   7.827   7.885  -3.242
  372    HB3  ASN  46           HB3      ASN  46   6.442   7.161  -4.030
  373   HD21  ASN  46          HD21      ASN  46   4.330   8.044  -3.785
  374   HD22  ASN  46          HD22      ASN  46   4.199   9.765  -3.402
  375    H    TYR  47           H        TYR  47   4.202   5.953  -2.496
  376    HA   TYR  47           HA       TYR  47   2.884   7.697  -0.609
  377    HB2  TYR  47           HB2      TYR  47   2.083   7.044  -2.936
  378    HB3  TYR  47           HB3      TYR  47   1.581   5.508  -2.231
  379    HD1  TYR  47           HD1      TYR  47   1.244   9.237  -1.876
  380    HD2  TYR  47           HD2      TYR  47  -0.590   5.392  -1.174
  381    HE1  TYR  47           HE1      TYR  47  -0.843  10.362  -1.132
  382    HE2  TYR  47           HE2      TYR  47  -2.674   6.528  -0.438
  383    HH   TYR  47           HH       TYR  47  -3.757   8.521  -0.174
  384    H    VAL  48           H        VAL  48   3.573   4.162  -0.605
  385    HA   VAL  48           HA       VAL  48   2.074   3.647   1.826
  386    HB   VAL  48           HB       VAL  48   4.447   2.160   0.639
  387   HG11  VAL  48          HG11      VAL  48   4.364   1.657   3.053
  388   HG12  VAL  48          HG12      VAL  48   2.613   1.414   2.973
  389   HG13  VAL  48          HG13      VAL  48   3.717   0.284   2.155
  390   HG21  VAL  48          HG21      VAL  48   1.457   1.524   0.691
  391   HG22  VAL  48          HG22      VAL  48   2.358   2.088  -0.730
  392   HG23  VAL  48          HG23      VAL  48   2.733   0.515  -0.028
  393    H    LYS  49           H        LYS  49   5.508   4.589   1.260
  394    HA   LYS  49           HA       LYS  49   6.218   4.666   4.052
  395    HB2  LYS  49           HB2      LYS  49   7.341   6.047   1.585
  396    HB3  LYS  49           HB3      LYS  49   8.075   6.186   3.194
  397    HG2  LYS  49           HG2      LYS  49   8.604   3.881   3.318
  398    HG3  LYS  49           HG3      LYS  49   7.519   3.448   1.999
  399    HD2  LYS  49           HD2      LYS  49   9.812   3.313   1.244
  400    HD3  LYS  49           HD3      LYS  49   8.929   4.575   0.372
  401    HE2  LYS  49           HE2      LYS  49   9.960   6.303   1.827
  402    HE3  LYS  49           HE3      LYS  49  10.893   5.046   2.658
  403    HZ1  LYS  49           HZ1      LYS  49  12.142   6.118   0.853
  404    HZ2  LYS  49           HZ2      LYS  49  11.033   5.641  -0.245
  405    HZ3  LYS  49           HZ3      LYS  49  11.961   4.517   0.547
  406    H    ASN  50           H        ASN  50   4.600   7.076   2.025
  407    HA   ASN  50           HA       ASN  50   4.420   9.064   4.145
  408    HB2  ASN  50           HB2      ASN  50   4.097   9.893   1.960
  409    HB3  ASN  50           HB3      ASN  50   3.010   8.591   1.507
  410   HD21  ASN  50          HD21      ASN  50   0.833   8.874   1.776
  411   HD22  ASN  50          HD22      ASN  50   0.135  10.241   2.635
  412    H    CYS  51           H        CYS  51   2.215   6.383   3.119
  413    HA   CYS  51           HA       CYS  51   0.099   7.098   4.891
  414    HB2  CYS  51           HB2      CYS  51   0.817   4.491   3.493
  415    HB3  CYS  51           HB3      CYS  51  -0.637   4.695   4.480
  416    HG   CYS  51           HG       CYS  51   0.303   6.338   1.771
  417    H    PHE  52           H        PHE  52   2.957   5.003   5.534
  418    HA   PHE  52           HA       PHE  52   2.350   5.406   8.344
  419    HB2  PHE  52           HB2      PHE  52   1.066   3.281   7.658
  420    HB3  PHE  52           HB3      PHE  52   2.637   2.522   7.458
  421    HD1  PHE  52           HD1      PHE  52   0.808   4.685   9.981
  422    HD2  PHE  52           HD2      PHE  52   3.423   1.318   9.336
  423    HE1  PHE  52           HE1      PHE  52   0.977   4.347  12.427
  424    HE2  PHE  52           HE2      PHE  52   3.591   0.987  11.794
  425    HZ   PHE  52           HZ       PHE  52   2.379   2.506  13.342
  426    H    ARG  53           H        ARG  53   3.949   4.604   9.820
  427    HA   ARG  53           HA       ARG  53   6.703   5.129   8.935
  428    HB2  ARG  53           HB2      ARG  53   5.391   4.651  11.622
  429    HB3  ARG  53           HB3      ARG  53   7.113   4.995  11.421
  430    HG2  ARG  53           HG2      ARG  53   4.862   6.889  10.560
  431    HG3  ARG  53           HG3      ARG  53   5.781   6.982  12.055
  432    HD2  ARG  53           HD2      ARG  53   6.858   8.543  10.767
  433    HD3  ARG  53           HD3      ARG  53   7.894   7.125  10.577
  434    HE   ARG  53           HE       ARG  53   5.865   7.484   8.449
  435   HH11  ARG  53          HH11      ARG  53   8.969   8.666   9.506
  436   HH12  ARG  53          HH12      ARG  53   9.298   9.363   7.930
  437   HH21  ARG  53          HH21      ARG  53   6.662   7.873   6.342
  438   HH22  ARG  53          HH22      ARG  53   8.189   8.692   6.172
  439    H    MET  54           H        MET  54   6.379   3.217   7.545
  440    HA   MET  54           HA       MET  54   8.048   1.054   8.694
  441    HB2  MET  54           HB2      MET  54   5.540   0.670   7.015
  442    HB3  MET  54           HB3      MET  54   6.833  -0.536   7.059
  443    HG2  MET  54           HG2      MET  54   6.620  -0.816   9.453
  444    HG3  MET  54           HG3      MET  54   5.449   0.492   9.563
  445    HE1  MET  54           HE1      MET  54   3.371  -2.758  10.408
  446    HE2  MET  54           HE2      MET  54   5.090  -2.499  10.766
  447    HE3  MET  54           HE3      MET  54   3.925  -1.177  11.003
  448    H    THR  55           H        THR  55   9.762   0.655   7.548
  449    HA   THR  55           HA       THR  55   9.778   0.956   4.596
  450    HB   THR  55           HB       THR  55  12.303   1.352   4.792
  451    HG1  THR  55           HG1      THR  55  12.957   2.380   6.649
  452   HG21  THR  55          HG21      THR  55  12.040   3.778   5.048
  453   HG22  THR  55          HG22      THR  55  10.421   3.551   5.743
  454   HG23  THR  55          HG23      THR  55  10.746   3.096   4.053
  455    H    ASP  56           H        ASP  56   9.131  -1.191   6.590
  456    HA   ASP  56           HA       ASP  56  11.007  -3.333   6.484
  457    HB2  ASP  56           HB2      ASP  56   7.962  -3.271   6.590
  458    HB3  ASP  56           HB3      ASP  56   8.937  -4.721   6.822
  459    H    GLN  57           H        GLN  57  11.892  -3.933   4.491
  460    HA   GLN  57           HA       GLN  57  10.379  -3.678   2.085
  461    HB2  GLN  57           HB2      GLN  57  13.099  -4.429   2.797
  462    HB3  GLN  57           HB3      GLN  57  12.488  -5.420   1.475
  463    HG2  GLN  57           HG2      GLN  57  12.415  -2.371   1.570
  464    HG3  GLN  57           HG3      GLN  57  13.630  -3.328   0.736
  465   HE21  GLN  57          HE21      GLN  57  11.676  -1.343  -0.437
  466   HE22  GLN  57          HE22      GLN  57  10.794  -2.295  -1.620
  467    H    GLU  58           H        GLU  58  10.521  -6.338   4.329
  468    HA   GLU  58           HA       GLU  58   9.244  -8.320   2.698
  469    HB2  GLU  58           HB2      GLU  58   8.438  -9.257   4.839
  470    HB3  GLU  58           HB3      GLU  58  10.172  -8.964   4.807
  471    HG2  GLU  58           HG2      GLU  58   9.967  -7.010   6.222
  472    HG3  GLU  58           HG3      GLU  58   8.207  -7.033   6.112
  473    H    ALA  59           H        ALA  59   7.867  -5.505   4.466
  474    HA   ALA  59           HA       ALA  59   5.115  -6.362   3.849
  475    HB1  ALA  59           HB1      ALA  59   6.105  -3.807   5.149
  476    HB2  ALA  59           HB2      ALA  59   4.425  -4.370   5.005
  477    HB3  ALA  59           HB3      ALA  59   5.581  -5.282   6.007
  478    H    ILE  60           H        ILE  60   7.505  -3.956   2.700
  479    HA   ILE  60           HA       ILE  60   5.813  -2.629   0.812
  480    HB   ILE  60           HB       ILE  60   8.787  -3.144   0.775
  481   HG12  ILE  60          HG12      ILE  60   7.267  -0.575   1.419
  482   HG13  ILE  60          HG13      ILE  60   7.738  -1.723   2.663
  483   HG21  ILE  60          HG21      ILE  60   8.079  -2.702  -1.532
  484   HG22  ILE  60          HG22      ILE  60   7.043  -1.359  -1.000
  485   HG23  ILE  60          HG23      ILE  60   8.806  -1.227  -0.919
  486   HD11  ILE  60          HD11      ILE  60  10.119  -1.472   2.043
  487   HD12  ILE  60          HD12      ILE  60   9.671  -0.231   0.848
  488   HD13  ILE  60          HD13      ILE  60   9.371   0.048   2.566
  489    H    GLN  61           H        GLN  61   7.905  -5.571   0.308
  490    HA   GLN  61           HA       GLN  61   6.754  -6.000  -2.297
  491    HB2  GLN  61           HB2      GLN  61   7.983  -8.006  -2.419
  492    HB3  GLN  61           HB3      GLN  61   8.979  -6.785  -1.643
  493    HG2  GLN  61           HG2      GLN  61   9.420  -8.645  -0.353
  494    HG3  GLN  61           HG3      GLN  61   8.201  -7.830   0.599
  495   HE21  GLN  61          HE21      GLN  61   6.774  -9.310   1.481
  496   HE22  GLN  61          HE22      GLN  61   6.169 -10.737   0.634
  497    H    ASP  62           H        ASP  62   5.628  -7.058   0.929
  498    HA   ASP  62           HA       ASP  62   3.728  -8.995  -0.080
  499    HB2  ASP  62           HB2      ASP  62   4.464  -8.902   2.256
  500    HB3  ASP  62           HB3      ASP  62   3.707  -7.323   2.460
  501    H    LEU  63           H        LEU  63   3.440  -5.514   0.750
  502    HA   LEU  63           HA       LEU  63   0.738  -5.244  -0.134
  503    HB2  LEU  63           HB2      LEU  63   2.991  -3.439   0.616
  504    HB3  LEU  63           HB3      LEU  63   1.747  -2.732  -0.394
  505    HG   LEU  63           HG       LEU  63   1.373  -2.334   2.020
  506   HD11  LEU  63          HD11      LEU  63  -0.815  -4.053   0.766
  507   HD12  LEU  63          HD12      LEU  63  -0.526  -2.334   0.431
  508   HD13  LEU  63          HD13      LEU  63  -1.005  -2.854   2.052
  509   HD21  LEU  63          HD21      LEU  63   0.855  -5.319   2.240
  510   HD22  LEU  63          HD22      LEU  63   0.525  -4.092   3.485
  511   HD23  LEU  63          HD23      LEU  63   2.189  -4.424   2.983
  512    H    TRP  64           H        TRP  64   3.865  -5.078  -1.861
  513    HA   TRP  64           HA       TRP  64   2.781  -4.392  -4.406
  514    HB2  TRP  64           HB2      TRP  64   5.282  -4.673  -3.577
  515    HB3  TRP  64           HB3      TRP  64   5.094  -6.297  -4.173
  516    HD1  TRP  64           HD1      TRP  64   3.183  -4.615  -6.675
  517    HE1  TRP  64           HE1      TRP  64   4.590  -3.707  -8.618
  518    HE3  TRP  64           HE3      TRP  64   7.816  -4.910  -4.523
  519    HZ2  TRP  64           HZ2      TRP  64   7.386  -3.489  -9.273
  520    HZ3  TRP  64           HZ3      TRP  64   9.834  -4.324  -5.821
  521    HH2  TRP  64           HH2      TRP  64   9.630  -3.634  -8.218
  522    H    GLN  65           H        GLN  65   3.083  -7.653  -2.827
  523    HA   GLN  65           HA       GLN  65   2.043  -9.086  -5.098
  524    HB2  GLN  65           HB2      GLN  65   1.614  -9.845  -2.182
  525    HB3  GLN  65           HB3      GLN  65   1.452 -10.867  -3.595
  526    HG2  GLN  65           HG2      GLN  65   3.947  -9.939  -2.221
  527    HG3  GLN  65           HG3      GLN  65   3.479 -11.546  -2.707
  528   HE21  GLN  65          HE21      GLN  65   5.229  -8.726  -3.602
  529   HE22  GLN  65          HE22      GLN  65   5.702  -9.238  -5.225
  530    H    TRP  66           H        TRP  66   0.459  -7.334  -2.453
  531    HA   TRP  66           HA       TRP  66  -2.248  -7.879  -3.340
  532    HB2  TRP  66           HB2      TRP  66  -1.231  -7.064  -1.012
  533    HB3  TRP  66           HB3      TRP  66  -1.553  -5.474  -1.679
  534    HD1  TRP  66           HD1      TRP  66  -4.056  -4.702  -1.698
  535    HE1  TRP  66           HE1      TRP  66  -6.289  -5.708  -0.877
  536    HE3  TRP  66           HE3      TRP  66  -2.527  -9.503  -0.786
  537    HZ2  TRP  66           HZ2      TRP  66  -7.225  -8.191   0.208
  538    HZ3  TRP  66           HZ3      TRP  66  -4.138 -11.191   0.062
  539    HH2  TRP  66           HH2      TRP  66  -6.486 -10.545   0.574
  540    H    ARG  67           H        ARG  67   0.123  -5.936  -4.757
  541    HA   ARG  67           HA       ARG  67  -1.928  -4.583  -6.484
  542    HB2  ARG  67           HB2      ARG  67   0.994  -3.841  -6.063
  543    HB3  ARG  67           HB3      ARG  67  -0.100  -3.050  -7.183
  544    HG2  ARG  67           HG2      ARG  67  -0.369  -2.994  -4.147
  545    HG3  ARG  67           HG3      ARG  67   0.340  -1.746  -5.163
  546    HD2  ARG  67           HD2      ARG  67  -1.856  -1.018  -4.600
  547    HD3  ARG  67           HD3      ARG  67  -1.860  -1.453  -6.313
  548    HE   ARG  67           HE       ARG  67  -2.654  -3.691  -4.672
  549   HH11  ARG  67          HH11      ARG  67  -4.037  -0.774  -6.124
  550   HH12  ARG  67          HH12      ARG  67  -5.572  -1.628  -6.343
  551   HH21  ARG  67          HH21      ARG  67  -4.533  -4.587  -5.069
  552   HH22  ARG  67          HH22      ARG  67  -5.853  -3.628  -5.756
  553    H    LYS  68           H        LYS  68   0.003  -7.245  -6.398
  554    HA   LYS  68           HA       LYS  68   0.489  -7.382  -9.316
  555    HB2  LYS  68           HB2      LYS  68   2.165  -8.244  -7.607
  556    HB3  LYS  68           HB3      LYS  68   0.999  -9.499  -7.179
  557    HG2  LYS  68           HG2      LYS  68   1.034 -10.183  -9.665
  558    HG3  LYS  68           HG3      LYS  68   2.403  -9.071  -9.839
  559    HD2  LYS  68           HD2      LYS  68   3.534 -10.406  -7.938
  560    HD3  LYS  68           HD3      LYS  68   2.210 -11.579  -8.112
  561    HE2  LYS  68           HE2      LYS  68   2.821 -11.686 -10.608
  562    HE3  LYS  68           HE3      LYS  68   4.251 -10.726 -10.211
  563    HZ1  LYS  68           HZ1      LYS  68   4.846 -12.572  -8.609
  564    HZ2  LYS  68           HZ2      LYS  68   4.855 -12.992 -10.209
  565    HZ3  LYS  68           HZ3      LYS  68   3.611 -13.456  -9.264
  566    H    SER  69           H        SER  69  -1.210  -9.310  -6.843
  567    HA   SER  69           HA       SER  69  -3.556  -9.723  -8.559
  568    HB2  SER  69           HB2      SER  69  -1.841 -12.071  -7.645
  569    HB3  SER  69           HB3      SER  69  -3.444 -12.194  -8.390
  570    HG   SER  69           HG       SER  69  -1.188 -12.207  -9.618
  571    H    LEU  70           H        LEU  70  -5.300  -9.759  -7.299
  572    HA   LEU  70           HA       LEU  70  -5.026 -10.051  -4.333
  573    HB2  LEU  70           HB2      LEU  70  -5.575  -7.816  -5.540
  574    HB3  LEU  70           HB3      LEU  70  -7.172  -8.496  -5.821
  575    HG   LEU  70           HG       LEU  70  -5.839  -8.082  -3.115
  576   HD11  LEU  70          HD11      LEU  70  -7.438  -6.205  -2.892
  577   HD12  LEU  70          HD12      LEU  70  -8.016  -6.501  -4.545
  578   HD13  LEU  70          HD13      LEU  70  -6.344  -5.975  -4.259
  579   HD21  LEU  70          HD21      LEU  70  -8.149  -8.375  -2.198
  580   HD22  LEU  70          HD22      LEU  70  -7.498  -9.851  -2.908
  581   HD23  LEU  70          HD23      LEU  70  -8.694  -8.889  -3.810
  Start of MODEL   11
    1    H    GLN   1           H1       GLN   1 -25.893 -20.734  32.805
    2    HA   GLN   1           HA       GLN   1 -26.215 -18.878  31.349
    3    HB2  GLN   1           HB2      GLN   1 -26.009 -17.350  33.963
    4    HB3  GLN   1           HB3      GLN   1 -25.717 -16.574  32.409
    5    HG2  GLN   1           HG2      GLN   1 -27.958 -17.023  31.643
    6    HG3  GLN   1           HG3      GLN   1 -28.318 -18.026  33.041
    7   HE21  GLN   1          HE21      GLN   1 -29.715 -15.565  32.101
    8   HE22  GLN   1          HE22      GLN   1 -29.680 -14.524  33.516
    9    H    GLU   2           H        GLU   2 -24.394 -17.740  30.397
   10    HA   GLU   2           HA       GLU   2 -21.720 -18.569  31.489
   11    HB2  GLU   2           HB2      GLU   2 -22.677 -17.687  28.745
   12    HB3  GLU   2           HB3      GLU   2 -20.987 -17.571  29.212
   13    HG2  GLU   2           HG2      GLU   2 -21.060 -19.592  28.116
   14    HG3  GLU   2           HG3      GLU   2 -21.049 -20.045  29.816
   15    H    SER   3           H        SER   3 -23.744 -15.738  31.112
   16    HA   SER   3           HA       SER   3 -21.660 -13.998  32.293
   17    HB2  SER   3           HB2      SER   3 -22.092 -12.290  30.466
   18    HB3  SER   3           HB3      SER   3 -21.160 -13.715  29.991
   19    HG   SER   3           HG       SER   3 -23.952 -13.331  29.494
   20    H    PHE   4           H        PHE   4 -22.464 -11.877  32.903
   21    HA   PHE   4           HA       PHE   4 -24.967 -11.911  34.259
   22    HB2  PHE   4           HB2      PHE   4 -23.188 -10.478  34.988
   23    HB3  PHE   4           HB3      PHE   4 -23.096  -9.675  33.426
   24    HD1  PHE   4           HD1      PHE   4 -25.635 -10.334  36.159
   25    HD2  PHE   4           HD2      PHE   4 -24.091  -7.577  33.219
   26    HE1  PHE   4           HE1      PHE   4 -27.295  -8.629  36.873
   27    HE2  PHE   4           HE2      PHE   4 -25.742  -5.876  33.950
   28    HZ   PHE   4           HZ       PHE   4 -27.366  -6.413  35.747
   29    H    LYS   5           H        LYS   5 -24.144 -10.138  31.213
   30    HA   LYS   5           HA       LYS   5 -26.902 -10.823  30.274
   31    HB2  LYS   5           HB2      LYS   5 -25.489  -8.196  29.719
   32    HB3  LYS   5           HB3      LYS   5 -26.961  -8.772  28.907
   33    HG2  LYS   5           HG2      LYS   5 -28.036  -8.967  31.203
   34    HG3  LYS   5           HG3      LYS   5 -26.625  -8.160  31.876
   35    HD2  LYS   5           HD2      LYS   5 -28.620  -6.985  29.902
   36    HD3  LYS   5           HD3      LYS   5 -28.488  -6.634  31.630
   37    HE2  LYS   5           HE2      LYS   5 -26.113  -5.776  31.148
   38    HE3  LYS   5           HE3      LYS   5 -26.521  -5.914  29.433
   39    HZ1  LYS   5           HZ1      LYS   5 -27.792  -4.124  31.435
   40    HZ2  LYS   5           HZ2      LYS   5 -28.480  -4.418  29.977
   41    HZ3  LYS   5           HZ3      LYS   5 -27.007  -3.697  30.054
   42    H    LYS   6           H        LYS   6 -24.330  -9.414  28.227
   43    HA   LYS   6           HA       LYS   6 -23.552 -12.098  27.290
   44    HB2  LYS   6           HB2      LYS   6 -24.254 -11.823  24.998
   45    HB3  LYS   6           HB3      LYS   6 -25.614 -11.816  26.104
   46    HG2  LYS   6           HG2      LYS   6 -25.913  -9.413  25.867
   47    HG3  LYS   6           HG3      LYS   6 -24.393  -9.265  24.975
   48    HD2  LYS   6           HD2      LYS   6 -26.310  -9.160  23.451
   49    HD3  LYS   6           HD3      LYS   6 -25.291 -10.568  23.111
   50    HE2  LYS   6           HE2      LYS   6 -26.903 -11.956  24.494
   51    HE3  LYS   6           HE3      LYS   6 -27.961 -10.543  24.594
   52    HZ1  LYS   6           HZ1      LYS   6 -28.510 -12.119  22.791
   53    HZ2  LYS   6           HZ2      LYS   6 -27.085 -11.875  22.083
   54    HZ3  LYS   6           HZ3      LYS   6 -28.172 -10.625  22.162
   55    H    GLN   7           H        GLN   7 -22.172  -9.650  28.385
   56    HA   GLN   7           HA       GLN   7 -20.216  -8.542  28.095
   57    HB2  GLN   7           HB2      GLN   7 -19.528 -11.249  26.932
   58    HB3  GLN   7           HB3      GLN   7 -18.318 -10.032  27.377
   59    HG2  GLN   7           HG2      GLN   7 -19.013 -10.047  29.696
   60    HG3  GLN   7           HG3      GLN   7 -20.406 -11.056  29.346
   61   HE21  GLN   7          HE21      GLN   7 -19.363 -12.195  31.235
   62   HE22  GLN   7          HE22      GLN   7 -18.302 -13.532  30.794
   63    H    GLU   8           H        GLU   8 -21.766  -7.414  26.430
   64    HA   GLU   8           HA       GLU   8 -21.044  -7.584  23.631
   65    HB2  GLU   8           HB2      GLU   8 -22.890  -6.104  23.278
   66    HB3  GLU   8           HB3      GLU   8 -23.345  -7.252  24.531
   67    HG2  GLU   8           HG2      GLU   8 -22.499  -5.359  26.188
   68    HG3  GLU   8           HG3      GLU   8 -22.704  -4.304  24.792
   69    H    LYS   9           H        LYS   9 -19.566  -5.704  26.037
   70    HA   LYS   9           HA       LYS   9 -17.980  -4.516  23.873
   71    HB2  LYS   9           HB2      LYS   9 -18.293  -2.266  24.433
   72    HB3  LYS   9           HB3      LYS   9 -19.866  -2.949  24.172
   73    HG2  LYS   9           HG2      LYS   9 -20.214  -3.128  26.651
   74    HG3  LYS   9           HG3      LYS   9 -18.658  -2.299  26.898
   75    HD2  LYS   9           HD2      LYS   9 -19.501  -0.360  25.594
   76    HD3  LYS   9           HD3      LYS   9 -21.055  -1.183  25.375
   77    HE2  LYS   9           HE2      LYS   9 -21.398  -1.180  27.845
   78    HE3  LYS   9           HE3      LYS   9 -19.848  -0.351  28.054
   79    HZ1  LYS   9           HZ1      LYS   9 -21.660   1.255  28.040
   80    HZ2  LYS   9           HZ2      LYS   9 -22.190   0.718  26.574
   81    HZ3  LYS   9           HZ3      LYS   9 -20.733   1.473  26.701
   82    H    THR  10           H        THR  10 -15.913  -3.868  24.378
   83    HA   THR  10           HA       THR  10 -14.966  -4.322  27.183
   84    HB   THR  10           HB       THR  10 -12.863  -5.296  26.157
   85    HG1  THR  10           HG1      THR  10 -13.299  -6.282  24.090
   86   HG21  THR  10          HG21      THR  10 -13.765  -7.497  26.006
   87   HG22  THR  10          HG22      THR  10 -15.392  -6.881  25.616
   88   HG23  THR  10          HG23      THR  10 -14.695  -6.636  27.230
   89    HA   PRO  11           HA       PRO  11 -12.970  -0.509  26.957
   90    HB2  PRO  11           HB2      PRO  11 -11.039  -0.617  28.838
   91    HB3  PRO  11           HB3      PRO  11 -12.756  -0.914  29.226
   92    HG2  PRO  11           HG2      PRO  11 -10.658  -3.029  28.605
   93    HG3  PRO  11           HG3      PRO  11 -11.702  -2.922  30.060
   94    HD2  PRO  11           HD2      PRO  11 -12.418  -4.435  27.967
   95    HD3  PRO  11           HD3      PRO  11 -13.641  -3.462  28.836
   96    H    LYS  12           H        LYS  12 -12.383  -1.312  24.686
   97    HA   LYS  12           HA       LYS  12  -9.834  -0.080  24.064
   98    HB2  LYS  12           HB2      LYS  12  -9.525  -2.747  24.263
   99    HB3  LYS  12           HB3      LYS  12 -10.352  -2.756  22.718
  100    HG2  LYS  12           HG2      LYS  12  -8.067  -2.769  22.146
  101    HG3  LYS  12           HG3      LYS  12  -8.540  -1.096  21.905
  102    HD2  LYS  12           HD2      LYS  12  -6.475  -0.938  23.067
  103    HD3  LYS  12           HD3      LYS  12  -7.676  -0.679  24.326
  104    HE2  LYS  12           HE2      LYS  12  -6.261  -2.208  25.352
  105    HE3  LYS  12           HE3      LYS  12  -7.500  -3.284  24.684
  106    HZ1  LYS  12           HZ1      LYS  12  -5.893  -3.441  22.684
  107    HZ2  LYS  12           HZ2      LYS  12  -5.418  -4.204  24.057
  108    HZ3  LYS  12           HZ3      LYS  12  -4.781  -2.742  23.661
  109    H    THR  13           H        THR  13  -9.838   0.730  21.887
  110    HA   THR  13           HA       THR  13 -12.152   0.091  20.109
  111    HB   THR  13           HB       THR  13 -11.765   2.575  19.265
  112    HG1  THR  13           HG1      THR  13 -11.338   3.983  20.834
  113   HG21  THR  13          HG21      THR  13 -13.909   1.657  19.936
  114   HG22  THR  13          HG22      THR  13 -13.688   3.290  20.581
  115   HG23  THR  13          HG23      THR  13 -13.497   1.885  21.659
  116    HA   PRO  14           HA       PRO  14  -7.970  -0.643  18.492
  117    HB2  PRO  14           HB2      PRO  14  -8.192  -3.144  17.466
  118    HB3  PRO  14           HB3      PRO  14  -8.244  -2.825  19.222
  119    HG2  PRO  14           HG2      PRO  14 -10.625  -3.101  17.341
  120    HG3  PRO  14           HG3      PRO  14 -10.310  -4.015  18.847
  121    HD2  PRO  14           HD2      PRO  14 -11.867  -1.786  18.839
  122    HD3  PRO  14           HD3      PRO  14 -10.751  -2.121  20.196
  123    H    LYS  15           H        LYS  15  -8.940   1.241  17.097
  124    HA   LYS  15           HA       LYS  15  -9.226   0.543  14.218
  125    HB2  LYS  15           HB2      LYS  15  -9.115   3.206  15.705
  126    HB3  LYS  15           HB3      LYS  15  -9.094   3.065  13.954
  127    HG2  LYS  15           HG2      LYS  15 -11.272   3.553  14.447
  128    HG3  LYS  15           HG3      LYS  15 -11.304   1.838  14.057
  129    HD2  LYS  15           HD2      LYS  15 -11.577   1.233  16.395
  130    HD3  LYS  15           HD3      LYS  15 -11.225   2.874  16.935
  131    HE2  LYS  15           HE2      LYS  15 -13.673   1.986  15.347
  132    HE3  LYS  15           HE3      LYS  15 -13.618   2.355  17.072
  133    HZ1  LYS  15           HZ1      LYS  15 -13.349   4.234  14.811
  134    HZ2  LYS  15           HZ2      LYS  15 -12.771   4.645  16.278
  135    HZ3  LYS  15           HZ3      LYS  15 -14.390   4.325  16.067
  136    H    GLY  16           H        GLY  16  -7.732   1.248  12.635
  137    HA2  GLY  16           HA2      GLY  16  -5.659   1.281  11.675
  138    HA3  GLY  16           HA3      GLY  16  -5.407   2.601  12.807
  139    HA   PRO  17           HA       PRO  17  -3.568  -1.445  14.951
  140    HB2  PRO  17           HB2      PRO  17  -2.886  -2.888  12.384
  141    HB3  PRO  17           HB3      PRO  17  -3.234  -3.574  14.003
  142    HG2  PRO  17           HG2      PRO  17  -5.180  -3.528  12.125
  143    HG3  PRO  17           HG3      PRO  17  -5.563  -3.060  13.806
  144    HD2  PRO  17           HD2      PRO  17  -5.075  -1.284  11.424
  145    HD3  PRO  17           HD3      PRO  17  -6.288  -1.147  12.719
  146    H    SER  18           H        SER  18  -1.306  -2.331  15.169
  147    HA   SER  18           HA       SER  18   0.656  -0.254  14.487
  148    HB2  SER  18           HB2      SER  18   2.020  -1.470  16.206
  149    HB3  SER  18           HB3      SER  18   0.450  -0.887  16.772
  150    HG   SER  18           HG       SER  18   0.507  -2.897  17.473
  151    H    SER  19           H        SER  19  -0.234  -2.829  12.750
  152    HA   SER  19           HA       SER  19   2.384  -3.278  11.483
  153    HB2  SER  19           HB2      SER  19   2.098  -4.937  13.429
  154    HB3  SER  19           HB3      SER  19   0.766  -5.638  12.486
  155    HG   SER  19           HG       SER  19   2.696  -6.704  12.077
  156    H    VAL  20           H        VAL  20   1.653  -5.414   9.873
  157    HA   VAL  20           HA       VAL  20   0.689  -4.024   7.695
  158    HB   VAL  20           HB       VAL  20   0.817  -7.020   8.134
  159   HG11  VAL  20          HG11      VAL  20  -0.617  -6.712   6.222
  160   HG12  VAL  20          HG12      VAL  20   0.489  -5.496   5.529
  161   HG13  VAL  20          HG13      VAL  20   0.966  -7.219   5.662
  162   HG21  VAL  20          HG21      VAL  20   2.947  -6.812   6.855
  163   HG22  VAL  20          HG22      VAL  20   2.716  -5.059   6.746
  164   HG23  VAL  20          HG23      VAL  20   2.998  -5.836   8.320
  165    H    GLU  21           H        GLU  21  -1.464  -5.764   9.933
  166    HA   GLU  21           HA       GLU  21  -3.848  -5.874   8.409
  167    HB2  GLU  21           HB2      GLU  21  -3.305  -5.133  11.318
  168    HB3  GLU  21           HB3      GLU  21  -4.943  -5.255  10.671
  169    HG2  GLU  21           HG2      GLU  21  -2.953  -7.538  10.583
  170    HG3  GLU  21           HG3      GLU  21  -4.129  -7.295  11.880
  171    H    ASP  22           H        ASP  22  -2.301  -3.027   9.867
  172    HA   ASP  22           HA       ASP  22  -4.430  -1.129   9.481
  173    HB2  ASP  22           HB2      ASP  22  -2.499  -0.933  11.016
  174    HB3  ASP  22           HB3      ASP  22  -1.395  -0.828   9.652
  175    H    ILE  23           H        ILE  23  -1.492  -1.826   7.521
  176    HA   ILE  23           HA       ILE  23  -2.332   0.082   5.525
  177    HB   ILE  23           HB       ILE  23   0.037  -0.584   6.129
  178   HG12  ILE  23          HG12      ILE  23  -0.726  -0.383   3.196
  179   HG13  ILE  23          HG13      ILE  23  -0.629   0.965   4.336
  180   HG21  ILE  23          HG21      ILE  23  -0.205  -3.047   5.804
  181   HG22  ILE  23          HG22      ILE  23  -0.388  -2.781   4.058
  182   HG23  ILE  23          HG23      ILE  23   1.123  -2.367   4.889
  183   HD11  ILE  23          HD11      ILE  23   1.409   0.992   3.118
  184   HD12  ILE  23          HD12      ILE  23   1.812   0.363   4.724
  185   HD13  ILE  23          HD13      ILE  23   1.669  -0.753   3.346
  186    H    LYS  24           H        LYS  24  -2.760  -3.432   5.839
  187    HA   LYS  24           HA       LYS  24  -3.936  -3.950   3.259
  188    HB2  LYS  24           HB2      LYS  24  -4.529  -5.136   6.002
  189    HB3  LYS  24           HB3      LYS  24  -5.169  -5.785   4.508
  190    HG2  LYS  24           HG2      LYS  24  -2.167  -5.542   4.853
  191    HG3  LYS  24           HG3      LYS  24  -3.071  -6.790   5.703
  192    HD2  LYS  24           HD2      LYS  24  -4.009  -7.435   3.348
  193    HD3  LYS  24           HD3      LYS  24  -2.697  -6.439   2.720
  194    HE2  LYS  24           HE2      LYS  24  -1.927  -8.726   2.782
  195    HE3  LYS  24           HE3      LYS  24  -1.062  -7.853   4.049
  196    HZ1  LYS  24           HZ1      LYS  24  -1.960 -10.042   4.787
  197    HZ2  LYS  24           HZ2      LYS  24  -3.495  -9.493   4.511
  198    HZ3  LYS  24           HZ3      LYS  24  -2.561  -8.823   5.682
  199    H    ALA  25           H        ALA  25  -5.570  -3.128   6.375
  200    HA   ALA  25           HA       ALA  25  -8.167  -2.929   5.260
  201    HB1  ALA  25           HB1      ALA  25  -7.681  -3.299   7.646
  202    HB2  ALA  25           HB2      ALA  25  -6.985  -1.671   7.778
  203    HB3  ALA  25           HB3      ALA  25  -8.716  -1.874   7.434
  204    H    LYS  26           H        LYS  26  -5.740  -0.344   5.843
  205    HA   LYS  26           HA       LYS  26  -7.495   1.781   4.917
  206    HB2  LYS  26           HB2      LYS  26  -4.529   1.658   5.532
  207    HB3  LYS  26           HB3      LYS  26  -5.356   3.143   5.044
  208    HG2  LYS  26           HG2      LYS  26  -6.670   3.246   7.019
  209    HG3  LYS  26           HG3      LYS  26  -6.465   1.540   7.370
  210    HD2  LYS  26           HD2      LYS  26  -5.238   2.927   8.947
  211    HD3  LYS  26           HD3      LYS  26  -4.201   1.835   8.034
  212    HE2  LYS  26           HE2      LYS  26  -3.565   3.717   6.534
  213    HE3  LYS  26           HE3      LYS  26  -4.478   4.822   7.569
  214    HZ1  LYS  26           HZ1      LYS  26  -2.302   3.065   8.587
  215    HZ2  LYS  26           HZ2      LYS  26  -3.017   4.264   9.392
  216    HZ3  LYS  26           HZ3      LYS  26  -2.025   4.611   8.101
  217    H    MET  27           H        MET  27  -5.055  -0.224   3.227
  218    HA   MET  27           HA       MET  27  -5.372   1.139   0.682
  219    HB2  MET  27           HB2      MET  27  -4.475  -1.672   1.416
  220    HB3  MET  27           HB3      MET  27  -4.661  -1.134  -0.251
  221    HG2  MET  27           HG2      MET  27  -3.095   0.698   0.092
  222    HG3  MET  27           HG3      MET  27  -2.860   0.233   1.772
  223    HE1  MET  27           HE1      MET  27   0.570  -0.603   0.005
  224    HE2  MET  27           HE2      MET  27  -0.541   0.635  -0.622
  225    HE3  MET  27           HE3      MET  27  -0.282   0.468   1.130
  226    H    GLN  28           H        GLN  28  -7.243  -1.537   2.264
  227    HA   GLN  28           HA       GLN  28  -9.028  -1.796   0.016
  228    HB2  GLN  28           HB2      GLN  28  -9.607  -2.418   2.930
  229    HB3  GLN  28           HB3      GLN  28 -10.636  -2.788   1.553
  230    HG2  GLN  28           HG2      GLN  28  -8.062  -4.090   2.363
  231    HG3  GLN  28           HG3      GLN  28  -9.584  -4.822   1.918
  232   HE21  GLN  28          HE21      GLN  28  -6.474  -3.972   0.823
  233   HE22  GLN  28          HE22      GLN  28  -6.766  -4.288  -0.899
  234    H    ALA  29           H        ALA  29  -9.222   0.345   2.922
  235    HA   ALA  29           HA       ALA  29 -11.618   1.620   2.160
  236    HB1  ALA  29           HB1      ALA  29  -9.224   2.883   3.566
  237    HB2  ALA  29           HB2      ALA  29 -10.909   3.436   3.618
  238    HB3  ALA  29           HB3      ALA  29 -10.467   1.885   4.353
  239    H    SER  30           H        SER  30  -8.281   2.376   1.031
  240    HA   SER  30           HA       SER  30  -9.019   4.556  -0.674
  241    HB2  SER  30           HB2      SER  30  -6.705   2.599  -0.907
  242    HB3  SER  30           HB3      SER  30  -6.884   4.092  -1.842
  243    HG   SER  30           HG       SER  30  -6.929   5.243   0.132
  244    H    ILE  31           H        ILE  31  -8.564   1.045  -1.551
  245    HA   ILE  31           HA       ILE  31  -9.295   1.674  -4.284
  246    HB   ILE  31           HB       ILE  31  -7.591  -0.025  -3.475
  247   HG12  ILE  31          HG12      ILE  31  -9.572  -0.954  -5.587
  248   HG13  ILE  31          HG13      ILE  31  -8.325   0.277  -5.830
  249   HG21  ILE  31          HG21      ILE  31  -9.250  -1.182  -1.920
  250   HG22  ILE  31          HG22      ILE  31  -9.948  -1.950  -3.353
  251   HG23  ILE  31          HG23      ILE  31  -8.255  -2.245  -2.911
  252   HD11  ILE  31          HD11      ILE  31  -6.571  -1.426  -5.300
  253   HD12  ILE  31          HD12      ILE  31  -7.847  -2.665  -5.194
  254   HD13  ILE  31          HD13      ILE  31  -7.548  -1.833  -6.725
  255    H    GLU  32           H        GLU  32 -11.132   0.324  -1.576
  256    HA   GLU  32           HA       GLU  32 -13.426  -0.390  -3.280
  257    HB2  GLU  32           HB2      GLU  32 -13.165  -0.553  -0.261
  258    HB3  GLU  32           HB3      GLU  32 -14.459  -1.210  -1.258
  259    HG2  GLU  32           HG2      GLU  32 -12.778  -2.651  -2.443
  260    HG3  GLU  32           HG3      GLU  32 -11.550  -2.115  -1.298
  261    H    LYS  33           H        LYS  33 -12.671   2.163  -0.846
  262    HA   LYS  33           HA       LYS  33 -15.310   3.424  -1.553
  263    HB2  LYS  33           HB2      LYS  33 -13.753   3.706   1.035
  264    HB3  LYS  33           HB3      LYS  33 -15.277   4.495   0.622
  265    HG2  LYS  33           HG2      LYS  33 -16.274   2.140   0.332
  266    HG3  LYS  33           HG3      LYS  33 -14.782   1.522   1.059
  267    HD2  LYS  33           HD2      LYS  33 -15.212   2.962   3.071
  268    HD3  LYS  33           HD3      LYS  33 -16.694   3.540   2.318
  269    HE2  LYS  33           HE2      LYS  33 -17.230   1.874   3.973
  270    HE3  LYS  33           HE3      LYS  33 -17.662   1.264   2.374
  271    HZ1  LYS  33           HZ1      LYS  33 -15.004   0.585   3.390
  272    HZ2  LYS  33           HZ2      LYS  33 -16.045  -0.347   2.513
  273    HZ3  LYS  33           HZ3      LYS  33 -16.226  -0.132   4.143
  274    H    GLY  34           H        GLY  34 -11.874   4.210  -1.114
  275    HA2  GLY  34           HA2      GLY  34 -12.152   7.013  -1.827
  276    HA3  GLY  34           HA3      GLY  34 -10.659   6.074  -1.729
  277    H    GLY  35           H        GLY  35 -12.071   4.132  -3.734
  278    HA2  GLY  35           HA2      GLY  35 -12.621   3.930  -5.975
  279    HA3  GLY  35           HA3      GLY  35 -12.397   5.661  -6.202
  280    H    SER  36           H        SER  36  -9.484   4.745  -4.812
  281    HA   SER  36           HA       SER  36  -8.228   3.584  -7.175
  282    HB2  SER  36           HB2      SER  36  -6.801   5.647  -7.621
  283    HB3  SER  36           HB3      SER  36  -8.470   5.672  -8.179
  284    HG   SER  36           HG       SER  36  -8.280   7.561  -7.246
  285    H    LEU  37           H        LEU  37  -6.103   3.037  -6.979
  286    HA   LEU  37           HA       LEU  37  -4.508   3.784  -4.638
  287    HB2  LEU  37           HB2      LEU  37  -5.926   1.791  -3.939
  288    HB3  LEU  37           HB3      LEU  37  -5.234   0.886  -5.280
  289    HG   LEU  37           HG       LEU  37  -2.938   1.260  -4.170
  290   HD11  LEU  37          HD11      LEU  37  -3.809   3.106  -2.594
  291   HD12  LEU  37          HD12      LEU  37  -2.876   1.811  -1.837
  292   HD13  LEU  37          HD13      LEU  37  -4.649   1.827  -1.709
  293   HD21  LEU  37          HD21      LEU  37  -5.056  -0.357  -2.695
  294   HD22  LEU  37          HD22      LEU  37  -3.294  -0.573  -2.559
  295   HD23  LEU  37          HD23      LEU  37  -4.109  -0.891  -4.101
  296    HA   PRO  38           HA       PRO  38  -1.724   3.719  -8.061
  297    HB2  PRO  38           HB2      PRO  38   0.766   3.877  -6.910
  298    HB3  PRO  38           HB3      PRO  38  -0.418   5.222  -6.908
  299    HG2  PRO  38           HG2      PRO  38   0.014   3.136  -4.735
  300    HG3  PRO  38           HG3      PRO  38   0.006   4.923  -4.561
  301    HD2  PRO  38           HD2      PRO  38  -2.191   3.491  -4.028
  302    HD3  PRO  38           HD3      PRO  38  -2.341   5.014  -4.953
  303    H    LYS  39           H        LYS  39  -0.508   2.499  -9.357
  304    HA   LYS  39           HA       LYS  39  -0.136  -0.374  -8.664
  305    HB2  LYS  39           HB2      LYS  39  -1.665   0.172 -10.410
  306    HB3  LYS  39           HB3      LYS  39  -0.490   1.170 -11.246
  307    HG2  LYS  39           HG2      LYS  39   0.897  -0.876 -11.706
  308    HG3  LYS  39           HG3      LYS  39  -0.382  -1.844 -10.975
  309    HD2  LYS  39           HD2      LYS  39  -0.525  -0.159 -13.495
  310    HD3  LYS  39           HD3      LYS  39  -0.684  -1.919 -13.357
  311    HE2  LYS  39           HE2      LYS  39  -2.792  -1.562 -12.014
  312    HE3  LYS  39           HE3      LYS  39  -2.614   0.181 -12.285
  313    HZ1  LYS  39           HZ1      LYS  39  -2.802  -0.224 -14.672
  314    HZ2  LYS  39           HZ2      LYS  39  -4.143  -0.739 -13.872
  315    HZ3  LYS  39           HZ3      LYS  39  -3.056  -1.830 -14.429
  316    H    VAL  40           H        VAL  40   1.677   2.259 -10.269
  317    HA   VAL  40           HA       VAL  40   4.058   0.638 -10.539
  318    HB   VAL  40           HB       VAL  40   3.406   2.212 -12.225
  319   HG11  VAL  40          HG11      VAL  40   2.405   4.003 -10.872
  320   HG12  VAL  40          HG12      VAL  40   4.014   4.437 -10.238
  321   HG13  VAL  40          HG13      VAL  40   3.639   4.631 -11.962
  322   HG21  VAL  40          HG21      VAL  40   5.785   1.618 -12.021
  323   HG22  VAL  40          HG22      VAL  40   5.530   3.228 -12.706
  324   HG23  VAL  40          HG23      VAL  40   6.044   3.068 -11.019
  325    H    GLU  41           H        GLU  41   6.105   0.892  -9.620
  326    HA   GLU  41           HA       GLU  41   5.837   0.615  -6.896
  327    HB2  GLU  41           HB2      GLU  41   7.491  -0.474  -8.400
  328    HB3  GLU  41           HB3      GLU  41   8.444   1.016  -8.391
  329    HG2  GLU  41           HG2      GLU  41   8.677   0.790  -5.899
  330    HG3  GLU  41           HG3      GLU  41   7.750  -0.712  -5.964
  331    H    ALA  42           H        ALA  42   7.597   3.477  -8.382
  332    HA   ALA  42           HA       ALA  42   8.269   4.491  -5.791
  333    HB1  ALA  42           HB1      ALA  42   9.510   5.091  -7.813
  334    HB2  ALA  42           HB2      ALA  42   8.104   5.990  -8.432
  335    HB3  ALA  42           HB3      ALA  42   8.934   6.535  -6.968
  336    H    LYS  43           H        LYS  43   5.392   5.056  -7.788
  337    HA   LYS  43           HA       LYS  43   4.223   7.102  -6.044
  338    HB2  LYS  43           HB2      LYS  43   2.944   5.224  -8.072
  339    HB3  LYS  43           HB3      LYS  43   2.092   6.504  -7.216
  340    HG2  LYS  43           HG2      LYS  43   4.425   6.913  -9.114
  341    HG3  LYS  43           HG3      LYS  43   2.711   7.136  -9.491
  342    HD2  LYS  43           HD2      LYS  43   2.573   8.928  -7.751
  343    HD3  LYS  43           HD3      LYS  43   4.319   8.767  -7.468
  344    HE2  LYS  43           HE2      LYS  43   4.762   9.371  -9.827
  345    HE3  LYS  43           HE3      LYS  43   3.025   9.556 -10.113
  346    HZ1  LYS  43           HZ1      LYS  43   4.552  11.151  -8.111
  347    HZ2  LYS  43           HZ2      LYS  43   2.987  11.321  -8.476
  348    HZ3  LYS  43           HZ3      LYS  43   4.119  11.693  -9.618
  349    H    PHE  44           H        PHE  44   3.983   3.546  -6.280
  350    HA   PHE  44           HA       PHE  44   2.112   3.287  -4.188
  351    HB2  PHE  44           HB2      PHE  44   2.594   1.516  -5.798
  352    HB3  PHE  44           HB3      PHE  44   4.238   1.364  -5.210
  353    HD1  PHE  44           HD2      PHE  44   0.663   0.760  -4.364
  354    HD2  PHE  44           HD1      PHE  44   4.774   0.013  -3.290
  355    HE1  PHE  44           HE2      PHE  44  -0.063  -1.037  -2.811
  356    HE2  PHE  44           HE1      PHE  44   4.044  -1.804  -1.760
  357    HZ   PHE  44           HZ       PHE  44   1.622  -2.336  -1.529
  358    H    ILE  45           H        ILE  45   5.723   3.239  -4.022
  359    HA   ILE  45           HA       ILE  45   5.909   3.028  -1.166
  360    HB   ILE  45           HB       ILE  45   7.805   4.178  -3.234
  361   HG12  ILE  45          HG12      ILE  45   7.888   1.558  -1.650
  362   HG13  ILE  45          HG13      ILE  45   7.226   1.683  -3.271
  363   HG21  ILE  45          HG21      ILE  45   9.564   4.058  -1.476
  364   HG22  ILE  45          HG22      ILE  45   8.324   5.209  -1.037
  365   HG23  ILE  45          HG23      ILE  45   8.335   3.607  -0.273
  366   HD11  ILE  45          HD11      ILE  45  10.127   2.154  -2.499
  367   HD12  ILE  45          HD12      ILE  45   9.452   0.827  -3.451
  368   HD13  ILE  45          HD13      ILE  45   9.444   2.474  -4.114
  369    H    ASN  46           H        ASN  46   5.570   5.935  -3.264
  370    HA   ASN  46           HA       ASN  46   5.622   7.897  -1.197
  371    HB2  ASN  46           HB2      ASN  46   5.707   8.849  -3.275
  372    HB3  ASN  46           HB3      ASN  46   4.618   7.696  -4.002
  373   HD21  ASN  46          HD21      ASN  46   2.256   8.026  -3.834
  374   HD22  ASN  46          HD22      ASN  46   1.690   9.622  -3.406
  375    H    TYR  47           H        TYR  47   2.805   5.973  -2.399
  376    HA   TYR  47           HA       TYR  47   0.927   7.063  -0.527
  377    HB2  TYR  47           HB2      TYR  47   0.152   5.914  -2.474
  378    HB3  TYR  47           HB3      TYR  47   0.995   4.434  -2.043
  379    HD1  TYR  47           HD2      TYR  47   0.251   3.094  -0.018
  380    HD2  TYR  47           HD1      TYR  47  -2.075   6.354  -1.629
  381    HE1  TYR  47           HE2      TYR  47  -1.728   2.345   1.297
  382    HE2  TYR  47           HE1      TYR  47  -4.069   5.535  -0.388
  383    HH   TYR  47           HH       TYR  47  -4.925   3.873   0.975
  384    H    VAL  48           H        VAL  48   3.024   4.142  -0.312
  385    HA   VAL  48           HA       VAL  48   2.209   3.197   2.234
  386    HB   VAL  48           HB       VAL  48   4.882   3.084   0.805
  387   HG11  VAL  48          HG11      VAL  48   5.577   1.297   2.329
  388   HG12  VAL  48          HG12      VAL  48   5.397   2.815   3.196
  389   HG13  VAL  48          HG13      VAL  48   4.134   1.570   3.329
  390   HG21  VAL  48          HG21      VAL  48   2.906   1.800  -0.154
  391   HG22  VAL  48          HG22      VAL  48   4.280   0.797   0.312
  392   HG23  VAL  48          HG23      VAL  48   2.845   0.883   1.351
  393    H    LYS  49           H        LYS  49   4.915   5.516   1.557
  394    HA   LYS  49           HA       LYS  49   5.395   6.104   4.310
  395    HB2  LYS  49           HB2      LYS  49   5.985   7.642   1.754
  396    HB3  LYS  49           HB3      LYS  49   6.542   8.169   3.352
  397    HG2  LYS  49           HG2      LYS  49   7.782   6.091   3.681
  398    HG3  LYS  49           HG3      LYS  49   7.180   5.432   2.151
  399    HD2  LYS  49           HD2      LYS  49   8.364   7.136   0.876
  400    HD3  LYS  49           HD3      LYS  49   8.885   7.942   2.365
  401    HE2  LYS  49           HE2      LYS  49  10.123   5.872   3.036
  402    HE3  LYS  49           HE3      LYS  49   9.615   5.097   1.533
  403    HZ1  LYS  49           HZ1      LYS  49  10.807   6.878   0.324
  404    HZ2  LYS  49           HZ2      LYS  49  11.839   6.012   1.254
  405    HZ3  LYS  49           HZ3      LYS  49  11.388   7.483   1.755
  406    H    ASN  50           H        ASN  50   3.023   7.538   2.133
  407    HA   ASN  50           HA       ASN  50   2.141   9.544   4.051
  408    HB2  ASN  50           HB2      ASN  50   1.433  10.390   2.140
  409    HB3  ASN  50           HB3      ASN  50   1.676   8.898   1.269
  410   HD21  ASN  50          HD21      ASN  50  -0.128   7.179   1.640
  411   HD22  ASN  50          HD22      ASN  50  -1.733   7.897   1.412
  412    H    CYS  51           H        CYS  51   1.514   6.152   3.895
  413    HA   CYS  51           HA       CYS  51  -1.083   6.435   5.360
  414    HB2  CYS  51           HB2      CYS  51  -1.144   5.534   3.075
  415    HB3  CYS  51           HB3      CYS  51  -0.012   4.253   3.521
  416    HG   CYS  51           HG       CYS  51  -2.677   3.582   3.234
  417    H    PHE  52           H        PHE  52   1.736   4.230   5.207
  418    HA   PHE  52           HA       PHE  52   2.197   4.167   8.026
  419    HB2  PHE  52           HB2      PHE  52   0.311   2.623   8.111
  420    HB3  PHE  52           HB3      PHE  52   0.918   1.716   6.737
  421    HD1  PHE  52           HD2      PHE  52   2.107   2.829  10.151
  422    HD2  PHE  52           HD1      PHE  52   1.996  -0.320   7.213
  423    HE1  PHE  52           HE2      PHE  52   3.266   1.313  11.731
  424    HE2  PHE  52           HE1      PHE  52   3.141  -1.845   8.808
  425    HZ   PHE  52           HZ       PHE  52   3.763  -1.034  11.068
  426    H    ARG  53           H        ARG  53   4.401   4.150   7.964
  427    HA   ARG  53           HA       ARG  53   5.703   3.920   5.445
  428    HB2  ARG  53           HB2      ARG  53   6.810   4.119   8.264
  429    HB3  ARG  53           HB3      ARG  53   7.798   4.294   6.814
  430    HG2  ARG  53           HG2      ARG  53   6.674   6.302   6.140
  431    HG3  ARG  53           HG3      ARG  53   5.402   6.103   7.359
  432    HD2  ARG  53           HD2      ARG  53   7.029   6.397   9.161
  433    HD3  ARG  53           HD3      ARG  53   8.350   6.536   8.006
  434    HE   ARG  53           HE       ARG  53   6.310   8.565   8.692
  435   HH11  ARG  53          HH11      ARG  53   8.917   7.825   6.422
  436   HH12  ARG  53          HH12      ARG  53   9.050   9.503   5.951
  437   HH21  ARG  53          HH21      ARG  53   6.840  10.715   8.234
  438   HH22  ARG  53          HH22      ARG  53   7.969  11.013   6.930
  439    H    MET  54           H        MET  54   5.211   1.404   7.699
  440    HA   MET  54           HA       MET  54   5.804  -0.728   7.954
  441    HB2  MET  54           HB2      MET  54   6.464  -0.609   4.993
  442    HB3  MET  54           HB3      MET  54   6.415  -2.082   5.966
  443    HG2  MET  54           HG2      MET  54   4.046  -1.471   6.610
  444    HG3  MET  54           HG3      MET  54   4.093  -0.240   5.345
  445    HE1  MET  54           HE1      MET  54   4.392  -2.425   2.089
  446    HE2  MET  54           HE2      MET  54   4.158  -0.791   2.750
  447    HE3  MET  54           HE3      MET  54   5.710  -1.634   2.979
  448    H    THR  55           H        THR  55   8.473   0.899   6.280
  449    HA   THR  55           HA       THR  55  10.695   0.747   6.348
  450    HB   THR  55           HB       THR  55  11.750   0.930   8.547
  451    HG1  THR  55           HG1      THR  55  10.807  -0.123  10.020
  452   HG21  THR  55          HG21      THR  55   9.146   2.494   8.336
  453   HG22  THR  55          HG22      THR  55  10.670   2.898   7.517
  454   HG23  THR  55          HG23      THR  55  10.583   2.923   9.286
  455    H    ASP  56           H        ASP  56   9.353  -2.029   6.220
  456    HA   ASP  56           HA       ASP  56  11.939  -3.542   6.364
  457    HB2  ASP  56           HB2      ASP  56   9.084  -4.573   6.549
  458    HB3  ASP  56           HB3      ASP  56  10.527  -5.562   6.418
  459    H    GLN  57           H        GLN  57  12.758  -3.826   4.326
  460    HA   GLN  57           HA       GLN  57  11.324  -3.278   1.959
  461    HB2  GLN  57           HB2      GLN  57  13.932  -3.659   2.535
  462    HB3  GLN  57           HB3      GLN  57  13.603  -5.238   1.829
  463    HG2  GLN  57           HG2      GLN  57  13.192  -2.495   0.553
  464    HG3  GLN  57           HG3      GLN  57  14.469  -3.640   0.163
  465   HE21  GLN  57          HE21      GLN  57  11.688  -2.431  -1.076
  466   HE22  GLN  57          HE22      GLN  57  11.054  -3.877  -1.872
  467    H    GLU  58           H        GLU  58  11.749  -6.372   3.636
  468    HA   GLU  58           HA       GLU  58  10.496  -8.161   1.842
  469    HB2  GLU  58           HB2      GLU  58   9.931  -9.462   3.941
  470    HB3  GLU  58           HB3      GLU  58  11.637  -9.070   3.696
  471    HG2  GLU  58           HG2      GLU  58  11.542  -7.266   5.309
  472    HG3  GLU  58           HG3      GLU  58   9.788  -7.435   5.464
  473    H    ALA  59           H        ALA  59   8.890  -5.977   4.243
  474    HA   ALA  59           HA       ALA  59   6.226  -6.955   3.569
  475    HB1  ALA  59           HB1      ALA  59   5.428  -5.123   4.909
  476    HB2  ALA  59           HB2      ALA  59   6.711  -5.997   5.774
  477    HB3  ALA  59           HB3      ALA  59   7.060  -4.420   5.012
  478    H    ILE  60           H        ILE  60   8.285  -4.185   2.525
  479    HA   ILE  60           HA       ILE  60   6.356  -2.868   0.892
  480    HB   ILE  60           HB       ILE  60   9.358  -3.040   0.830
  481   HG12  ILE  60          HG12      ILE  60   7.407  -0.788   1.462
  482   HG13  ILE  60          HG13      ILE  60   8.231  -1.801   2.648
  483   HG21  ILE  60          HG21      ILE  60   9.378  -1.240  -0.906
  484   HG22  ILE  60          HG22      ILE  60   8.680  -2.710  -1.548
  485   HG23  ILE  60          HG23      ILE  60   7.614  -1.373  -1.060
  486   HD11  ILE  60          HD11      ILE  60   9.496   0.231   0.783
  487   HD12  ILE  60          HD12      ILE  60   9.436   0.244   2.549
  488   HD13  ILE  60          HD13      ILE  60  10.439  -0.965   1.713
  489    H    GLN  61           H        GLN  61   8.573  -5.544  -0.085
  490    HA   GLN  61           HA       GLN  61   7.267  -5.712  -2.680
  491    HB2  GLN  61           HB2      GLN  61   8.657  -7.695  -3.065
  492    HB3  GLN  61           HB3      GLN  61   9.508  -6.231  -2.605
  493    HG2  GLN  61           HG2      GLN  61  10.717  -7.599  -1.326
  494    HG3  GLN  61           HG3      GLN  61   9.436  -7.345  -0.166
  495   HE21  GLN  61          HE21      GLN  61   8.301  -9.176   0.584
  496   HE22  GLN  61          HE22      GLN  61   8.623 -10.779  -0.058
  497    H    ASP  62           H        ASP  62   6.774  -7.565   0.352
  498    HA   ASP  62           HA       ASP  62   4.992  -9.532  -0.683
  499    HB2  ASP  62           HB2      ASP  62   6.045  -9.512   1.577
  500    HB3  ASP  62           HB3      ASP  62   5.022  -8.154   2.039
  501    H    LEU  63           H        LEU  63   4.336  -6.244   0.560
  502    HA   LEU  63           HA       LEU  63   1.491  -6.422   0.096
  503    HB2  LEU  63           HB2      LEU  63   3.396  -4.301   1.017
  504    HB3  LEU  63           HB3      LEU  63   1.811  -3.807   0.464
  505    HG   LEU  63           HG       LEU  63   1.932  -4.063   2.899
  506   HD11  LEU  63          HD11      LEU  63  -0.158  -5.232   3.210
  507   HD12  LEU  63          HD12      LEU  63   0.013  -6.075   1.661
  508   HD13  LEU  63          HD13      LEU  63  -0.225  -4.313   1.699
  509   HD21  LEU  63          HD21      LEU  63   2.027  -6.204   3.990
  510   HD22  LEU  63          HD22      LEU  63   3.467  -6.029   3.012
  511   HD23  LEU  63          HD23      LEU  63   2.142  -7.069   2.448
  512    H    TRP  64           H        TRP  64   4.237  -5.184  -1.871
  513    HA   TRP  64           HA       TRP  64   2.487  -3.916  -3.784
  514    HB2  TRP  64           HB2      TRP  64   4.972  -3.468  -3.480
  515    HB3  TRP  64           HB3      TRP  64   5.265  -4.961  -4.351
  516    HD1  TRP  64           HD1      TRP  64   2.723  -2.118  -5.168
  517    HE1  TRP  64           HE1      TRP  64   3.137  -1.309  -7.590
  518    HE3  TRP  64           HE3      TRP  64   6.910  -4.834  -6.260
  519    HZ2  TRP  64           HZ2      TRP  64   5.026  -1.747  -9.674
  520    HZ3  TRP  64           HZ3      TRP  64   8.051  -4.560  -8.451
  521    HH2  TRP  64           HH2      TRP  64   7.108  -3.035 -10.172
  522    H    GLN  65           H        GLN  65   3.753  -7.258  -3.542
  523    HA   GLN  65           HA       GLN  65   2.323  -8.097  -5.958
  524    HB2  GLN  65           HB2      GLN  65   3.702  -9.610  -3.725
  525    HB3  GLN  65           HB3      GLN  65   2.684 -10.411  -4.919
  526    HG2  GLN  65           HG2      GLN  65   4.684 -10.644  -5.968
  527    HG3  GLN  65           HG3      GLN  65   4.145  -9.157  -6.717
  528   HE21  GLN  65          HE21      GLN  65   5.521  -7.324  -6.483
  529   HE22  GLN  65          HE22      GLN  65   6.980  -7.369  -5.489
  530    H    TRP  66           H        TRP  66   1.436  -8.073  -2.437
  531    HA   TRP  66           HA       TRP  66  -1.090  -9.333  -2.767
  532    HB2  TRP  66           HB2      TRP  66  -0.016  -8.643  -0.582
  533    HB3  TRP  66           HB3      TRP  66  -0.536  -6.996  -0.904
  534    HD1  TRP  66           HD1      TRP  66  -3.327  -6.710  -1.148
  535    HE1  TRP  66           HE1      TRP  66  -5.214  -7.870   0.185
  536    HE3  TRP  66           HE3      TRP  66  -0.708 -10.704   0.700
  537    HZ2  TRP  66           HZ2      TRP  66  -5.551 -10.239   1.745
  538    HZ3  TRP  66           HZ3      TRP  66  -1.839 -12.378   2.146
  539    HH2  TRP  66           HH2      TRP  66  -4.257 -12.165   2.668
  540    H    ARG  67           H        ARG  67  -0.243  -5.885  -3.132
  541    HA   ARG  67           HA       ARG  67  -2.682  -4.835  -4.144
  542    HB2  ARG  67           HB2      ARG  67  -0.875  -3.444  -3.444
  543    HB3  ARG  67           HB3      ARG  67   0.237  -4.131  -4.589
  544    HG2  ARG  67           HG2      ARG  67  -2.152  -2.390  -5.302
  545    HG3  ARG  67           HG3      ARG  67  -0.496  -1.836  -5.128
  546    HD2  ARG  67           HD2      ARG  67  -1.647  -3.535  -7.332
  547    HD3  ARG  67           HD3      ARG  67  -0.899  -1.955  -7.427
  548    HE   ARG  67           HE       ARG  67   1.087  -3.744  -6.453
  549   HH11  ARG  67          HH11      ARG  67  -0.775  -3.445  -9.436
  550   HH12  ARG  67          HH12      ARG  67   0.413  -4.333 -10.348
  551   HH21  ARG  67          HH21      ARG  67   2.595  -4.751  -7.708
  552   HH22  ARG  67          HH22      ARG  67   2.336  -4.861  -9.439
  553    H    LYS  68           H        LYS  68  -0.021  -6.439  -5.959
  554    HA   LYS  68           HA       LYS  68  -1.126  -6.161  -8.547
  555    HB2  LYS  68           HB2      LYS  68   1.191  -7.131  -7.754
  556    HB3  LYS  68           HB3      LYS  68   0.349  -8.686  -7.734
  557    HG2  LYS  68           HG2      LYS  68  -0.318  -8.254 -10.155
  558    HG3  LYS  68           HG3      LYS  68   0.647  -6.782 -10.086
  559    HD2  LYS  68           HD2      LYS  68   2.131  -8.269 -11.064
  560    HD3  LYS  68           HD3      LYS  68   2.628  -8.297  -9.383
  561    HE2  LYS  68           HE2      LYS  68   2.641 -10.545 -10.209
  562    HE3  LYS  68           HE3      LYS  68   1.295 -10.431  -9.068
  563    HZ1  LYS  68           HZ1      LYS  68  -0.240 -10.445 -10.875
  564    HZ2  LYS  68           HZ2      LYS  68   0.881 -11.559 -11.334
  565    HZ3  LYS  68           HZ3      LYS  68   0.946 -10.098 -11.995
  566    H    SER  69           H        SER  69  -1.859  -8.637  -6.105
  567    HA   SER  69           HA       SER  69  -3.908  -9.795  -7.910
  568    HB2  SER  69           HB2      SER  69  -2.694 -10.877  -5.364
  569    HB3  SER  69           HB3      SER  69  -3.983 -11.667  -6.299
  570    HG   SER  69           HG       SER  69  -2.155 -12.501  -7.096
  571    H    LEU  70           H        LEU  70  -4.288  -7.201  -6.119
  572    HA   LEU  70           HA       LEU  70  -6.772  -7.857  -4.735
  573    HB2  LEU  70           HB2      LEU  70  -5.670  -5.208  -5.762
  574    HB3  LEU  70           HB3      LEU  70  -7.198  -5.362  -4.918
  575    HG   LEU  70           HG       LEU  70  -4.486  -6.024  -3.730
  576   HD11  LEU  70          HD11      LEU  70  -6.394  -3.719  -3.202
  577   HD12  LEU  70          HD12      LEU  70  -4.884  -3.611  -4.125
  578   HD13  LEU  70          HD13      LEU  70  -4.828  -4.003  -2.399
  579   HD21  LEU  70          HD21      LEU  70  -5.735  -6.107  -1.570
  580   HD22  LEU  70          HD22      LEU  70  -6.184  -7.403  -2.671
  581   HD23  LEU  70          HD23      LEU  70  -7.264  -6.009  -2.481
  Start of MODEL   12
    1    H    GLN   1           H1       GLN   1 -32.262   5.004  32.113
    2    HA   GLN   1           HA       GLN   1 -34.167   7.200  32.519
    3    HB2  GLN   1           HB2      GLN   1 -33.643   4.753  34.239
    4    HB3  GLN   1           HB3      GLN   1 -34.342   6.240  34.875
    5    HG2  GLN   1           HG2      GLN   1 -36.135   6.091  33.086
    6    HG3  GLN   1           HG3      GLN   1 -35.522   4.471  32.707
    7   HE21  GLN   1          HE21      GLN   1 -37.149   6.458  35.206
    8   HE22  GLN   1          HE22      GLN   1 -37.562   5.078  36.232
    9    H    GLU   2           H        GLU   2 -33.612   8.546  34.382
   10    HA   GLU   2           HA       GLU   2 -32.165  10.126  35.111
   11    HB2  GLU   2           HB2      GLU   2 -31.058   9.355  37.101
   12    HB3  GLU   2           HB3      GLU   2 -32.698   8.797  36.915
   13    HG2  GLU   2           HG2      GLU   2 -31.852   6.539  36.217
   14    HG3  GLU   2           HG3      GLU   2 -30.204   7.102  36.560
   15    H    SER   3           H        SER   3 -31.250   9.606  32.636
   16    HA   SER   3           HA       SER   3 -29.558   9.845  31.192
   17    HB2  SER   3           HB2      SER   3 -28.653  11.718  33.385
   18    HB3  SER   3           HB3      SER   3 -27.834  11.616  31.827
   19    HG   SER   3           HG       SER   3 -30.336  12.620  32.439
   20    H    PHE   4           H        PHE   4 -29.184   7.374  32.645
   21    HA   PHE   4           HA       PHE   4 -26.284   7.254  33.018
   22    HB2  PHE   4           HB2      PHE   4 -26.635   4.820  33.449
   23    HB3  PHE   4           HB3      PHE   4 -27.198   6.000  34.578
   24    HD1  PHE   4           HD1      PHE   4 -28.821   4.465  31.486
   25    HD2  PHE   4           HD2      PHE   4 -28.970   5.081  35.753
   26    HE1  PHE   4           HE1      PHE   4 -30.932   3.169  31.610
   27    HE2  PHE   4           HE2      PHE   4 -31.098   3.818  35.860
   28    HZ   PHE   4           HZ       PHE   4 -32.074   2.840  33.787
   29    H    LYS   5           H        LYS   5 -24.803   6.069  32.077
   30    HA   LYS   5           HA       LYS   5 -24.621   6.200  29.235
   31    HB2  LYS   5           HB2      LYS   5 -22.776   6.567  30.820
   32    HB3  LYS   5           HB3      LYS   5 -22.925   4.941  31.428
   33    HG2  LYS   5           HG2      LYS   5 -20.977   5.158  30.038
   34    HG3  LYS   5           HG3      LYS   5 -22.102   3.985  29.371
   35    HD2  LYS   5           HD2      LYS   5 -20.961   5.385  27.699
   36    HD3  LYS   5           HD3      LYS   5 -22.721   5.484  27.576
   37    HE2  LYS   5           HE2      LYS   5 -22.779   7.677  28.448
   38    HE3  LYS   5           HE3      LYS   5 -21.164   7.545  29.160
   39    HZ1  LYS   5           HZ1      LYS   5 -21.585   7.481  26.223
   40    HZ2  LYS   5           HZ2      LYS   5 -20.175   7.644  27.060
   41    HZ3  LYS   5           HZ3      LYS   5 -21.241   8.870  27.088
   42    H    LYS   6           H        LYS   6 -25.287   3.455  31.370
   43    HA   LYS   6           HA       LYS   6 -24.614   1.348  29.712
   44    HB2  LYS   6           HB2      LYS   6 -26.155  -0.038  31.079
   45    HB3  LYS   6           HB3      LYS   6 -25.039   0.965  31.996
   46    HG2  LYS   6           HG2      LYS   6 -26.818   2.568  32.522
   47    HG3  LYS   6           HG3      LYS   6 -27.968   1.670  31.510
   48    HD2  LYS   6           HD2      LYS   6 -27.844  -0.259  32.971
   49    HD3  LYS   6           HD3      LYS   6 -26.524   0.448  33.911
   50    HE2  LYS   6           HE2      LYS   6 -27.906   2.113  34.871
   51    HE3  LYS   6           HE3      LYS   6 -29.189   1.867  33.671
   52    HZ1  LYS   6           HZ1      LYS   6 -28.399  -0.233  35.588
   53    HZ2  LYS   6           HZ2      LYS   6 -29.716  -0.219  34.626
   54    HZ3  LYS   6           HZ3      LYS   6 -29.605   0.810  35.918
   55    H    GLN   7           H        GLN   7 -27.287   3.362  28.954
   56    HA   GLN   7           HA       GLN   7 -28.635   1.330  27.295
   57    HB2  GLN   7           HB2      GLN   7 -29.029   4.325  27.594
   58    HB3  GLN   7           HB3      GLN   7 -29.993   3.282  26.536
   59    HG2  GLN   7           HG2      GLN   7 -30.696   1.916  28.484
   60    HG3  GLN   7           HG3      GLN   7 -29.755   2.960  29.562
   61   HE21  GLN   7          HE21      GLN   7 -32.550   2.892  27.324
   62   HE22  GLN   7          HE22      GLN   7 -33.271   4.365  27.978
   63    H    GLU   8           H        GLU   8 -25.895   3.395  26.852
   64    HA   GLU   8           HA       GLU   8 -26.045   3.542  23.922
   65    HB2  GLU   8           HB2      GLU   8 -24.981   5.271  25.408
   66    HB3  GLU   8           HB3      GLU   8 -23.758   4.089  25.868
   67    HG2  GLU   8           HG2      GLU   8 -22.897   4.000  23.601
   68    HG3  GLU   8           HG3      GLU   8 -24.242   4.991  23.008
   69    H    LYS   9           H        LYS   9 -25.319   1.969  22.555
   70    HA   LYS   9           HA       LYS   9 -23.965  -0.459  23.725
   71    HB2  LYS   9           HB2      LYS   9 -25.996  -0.454  21.471
   72    HB3  LYS   9           HB3      LYS   9 -25.347  -1.838  22.335
   73    HG2  LYS   9           HG2      LYS   9 -27.281   0.248  23.401
   74    HG3  LYS   9           HG3      LYS   9 -27.646  -1.410  22.947
   75    HD2  LYS   9           HD2      LYS   9 -26.246  -2.270  24.786
   76    HD3  LYS   9           HD3      LYS   9 -25.854  -0.607  25.285
   77    HE2  LYS   9           HE2      LYS   9 -28.262  -0.134  25.630
   78    HE3  LYS   9           HE3      LYS   9 -28.663  -1.762  25.088
   79    HZ1  LYS   9           HZ1      LYS   9 -27.336  -2.614  26.995
   80    HZ2  LYS   9           HZ2      LYS   9 -28.626  -1.705  27.470
   81    HZ3  LYS   9           HZ3      LYS   9 -27.116  -1.078  27.519
   82    H    THR  10           H        THR  10 -24.270   1.553  20.798
   83    HA   THR  10           HA       THR  10 -21.929   0.141  19.597
   84    HB   THR  10           HB       THR  10 -23.098   0.174  17.404
   85    HG1  THR  10           HG1      THR  10 -25.254   0.434  17.325
   86   HG21  THR  10          HG21      THR  10 -23.005  -1.877  18.834
   87   HG22  THR  10          HG22      THR  10 -24.425  -1.804  17.777
   88   HG23  THR  10          HG23      THR  10 -24.593  -1.446  19.504
   89    HA   PRO  11           HA       PRO  11 -21.304   4.744  19.236
   90    HB2  PRO  11           HB2      PRO  11 -18.522   3.839  19.956
   91    HB3  PRO  11           HB3      PRO  11 -19.386   5.331  20.447
   92    HG2  PRO  11           HG2      PRO  11 -19.159   3.275  22.186
   93    HG3  PRO  11           HG3      PRO  11 -20.737   4.114  22.012
   94    HD2  PRO  11           HD2      PRO  11 -19.842   1.514  20.726
   95    HD3  PRO  11           HD3      PRO  11 -21.359   1.884  21.593
   96    H    LYS  12           H        LYS  12 -19.863   1.919  17.766
   97    HA   LYS  12           HA       LYS  12 -18.679   1.517  15.839
   98    HB2  LYS  12           HB2      LYS  12 -20.608   3.624  14.862
   99    HB3  LYS  12           HB3      LYS  12 -19.710   2.532  13.815
  100    HG2  LYS  12           HG2      LYS  12 -20.829   0.602  14.570
  101    HG3  LYS  12           HG3      LYS  12 -21.511   1.396  15.988
  102    HD2  LYS  12           HD2      LYS  12 -22.208   2.202  13.141
  103    HD3  LYS  12           HD3      LYS  12 -23.134   1.018  14.083
  104    HE2  LYS  12           HE2      LYS  12 -23.692   2.646  15.776
  105    HE3  LYS  12           HE3      LYS  12 -22.593   3.850  15.093
  106    HZ1  LYS  12           HZ1      LYS  12 -24.942   2.773  13.655
  107    HZ2  LYS  12           HZ2      LYS  12 -23.967   4.013  13.155
  108    HZ3  LYS  12           HZ3      LYS  12 -24.960   4.182  14.466
  109    H    THR  13           H        THR  13 -17.075   2.890  17.359
  110    HA   THR  13           HA       THR  13 -16.064   5.309  16.061
  111    HB   THR  13           HB       THR  13 -16.235   5.207  18.475
  112    HG1  THR  13           HG1      THR  13 -13.688   5.424  18.674
  113   HG21  THR  13          HG21      THR  13 -15.705   2.799  18.877
  114   HG22  THR  13          HG22      THR  13 -14.755   3.902  19.875
  115   HG23  THR  13          HG23      THR  13 -14.016   3.133  18.453
  116    HA   PRO  14           HA       PRO  14 -12.812   2.979  13.970
  117    HB2  PRO  14           HB2      PRO  14 -11.493   4.949  12.701
  118    HB3  PRO  14           HB3      PRO  14 -13.173   4.512  12.262
  119    HG2  PRO  14           HG2      PRO  14 -12.239   6.793  14.032
  120    HG3  PRO  14           HG3      PRO  14 -13.451   6.835  12.717
  121    HD2  PRO  14           HD2      PRO  14 -14.090   6.571  15.399
  122    HD3  PRO  14           HD3      PRO  14 -15.097   5.910  14.075
  123    H    LYS  15           H        LYS  15 -10.685   2.353  14.361
  124    HA   LYS  15           HA       LYS  15  -9.260   3.761  16.603
  125    HB2  LYS  15           HB2      LYS  15  -9.528   0.849  15.888
  126    HB3  LYS  15           HB3      LYS  15  -8.045   1.416  16.642
  127    HG2  LYS  15           HG2      LYS  15  -9.506   0.597  18.347
  128    HG3  LYS  15           HG3      LYS  15  -9.272   2.333  18.550
  129    HD2  LYS  15           HD2      LYS  15 -11.521   2.787  17.672
  130    HD3  LYS  15           HD3      LYS  15 -11.714   1.086  17.224
  131    HE2  LYS  15           HE2      LYS  15 -12.949   1.386  19.232
  132    HE3  LYS  15           HE3      LYS  15 -11.507   0.468  19.656
  133    HZ1  LYS  15           HZ1      LYS  15 -10.528   2.491  20.562
  134    HZ2  LYS  15           HZ2      LYS  15 -11.994   2.246  21.229
  135    HZ3  LYS  15           HZ3      LYS  15 -11.818   3.410  20.082
  136    H    GLY  16           H        GLY  16  -8.626   2.119  13.496
  137    HA2  GLY  16           HA2      GLY  16  -6.881   2.317  11.988
  138    HA3  GLY  16           HA3      GLY  16  -6.463   3.851  12.733
  139    HA   PRO  17           HA       PRO  17  -4.168   0.388  15.360
  140    HB2  PRO  17           HB2      PRO  17  -3.968  -1.672  13.162
  141    HB3  PRO  17           HB3      PRO  17  -3.971  -1.912  14.924
  142    HG2  PRO  17           HG2      PRO  17  -6.242  -2.319  13.498
  143    HG3  PRO  17           HG3      PRO  17  -6.316  -1.473  15.075
  144    HD2  PRO  17           HD2      PRO  17  -6.430  -0.298  12.318
  145    HD3  PRO  17           HD3      PRO  17  -7.322   0.157  13.791
  146    H    SER  18           H        SER  18  -1.913   0.321  15.504
  147    HA   SER  18           HA       SER  18  -0.497   1.917  13.513
  148    HB2  SER  18           HB2      SER  18   1.318   1.967  15.179
  149    HB3  SER  18           HB3      SER  18  -0.247   2.468  15.820
  150    HG   SER  18           HG       SER  18   0.443   1.143  17.323
  151    H    SER  19           H        SER  19  -1.188  -0.740  12.553
  152    HA   SER  19           HA       SER  19   1.494  -1.871  11.951
  153    HB2  SER  19           HB2      SER  19  -0.868  -3.450  13.057
  154    HB3  SER  19           HB3      SER  19   0.569  -4.167  12.315
  155    HG   SER  19           HG       SER  19   0.424  -2.655  14.705
  156    H    VAL  20           H        VAL  20   1.536  -3.307  10.145
  157    HA   VAL  20           HA       VAL  20   0.314  -2.614   7.793
  158    HB   VAL  20           HB       VAL  20   1.419  -5.282   8.719
  159   HG11  VAL  20          HG11      VAL  20   0.392  -4.628   5.934
  160   HG12  VAL  20          HG12      VAL  20   1.559  -5.926   6.278
  161   HG13  VAL  20          HG13      VAL  20  -0.063  -5.990   6.967
  162   HG21  VAL  20          HG21      VAL  20   2.996  -3.393   8.432
  163   HG22  VAL  20          HG22      VAL  20   3.288  -4.660   7.234
  164   HG23  VAL  20          HG23      VAL  20   2.439  -3.173   6.762
  165    H    GLU  21           H        GLU  21  -1.185  -4.980  10.076
  166    HA   GLU  21           HA       GLU  21  -3.205  -5.842   8.329
  167    HB2  GLU  21           HB2      GLU  21  -4.386  -6.659  10.205
  168    HB3  GLU  21           HB3      GLU  21  -2.659  -6.855  10.489
  169    HG2  GLU  21           HG2      GLU  21  -2.686  -4.878  12.000
  170    HG3  GLU  21           HG3      GLU  21  -4.442  -4.765  11.782
  171    H    ASP  22           H        ASP  22  -3.118  -2.767  10.065
  172    HA   ASP  22           HA       ASP  22  -5.856  -1.925   9.545
  173    HB2  ASP  22           HB2      ASP  22  -4.492  -0.793  11.228
  174    HB3  ASP  22           HB3      ASP  22  -3.256  -0.402  10.037
  175    H    ILE  23           H        ILE  23  -2.714  -1.284   7.966
  176    HA   ILE  23           HA       ILE  23  -3.771   0.269   5.842
  177    HB   ILE  23           HB       ILE  23  -1.187  -1.311   6.121
  178   HG12  ILE  23          HG12      ILE  23  -1.556   1.714   6.089
  179   HG13  ILE  23          HG13      ILE  23  -1.754   0.790   7.577
  180   HG21  ILE  23          HG21      ILE  23  -2.042   0.545   3.859
  181   HG22  ILE  23          HG22      ILE  23  -0.360   0.097   4.166
  182   HG23  ILE  23          HG23      ILE  23  -1.520  -1.155   3.737
  183   HD11  ILE  23          HD11      ILE  23   0.443   1.681   7.486
  184   HD12  ILE  23          HD12      ILE  23   0.548  -0.085   7.362
  185   HD13  ILE  23          HD13      ILE  23   0.782   0.933   5.915
  186    H    LYS  24           H        LYS  24  -3.130  -3.226   6.037
  187    HA   LYS  24           HA       LYS  24  -4.007  -4.001   3.430
  188    HB2  LYS  24           HB2      LYS  24  -4.159  -5.371   6.146
  189    HB3  LYS  24           HB3      LYS  24  -4.710  -6.154   4.676
  190    HG2  LYS  24           HG2      LYS  24  -1.860  -5.139   5.076
  191    HG3  LYS  24           HG3      LYS  24  -2.415  -6.778   5.432
  192    HD2  LYS  24           HD2      LYS  24  -3.199  -6.917   2.995
  193    HD3  LYS  24           HD3      LYS  24  -2.347  -5.391   2.722
  194    HE2  LYS  24           HE2      LYS  24  -0.924  -7.211   2.018
  195    HE3  LYS  24           HE3      LYS  24  -0.214  -6.473   3.457
  196    HZ1  LYS  24           HZ1      LYS  24  -1.896  -8.924   3.562
  197    HZ2  LYS  24           HZ2      LYS  24  -1.007  -8.298   4.770
  198    HZ3  LYS  24           HZ3      LYS  24  -0.221  -8.907   3.484
  199    H    ALA  25           H        ALA  25  -6.029  -3.861   6.441
  200    HA   ALA  25           HA       ALA  25  -8.447  -4.479   5.080
  201    HB1  ALA  25           HB1      ALA  25  -7.977  -2.968   7.692
  202    HB2  ALA  25           HB2      ALA  25  -9.521  -3.679   7.166
  203    HB3  ALA  25           HB3      ALA  25  -8.136  -4.725   7.497
  204    H    LYS  26           H        LYS  26  -7.057  -1.262   5.888
  205    HA   LYS  26           HA       LYS  26  -9.306   0.203   4.785
  206    HB2  LYS  26           HB2      LYS  26  -6.587   0.966   5.840
  207    HB3  LYS  26           HB3      LYS  26  -7.465   2.103   4.810
  208    HG2  LYS  26           HG2      LYS  26  -7.983   2.653   7.035
  209    HG3  LYS  26           HG3      LYS  26  -9.431   1.929   6.333
  210    HD2  LYS  26           HD2      LYS  26  -8.873  -0.229   7.498
  211    HD3  LYS  26           HD3      LYS  26  -7.417   0.541   8.128
  212    HE2  LYS  26           HE2      LYS  26  -8.987   2.344   9.102
  213    HE3  LYS  26           HE3      LYS  26 -10.320   1.227   8.760
  214    HZ1  LYS  26           HZ1      LYS  26  -9.251  -0.381  10.211
  215    HZ2  LYS  26           HZ2      LYS  26  -9.371   1.057  11.039
  216    HZ3  LYS  26           HZ3      LYS  26  -7.930   0.611  10.391
  217    H    MET  27           H        MET  27  -6.221  -0.874   3.283
  218    HA   MET  27           HA       MET  27  -6.840   0.379   0.746
  219    HB2  MET  27           HB2      MET  27  -5.070  -1.990   1.436
  220    HB3  MET  27           HB3      MET  27  -5.307  -1.394  -0.211
  221    HG2  MET  27           HG2      MET  27  -4.567   0.886   0.570
  222    HG3  MET  27           HG3      MET  27  -4.094   0.160   2.091
  223    HE1  MET  27           HE1      MET  27  -2.489  -2.241   1.899
  224    HE2  MET  27           HE2      MET  27  -3.045  -2.782   0.295
  225    HE3  MET  27           HE3      MET  27  -1.328  -2.453   0.565
  226    H    GLN  28           H        GLN  28  -7.719  -2.882   2.087
  227    HA   GLN  28           HA       GLN  28  -8.873  -3.773  -0.389
  228    HB2  GLN  28           HB2      GLN  28  -9.603  -4.679   2.425
  229    HB3  GLN  28           HB3      GLN  28 -10.018  -5.472   0.915
  230    HG2  GLN  28           HG2      GLN  28  -7.456  -5.536   2.410
  231    HG3  GLN  28           HG3      GLN  28  -8.265  -6.781   1.527
  232   HE21  GLN  28          HE21      GLN  28  -5.799  -4.344   1.346
  233   HE22  GLN  28          HE22      GLN  28  -5.349  -4.681  -0.347
  234    H    ALA  29           H        ALA  29 -10.376  -2.072   2.401
  235    HA   ALA  29           HA       ALA  29 -12.998  -1.906   1.234
  236    HB1  ALA  29           HB1      ALA  29 -11.559  -0.065   3.190
  237    HB2  ALA  29           HB2      ALA  29 -13.299  -0.031   2.829
  238    HB3  ALA  29           HB3      ALA  29 -12.586  -1.460   3.596
  239    H    SER  30           H        SER  30 -10.232   0.452   1.125
  240    HA   SER  30           HA       SER  30 -11.440   2.359  -0.515
  241    HB2  SER  30           HB2      SER  30  -8.515   1.530  -0.377
  242    HB3  SER  30           HB3      SER  30  -9.105   2.994  -1.183
  243    HG   SER  30           HG       SER  30  -8.390   2.986   1.207
  244    H    ILE  31           H        ILE  31  -9.519  -0.471  -1.631
  245    HA   ILE  31           HA       ILE  31  -9.787   0.230  -4.396
  246    HB   ILE  31           HB       ILE  31  -7.894  -0.998  -3.172
  247   HG12  ILE  31          HG12      ILE  31  -8.825  -2.083  -5.857
  248   HG13  ILE  31          HG13      ILE  31  -7.969  -0.561  -5.596
  249   HG21  ILE  31          HG21      ILE  31  -9.457  -2.816  -2.268
  250   HG22  ILE  31          HG22      ILE  31  -9.444  -3.522  -3.891
  251   HG23  ILE  31          HG23      ILE  31  -7.938  -3.368  -2.966
  252   HD11  ILE  31          HD11      ILE  31  -6.880  -3.356  -5.049
  253   HD12  ILE  31          HD12      ILE  31  -6.400  -2.237  -6.328
  254   HD13  ILE  31          HD13      ILE  31  -6.043  -1.838  -4.636
  255    H    GLU  32           H        GLU  32 -11.828  -1.767  -2.321
  256    HA   GLU  32           HA       GLU  32 -13.327  -2.778  -4.694
  257    HB2  GLU  32           HB2      GLU  32 -13.638  -3.286  -1.730
  258    HB3  GLU  32           HB3      GLU  32 -14.716  -3.933  -2.958
  259    HG2  GLU  32           HG2      GLU  32 -11.714  -4.480  -2.838
  260    HG3  GLU  32           HG3      GLU  32 -12.967  -5.557  -2.248
  261    H    LYS  33           H        LYS  33 -13.409  -0.006  -2.710
  262    HA   LYS  33           HA       LYS  33 -16.249   0.565  -3.480
  263    HB2  LYS  33           HB2      LYS  33 -14.829   1.401  -0.941
  264    HB3  LYS  33           HB3      LYS  33 -16.512   1.704  -1.357
  265    HG2  LYS  33           HG2      LYS  33 -17.011  -0.713  -1.333
  266    HG3  LYS  33           HG3      LYS  33 -15.323  -1.086  -1.005
  267    HD2  LYS  33           HD2      LYS  33 -16.383  -1.288   1.051
  268    HD3  LYS  33           HD3      LYS  33 -15.487   0.233   1.135
  269    HE2  LYS  33           HE2      LYS  33 -17.615   1.470   0.631
  270    HE3  LYS  33           HE3      LYS  33 -18.476  -0.079   0.574
  271    HZ1  LYS  33           HZ1      LYS  33 -17.755  -0.435   2.906
  272    HZ2  LYS  33           HZ2      LYS  33 -18.714   0.917   2.736
  273    HZ3  LYS  33           HZ3      LYS  33 -17.095   1.076   2.926
  274    H    GLY  34           H        GLY  34 -13.435   1.550  -4.652
  275    HA2  GLY  34           HA2      GLY  34 -14.327   3.668  -6.022
  276    HA3  GLY  34           HA3      GLY  34 -13.891   4.473  -4.517
  277    H    GLY  35           H        GLY  35 -11.462   2.277  -4.651
  278    HA2  GLY  35           HA2      GLY  35  -9.524   2.093  -6.098
  279    HA3  GLY  35           HA3      GLY  35  -9.787   3.725  -6.673
  280    H    SER  36           H        SER  36  -8.674   5.332  -5.717
  281    HA   SER  36           HA       SER  36  -7.033   6.383  -4.613
  282    HB2  SER  36           HB2      SER  36  -7.533   4.652  -2.184
  283    HB3  SER  36           HB3      SER  36  -6.730   6.229  -2.258
  284    HG   SER  36           HG       SER  36  -8.850   6.967  -3.195
  285    H    LEU  37           H        LEU  37  -4.922   5.999  -3.309
  286    HA   LEU  37           HA       LEU  37  -2.880   5.290  -3.128
  287    HB2  LEU  37           HB2      LEU  37  -3.973   2.544  -3.810
  288    HB3  LEU  37           HB3      LEU  37  -2.272   2.820  -3.589
  289    HG   LEU  37           HG       LEU  37  -3.286   1.887  -1.616
  290   HD11  LEU  37          HD11      LEU  37  -1.296   3.355  -1.402
  291   HD12  LEU  37          HD12      LEU  37  -2.317   3.350   0.040
  292   HD13  LEU  37          HD13      LEU  37  -2.368   4.731  -1.058
  293   HD21  LEU  37          HD21      LEU  37  -5.541   2.928  -1.739
  294   HD22  LEU  37          HD22      LEU  37  -4.826   4.473  -1.205
  295   HD23  LEU  37          HD23      LEU  37  -4.785   3.064  -0.145
  296    HA   PRO  38           HA       PRO  38  -0.808   6.034  -6.876
  297    HB2  PRO  38           HB2      PRO  38   1.305   4.093  -5.934
  298    HB3  PRO  38           HB3      PRO  38   1.525   5.702  -6.681
  299    HG2  PRO  38           HG2      PRO  38   1.682   5.484  -4.013
  300    HG3  PRO  38           HG3      PRO  38   0.699   6.806  -4.711
  301    HD2  PRO  38           HD2      PRO  38  -0.243   4.151  -3.599
  302    HD3  PRO  38           HD3      PRO  38  -0.894   5.793  -3.335
  303    H    LYS  39           H        LYS  39  -0.164   5.315  -8.892
  304    HA   LYS  39           HA       LYS  39  -1.406   2.777  -9.842
  305    HB2  LYS  39           HB2      LYS  39  -2.214   4.961 -10.668
  306    HB3  LYS  39           HB3      LYS  39  -0.590   5.400 -11.160
  307    HG2  LYS  39           HG2      LYS  39  -1.895   4.949 -13.065
  308    HG3  LYS  39           HG3      LYS  39  -0.648   3.741 -12.984
  309    HD2  LYS  39           HD2      LYS  39  -3.497   3.251 -11.995
  310    HD3  LYS  39           HD3      LYS  39  -3.059   3.075 -13.686
  311    HE2  LYS  39           HE2      LYS  39  -1.886   1.445 -11.399
  312    HE3  LYS  39           HE3      LYS  39  -3.134   0.921 -12.532
  313    HZ1  LYS  39           HZ1      LYS  39  -0.295   1.468 -13.116
  314    HZ2  LYS  39           HZ2      LYS  39  -1.442   1.328 -14.331
  315    HZ3  LYS  39           HZ3      LYS  39  -1.126   0.079 -13.360
  316    H    VAL  40           H        VAL  40   1.724   3.858  -9.130
  317    HA   VAL  40           HA       VAL  40   2.927   1.756 -10.813
  318    HB   VAL  40           HB       VAL  40   2.940   3.756 -12.209
  319   HG11  VAL  40          HG11      VAL  40   4.328   5.698 -11.685
  320   HG12  VAL  40          HG12      VAL  40   3.040   5.510 -10.488
  321   HG13  VAL  40          HG13      VAL  40   4.708   5.020 -10.089
  322   HG21  VAL  40          HG21      VAL  40   4.764   2.115 -12.442
  323   HG22  VAL  40          HG22      VAL  40   5.272   3.759 -12.851
  324   HG23  VAL  40          HG23      VAL  40   5.751   3.060 -11.300
  325    H    GLU  41           H        GLU  41   4.831   0.932 -10.133
  326    HA   GLU  41           HA       GLU  41   4.895   0.454  -7.432
  327    HB2  GLU  41           HB2      GLU  41   5.701  -1.008  -9.222
  328    HB3  GLU  41           HB3      GLU  41   7.088   0.053  -9.484
  329    HG2  GLU  41           HG2      GLU  41   7.874  -0.462  -7.163
  330    HG3  GLU  41           HG3      GLU  41   6.474  -1.528  -6.952
  331    H    ALA  42           H        ALA  42   7.487   2.487  -9.068
  332    HA   ALA  42           HA       ALA  42   8.919   2.841  -6.651
  333    HB1  ALA  42           HB1      ALA  42  10.123   4.596  -7.809
  334    HB2  ALA  42           HB2      ALA  42   9.788   3.288  -8.959
  335    HB3  ALA  42           HB3      ALA  42   8.818   4.779  -8.984
  336    H    LYS  43           H        LYS  43   6.263   4.793  -7.988
  337    HA   LYS  43           HA       LYS  43   6.242   6.846  -5.938
  338    HB2  LYS  43           HB2      LYS  43   3.965   5.810  -7.694
  339    HB3  LYS  43           HB3      LYS  43   3.914   7.239  -6.652
  340    HG2  LYS  43           HG2      LYS  43   5.906   8.137  -7.952
  341    HG3  LYS  43           HG3      LYS  43   5.658   6.815  -9.097
  342    HD2  LYS  43           HD2      LYS  43   3.301   7.603  -9.445
  343    HD3  LYS  43           HD3      LYS  43   3.603   8.938  -8.324
  344    HE2  LYS  43           HE2      LYS  43   5.434   9.743  -9.834
  345    HE3  LYS  43           HE3      LYS  43   5.009   8.469 -10.993
  346    HZ1  LYS  43           HZ1      LYS  43   3.152  10.591 -10.032
  347    HZ2  LYS  43           HZ2      LYS  43   2.773   9.448 -11.132
  348    HZ3  LYS  43           HZ3      LYS  43   3.891  10.615 -11.477
  349    H    PHE  44           H        PHE  44   4.679   3.634  -6.211
  350    HA   PHE  44           HA       PHE  44   3.179   3.901  -3.808
  351    HB2  PHE  44           HB2      PHE  44   2.722   2.223  -5.590
  352    HB3  PHE  44           HB3      PHE  44   4.182   1.357  -5.151
  353    HD1  PHE  44           HD1      PHE  44   0.751   2.236  -4.094
  354    HD2  PHE  44           HD2      PHE  44   4.295  -0.016  -3.119
  355    HE1  PHE  44           HE1      PHE  44  -0.517   0.990  -2.352
  356    HE2  PHE  44           HE2      PHE  44   3.021  -1.286  -1.416
  357    HZ   PHE  44           HZ       PHE  44   0.601  -0.788  -1.038
  358    H    ILE  45           H        ILE  45   6.455   2.535  -4.362
  359    HA   ILE  45           HA       ILE  45   7.035   1.830  -1.655
  360    HB   ILE  45           HB       ILE  45   8.903   2.798  -3.860
  361   HG12  ILE  45          HG12      ILE  45   8.327  -0.051  -2.928
  362   HG13  ILE  45          HG13      ILE  45   7.558   0.673  -4.317
  363   HG21  ILE  45          HG21      ILE  45  10.725   1.736  -2.545
  364   HG22  ILE  45          HG22      ILE  45   9.987   3.042  -1.645
  365   HG23  ILE  45          HG23      ILE  45   9.572   1.361  -1.247
  366   HD11  ILE  45          HD11      ILE  45  10.525   0.085  -4.032
  367   HD12  ILE  45          HD12      ILE  45   9.354  -0.697  -5.097
  368   HD13  ILE  45          HD13      ILE  45   9.803   0.995  -5.382
  369    H    ASN  46           H        ASN  46   7.612   4.947  -3.365
  370    HA   ASN  46           HA       ASN  46   8.533   6.419  -1.095
  371    HB2  ASN  46           HB2      ASN  46   8.968   7.454  -3.111
  372    HB3  ASN  46           HB3      ASN  46   7.424   7.015  -3.826
  373   HD21  ASN  46          HD21      ASN  46   5.564   8.275  -3.422
  374   HD22  ASN  46          HD22      ASN  46   5.713   9.905  -2.786
  375    H    TYR  47           H        TYR  47   5.168   5.889  -2.253
  376    HA   TYR  47           HA       TYR  47   3.912   7.634  -0.405
  377    HB2  TYR  47           HB2      TYR  47   2.839   6.745  -2.390
  378    HB3  TYR  47           HB3      TYR  47   2.803   5.125  -1.687
  379    HD1  TYR  47           HD1      TYR  47   1.328   4.646   0.309
  380    HD2  TYR  47           HD2      TYR  47   1.272   8.462  -1.718
  381    HE1  TYR  47           HE1      TYR  47  -0.782   5.250   1.483
  382    HE2  TYR  47           HE2      TYR  47  -0.855   9.031  -0.580
  383    HH   TYR  47           HH       TYR  47  -2.406   8.401   0.941
  384    H    VAL  48           H        VAL  48   4.443   4.067  -0.141
  385    HA   VAL  48           HA       VAL  48   3.503   3.785   2.533
  386    HB   VAL  48           HB       VAL  48   5.592   2.207   0.976
  387   HG11  VAL  48          HG11      VAL  48   4.314   1.596   3.675
  388   HG12  VAL  48          HG12      VAL  48   5.131   0.386   2.665
  389   HG13  VAL  48          HG13      VAL  48   6.052   1.748   3.305
  390   HG21  VAL  48          HG21      VAL  48   3.290   2.124   0.052
  391   HG22  VAL  48          HG22      VAL  48   3.746   0.571   0.750
  392   HG23  VAL  48          HG23      VAL  48   2.662   1.663   1.645
  393    H    LYS  49           H        LYS  49   6.872   4.454   1.411
  394    HA   LYS  49           HA       LYS  49   7.946   4.523   4.077
  395    HB2  LYS  49           HB2      LYS  49   8.967   5.532   1.396
  396    HB3  LYS  49           HB3      LYS  49   9.893   5.687   2.892
  397    HG2  LYS  49           HG2      LYS  49   9.773   3.234   3.257
  398    HG3  LYS  49           HG3      LYS  49   8.915   3.044   1.714
  399    HD2  LYS  49           HD2      LYS  49  10.820   4.025   0.511
  400    HD3  LYS  49           HD3      LYS  49  11.660   4.315   2.051
  401    HE2  LYS  49           HE2      LYS  49  11.567   1.820   2.481
  402    HE3  LYS  49           HE3      LYS  49  10.942   1.624   0.834
  403    HZ1  LYS  49           HZ1      LYS  49  13.597   2.718   1.602
  404    HZ2  LYS  49           HZ2      LYS  49  13.020   2.744   0.060
  405    HZ3  LYS  49           HZ3      LYS  49  13.288   1.309   0.849
  406    H    ASN  50           H        ASN  50   6.251   7.057   2.381
  407    HA   ASN  50           HA       ASN  50   7.070   8.932   4.554
  408    HB2  ASN  50           HB2      ASN  50   7.025  10.642   3.177
  409    HB3  ASN  50           HB3      ASN  50   7.261   9.419   1.941
  410   HD21  ASN  50          HD21      ASN  50   5.155   8.604   0.903
  411   HD22  ASN  50          HD22      ASN  50   3.980   9.890   0.571
  412    H    CYS  51           H        CYS  51   4.343   7.055   3.643
  413    HA   CYS  51           HA       CYS  51   2.561   8.707   5.358
  414    HB2  CYS  51           HB2      CYS  51   1.911   6.536   3.329
  415    HB3  CYS  51           HB3      CYS  51   0.741   7.469   4.266
  416    HG   CYS  51           HG       CYS  51   2.958   8.481   2.058
  417    H    PHE  52           H        PHE  52   4.344   5.750   5.565
  418    HA   PHE  52           HA       PHE  52   3.041   5.200   8.162
  419    HB2  PHE  52           HB2      PHE  52   1.931   3.708   6.650
  420    HB3  PHE  52           HB3      PHE  52   3.427   3.193   5.912
  421    HD1  PHE  52           HD2      PHE  52   1.989   3.365   9.413
  422    HD2  PHE  52           HD1      PHE  52   4.022   0.995   6.438
  423    HE1  PHE  52           HE2      PHE  52   2.082   1.455  10.999
  424    HE2  PHE  52           HE1      PHE  52   4.034  -0.935   8.006
  425    HZ   PHE  52           HZ       PHE  52   3.110  -0.696  10.292
  426    H    ARG  53           H        ARG  53   4.356   3.528   9.381
  427    HA   ARG  53           HA       ARG  53   6.984   4.772   9.752
  428    HB2  ARG  53           HB2      ARG  53   5.467   2.762  11.475
  429    HB3  ARG  53           HB3      ARG  53   6.883   3.689  11.956
  430    HG2  ARG  53           HG2      ARG  53   4.111   4.810  11.362
  431    HG3  ARG  53           HG3      ARG  53   4.901   4.672  12.938
  432    HD2  ARG  53           HD2      ARG  53   6.695   6.231  12.139
  433    HD3  ARG  53           HD3      ARG  53   5.815   6.398  10.606
  434    HE   ARG  53           HE       ARG  53   4.070   7.074  12.792
  435   HH11  ARG  53          HH11      ARG  53   6.735   8.413  10.877
  436   HH12  ARG  53          HH12      ARG  53   6.132  10.046  11.152
  437   HH21  ARG  53          HH21      ARG  53   3.522   9.125  13.109
  438   HH22  ARG  53          HH22      ARG  53   4.464  10.444  12.368
  439    H    MET  54           H        MET  54   6.098   1.822   8.253
  440    HA   MET  54           HA       MET  54   8.660   0.508   8.967
  441    HB2  MET  54           HB2      MET  54   6.283  -0.387   7.315
  442    HB3  MET  54           HB3      MET  54   7.789  -1.294   7.388
  443    HG2  MET  54           HG2      MET  54   7.604  -1.341   9.903
  444    HG3  MET  54           HG3      MET  54   6.023  -0.579   9.757
  445    HE1  MET  54           HE1      MET  54   8.103  -3.827   9.631
  446    HE2  MET  54           HE2      MET  54   7.120  -4.927   8.641
  447    HE3  MET  54           HE3      MET  54   7.944  -3.552   7.881
  448    H    THR  55           H        THR  55  10.089  -0.339   7.408
  449    HA   THR  55           HA       THR  55  10.257   1.041   4.770
  450    HB   THR  55           HB       THR  55  12.748   1.249   5.125
  451    HG1  THR  55           HG1      THR  55  13.121  -0.030   6.873
  452   HG21  THR  55          HG21      THR  55  11.090   2.856   7.112
  453   HG22  THR  55          HG22      THR  55  11.178   3.193   5.368
  454   HG23  THR  55          HG23      THR  55  12.632   3.315   6.369
  455    H    ASP  56           H        ASP  56  10.346  -1.912   6.450
  456    HA   ASP  56           HA       ASP  56  12.195  -3.442   4.999
  457    HB2  ASP  56           HB2      ASP  56   9.595  -4.100   6.387
  458    HB3  ASP  56           HB3      ASP  56  10.416  -5.339   5.455
  459    H    GLN  57           H        GLN  57  12.350  -4.254   3.032
  460    HA   GLN  57           HA       GLN  57  10.445  -3.408   1.084
  461    HB2  GLN  57           HB2      GLN  57  12.982  -3.629   0.811
  462    HB3  GLN  57           HB3      GLN  57  12.710  -5.358   0.572
  463    HG2  GLN  57           HG2      GLN  57  12.870  -4.098  -1.576
  464    HG3  GLN  57           HG3      GLN  57  11.313  -4.896  -1.389
  465   HE21  GLN  57          HE21      GLN  57  10.485  -3.361  -3.004
  466   HE22  GLN  57          HE22      GLN  57   9.854  -1.837  -2.345
  467    H    GLU  58           H        GLU  58  10.865  -6.477   2.749
  468    HA   GLU  58           HA       GLU  58   9.089  -8.080   1.198
  469    HB2  GLU  58           HB2      GLU  58  10.450  -9.056   2.962
  470    HB3  GLU  58           HB3      GLU  58   9.686  -8.038   4.177
  471    HG2  GLU  58           HG2      GLU  58   8.772 -10.230   4.391
  472    HG3  GLU  58           HG3      GLU  58   7.511  -9.193   3.818
  473    H    ALA  59           H        ALA  59   8.301  -5.878   4.000
  474    HA   ALA  59           HA       ALA  59   5.463  -6.484   3.779
  475    HB1  ALA  59           HB1      ALA  59   6.453  -5.802   5.886
  476    HB2  ALA  59           HB2      ALA  59   6.866  -4.204   5.197
  477    HB3  ALA  59           HB3      ALA  59   5.157  -4.688   5.360
  478    H    ILE  60           H        ILE  60   7.568  -3.873   2.521
  479    HA   ILE  60           HA       ILE  60   5.603  -2.231   1.287
  480    HB   ILE  60           HB       ILE  60   8.481  -2.853   0.721
  481   HG12  ILE  60          HG12      ILE  60   7.113  -0.318   1.703
  482   HG13  ILE  60          HG13      ILE  60   7.718  -1.573   2.786
  483   HG21  ILE  60          HG21      ILE  60   6.745  -0.800  -0.739
  484   HG22  ILE  60          HG22      ILE  60   8.516  -0.913  -0.837
  485   HG23  ILE  60          HG23      ILE  60   7.531  -2.217  -1.472
  486   HD11  ILE  60          HD11      ILE  60   9.356   0.175   2.666
  487   HD12  ILE  60          HD12      ILE  60  10.004  -1.260   1.845
  488   HD13  ILE  60          HD13      ILE  60   9.396   0.116   0.899
  489    H    GLN  61           H        GLN  61   7.210  -5.163  -0.127
  490    HA   GLN  61           HA       GLN  61   5.427  -4.956  -2.430
  491    HB2  GLN  61           HB2      GLN  61   6.537  -6.825  -3.359
  492    HB3  GLN  61           HB3      GLN  61   7.705  -5.693  -2.691
  493    HG2  GLN  61           HG2      GLN  61   8.535  -7.790  -2.093
  494    HG3  GLN  61           HG3      GLN  61   7.818  -7.161  -0.627
  495   HE21  GLN  61          HE21      GLN  61   6.781  -8.755   0.502
  496   HE22  GLN  61          HE22      GLN  61   6.020 -10.169  -0.210
  497    H    ASP  62           H        ASP  62   5.174  -6.755   0.648
  498    HA   ASP  62           HA       ASP  62   3.006  -8.448  -0.276
  499    HB2  ASP  62           HB2      ASP  62   4.385  -8.771   1.813
  500    HB3  ASP  62           HB3      ASP  62   3.523  -7.425   2.539
  501    H    LEU  63           H        LEU  63   3.171  -5.188   1.157
  502    HA   LEU  63           HA       LEU  63   0.420  -4.488   1.061
  503    HB2  LEU  63           HB2      LEU  63   3.044  -3.082   1.182
  504    HB3  LEU  63           HB3      LEU  63   1.730  -2.154   0.486
  505    HG   LEU  63           HG       LEU  63   0.348  -2.512   2.504
  506   HD11  LEU  63          HD11      LEU  63   1.360  -3.246   4.574
  507   HD12  LEU  63          HD12      LEU  63   2.866  -3.666   3.754
  508   HD13  LEU  63          HD13      LEU  63   1.386  -4.583   3.402
  509   HD21  LEU  63          HD21      LEU  63   1.681  -0.482   2.250
  510   HD22  LEU  63          HD22      LEU  63   3.113  -1.296   2.924
  511   HD23  LEU  63          HD23      LEU  63   1.700  -0.983   3.949
  512    H    TRP  64           H        TRP  64   3.019  -4.130  -1.441
  513    HA   TRP  64           HA       TRP  64   1.354  -2.929  -3.396
  514    HB2  TRP  64           HB2      TRP  64   3.921  -3.036  -3.344
  515    HB3  TRP  64           HB3      TRP  64   3.774  -4.646  -4.012
  516    HD1  TRP  64           HD1      TRP  64   2.072  -1.285  -4.992
  517    HE1  TRP  64           HE1      TRP  64   2.252  -0.968  -7.550
  518    HE3  TRP  64           HE3      TRP  64   4.810  -5.462  -6.145
  519    HZ2  TRP  64           HZ2      TRP  64   3.471  -2.311  -9.759
  520    HZ3  TRP  64           HZ3      TRP  64   5.426  -5.936  -8.502
  521    HH2  TRP  64           HH2      TRP  64   4.780  -4.367 -10.310
  522    H    GLN  65           H        GLN  65   2.195  -6.410  -3.013
  523    HA   GLN  65           HA       GLN  65   0.528  -7.406  -5.128
  524    HB2  GLN  65           HB2      GLN  65   1.786  -8.495  -2.627
  525    HB3  GLN  65           HB3      GLN  65   0.447  -9.397  -3.307
  526    HG2  GLN  65           HG2      GLN  65   2.736 -10.125  -4.061
  527    HG3  GLN  65           HG3      GLN  65   1.527  -9.877  -5.298
  528   HE21  GLN  65          HE21      GLN  65   4.136  -7.881  -3.696
  529   HE22  GLN  65          HE22      GLN  65   4.822  -7.411  -5.250
  530    H    TRP  66           H        TRP  66  -0.268  -6.553  -1.715
  531    HA   TRP  66           HA       TRP  66  -3.105  -7.039  -2.190
  532    HB2  TRP  66           HB2      TRP  66  -1.456  -6.340   0.171
  533    HB3  TRP  66           HB3      TRP  66  -3.114  -5.799   0.190
  534    HD1  TRP  66           HD1      TRP  66  -4.850  -7.396   0.982
  535    HE1  TRP  66           HE1      TRP  66  -5.176  -9.911   1.168
  536    HE3  TRP  66           HE3      TRP  66  -0.381  -8.944  -1.015
  537    HZ2  TRP  66           HZ2      TRP  66  -3.779 -12.306   0.366
  538    HZ3  TRP  66           HZ3      TRP  66   0.022 -11.354  -1.423
  539    HH2  TRP  66           HH2      TRP  66  -1.666 -13.046  -0.745
  540    H    ARG  67           H        ARG  67  -1.490  -4.770  -3.663
  541    HA   ARG  67           HA       ARG  67  -4.187  -3.597  -4.010
  542    HB2  ARG  67           HB2      ARG  67  -3.548  -1.411  -4.464
  543    HB3  ARG  67           HB3      ARG  67  -2.758  -1.875  -2.982
  544    HG2  ARG  67           HG2      ARG  67  -1.134  -0.652  -4.060
  545    HG3  ARG  67           HG3      ARG  67  -0.647  -2.301  -4.383
  546    HD2  ARG  67           HD2      ARG  67  -0.287  -1.117  -6.383
  547    HD3  ARG  67           HD3      ARG  67  -1.746  -2.023  -6.703
  548    HE   ARG  67           HE       ARG  67  -1.424   0.883  -6.537
  549   HH11  ARG  67          HH11      ARG  67  -3.901  -1.676  -6.801
  550   HH12  ARG  67          HH12      ARG  67  -4.977  -0.507  -7.518
  551   HH21  ARG  67          HH21      ARG  67  -2.911   2.129  -7.432
  552   HH22  ARG  67          HH22      ARG  67  -4.486   1.476  -7.849
  553    H    LYS  68           H        LYS  68  -1.490  -5.095  -5.671
  554    HA   LYS  68           HA       LYS  68  -3.115  -4.876  -8.190
  555    HB2  LYS  68           HB2      LYS  68  -1.046  -4.636  -9.514
  556    HB3  LYS  68           HB3      LYS  68  -1.485  -3.286  -8.516
  557    HG2  LYS  68           HG2      LYS  68   0.912  -3.624  -8.536
  558    HG3  LYS  68           HG3      LYS  68   0.262  -3.757  -6.924
  559    HD2  LYS  68           HD2      LYS  68   1.886  -5.489  -7.096
  560    HD3  LYS  68           HD3      LYS  68   0.355  -6.326  -7.234
  561    HE2  LYS  68           HE2      LYS  68   0.613  -6.094  -9.788
  562    HE3  LYS  68           HE3      LYS  68   2.245  -5.485  -9.477
  563    HZ1  LYS  68           HZ1      LYS  68   1.188  -8.171  -8.814
  564    HZ2  LYS  68           HZ2      LYS  68   2.619  -7.647  -8.257
  565    HZ3  LYS  68           HZ3      LYS  68   2.387  -7.805  -9.897
  566    H    SER  69           H        SER  69  -2.462  -7.217  -6.168
  567    HA   SER  69           HA       SER  69  -2.394  -9.245  -8.362
  568    HB2  SER  69           HB2      SER  69  -0.892  -9.425  -5.728
  569    HB3  SER  69           HB3      SER  69  -1.039 -10.713  -6.935
  570    HG   SER  69           HG       SER  69   0.781  -9.825  -7.490
  571    H    LEU  70           H        LEU  70  -4.735  -8.404  -7.655
  572    HA   LEU  70           HA       LEU  70  -5.934 -10.333  -5.707
  573    HB2  LEU  70           HB2      LEU  70  -6.512  -7.368  -6.105
  574    HB3  LEU  70           HB3      LEU  70  -7.430  -8.430  -5.053
  575    HG   LEU  70           HG       LEU  70  -4.482  -7.751  -4.658
  576   HD11  LEU  70          HD11      LEU  70  -7.016  -6.643  -3.403
  577   HD12  LEU  70          HD12      LEU  70  -5.852  -5.765  -4.415
  578   HD13  LEU  70          HD13      LEU  70  -5.387  -6.341  -2.802
  579   HD21  LEU  70          HD21      LEU  70  -6.525  -9.119  -2.854
  580   HD22  LEU  70          HD22      LEU  70  -4.879  -8.657  -2.382
  581   HD23  LEU  70          HD23      LEU  70  -5.112  -9.895  -3.624
  Start of MODEL   13
    1    H    GLN   1           H1       GLN   1 -38.055  -0.509  29.523
    2    HA   GLN   1           HA       GLN   1 -38.279  -1.510  26.782
    3    HB2  GLN   1           HB2      GLN   1 -40.215  -1.882  28.362
    4    HB3  GLN   1           HB3      GLN   1 -40.430  -0.136  28.433
    5    HG2  GLN   1           HG2      GLN   1 -40.830  -0.047  26.007
    6    HG3  GLN   1           HG3      GLN   1 -40.457  -1.766  25.860
    7   HE21  GLN   1          HE21      GLN   1 -42.704  -1.374  24.760
    8   HE22  GLN   1          HE22      GLN   1 -44.066  -1.823  25.803
    9    H    GLU   2           H        GLU   2 -38.782   1.632  28.593
   10    HA   GLU   2           HA       GLU   2 -39.112   2.875  26.016
   11    HB2  GLU   2           HB2      GLU   2 -39.161   4.269  28.704
   12    HB3  GLU   2           HB3      GLU   2 -39.943   4.735  27.204
   13    HG2  GLU   2           HG2      GLU   2 -41.780   3.833  28.117
   14    HG3  GLU   2           HG3      GLU   2 -41.131   2.302  27.549
   15    H    SER   3           H        SER   3 -36.246   2.641  27.883
   16    HA   SER   3           HA       SER   3 -34.897   4.463  26.021
   17    HB2  SER   3           HB2      SER   3 -35.574   5.993  27.834
   18    HB3  SER   3           HB3      SER   3 -34.761   4.954  29.024
   19    HG   SER   3           HG       SER   3 -33.452   6.740  28.295
   20    H    PHE   4           H        PHE   4 -32.698   4.095  25.814
   21    HA   PHE   4           HA       PHE   4 -31.502   1.679  27.091
   22    HB2  PHE   4           HB2      PHE   4 -30.555   3.591  24.929
   23    HB3  PHE   4           HB3      PHE   4 -29.584   2.301  25.608
   24    HD1  PHE   4           HD2      PHE   4 -30.059  -0.063  25.132
   25    HD2  PHE   4           HD1      PHE   4 -32.364   3.115  23.345
   26    HE1  PHE   4           HE2      PHE   4 -30.895  -1.636  23.403
   27    HE2  PHE   4           HE1      PHE   4 -33.182   1.541  21.606
   28    HZ   PHE   4           HZ       PHE   4 -32.438  -0.819  21.620
   29    H    LYS   5           H        LYS   5 -31.612   5.096  27.391
   30    HA   LYS   5           HA       LYS   5 -30.650   6.683  28.616
   31    HB2  LYS   5           HB2      LYS   5 -29.782   4.369  30.356
   32    HB3  LYS   5           HB3      LYS   5 -29.662   6.065  30.838
   33    HG2  LYS   5           HG2      LYS   5 -32.049   6.364  30.797
   34    HG3  LYS   5           HG3      LYS   5 -32.309   4.835  29.961
   35    HD2  LYS   5           HD2      LYS   5 -33.006   4.512  32.157
   36    HD3  LYS   5           HD3      LYS   5 -31.514   3.596  31.953
   37    HE2  LYS   5           HE2      LYS   5 -30.260   5.322  33.186
   38    HE3  LYS   5           HE3      LYS   5 -31.704   6.350  33.270
   39    HZ1  LYS   5           HZ1      LYS   5 -31.508   3.641  34.466
   40    HZ2  LYS   5           HZ2      LYS   5 -32.797   4.610  34.567
   41    HZ3  LYS   5           HZ3      LYS   5 -31.375   5.044  35.316
   42    H    LYS   6           H        LYS   6 -28.868   7.904  29.028
   43    HA   LYS   6           HA       LYS   6 -26.942   8.917  28.430
   44    HB2  LYS   6           HB2      LYS   6 -25.719   6.173  28.863
   45    HB3  LYS   6           HB3      LYS   6 -24.800   7.656  28.595
   46    HG2  LYS   6           HG2      LYS   6 -25.868   8.706  30.545
   47    HG3  LYS   6           HG3      LYS   6 -26.786   7.228  30.877
   48    HD2  LYS   6           HD2      LYS   6 -24.759   5.995  31.396
   49    HD3  LYS   6           HD3      LYS   6 -23.746   7.334  30.822
   50    HE2  LYS   6           HE2      LYS   6 -24.766   8.809  32.572
   51    HE3  LYS   6           HE3      LYS   6 -25.622   7.410  33.224
   52    HZ1  LYS   6           HZ1      LYS   6 -23.527   6.417  33.783
   53    HZ2  LYS   6           HZ2      LYS   6 -23.516   7.944  34.370
   54    HZ3  LYS   6           HZ3      LYS   6 -22.658   7.598  33.005
   55    H    GLN   7           H        GLN   7 -26.285   5.924  26.576
   56    HA   GLN   7           HA       GLN   7 -25.590   5.625  24.430
   57    HB2  GLN   7           HB2      GLN   7 -27.838   7.578  23.868
   58    HB3  GLN   7           HB3      GLN   7 -27.179   6.416  22.723
   59    HG2  GLN   7           HG2      GLN   7 -28.642   5.658  25.283
   60    HG3  GLN   7           HG3      GLN   7 -29.345   5.747  23.683
   61   HE21  GLN   7          HE21      GLN   7 -29.163   3.953  22.274
   62   HE22  GLN   7          HE22      GLN   7 -28.211   2.546  22.708
   63    H    GLU   8           H        GLU   8 -24.189   8.033  25.709
   64    HA   GLU   8           HA       GLU   8 -24.314  10.218  23.923
   65    HB2  GLU   8           HB2      GLU   8 -22.185   9.604  26.004
   66    HB3  GLU   8           HB3      GLU   8 -22.441  11.154  25.194
   67    HG2  GLU   8           HG2      GLU   8 -24.883  10.957  26.117
   68    HG3  GLU   8           HG3      GLU   8 -24.183   9.793  27.253
   69    H    LYS   9           H        LYS   9 -21.787   7.757  24.064
   70    HA   LYS   9           HA       LYS   9 -20.518   8.817  21.611
   71    HB2  LYS   9           HB2      LYS   9 -18.468   9.402  22.763
   72    HB3  LYS   9           HB3      LYS   9 -19.783  10.383  23.345
   73    HG2  LYS   9           HG2      LYS   9 -19.895   9.191  25.444
   74    HG3  LYS   9           HG3      LYS   9 -18.811   7.933  24.866
   75    HD2  LYS   9           HD2      LYS   9 -17.567   9.347  26.338
   76    HD3  LYS   9           HD3      LYS   9 -16.968   9.599  24.693
   77    HE2  LYS   9           HE2      LYS   9 -18.414  11.672  24.556
   78    HE3  LYS   9           HE3      LYS   9 -18.874  11.413  26.246
   79    HZ1  LYS   9           HZ1      LYS   9 -16.102  11.882  25.263
   80    HZ2  LYS   9           HZ2      LYS   9 -16.504  11.655  26.837
   81    HZ3  LYS   9           HZ3      LYS   9 -17.049  12.977  26.062
   82    H    THR  10           H        THR  10 -18.729   7.580  20.851
   83    HA   THR  10           HA       THR  10 -18.398   4.862  22.072
   84    HB   THR  10           HB       THR  10 -18.153   3.908  19.821
   85    HG1  THR  10           HG1      THR  10 -17.761   5.860  18.754
   86   HG21  THR  10          HG21      THR  10 -20.872   5.237  20.183
   87   HG22  THR  10          HG22      THR  10 -20.327   3.802  21.075
   88   HG23  THR  10          HG23      THR  10 -20.503   3.727  19.319
   89    HA   PRO  11           HA       PRO  11 -14.458   7.221  21.626
   90    HB2  PRO  11           HB2      PRO  11 -13.560   7.199  24.182
   91    HB3  PRO  11           HB3      PRO  11 -14.976   8.180  23.708
   92    HG2  PRO  11           HG2      PRO  11 -14.981   5.408  24.946
   93    HG3  PRO  11           HG3      PRO  11 -15.874   6.861  25.501
   94    HD2  PRO  11           HD2      PRO  11 -17.003   4.955  23.883
   95    HD3  PRO  11           HD3      PRO  11 -17.414   6.689  23.752
   96    H    LYS  12           H        LYS  12 -12.136   6.692  22.330
   97    HA   LYS  12           HA       LYS  12 -10.298   5.405  22.214
   98    HB2  LYS  12           HB2      LYS  12 -11.401   4.767  24.474
   99    HB3  LYS  12           HB3      LYS  12 -11.790   3.241  23.706
  100    HG2  LYS  12           HG2      LYS  12  -9.809   2.886  24.946
  101    HG3  LYS  12           HG3      LYS  12  -9.317   2.918  23.261
  102    HD2  LYS  12           HD2      LYS  12  -7.683   4.065  24.579
  103    HD3  LYS  12           HD3      LYS  12  -8.489   5.264  23.570
  104    HE2  LYS  12           HE2      LYS  12  -9.828   5.994  25.528
  105    HE3  LYS  12           HE3      LYS  12  -9.083   4.723  26.521
  106    HZ1  LYS  12           HZ1      LYS  12  -7.957   6.899  26.810
  107    HZ2  LYS  12           HZ2      LYS  12  -7.597   6.936  25.218
  108    HZ3  LYS  12           HZ3      LYS  12  -6.929   5.781  26.167
  109    H    THR  13           H        THR  13 -11.663   5.439  19.917
  110    HA   THR  13           HA       THR  13 -12.077   2.820  18.773
  111    HB   THR  13           HB       THR  13 -12.145   4.283  16.585
  112    HG1  THR  13           HG1      THR  13 -13.007   6.415  17.405
  113   HG21  THR  13          HG21      THR  13 -14.088   3.246  17.705
  114   HG22  THR  13          HG22      THR  13 -14.457   4.831  17.027
  115   HG23  THR  13          HG23      THR  13 -14.208   4.657  18.784
  116    HA   PRO  14           HA       PRO  14  -7.995   2.479  16.815
  117    HB2  PRO  14           HB2      PRO  14  -8.339   0.224  15.364
  118    HB3  PRO  14           HB3      PRO  14  -8.309   0.191  17.153
  119    HG2  PRO  14           HG2      PRO  14 -10.721   0.122  15.321
  120    HG3  PRO  14           HG3      PRO  14 -10.407  -0.842  16.793
  121    HD2  PRO  14           HD2      PRO  14 -11.932   1.506  16.701
  122    HD3  PRO  14           HD3      PRO  14 -11.137   0.861  18.170
  123    H    LYS  15           H        LYS  15  -7.748   4.216  15.467
  124    HA   LYS  15           HA       LYS  15  -9.512   4.539  13.099
  125    HB2  LYS  15           HB2      LYS  15  -7.443   6.353  14.391
  126    HB3  LYS  15           HB3      LYS  15  -8.430   6.793  13.013
  127    HG2  LYS  15           HG2      LYS  15  -9.415   6.159  15.829
  128    HG3  LYS  15           HG3      LYS  15  -9.330   7.743  15.072
  129    HD2  LYS  15           HD2      LYS  15 -11.170   5.458  14.246
  130    HD3  LYS  15           HD3      LYS  15 -11.638   6.913  15.121
  131    HE2  LYS  15           HE2      LYS  15 -11.048   8.348  13.225
  132    HE3  LYS  15           HE3      LYS  15 -10.385   6.967  12.339
  133    HZ1  LYS  15           HZ1      LYS  15 -12.632   5.995  12.333
  134    HZ2  LYS  15           HZ2      LYS  15 -12.568   7.425  11.533
  135    HZ3  LYS  15           HZ3      LYS  15 -13.245   7.370  13.002
  136    H    GLY  16           H        GLY  16  -6.124   3.909  13.724
  137    HA2  GLY  16           HA2      GLY  16  -5.645   2.919  10.958
  138    HA3  GLY  16           HA3      GLY  16  -4.785   4.369  11.448
  139    HA   PRO  17           HA       PRO  17  -3.443   0.725  14.587
  140    HB2  PRO  17           HB2      PRO  17  -4.088  -1.387  12.515
  141    HB3  PRO  17           HB3      PRO  17  -3.837  -1.604  14.260
  142    HG2  PRO  17           HG2      PRO  17  -6.344  -1.325  13.313
  143    HG3  PRO  17           HG3      PRO  17  -5.857  -0.406  14.774
  144    HD2  PRO  17           HD2      PRO  17  -6.167   0.581  11.955
  145    HD3  PRO  17           HD3      PRO  17  -6.524   1.397  13.492
  146    H    SER  18           H        SER  18  -1.335   0.023  14.780
  147    HA   SER  18           HA       SER  18   0.481   0.933  12.667
  148    HB2  SER  18           HB2      SER  18   0.946  -0.188  15.450
  149    HB3  SER  18           HB3      SER  18   2.215   0.444  14.396
  150    HG   SER  18           HG       SER  18   1.174   1.935  15.973
  151    H    SER  19           H        SER  19  -0.432  -0.745  11.171
  152    HA   SER  19           HA       SER  19   1.021  -3.357  11.314
  153    HB2  SER  19           HB2      SER  19  -1.982  -3.065  10.906
  154    HB3  SER  19           HB3      SER  19  -1.053  -4.574  10.999
  155    HG   SER  19           HG       SER  19  -2.206  -4.008  12.933
  156    H    VAL  20           H        VAL  20   1.482  -4.286   9.286
  157    HA   VAL  20           HA       VAL  20   0.820  -2.978   6.789
  158    HB   VAL  20           HB       VAL  20   1.393  -5.930   7.269
  159   HG11  VAL  20          HG11      VAL  20   2.127  -5.923   4.894
  160   HG12  VAL  20          HG12      VAL  20   0.409  -5.548   5.038
  161   HG13  VAL  20          HG13      VAL  20   1.572  -4.241   4.732
  162   HG21  VAL  20          HG21      VAL  20   3.705  -5.398   6.606
  163   HG22  VAL  20          HG22      VAL  20   3.287  -3.677   6.459
  164   HG23  VAL  20          HG23      VAL  20   3.276  -4.476   8.043
  165    H    GLU  21           H        GLU  21  -0.921  -5.275   8.828
  166    HA   GLU  21           HA       GLU  21  -3.163  -5.821   7.197
  167    HB2  GLU  21           HB2      GLU  21  -3.083  -5.439  10.223
  168    HB3  GLU  21           HB3      GLU  21  -4.339  -6.259   9.296
  169    HG2  GLU  21           HG2      GLU  21  -2.552  -7.877   8.474
  170    HG3  GLU  21           HG3      GLU  21  -1.440  -7.130   9.628
  171    H    ASP  22           H        ASP  22  -2.418  -2.784   8.924
  172    HA   ASP  22           HA       ASP  22  -5.128  -1.697   8.620
  173    HB2  ASP  22           HB2      ASP  22  -3.642  -0.943  10.481
  174    HB3  ASP  22           HB3      ASP  22  -2.544  -0.253   9.278
  175    H    ILE  23           H        ILE  23  -1.932  -1.372   6.992
  176    HA   ILE  23           HA       ILE  23  -2.770   0.416   4.913
  177    HB   ILE  23           HB       ILE  23  -0.553  -1.638   5.153
  178   HG12  ILE  23          HG12      ILE  23  -0.638   1.379   4.807
  179   HG13  ILE  23          HG13      ILE  23  -0.475   0.555   6.356
  180   HG21  ILE  23          HG21      ILE  23   0.350  -0.938   2.957
  181   HG22  ILE  23          HG22      ILE  23  -1.186  -1.765   2.771
  182   HG23  ILE  23          HG23      ILE  23  -1.126   0.010   2.652
  183   HD11  ILE  23          HD11      ILE  23   1.675   1.443   5.630
  184   HD12  ILE  23          HD12      ILE  23   1.736  -0.330   5.668
  185   HD13  ILE  23          HD13      ILE  23   1.590   0.541   4.118
  186    H    LYS  24           H        LYS  24  -2.924  -3.168   5.053
  187    HA   LYS  24           HA       LYS  24  -4.185  -3.404   2.481
  188    HB2  LYS  24           HB2      LYS  24  -2.987  -5.211   3.756
  189    HB3  LYS  24           HB3      LYS  24  -4.355  -5.308   4.861
  190    HG2  LYS  24           HG2      LYS  24  -4.292  -7.065   3.097
  191    HG3  LYS  24           HG3      LYS  24  -5.791  -6.148   3.123
  192    HD2  LYS  24           HD2      LYS  24  -5.321  -5.036   1.116
  193    HD3  LYS  24           HD3      LYS  24  -3.579  -5.302   1.246
  194    HE2  LYS  24           HE2      LYS  24  -4.723  -6.633  -0.563
  195    HE3  LYS  24           HE3      LYS  24  -3.769  -7.582   0.565
  196    HZ1  LYS  24           HZ1      LYS  24  -5.713  -8.470   1.542
  197    HZ2  LYS  24           HZ2      LYS  24  -5.994  -8.503  -0.040
  198    HZ3  LYS  24           HZ3      LYS  24  -6.712  -7.358   0.933
  199    H    ALA  25           H        ALA  25  -5.629  -3.050   5.744
  200    HA   ALA  25           HA       ALA  25  -8.346  -3.134   4.899
  201    HB1  ALA  25           HB1      ALA  25  -7.067  -1.666   7.249
  202    HB2  ALA  25           HB2      ALA  25  -8.785  -2.039   7.069
  203    HB3  ALA  25           HB3      ALA  25  -7.618  -3.355   7.242
  204    H    LYS  26           H        LYS  26  -6.085  -0.349   5.079
  205    HA   LYS  26           HA       LYS  26  -8.017   1.623   4.177
  206    HB2  LYS  26           HB2      LYS  26  -5.110   1.559   4.877
  207    HB3  LYS  26           HB3      LYS  26  -5.578   2.765   3.676
  208    HG2  LYS  26           HG2      LYS  26  -5.662   3.738   5.885
  209    HG3  LYS  26           HG3      LYS  26  -7.303   3.646   5.217
  210    HD2  LYS  26           HD2      LYS  26  -7.696   1.585   6.602
  211    HD3  LYS  26           HD3      LYS  26  -6.031   1.725   7.210
  212    HE2  LYS  26           HE2      LYS  26  -6.597   4.023   8.052
  213    HE3  LYS  26           HE3      LYS  26  -8.280   3.751   7.574
  214    HZ1  LYS  26           HZ1      LYS  26  -6.761   2.004   9.423
  215    HZ2  LYS  26           HZ2      LYS  26  -8.350   1.873   9.084
  216    HZ3  LYS  26           HZ3      LYS  26  -7.815   3.197   9.912
  217    H    MET  27           H        MET  27  -5.733  -0.450   2.403
  218    HA   MET  27           HA       MET  27  -6.448   0.607  -0.190
  219    HB2  MET  27           HB2      MET  27  -5.471  -2.137   0.674
  220    HB3  MET  27           HB3      MET  27  -5.843  -1.720  -1.001
  221    HG2  MET  27           HG2      MET  27  -4.227   0.142  -0.917
  222    HG3  MET  27           HG3      MET  27  -3.809  -0.285   0.744
  223    HE1  MET  27           HE1      MET  27  -1.215  -0.328  -0.016
  224    HE2  MET  27           HE2      MET  27  -0.641  -1.251  -1.424
  225    HE3  MET  27           HE3      MET  27  -1.758   0.113  -1.654
  226    H    GLN  28           H        GLN  28  -8.049  -1.998   1.813
  227    HA   GLN  28           HA       GLN  28 -10.114  -2.463  -0.134
  228    HB2  GLN  28           HB2      GLN  28 -10.362  -2.740   2.888
  229    HB3  GLN  28           HB3      GLN  28 -11.449  -3.394   1.679
  230    HG2  GLN  28           HG2      GLN  28  -8.681  -4.317   2.395
  231    HG3  GLN  28           HG3      GLN  28 -10.173  -5.222   2.359
  232   HE21  GLN  28          HE21      GLN  28  -7.423  -4.218   0.537
  233   HE22  GLN  28          HE22      GLN  28  -7.905  -4.961  -0.999
  234    H    ALA  29           H        ALA  29 -10.011  -0.161   2.604
  235    HA   ALA  29           HA       ALA  29 -12.541   1.041   2.231
  236    HB1  ALA  29           HB1      ALA  29 -11.072   1.359   4.201
  237    HB2  ALA  29           HB2      ALA  29  -9.962   2.333   3.201
  238    HB3  ALA  29           HB3      ALA  29 -11.614   2.896   3.501
  239    H    SER  30           H        SER  30  -9.393   1.821   0.641
  240    HA   SER  30           HA       SER  30 -10.384   3.993  -0.938
  241    HB2  SER  30           HB2      SER  30  -8.087   2.080  -1.495
  242    HB3  SER  30           HB3      SER  30  -8.398   3.602  -2.349
  243    HG   SER  30           HG       SER  30  -7.809   3.259   0.424
  244    H    ILE  31           H        ILE  31 -10.349   0.461  -1.620
  245    HA   ILE  31           HA       ILE  31 -11.338   0.632  -4.307
  246    HB   ILE  31           HB       ILE  31 -11.567  -1.599  -2.261
  247   HG12  ILE  31          HG12      ILE  31  -9.723  -1.334  -4.680
  248   HG13  ILE  31          HG13      ILE  31  -9.264  -0.839  -3.063
  249   HG21  ILE  31          HG21      ILE  31 -12.039  -3.096  -4.194
  250   HG22  ILE  31          HG22      ILE  31 -13.325  -1.924  -3.968
  251   HG23  ILE  31          HG23      ILE  31 -12.122  -1.687  -5.262
  252   HD11  ILE  31          HD11      ILE  31  -9.684  -3.177  -2.241
  253   HD12  ILE  31          HD12      ILE  31  -9.899  -3.665  -3.938
  254   HD13  ILE  31          HD13      ILE  31  -8.349  -3.004  -3.394
  255    H    GLU  32           H        GLU  32 -13.133   0.342  -1.184
  256    HA   GLU  32           HA       GLU  32 -15.697   0.430  -2.612
  257    HB2  GLU  32           HB2      GLU  32 -16.725   0.209  -0.439
  258    HB3  GLU  32           HB3      GLU  32 -15.454  -0.982  -0.689
  259    HG2  GLU  32           HG2      GLU  32 -13.923   0.572   0.636
  260    HG3  GLU  32           HG3      GLU  32 -15.362   1.499   1.061
  261    H    LYS  33           H        LYS  33 -13.814   2.853  -0.781
  262    HA   LYS  33           HA       LYS  33 -15.940   4.875  -1.197
  263    HB2  LYS  33           HB2      LYS  33 -13.322   5.193   0.308
  264    HB3  LYS  33           HB3      LYS  33 -14.697   6.278   0.327
  265    HG2  LYS  33           HG2      LYS  33 -14.477   3.548   1.612
  266    HG3  LYS  33           HG3      LYS  33 -14.718   5.102   2.383
  267    HD2  LYS  33           HD2      LYS  33 -16.746   3.603   0.673
  268    HD3  LYS  33           HD3      LYS  33 -16.771   3.769   2.429
  269    HE2  LYS  33           HE2      LYS  33 -17.160   6.150   2.293
  270    HE3  LYS  33           HE3      LYS  33 -16.868   6.156   0.548
  271    HZ1  LYS  33           HZ1      LYS  33 -19.152   4.826   1.888
  272    HZ2  LYS  33           HZ2      LYS  33 -18.815   4.740   0.275
  273    HZ3  LYS  33           HZ3      LYS  33 -19.210   6.179   0.943
  274    H    GLY  34           H        GLY  34 -13.869   3.836  -3.337
  275    HA2  GLY  34           HA2      GLY  34 -13.558   4.749  -5.429
  276    HA3  GLY  34           HA3      GLY  34 -14.261   6.252  -4.841
  277    H    GLY  35           H        GLY  35 -11.384   5.087  -3.238
  278    HA2  GLY  35           HA2      GLY  35  -9.779   7.357  -4.303
  279    HA3  GLY  35           HA3      GLY  35  -9.353   6.275  -2.980
  280    H    SER  36           H        SER  36  -7.839   7.039  -5.501
  281    HA   SER  36           HA       SER  36  -7.774   4.579  -7.092
  282    HB2  SER  36           HB2      SER  36  -7.573   6.815  -8.108
  283    HB3  SER  36           HB3      SER  36  -6.060   7.058  -7.224
  284    HG   SER  36           HG       SER  36  -6.663   5.406  -9.404
  285    H    LEU  37           H        LEU  37  -6.383   2.918  -6.977
  286    HA   LEU  37           HA       LEU  37  -4.465   2.883  -4.725
  287    HB2  LEU  37           HB2      LEU  37  -5.720   0.727  -6.451
  288    HB3  LEU  37           HB3      LEU  37  -4.297   0.408  -5.471
  289    HG   LEU  37           HG       LEU  37  -5.551   1.167  -3.427
  290   HD11  LEU  37          HD11      LEU  37  -7.386   2.460  -4.382
  291   HD12  LEU  37          HD12      LEU  37  -8.052   1.054  -3.553
  292   HD13  LEU  37          HD13      LEU  37  -7.939   1.056  -5.323
  293   HD21  LEU  37          HD21      LEU  37  -6.719  -1.179  -4.977
  294   HD22  LEU  37          HD22      LEU  37  -6.796  -0.940  -3.217
  295   HD23  LEU  37          HD23      LEU  37  -5.233  -1.210  -4.005
  296    HA   PRO  38           HA       PRO  38  -1.121   3.607  -7.404
  297    HB2  PRO  38           HB2      PRO  38   1.066   2.925  -5.901
  298    HB3  PRO  38           HB3      PRO  38   0.005   4.317  -5.532
  299    HG2  PRO  38           HG2      PRO  38  -0.115   1.527  -4.334
  300    HG3  PRO  38           HG3      PRO  38  -0.131   3.101  -3.475
  301    HD2  PRO  38           HD2      PRO  38  -2.424   1.748  -4.027
  302    HD3  PRO  38           HD3      PRO  38  -2.355   3.535  -4.130
  303    H    LYS  39           H        LYS  39   0.359   2.998  -8.706
  304    HA   LYS  39           HA       LYS  39   0.481   0.134  -9.604
  305    HB2  LYS  39           HB2      LYS  39   0.295   2.721 -11.205
  306    HB3  LYS  39           HB3      LYS  39   0.332   1.091 -11.853
  307    HG2  LYS  39           HG2      LYS  39  -1.873   0.612 -10.847
  308    HG3  LYS  39           HG3      LYS  39  -1.955   2.267 -10.214
  309    HD2  LYS  39           HD2      LYS  39  -1.647   1.562 -13.164
  310    HD3  LYS  39           HD3      LYS  39  -3.195   1.914 -12.393
  311    HE2  LYS  39           HE2      LYS  39  -2.652   4.187 -11.998
  312    HE3  LYS  39           HE3      LYS  39  -0.920   3.928 -12.246
  313    HZ1  LYS  39           HZ1      LYS  39  -1.982   4.993 -14.184
  314    HZ2  LYS  39           HZ2      LYS  39  -2.870   3.603 -14.460
  315    HZ3  LYS  39           HZ3      LYS  39  -1.255   3.601 -14.545
  316    H    VAL  40           H        VAL  40   2.132   3.282  -9.466
  317    HA   VAL  40           HA       VAL  40   4.620   2.190 -10.697
  318    HB   VAL  40           HB       VAL  40   3.708   5.051 -10.171
  319   HG11  VAL  40          HG11      VAL  40   6.127   4.006 -11.703
  320   HG12  VAL  40          HG12      VAL  40   5.590   5.695 -11.634
  321   HG13  VAL  40          HG13      VAL  40   6.166   4.906 -10.165
  322   HG21  VAL  40          HG21      VAL  40   3.870   3.449 -12.767
  323   HG22  VAL  40          HG22      VAL  40   2.382   4.015 -11.973
  324   HG23  VAL  40          HG23      VAL  40   3.513   5.183 -12.649
  325    H    GLU  41           H        GLU  41   6.482   1.963  -9.474
  326    HA   GLU  41           HA       GLU  41   5.881   1.541  -6.769
  327    HB2  GLU  41           HB2      GLU  41   7.495   0.206  -8.069
  328    HB3  GLU  41           HB3      GLU  41   8.673   1.533  -7.939
  329    HG2  GLU  41           HG2      GLU  41   8.632   1.378  -5.500
  330    HG3  GLU  41           HG3      GLU  41   7.310   0.201  -5.545
  331    H    ALA  42           H        ALA  42   7.748   4.311  -8.105
  332    HA   ALA  42           HA       ALA  42   8.558   5.429  -5.658
  333    HB1  ALA  42           HB1      ALA  42   9.243   6.258  -7.857
  334    HB2  ALA  42           HB2      ALA  42   7.596   6.852  -8.180
  335    HB3  ALA  42           HB3      ALA  42   8.569   7.576  -6.881
  336    H    LYS  43           H        LYS  43   5.358   5.795  -7.234
  337    HA   LYS  43           HA       LYS  43   4.201   7.429  -5.096
  338    HB2  LYS  43           HB2      LYS  43   2.936   5.927  -7.426
  339    HB3  LYS  43           HB3      LYS  43   2.033   6.886  -6.243
  340    HG2  LYS  43           HG2      LYS  43   3.400   8.873  -6.829
  341    HG3  LYS  43           HG3      LYS  43   4.171   7.926  -8.125
  342    HD2  LYS  43           HD2      LYS  43   1.907   7.534  -9.124
  343    HD3  LYS  43           HD3      LYS  43   1.182   8.538  -7.871
  344    HE2  LYS  43           HE2      LYS  43   3.154   9.474 -10.012
  345    HE3  LYS  43           HE3      LYS  43   1.408   9.698 -10.028
  346    HZ1  LYS  43           HZ1      LYS  43   3.351  11.004  -8.230
  347    HZ2  LYS  43           HZ2      LYS  43   1.746  10.931  -7.849
  348    HZ3  LYS  43           HZ3      LYS  43   2.228  11.703  -9.202
  349    H    PHE  44           H        PHE  44   4.271   3.952  -5.866
  350    HA   PHE  44           HA       PHE  44   2.371   3.154  -3.923
  351    HB2  PHE  44           HB2      PHE  44   3.276   1.743  -5.790
  352    HB3  PHE  44           HB3      PHE  44   4.822   1.685  -4.969
  353    HD1  PHE  44           HD1      PHE  44   5.146   0.392  -2.870
  354    HD2  PHE  44           HD2      PHE  44   1.548   0.163  -5.237
  355    HE1  PHE  44           HE1      PHE  44   4.608  -1.805  -1.848
  356    HE2  PHE  44           HE2      PHE  44   1.003  -2.014  -4.180
  357    HZ   PHE  44           HZ       PHE  44   2.542  -3.007  -2.504
  358    H    ILE  45           H        ILE  45   5.933   3.416  -3.684
  359    HA   ILE  45           HA       ILE  45   6.102   2.812  -0.881
  360    HB   ILE  45           HB       ILE  45   8.020   4.210  -2.784
  361   HG12  ILE  45          HG12      ILE  45   7.896   1.366  -1.653
  362   HG13  ILE  45          HG13      ILE  45   7.516   1.831  -3.307
  363   HG21  ILE  45          HG21      ILE  45   8.501   4.900  -0.452
  364   HG22  ILE  45          HG22      ILE  45   8.527   3.185   0.044
  365   HG23  ILE  45          HG23      ILE  45   9.755   3.848  -1.062
  366   HD11  ILE  45          HD11      ILE  45  10.261   1.884  -2.008
  367   HD12  ILE  45          HD12      ILE  45   9.689   0.844  -3.311
  368   HD13  ILE  45          HD13      ILE  45   9.898   2.584  -3.607
  369    H    ASN  46           H        ASN  46   5.820   5.986  -2.614
  370    HA   ASN  46           HA       ASN  46   5.907   7.666  -0.348
  371    HB2  ASN  46           HB2      ASN  46   5.861   8.607  -2.558
  372    HB3  ASN  46           HB3      ASN  46   4.329   7.837  -2.942
  373   HD21  ASN  46          HD21      ASN  46   2.373   8.806  -2.362
  374   HD22  ASN  46          HD22      ASN  46   2.245  10.159  -1.282
  375    H    TYR  47           H        TYR  47   3.026   5.934  -1.654
  376    HA   TYR  47           HA       TYR  47   1.223   6.929   0.350
  377    HB2  TYR  47           HB2      TYR  47   0.384   6.254  -1.739
  378    HB3  TYR  47           HB3      TYR  47   1.112   4.652  -1.632
  379    HD1  TYR  47           HD2      TYR  47  -1.619   6.827  -0.322
  380    HD2  TYR  47           HD1      TYR  47   0.034   2.841  -0.437
  381    HE1  TYR  47           HE2      TYR  47  -3.709   5.927   0.678
  382    HE2  TYR  47           HE1      TYR  47  -2.075   1.951   0.574
  383    HH   TYR  47           HH       TYR  47  -4.833   4.050   1.433
  384    H    VAL  48           H        VAL  48   3.075   3.845   0.146
  385    HA   VAL  48           HA       VAL  48   2.118   2.709   2.605
  386    HB   VAL  48           HB       VAL  48   4.684   2.372   1.020
  387   HG11  VAL  48          HG11      VAL  48   3.892   0.866   3.549
  388   HG12  VAL  48          HG12      VAL  48   5.141   0.340   2.399
  389   HG13  VAL  48          HG13      VAL  48   5.355   1.843   3.292
  390   HG21  VAL  48          HG21      VAL  48   2.560   1.463   0.063
  391   HG22  VAL  48          HG22      VAL  48   3.708   0.188   0.474
  392   HG23  VAL  48          HG23      VAL  48   2.321   0.507   1.538
  393    H    LYS  49           H        LYS  49   4.873   4.944   1.993
  394    HA   LYS  49           HA       LYS  49   5.604   5.097   4.777
  395    HB2  LYS  49           HB2      LYS  49   6.298   6.795   2.363
  396    HB3  LYS  49           HB3      LYS  49   6.900   7.156   3.991
  397    HG2  LYS  49           HG2      LYS  49   7.908   4.944   4.184
  398    HG3  LYS  49           HG3      LYS  49   7.258   4.459   2.612
  399    HD2  LYS  49           HD2      LYS  49   8.653   6.236   1.527
  400    HD3  LYS  49           HD3      LYS  49   9.372   6.597   3.115
  401    HE2  LYS  49           HE2      LYS  49  10.151   4.261   3.315
  402    HE3  LYS  49           HE3      LYS  49   9.360   3.839   1.802
  403    HZ1  LYS  49           HZ1      LYS  49  11.686   5.635   2.135
  404    HZ2  LYS  49           HZ2      LYS  49  10.869   5.522   0.722
  405    HZ3  LYS  49           HZ3      LYS  49  11.631   4.199   1.290
  406    H    ASN  50           H        ASN  50   3.406   7.116   2.820
  407    HA   ASN  50           HA       ASN  50   2.707   8.962   4.883
  408    HB2  ASN  50           HB2      ASN  50   1.982   9.550   2.751
  409    HB3  ASN  50           HB3      ASN  50   1.438   7.932   2.350
  410   HD21  ASN  50          HD21      ASN  50  -0.679   7.281   2.828
  411   HD22  ASN  50          HD22      ASN  50  -1.866   8.439   3.413
  412    H    CYS  51           H        CYS  51   1.417   5.668   4.226
  413    HA   CYS  51           HA       CYS  51  -0.559   5.853   6.334
  414    HB2  CYS  51           HB2      CYS  51   0.515   3.459   4.798
  415    HB3  CYS  51           HB3      CYS  51  -0.871   3.443   5.913
  416    HG   CYS  51           HG       CYS  51  -0.434   4.902   2.995
  417    H    PHE  52           H        PHE  52   2.529   3.945   6.192
  418    HA   PHE  52           HA       PHE  52   2.636   4.064   9.156
  419    HB2  PHE  52           HB2      PHE  52   1.315   2.059   8.462
  420    HB3  PHE  52           HB3      PHE  52   2.743   1.466   7.618
  421    HD1  PHE  52           HD2      PHE  52   2.555   3.050  11.061
  422    HD2  PHE  52           HD1      PHE  52   3.192  -0.541   8.753
  423    HE1  PHE  52           HE2      PHE  52   3.402   1.900  13.075
  424    HE2  PHE  52           HE1      PHE  52   4.008  -1.699  10.792
  425    HZ   PHE  52           HZ       PHE  52   4.126  -0.480  12.951
  426    H    ARG  53           H        ARG  53   4.309   5.227   6.952
  427    HA   ARG  53           HA       ARG  53   6.503   5.776   6.642
  428    HB2  ARG  53           HB2      ARG  53   5.649   6.378   8.969
  429    HB3  ARG  53           HB3      ARG  53   6.751   5.145   9.576
  430    HG2  ARG  53           HG2      ARG  53   8.678   6.395   8.655
  431    HG3  ARG  53           HG3      ARG  53   7.583   7.515   7.822
  432    HD2  ARG  53           HD2      ARG  53   6.721   8.315   9.992
  433    HD3  ARG  53           HD3      ARG  53   7.785   7.180  10.844
  434    HE   ARG  53           HE       ARG  53   9.397   8.789   9.127
  435   HH11  ARG  53          HH11      ARG  53   7.402   9.375  12.008
  436   HH12  ARG  53          HH12      ARG  53   8.536  10.609  12.554
  437   HH21  ARG  53          HH21      ARG  53  10.699  10.453  10.015
  438   HH22  ARG  53          HH22      ARG  53  10.167  11.184  11.522
  439    H    MET  54           H        MET  54   6.095   2.891   6.110
  440    HA   MET  54           HA       MET  54   8.348   1.505   7.234
  441    HB2  MET  54           HB2      MET  54   6.531   0.594   4.980
  442    HB3  MET  54           HB3      MET  54   7.631  -0.408   5.925
  443    HG2  MET  54           HG2      MET  54   6.308   0.238   7.996
  444    HG3  MET  54           HG3      MET  54   5.151   1.024   6.916
  445    HE1  MET  54           HE1      MET  54   5.805  -3.504   7.487
  446    HE2  MET  54           HE2      MET  54   7.151  -2.449   7.007
  447    HE3  MET  54           HE3      MET  54   6.343  -2.205   8.570
  448    H    THR  55           H        THR  55  10.175   0.691   6.356
  449    HA   THR  55           HA       THR  55  10.960   1.406   3.548
  450    HB   THR  55           HB       THR  55  13.305   1.539   4.379
  451    HG1  THR  55           HG1      THR  55  13.732   1.645   6.439
  452   HG21  THR  55          HG21      THR  55  13.140   3.765   5.442
  453   HG22  THR  55          HG22      THR  55  11.386   3.550   5.628
  454   HG23  THR  55          HG23      THR  55  12.119   3.621   4.008
  455    H    ASP  56           H        ASP  56  10.556  -1.131   5.831
  456    HA   ASP  56           HA       ASP  56  12.582  -2.978   5.129
  457    HB2  ASP  56           HB2      ASP  56   9.758  -3.281   6.182
  458    HB3  ASP  56           HB3      ASP  56  10.767  -4.680   5.856
  459    H    GLN  57           H        GLN  57  13.085  -3.689   3.127
  460    HA   GLN  57           HA       GLN  57  11.294  -3.852   0.949
  461    HB2  GLN  57           HB2      GLN  57  14.030  -4.949   1.539
  462    HB3  GLN  57           HB3      GLN  57  13.159  -5.596   0.150
  463    HG2  GLN  57           HG2      GLN  57  13.615  -2.616   0.575
  464    HG3  GLN  57           HG3      GLN  57  14.676  -3.654  -0.378
  465   HE21  GLN  57          HE21      GLN  57  11.758  -1.761  -0.530
  466   HE22  GLN  57          HE22      GLN  57  11.118  -2.490  -2.015
  467    H    GLU  58           H        GLU  58  12.031  -6.384   3.364
  468    HA   GLU  58           HA       GLU  58  10.586  -8.497   2.202
  469    HB2  GLU  58           HB2      GLU  58  10.336  -9.355   4.516
  470    HB3  GLU  58           HB3      GLU  58  11.974  -8.860   4.113
  471    HG2  GLU  58           HG2      GLU  58  11.688  -6.769   5.406
  472    HG3  GLU  58           HG3      GLU  58  10.020  -7.190   5.749
  473    H    ALA  59           H        ALA  59   9.252  -5.759   4.092
  474    HA   ALA  59           HA       ALA  59   6.524  -6.859   3.976
  475    HB1  ALA  59           HB1      ALA  59   5.876  -4.772   5.049
  476    HB2  ALA  59           HB2      ALA  59   7.214  -5.545   5.928
  477    HB3  ALA  59           HB3      ALA  59   7.530  -4.134   4.881
  478    H    ILE  60           H        ILE  60   8.417  -4.305   2.319
  479    HA   ILE  60           HA       ILE  60   6.312  -3.271   0.692
  480    HB   ILE  60           HB       ILE  60   9.297  -3.395   0.319
  481   HG12  ILE  60          HG12      ILE  60   7.515  -1.017   1.000
  482   HG13  ILE  60          HG13      ILE  60   8.206  -2.060   2.238
  483   HG21  ILE  60          HG21      ILE  60   7.219  -1.879  -1.347
  484   HG22  ILE  60          HG22      ILE  60   8.969  -1.602  -1.438
  485   HG23  ILE  60          HG23      ILE  60   8.311  -3.153  -1.928
  486   HD11  ILE  60          HD11      ILE  60   9.798  -0.401   0.255
  487   HD12  ILE  60          HD12      ILE  60   9.638  -0.154   2.003
  488   HD13  ILE  60          HD13      ILE  60  10.486  -1.591   1.387
  489    H    GLN  61           H        GLN  61   8.597  -5.984  -0.003
  490    HA   GLN  61           HA       GLN  61   7.340  -6.535  -2.529
  491    HB2  GLN  61           HB2      GLN  61   8.797  -8.352  -2.755
  492    HB3  GLN  61           HB3      GLN  61   9.671  -7.027  -2.023
  493    HG2  GLN  61           HG2      GLN  61  10.468  -8.722  -0.726
  494    HG3  GLN  61           HG3      GLN  61   9.105  -8.228   0.252
  495   HE21  GLN  61          HE21      GLN  61   8.662 -10.320   1.253
  496   HE22  GLN  61          HE22      GLN  61   8.138 -11.671   0.258
  497    H    ASP  62           H        ASP  62   6.887  -8.116   0.748
  498    HA   ASP  62           HA       ASP  62   5.014 -10.005  -0.354
  499    HB2  ASP  62           HB2      ASP  62   6.303 -10.106   1.877
  500    HB3  ASP  62           HB3      ASP  62   5.015  -9.100   2.534
  501    H    LEU  63           H        LEU  63   4.555  -6.701   0.884
  502    HA   LEU  63           HA       LEU  63   1.682  -6.751   0.701
  503    HB2  LEU  63           HB2      LEU  63   3.036  -5.278   2.140
  504    HB3  LEU  63           HB3      LEU  63   3.599  -4.395   0.732
  505    HG   LEU  63           HG       LEU  63   1.805  -3.357   2.181
  506   HD11  LEU  63          HD11      LEU  63   2.276  -2.537  -0.096
  507   HD12  LEU  63          HD12      LEU  63   0.600  -2.299   0.416
  508   HD13  LEU  63          HD13      LEU  63   0.985  -3.594  -0.726
  509   HD21  LEU  63          HD21      LEU  63  -0.516  -3.954   1.888
  510   HD22  LEU  63          HD22      LEU  63   0.380  -5.354   2.492
  511   HD23  LEU  63          HD23      LEU  63  -0.096  -5.266   0.775
  512    H    TRP  64           H        TRP  64   4.312  -5.849  -1.603
  513    HA   TRP  64           HA       TRP  64   2.764  -4.967  -3.786
  514    HB2  TRP  64           HB2      TRP  64   5.456  -6.119  -3.405
  515    HB3  TRP  64           HB3      TRP  64   4.783  -6.615  -4.901
  516    HD1  TRP  64           HD1      TRP  64   7.034  -4.226  -3.862
  517    HE1  TRP  64           HE1      TRP  64   7.119  -2.130  -5.333
  518    HE3  TRP  64           HE3      TRP  64   2.501  -4.699  -6.195
  519    HZ2  TRP  64           HZ2      TRP  64   5.311  -0.687  -7.079
  520    HZ3  TRP  64           HZ3      TRP  64   1.700  -2.933  -7.754
  521    HH2  TRP  64           HH2      TRP  64   3.081  -0.919  -8.177
  522    H    GLN  65           H        GLN  65   3.748  -8.362  -3.120
  523    HA   GLN  65           HA       GLN  65   2.047  -9.355  -5.240
  524    HB2  GLN  65           HB2      GLN  65   2.586 -11.605  -4.370
  525    HB3  GLN  65           HB3      GLN  65   3.940 -10.579  -4.796
  526    HG2  GLN  65           HG2      GLN  65   3.752 -10.112  -2.102
  527    HG3  GLN  65           HG3      GLN  65   3.172 -11.764  -2.186
  528   HE21  GLN  65          HE21      GLN  65   5.810  -9.599  -3.208
  529   HE22  GLN  65          HE22      GLN  65   7.092 -10.743  -3.091
  530    H    TRP  66           H        TRP  66   1.341  -8.638  -1.863
  531    HA   TRP  66           HA       TRP  66  -1.237  -9.941  -1.891
  532    HB2  TRP  66           HB2      TRP  66   0.219  -8.940   0.071
  533    HB3  TRP  66           HB3      TRP  66  -0.653  -7.464  -0.271
  534    HD1  TRP  66           HD1      TRP  66  -3.060 -10.220  -0.723
  535    HE1  TRP  66           HE1      TRP  66  -4.352 -10.764   1.415
  536    HE3  TRP  66           HE3      TRP  66  -0.220  -7.598   2.649
  537    HZ2  TRP  66           HZ2      TRP  66  -4.272 -10.046   4.185
  538    HZ3  TRP  66           HZ3      TRP  66  -0.869  -7.551   5.054
  539    HH2  TRP  66           HH2      TRP  66  -2.887  -8.772   5.833
  540    H    ARG  67           H        ARG  67  -0.175  -6.639  -2.822
  541    HA   ARG  67           HA       ARG  67  -2.837  -5.775  -3.633
  542    HB2  ARG  67           HB2      ARG  67  -0.810  -4.355  -2.909
  543    HB3  ARG  67           HB3      ARG  67  -0.182  -4.565  -4.535
  544    HG2  ARG  67           HG2      ARG  67  -3.026  -3.575  -4.354
  545    HG3  ARG  67           HG3      ARG  67  -1.817  -2.546  -3.616
  546    HD2  ARG  67           HD2      ARG  67  -1.943  -1.627  -5.695
  547    HD3  ARG  67           HD3      ARG  67  -0.524  -2.665  -5.852
  548    HE   ARG  67           HE       ARG  67  -2.873  -4.104  -6.696
  549   HH11  ARG  67          HH11      ARG  67  -0.970  -1.340  -7.883
  550   HH12  ARG  67          HH12      ARG  67  -0.999  -2.005  -9.509
  551   HH21  ARG  67          HH21      ARG  67  -3.465  -4.270  -8.780
  552   HH22  ARG  67          HH22      ARG  67  -2.774  -3.231  -9.986
  553    H    LYS  68           H        LYS  68  -0.272  -7.497  -5.277
  554    HA   LYS  68           HA       LYS  68  -1.711  -7.428  -7.858
  555    HB2  LYS  68           HB2      LYS  68   0.892  -8.755  -7.045
  556    HB3  LYS  68           HB3      LYS  68   0.199  -8.873  -8.649
  557    HG2  LYS  68           HG2      LYS  68   1.196  -6.342  -7.306
  558    HG3  LYS  68           HG3      LYS  68   1.957  -7.216  -8.623
  559    HD2  LYS  68           HD2      LYS  68  -0.612  -5.606  -8.694
  560    HD3  LYS  68           HD3      LYS  68   0.902  -5.226  -9.494
  561    HE2  LYS  68           HE2      LYS  68  -0.926  -7.579 -10.188
  562    HE3  LYS  68           HE3      LYS  68  -0.870  -6.034 -11.030
  563    HZ1  LYS  68           HZ1      LYS  68   1.324  -8.032 -10.920
  564    HZ2  LYS  68           HZ2      LYS  68   1.512  -6.545 -11.556
  565    HZ3  LYS  68           HZ3      LYS  68   0.436  -7.599 -12.223
  566    H    SER  69           H        SER  69  -2.358  -9.229  -5.143
  567    HA   SER  69           HA       SER  69  -4.177 -10.544  -7.002
  568    HB2  SER  69           HB2      SER  69  -2.533 -12.344  -6.652
  569    HB3  SER  69           HB3      SER  69  -2.894 -12.322  -4.913
  570    HG   SER  69           HG       SER  69  -4.123 -13.774  -6.522
  571    H    LEU  70           H        LEU  70  -5.557  -9.011  -6.346
  572    HA   LEU  70           HA       LEU  70  -6.771  -9.105  -3.654
  573    HB2  LEU  70           HB2      LEU  70  -7.553  -7.665  -6.213
  574    HB3  LEU  70           HB3      LEU  70  -8.413  -7.532  -4.687
  575    HG   LEU  70           HG       LEU  70  -5.558  -6.602  -5.224
  576   HD11  LEU  70          HD11      LEU  70  -8.161  -5.118  -4.680
  577   HD12  LEU  70          HD12      LEU  70  -7.319  -5.211  -6.232
  578   HD13  LEU  70          HD13      LEU  70  -6.558  -4.363  -4.882
  579   HD21  LEU  70          HD21      LEU  70  -7.231  -6.494  -2.686
  580   HD22  LEU  70          HD22      LEU  70  -5.744  -5.542  -2.961
  581   HD23  LEU  70          HD23      LEU  70  -5.664  -7.307  -2.913
  Start of MODEL   14
    1    H    GLN   1           H1       GLN   1 -33.348   4.740  29.002
    2    HA   GLN   1           HA       GLN   1 -33.048   6.258  27.188
    3    HB2  GLN   1           HB2      GLN   1 -31.128   7.478  28.090
    4    HB3  GLN   1           HB3      GLN   1 -30.111   6.049  27.949
    5    HG2  GLN   1           HG2      GLN   1 -29.718   7.721  26.146
    6    HG3  GLN   1           HG3      GLN   1 -30.185   6.145  25.521
    7   HE21  GLN   1          HE21      GLN   1 -31.133   9.552  25.732
    8   HE22  GLN   1          HE22      GLN   1 -32.614   9.337  24.803
    9    H    GLU   2           H        GLU   2 -33.994   4.661  26.074
   10    HA   GLU   2           HA       GLU   2 -32.293   2.361  25.145
   11    HB2  GLU   2           HB2      GLU   2 -35.320   2.467  25.495
   12    HB3  GLU   2           HB3      GLU   2 -34.389   1.118  24.863
   13    HG2  GLU   2           HG2      GLU   2 -34.827   0.431  27.003
   14    HG3  GLU   2           HG3      GLU   2 -33.179   1.038  27.119
   15    H    SER   3           H        SER   3 -33.369   5.276  24.071
   16    HA   SER   3           HA       SER   3 -34.426   4.338  21.438
   17    HB2  SER   3           HB2      SER   3 -34.740   7.017  22.822
   18    HB3  SER   3           HB3      SER   3 -35.560   6.469  21.351
   19    HG   SER   3           HG       SER   3 -36.869   6.251  23.200
   20    H    PHE   4           H        PHE   4 -31.994   6.385  22.902
   21    HA   PHE   4           HA       PHE   4 -30.114   7.375  22.222
   22    HB2  PHE   4           HB2      PHE   4 -30.141   5.268  20.049
   23    HB3  PHE   4           HB3      PHE   4 -28.737   6.163  20.602
   24    HD1  PHE   4           HD1      PHE   4 -28.022   5.960  23.079
   25    HD2  PHE   4           HD2      PHE   4 -30.769   3.254  21.164
   26    HE1  PHE   4           HE1      PHE   4 -27.636   4.291  24.873
   27    HE2  PHE   4           HE2      PHE   4 -30.386   1.583  22.959
   28    HZ   PHE   4           HZ       PHE   4 -28.834   2.103  24.833
   29    H    LYS   5           H        LYS   5 -28.745   8.241  20.232
   30    HA   LYS   5           HA       LYS   5 -30.487   9.635  18.294
   31    HB2  LYS   5           HB2      LYS   5 -29.904  10.883  20.688
   32    HB3  LYS   5           HB3      LYS   5 -28.558  11.434  19.694
   33    HG2  LYS   5           HG2      LYS   5 -30.215  12.261  17.992
   34    HG3  LYS   5           HG3      LYS   5 -31.525  11.712  19.051
   35    HD2  LYS   5           HD2      LYS   5 -30.659  13.234  20.858
   36    HD3  LYS   5           HD3      LYS   5 -29.437  13.835  19.715
   37    HE2  LYS   5           HE2      LYS   5 -31.290  14.514  18.166
   38    HE3  LYS   5           HE3      LYS   5 -32.468  13.995  19.380
   39    HZ1  LYS   5           HZ1      LYS   5 -32.037  16.380  19.485
   40    HZ2  LYS   5           HZ2      LYS   5 -30.440  16.138  19.787
   41    HZ3  LYS   5           HZ3      LYS   5 -31.569  15.677  20.889
   42    H    LYS   6           H        LYS   6 -29.579  10.190  16.462
   43    HA   LYS   6           HA       LYS   6 -28.237  10.399  14.701
   44    HB2  LYS   6           HB2      LYS   6 -25.987  11.038  16.612
   45    HB3  LYS   6           HB3      LYS   6 -26.184  11.572  14.935
   46    HG2  LYS   6           HG2      LYS   6 -28.222  12.846  15.565
   47    HG3  LYS   6           HG3      LYS   6 -27.979  12.391  17.256
   48    HD2  LYS   6           HD2      LYS   6 -26.095  14.091  15.597
   49    HD3  LYS   6           HD3      LYS   6 -27.206  14.630  16.865
   50    HE2  LYS   6           HE2      LYS   6 -25.878  12.877  18.364
   51    HE3  LYS   6           HE3      LYS   6 -24.642  13.041  17.101
   52    HZ1  LYS   6           HZ1      LYS   6 -25.742  15.152  18.853
   53    HZ2  LYS   6           HZ2      LYS   6 -24.930  15.536  17.499
   54    HZ3  LYS   6           HZ3      LYS   6 -24.170  14.717  18.718
   55    H    GLN   7           H        GLN   7 -27.976   7.641  16.314
   56    HA   GLN   7           HA       GLN   7 -25.456   6.578  15.373
   57    HB2  GLN   7           HB2      GLN   7 -27.993   5.190  16.333
   58    HB3  GLN   7           HB3      GLN   7 -26.453   4.385  16.002
   59    HG2  GLN   7           HG2      GLN   7 -25.336   5.830  17.692
   60    HG3  GLN   7           HG3      GLN   7 -26.898   6.544  18.107
   61   HE21  GLN   7          HE21      GLN   7 -25.482   5.368  20.126
   62   HE22  GLN   7          HE22      GLN   7 -26.341   3.882  20.595
   63    H    GLU   8           H        GLU   8 -28.588   6.918  13.762
   64    HA   GLU   8           HA       GLU   8 -27.857   5.055  11.618
   65    HB2  GLU   8           HB2      GLU   8 -29.781   5.930  10.418
   66    HB3  GLU   8           HB3      GLU   8 -30.185   5.352  12.023
   67    HG2  GLU   8           HG2      GLU   8 -29.705   8.310  11.614
   68    HG3  GLU   8           HG3      GLU   8 -31.208   7.587  11.055
   69    H    LYS   9           H        LYS   9 -26.776   8.154  12.401
   70    HA   LYS   9           HA       LYS   9 -25.874   8.793   9.633
   71    HB2  LYS   9           HB2      LYS   9 -25.565  10.420  12.140
   72    HB3  LYS   9           HB3      LYS   9 -25.350  10.958  10.476
   73    HG2  LYS   9           HG2      LYS   9 -27.969  10.251  11.871
   74    HG3  LYS   9           HG3      LYS   9 -27.381  11.861  11.472
   75    HD2  LYS   9           HD2      LYS   9 -27.531  11.336   9.048
   76    HD3  LYS   9           HD3      LYS   9 -28.143   9.714   9.452
   77    HE2  LYS   9           HE2      LYS   9 -30.064  10.718  10.645
   78    HE3  LYS   9           HE3      LYS   9 -29.452  12.338  10.288
   79    HZ1  LYS   9           HZ1      LYS   9 -30.254  10.377   8.203
   80    HZ2  LYS   9           HZ2      LYS   9 -29.785  11.921   7.949
   81    HZ3  LYS   9           HZ3      LYS   9 -31.188  11.655   8.727
   82    H    THR  10           H        THR  10 -24.737   7.067  12.281
   83    HA   THR  10           HA       THR  10 -22.007   7.053  11.117
   84    HB   THR  10           HB       THR  10 -21.108   6.755  13.496
   85    HG1  THR  10           HG1      THR  10 -22.871   6.596  14.745
   86   HG21  THR  10          HG21      THR  10 -22.176   9.470  12.685
   87   HG22  THR  10          HG22      THR  10 -20.639   8.743  12.179
   88   HG23  THR  10          HG23      THR  10 -20.905   9.149  13.882
   89    HA   PRO  11           HA       PRO  11 -23.965   2.859  11.904
   90    HB2  PRO  11           HB2      PRO  11 -23.462   2.326   9.001
   91    HB3  PRO  11           HB3      PRO  11 -24.923   1.991   9.978
   92    HG2  PRO  11           HG2      PRO  11 -24.882   4.043   8.200
   93    HG3  PRO  11           HG3      PRO  11 -25.639   4.263   9.818
   94    HD2  PRO  11           HD2      PRO  11 -22.815   5.002   8.963
   95    HD3  PRO  11           HD3      PRO  11 -24.051   6.030   9.723
   96    H    LYS  12           H        LYS  12 -20.859   3.827  10.924
   97    HA   LYS  12           HA       LYS  12 -19.817   1.064  10.514
   98    HB2  LYS  12           HB2      LYS  12 -19.902   3.079   8.810
   99    HB3  LYS  12           HB3      LYS  12 -18.456   3.625   9.666
  100    HG2  LYS  12           HG2      LYS  12 -17.341   1.484   9.136
  101    HG3  LYS  12           HG3      LYS  12 -18.827   0.902   8.350
  102    HD2  LYS  12           HD2      LYS  12 -17.242   3.346   7.469
  103    HD3  LYS  12           HD3      LYS  12 -17.103   1.729   6.759
  104    HE2  LYS  12           HE2      LYS  12 -19.483   1.783   6.100
  105    HE3  LYS  12           HE3      LYS  12 -19.655   3.395   6.810
  106    HZ1  LYS  12           HZ1      LYS  12 -17.833   2.730   4.567
  107    HZ2  LYS  12           HZ2      LYS  12 -18.011   4.215   5.247
  108    HZ3  LYS  12           HZ3      LYS  12 -19.278   3.567   4.455
  109    H    THR  13           H        THR  13 -17.834   0.372  11.358
  110    HA   THR  13           HA       THR  13 -16.594   2.047  13.525
  111    HB   THR  13           HB       THR  13 -17.373  -0.864  13.900
  112    HG1  THR  13           HG1      THR  13 -19.210   0.263  14.040
  113   HG21  THR  13          HG21      THR  13 -16.854  -0.357  16.283
  114   HG22  THR  13          HG22      THR  13 -16.271   1.255  15.812
  115   HG23  THR  13          HG23      THR  13 -15.411  -0.207  15.276
  116    HA   PRO  14           HA       PRO  14 -12.931   0.253  11.402
  117    HB2  PRO  14           HB2      PRO  14 -11.911   3.025  11.643
  118    HB3  PRO  14           HB3      PRO  14 -11.964   1.978  10.200
  119    HG2  PRO  14           HG2      PRO  14 -13.576   4.179  10.488
  120    HG3  PRO  14           HG3      PRO  14 -14.116   2.697   9.628
  121    HD2  PRO  14           HD2      PRO  14 -14.663   3.507  12.498
  122    HD3  PRO  14           HD3      PRO  14 -15.809   2.918  11.254
  123    H    LYS  15           H        LYS  15 -10.965  -0.146  12.611
  124    HA   LYS  15           HA       LYS  15 -10.591   1.394  15.128
  125    HB2  LYS  15           HB2      LYS  15 -10.264  -0.519  16.515
  126    HB3  LYS  15           HB3      LYS  15 -11.870  -0.557  15.826
  127    HG2  LYS  15           HG2      LYS  15  -9.628  -2.141  14.505
  128    HG3  LYS  15           HG3      LYS  15 -10.375  -2.722  15.988
  129    HD2  LYS  15           HD2      LYS  15 -12.616  -2.645  14.911
  130    HD3  LYS  15           HD3      LYS  15 -11.856  -2.190  13.376
  131    HE2  LYS  15           HE2      LYS  15 -10.635  -4.238  13.236
  132    HE3  LYS  15           HE3      LYS  15 -10.960  -4.644  14.929
  133    HZ1  LYS  15           HZ1      LYS  15 -13.101  -4.479  12.888
  134    HZ2  LYS  15           HZ2      LYS  15 -13.217  -5.018  14.440
  135    HZ3  LYS  15           HZ3      LYS  15 -12.349  -5.880  13.338
  136    H    GLY  16           H        GLY  16  -9.035  -0.044  12.452
  137    HA2  GLY  16           HA2      GLY  16  -6.883   0.346  11.703
  138    HA3  GLY  16           HA3      GLY  16  -6.719   1.500  13.008
  139    HA   PRO  17           HA       PRO  17  -5.295  -2.997  14.515
  140    HB2  PRO  17           HB2      PRO  17  -4.034  -3.733  11.881
  141    HB3  PRO  17           HB3      PRO  17  -4.708  -4.812  13.137
  142    HG2  PRO  17           HG2      PRO  17  -6.179  -4.191  10.946
  143    HG3  PRO  17           HG3      PRO  17  -6.943  -4.215  12.565
  144    HD2  PRO  17           HD2      PRO  17  -6.119  -1.830  10.949
  145    HD3  PRO  17           HD3      PRO  17  -7.511  -2.073  12.022
  146    H    SER  18           H        SER  18  -3.443  -0.416  13.409
  147    HA   SER  18           HA       SER  18  -1.263   0.237  13.542
  148    HB2  SER  18           HB2      SER  18  -1.444  -1.235  16.182
  149    HB3  SER  18           HB3      SER  18  -0.306   0.058  15.764
  150    HG   SER  18           HG       SER  18  -3.043   0.170  16.310
  151    H    SER  19           H        SER  19  -1.053  -1.702  11.756
  152    HA   SER  19           HA       SER  19   1.427  -3.221  12.184
  153    HB2  SER  19           HB2      SER  19  -0.227  -4.532  13.467
  154    HB3  SER  19           HB3      SER  19  -1.333  -4.512  12.087
  155    HG   SER  19           HG       SER  19   0.107  -6.428  12.570
  156    H    VAL  20           H        VAL  20   1.641  -4.828  10.152
  157    HA   VAL  20           HA       VAL  20   0.918  -3.605   7.610
  158    HB   VAL  20           HB       VAL  20   1.524  -6.510   8.264
  159   HG11  VAL  20          HG11      VAL  20   0.316  -6.419   6.143
  160   HG12  VAL  20          HG12      VAL  20   1.323  -5.064   5.588
  161   HG13  VAL  20          HG13      VAL  20   2.025  -6.687   5.800
  162   HG21  VAL  20          HG21      VAL  20   3.743  -6.093   7.372
  163   HG22  VAL  20          HG22      VAL  20   3.318  -4.421   6.950
  164   HG23  VAL  20          HG23      VAL  20   3.444  -4.910   8.644
  165    H    GLU  21           H        GLU  21  -0.807  -5.709   9.883
  166    HA   GLU  21           HA       GLU  21  -3.101  -6.312   8.263
  167    HB2  GLU  21           HB2      GLU  21  -2.726  -5.930  11.257
  168    HB3  GLU  21           HB3      GLU  21  -4.241  -6.428  10.529
  169    HG2  GLU  21           HG2      GLU  21  -3.199  -8.441   9.587
  170    HG3  GLU  21           HG3      GLU  21  -1.613  -7.930  10.175
  171    H    ASP  22           H        ASP  22  -2.100  -3.259   9.678
  172    HA   ASP  22           HA       ASP  22  -4.736  -1.984   9.521
  173    HB2  ASP  22           HB2      ASP  22  -3.034  -1.341  11.216
  174    HB3  ASP  22           HB3      ASP  22  -1.983  -0.745   9.930
  175    H    ILE  23           H        ILE  23  -1.647  -1.820   7.623
  176    HA   ILE  23           HA       ILE  23  -2.879  -0.079   5.703
  177    HB   ILE  23           HB       ILE  23  -0.382  -0.451   6.147
  178   HG12  ILE  23          HG12      ILE  23  -1.284  -0.228   3.253
  179   HG13  ILE  23          HG13      ILE  23  -1.391   1.070   4.446
  180   HG21  ILE  23          HG21      ILE  23  -0.743  -2.603   4.005
  181   HG22  ILE  23          HG22      ILE  23   0.788  -2.000   4.637
  182   HG23  ILE  23          HG23      ILE  23  -0.280  -2.877   5.701
  183   HD11  ILE  23          HD11      ILE  23   0.593   1.441   3.140
  184   HD12  ILE  23          HD12      ILE  23   1.107   0.955   4.764
  185   HD13  ILE  23          HD13      ILE  23   1.179  -0.205   3.417
  186    H    LYS  24           H        LYS  24  -2.685  -3.610   5.894
  187    HA   LYS  24           HA       LYS  24  -3.993  -4.310   3.445
  188    HB2  LYS  24           HB2      LYS  24  -4.007  -5.521   6.235
  189    HB3  LYS  24           HB3      LYS  24  -4.863  -6.265   4.908
  190    HG2  LYS  24           HG2      LYS  24  -1.879  -5.711   4.728
  191    HG3  LYS  24           HG3      LYS  24  -2.539  -7.148   5.513
  192    HD2  LYS  24           HD2      LYS  24  -3.750  -7.713   3.368
  193    HD3  LYS  24           HD3      LYS  24  -2.947  -6.335   2.610
  194    HE2  LYS  24           HE2      LYS  24  -1.746  -8.333   2.020
  195    HE3  LYS  24           HE3      LYS  24  -0.721  -7.378   3.087
  196    HZ1  LYS  24           HZ1      LYS  24  -0.797  -9.809   3.604
  197    HZ2  LYS  24           HZ2      LYS  24  -2.384  -9.654   4.034
  198    HZ3  LYS  24           HZ3      LYS  24  -1.236  -8.896   4.888
  199    H    ALA  25           H        ALA  25  -5.523  -3.641   6.666
  200    HA   ALA  25           HA       ALA  25  -8.185  -3.765   5.655
  201    HB1  ALA  25           HB1      ALA  25  -7.070  -2.369   8.128
  202    HB2  ALA  25           HB2      ALA  25  -8.779  -2.763   7.836
  203    HB3  ALA  25           HB3      ALA  25  -7.590  -4.066   8.016
  204    H    LYS  26           H        LYS  26  -6.083  -0.895   6.166
  205    HA   LYS  26           HA       LYS  26  -8.064   1.066   5.398
  206    HB2  LYS  26           HB2      LYS  26  -5.068   1.068   5.840
  207    HB3  LYS  26           HB3      LYS  26  -5.820   2.429   5.030
  208    HG2  LYS  26           HG2      LYS  26  -5.503   2.827   7.414
  209    HG3  LYS  26           HG3      LYS  26  -7.178   2.987   6.887
  210    HD2  LYS  26           HD2      LYS  26  -7.675   0.771   7.902
  211    HD3  LYS  26           HD3      LYS  26  -6.006   0.663   8.470
  212    HE2  LYS  26           HE2      LYS  26  -7.924   2.920   9.201
  213    HE3  LYS  26           HE3      LYS  26  -7.688   1.472  10.178
  214    HZ1  LYS  26           HZ1      LYS  26  -6.251   3.254  10.998
  215    HZ2  LYS  26           HZ2      LYS  26  -5.598   3.477   9.519
  216    HZ3  LYS  26           HZ3      LYS  26  -5.295   2.088  10.338
  217    H    MET  27           H        MET  27  -5.465  -0.538   3.456
  218    HA   MET  27           HA       MET  27  -6.166   0.836   1.017
  219    HB2  MET  27           HB2      MET  27  -4.785  -1.831   1.512
  220    HB3  MET  27           HB3      MET  27  -5.121  -1.201  -0.101
  221    HG2  MET  27           HG2      MET  27  -3.860   0.851   0.388
  222    HG3  MET  27           HG3      MET  27  -3.445   0.228   1.987
  223    HE1  MET  27           HE1      MET  27  -1.449   1.245  -0.531
  224    HE2  MET  27           HE2      MET  27  -0.956   0.946   1.152
  225    HE3  MET  27           HE3      MET  27  -0.100   0.143  -0.187
  226    H    GLN  28           H        GLN  28  -7.363  -2.307   2.393
  227    HA   GLN  28           HA       GLN  28  -9.117  -2.889   0.214
  228    HB2  GLN  28           HB2      GLN  28  -9.035  -3.632   3.139
  229    HB3  GLN  28           HB3      GLN  28 -10.471  -4.003   2.221
  230    HG2  GLN  28           HG2      GLN  28  -8.404  -5.720   2.456
  231    HG3  GLN  28           HG3      GLN  28  -9.575  -5.739   1.149
  232   HE21  GLN  28          HE21      GLN  28  -6.306  -4.463   1.955
  233   HE22  GLN  28          HE22      GLN  28  -5.756  -4.594   0.271
  234    H    ALA  29           H        ALA  29  -9.730  -0.845   3.126
  235    HA   ALA  29           HA       ALA  29 -12.433  -0.265   2.438
  236    HB1  ALA  29           HB1      ALA  29 -10.414   1.412   3.998
  237    HB2  ALA  29           HB2      ALA  29 -12.177   1.625   4.002
  238    HB3  ALA  29           HB3      ALA  29 -11.464   0.144   4.668
  239    H    SER  30           H        SER  30  -9.402   1.551   1.600
  240    HA   SER  30           HA       SER  30 -10.683   3.546   0.009
  241    HB2  SER  30           HB2      SER  30  -7.883   2.378  -0.125
  242    HB3  SER  30           HB3      SER  30  -8.419   3.806  -1.040
  243    HG   SER  30           HG       SER  30  -7.416   3.995   1.233
  244    H    ILE  31           H        ILE  31  -9.588   0.265  -0.921
  245    HA   ILE  31           HA       ILE  31 -10.181   0.531  -3.733
  246    HB   ILE  31           HB       ILE  31  -9.879  -1.861  -1.884
  247   HG12  ILE  31          HG12      ILE  31  -8.075  -0.923  -4.151
  248   HG13  ILE  31          HG13      ILE  31  -7.889  -0.316  -2.517
  249   HG21  ILE  31          HG21      ILE  31 -10.211  -1.890  -4.920
  250   HG22  ILE  31          HG22      ILE  31  -9.741  -3.283  -3.926
  251   HG23  ILE  31          HG23      ILE  31 -11.339  -2.589  -3.735
  252   HD11  ILE  31          HD11      ILE  31  -7.568  -3.219  -3.369
  253   HD12  ILE  31          HD12      ILE  31  -6.305  -2.095  -2.845
  254   HD13  ILE  31          HD13      ILE  31  -7.527  -2.641  -1.686
  255    H    GLU  32           H        GLU  32 -12.158  -0.658  -0.965
  256    HA   GLU  32           HA       GLU  32 -14.516  -1.252  -2.517
  257    HB2  GLU  32           HB2      GLU  32 -14.078  -0.561   0.414
  258    HB3  GLU  32           HB3      GLU  32 -15.647  -0.980  -0.242
  259    HG2  GLU  32           HG2      GLU  32 -13.189  -2.763  -0.241
  260    HG3  GLU  32           HG3      GLU  32 -14.587  -2.920   0.819
  261    H    LYS  33           H        LYS  33 -13.341   1.778  -1.182
  262    HA   LYS  33           HA       LYS  33 -15.777   3.238  -2.021
  263    HB2  LYS  33           HB2      LYS  33 -13.215   4.074  -0.611
  264    HB3  LYS  33           HB3      LYS  33 -14.548   5.166  -1.001
  265    HG2  LYS  33           HG2      LYS  33 -16.109   3.664   0.295
  266    HG3  LYS  33           HG3      LYS  33 -14.749   2.660   0.747
  267    HD2  LYS  33           HD2      LYS  33 -15.267   4.103   2.589
  268    HD3  LYS  33           HD3      LYS  33 -13.684   4.554   1.934
  269    HE2  LYS  33           HE2      LYS  33 -14.692   6.451   0.729
  270    HE3  LYS  33           HE3      LYS  33 -16.306   5.957   1.250
  271    HZ1  LYS  33           HZ1      LYS  33 -15.304   7.771   2.565
  272    HZ2  LYS  33           HZ2      LYS  33 -14.141   6.768   3.109
  273    HZ3  LYS  33           HZ3      LYS  33 -15.727   6.495   3.518
  274    H    GLY  34           H        GLY  34 -12.805   2.434  -3.483
  275    HA2  GLY  34           HA2      GLY  34 -12.466   2.396  -5.756
  276    HA3  GLY  34           HA3      GLY  34 -13.813   3.505  -5.987
  277    H    GLY  35           H        GLY  35 -12.594   5.597  -4.196
  278    HA2  GLY  35           HA2      GLY  35 -10.840   6.896  -6.144
  279    HA3  GLY  35           HA3      GLY  35 -11.347   7.530  -4.581
  280    H    SER  36           H        SER  36  -8.872   8.052  -5.275
  281    HA   SER  36           HA       SER  36  -6.747   8.129  -4.523
  282    HB2  SER  36           HB2      SER  36  -7.738   6.389  -2.244
  283    HB3  SER  36           HB3      SER  36  -6.245   7.331  -2.259
  284    HG   SER  36           HG       SER  36  -7.276   9.126  -2.024
  285    H    LEU  37           H        LEU  37  -4.895   6.636  -3.529
  286    HA   LEU  37           HA       LEU  37  -3.339   5.185  -3.806
  287    HB2  LEU  37           HB2      LEU  37  -5.384   3.351  -5.049
  288    HB3  LEU  37           HB3      LEU  37  -3.685   2.980  -5.113
  289    HG   LEU  37           HG       LEU  37  -3.519   3.077  -2.645
  290   HD11  LEU  37          HD11      LEU  37  -6.551   3.368  -2.736
  291   HD12  LEU  37          HD12      LEU  37  -5.389   4.492  -1.988
  292   HD13  LEU  37          HD13      LEU  37  -5.616   2.891  -1.298
  293   HD21  LEU  37          HD21      LEU  37  -3.886   0.954  -3.842
  294   HD22  LEU  37          HD22      LEU  37  -5.644   1.184  -3.723
  295   HD23  LEU  37          HD23      LEU  37  -4.671   0.937  -2.257
  296    HA   PRO  38           HA       PRO  38  -1.566   6.696  -7.411
  297    HB2  PRO  38           HB2      PRO  38   0.991   6.199  -6.916
  298    HB3  PRO  38           HB3      PRO  38  -0.036   6.942  -5.653
  299    HG2  PRO  38           HG2      PRO  38   0.693   4.011  -5.977
  300    HG3  PRO  38           HG3      PRO  38   0.811   5.044  -4.506
  301    HD2  PRO  38           HD2      PRO  38  -1.350   3.401  -5.072
  302    HD3  PRO  38           HD3      PRO  38  -1.406   4.886  -4.078
  303    H    LYS  39           H        LYS  39  -2.136   3.483  -7.846
  304    HA   LYS  39           HA       LYS  39  -1.746   1.857  -9.292
  305    HB2  LYS  39           HB2      LYS  39  -2.578   3.624 -10.778
  306    HB3  LYS  39           HB3      LYS  39  -0.912   4.004 -11.242
  307    HG2  LYS  39           HG2      LYS  39  -0.650   1.630 -12.049
  308    HG3  LYS  39           HG3      LYS  39  -2.350   1.339 -11.637
  309    HD2  LYS  39           HD2      LYS  39  -3.012   3.155 -13.220
  310    HD3  LYS  39           HD3      LYS  39  -1.299   3.389 -13.640
  311    HE2  LYS  39           HE2      LYS  39  -1.173   1.044 -14.437
  312    HE3  LYS  39           HE3      LYS  39  -2.862   0.794 -13.985
  313    HZ1  LYS  39           HZ1      LYS  39  -3.358   2.686 -15.577
  314    HZ2  LYS  39           HZ2      LYS  39  -2.838   1.285 -16.284
  315    HZ3  LYS  39           HZ3      LYS  39  -1.808   2.537 -16.121
  316    H    VAL  40           H        VAL  40   1.177   3.859  -9.900
  317    HA   VAL  40           HA       VAL  40   2.529   1.393 -10.800
  318    HB   VAL  40           HB       VAL  40   2.244   3.319 -12.271
  319   HG11  VAL  40          HG11      VAL  40   4.242   4.761 -10.495
  320   HG12  VAL  40          HG12      VAL  40   3.612   5.336 -12.046
  321   HG13  VAL  40          HG13      VAL  40   2.521   5.175 -10.666
  322   HG21  VAL  40          HG21      VAL  40   4.084   1.737 -12.701
  323   HG22  VAL  40          HG22      VAL  40   4.443   3.375 -13.259
  324   HG23  VAL  40          HG23      VAL  40   5.192   2.779 -11.771
  325    H    GLU  41           H        GLU  41   4.679   0.763 -10.325
  326    HA   GLU  41           HA       GLU  41   5.044   0.285  -7.726
  327    HB2  GLU  41           HB2      GLU  41   7.368  -0.396  -8.142
  328    HB3  GLU  41           HB3      GLU  41   6.215  -1.039  -9.294
  329    HG2  GLU  41           HG2      GLU  41   7.058   0.274 -11.078
  330    HG3  GLU  41           HG3      GLU  41   7.793   1.441 -10.022
  331    H    ALA  42           H        ALA  42   7.092   2.935  -9.173
  332    HA   ALA  42           HA       ALA  42   8.418   3.358  -6.661
  333    HB1  ALA  42           HB1      ALA  42   9.400   3.876  -8.881
  334    HB2  ALA  42           HB2      ALA  42   8.222   5.195  -9.090
  335    HB3  ALA  42           HB3      ALA  42   9.432   5.273  -7.794
  336    H    LYS  43           H        LYS  43   5.655   4.951  -8.213
  337    HA   LYS  43           HA       LYS  43   5.191   6.958  -6.169
  338    HB2  LYS  43           HB2      LYS  43   3.173   5.649  -8.044
  339    HB3  LYS  43           HB3      LYS  43   2.981   7.168  -7.164
  340    HG2  LYS  43           HG2      LYS  43   5.019   6.699  -9.368
  341    HG3  LYS  43           HG3      LYS  43   3.433   7.456  -9.558
  342    HD2  LYS  43           HD2      LYS  43   4.116   9.172  -7.838
  343    HD3  LYS  43           HD3      LYS  43   5.764   8.500  -7.887
  344    HE2  LYS  43           HE2      LYS  43   5.910   9.030 -10.297
  345    HE3  LYS  43           HE3      LYS  43   4.228   9.592 -10.282
  346    HZ1  LYS  43           HZ1      LYS  43   5.669  11.506 -10.058
  347    HZ2  LYS  43           HZ2      LYS  43   6.487  10.847  -8.810
  348    HZ3  LYS  43           HZ3      LYS  43   4.913  11.286  -8.633
  349    H    PHE  44           H        PHE  44   4.142   3.579  -6.571
  350    HA   PHE  44           HA       PHE  44   2.340   3.584  -4.360
  351    HB2  PHE  44           HB2      PHE  44   2.206   1.924  -6.145
  352    HB3  PHE  44           HB3      PHE  44   3.794   1.304  -5.746
  353    HD1  PHE  44           HD2      PHE  44   4.173  -0.079  -3.731
  354    HD2  PHE  44           HD1      PHE  44   0.239   1.328  -4.796
  355    HE1  PHE  44           HE2      PHE  44   3.163  -1.736  -2.183
  356    HE2  PHE  44           HE1      PHE  44  -0.770  -0.333  -3.244
  357    HZ   PHE  44           HZ       PHE  44   0.689  -1.869  -1.943
  358    H    ILE  45           H        ILE  45   5.761   2.507  -4.621
  359    HA   ILE  45           HA       ILE  45   6.090   1.830  -1.870
  360    HB   ILE  45           HB       ILE  45   8.093   2.711  -3.981
  361   HG12  ILE  45          HG12      ILE  45   7.594  -0.074  -2.824
  362   HG13  ILE  45          HG13      ILE  45   6.747   0.504  -4.248
  363   HG21  ILE  45          HG21      ILE  45   9.101   3.160  -1.804
  364   HG22  ILE  45          HG22      ILE  45   8.584   1.572  -1.186
  365   HG23  ILE  45          HG23      ILE  45   9.824   1.696  -2.445
  366   HD11  ILE  45          HD11      ILE  45   8.925   0.860  -5.413
  367   HD12  ILE  45          HD12      ILE  45   9.756   0.120  -4.023
  368   HD13  ILE  45          HD13      ILE  45   8.604  -0.828  -4.973
  369    H    ASN  46           H        ASN  46   6.718   4.994  -3.534
  370    HA   ASN  46           HA       ASN  46   7.433   6.408  -1.168
  371    HB2  ASN  46           HB2      ASN  46   7.862   7.492  -3.239
  372    HB3  ASN  46           HB3      ASN  46   6.213   7.243  -3.823
  373   HD21  ASN  46          HD21      ASN  46   4.686   8.823  -3.466
  374   HD22  ASN  46          HD22      ASN  46   4.794  10.022  -2.227
  375    H    TYR  47           H        TYR  47   4.141   6.009  -2.602
  376    HA   TYR  47           HA       TYR  47   2.720   7.542  -0.679
  377    HB2  TYR  47           HB2      TYR  47   1.725   6.956  -2.724
  378    HB3  TYR  47           HB3      TYR  47   2.020   5.237  -2.492
  379    HD1  TYR  47           HD2      TYR  47  -0.047   8.092  -1.232
  380    HD2  TYR  47           HD1      TYR  47   0.416   3.811  -1.495
  381    HE1  TYR  47           HE2      TYR  47  -2.365   7.786  -0.380
  382    HE2  TYR  47           HE1      TYR  47  -1.920   3.520  -0.645
  383    HH   TYR  47           HH       TYR  47  -3.953   6.313   0.278
  384    H    VAL  48           H        VAL  48   3.551   4.037  -0.647
  385    HA   VAL  48           HA       VAL  48   2.389   3.534   1.912
  386    HB   VAL  48           HB       VAL  48   4.598   2.131   0.355
  387   HG11  VAL  48          HG11      VAL  48   3.377   1.280   3.011
  388   HG12  VAL  48          HG12      VAL  48   4.290   0.203   1.931
  389   HG13  VAL  48          HG13      VAL  48   5.096   1.590   2.663
  390   HG21  VAL  48          HG21      VAL  48   2.270   1.972  -0.536
  391   HG22  VAL  48          HG22      VAL  48   2.878   0.411   0.014
  392   HG23  VAL  48          HG23      VAL  48   1.734   1.321   1.024
  393    H    LYS  49           H        LYS  49   5.850   4.274   1.145
  394    HA   LYS  49           HA       LYS  49   6.765   4.225   3.837
  395    HB2  LYS  49           HB2      LYS  49   7.718   5.761   1.384
  396    HB3  LYS  49           HB3      LYS  49   8.571   5.785   2.933
  397    HG2  LYS  49           HG2      LYS  49   8.963   3.413   2.878
  398    HG3  LYS  49           HG3      LYS  49   8.010   3.213   1.403
  399    HD2  LYS  49           HD2      LYS  49   9.573   4.569   0.125
  400    HD3  LYS  49           HD3      LYS  49  10.473   5.004   1.592
  401    HE2  LYS  49           HE2      LYS  49  11.082   2.640   1.946
  402    HE3  LYS  49           HE3      LYS  49  10.211   2.174   0.475
  403    HZ1  LYS  49           HZ1      LYS  49  12.507   4.064   0.527
  404    HZ2  LYS  49           HZ2      LYS  49  11.766   3.472  -0.826
  405    HZ3  LYS  49           HZ3      LYS  49  12.619   2.472   0.154
  406    H    ASN  50           H        ASN  50   5.604   7.060   1.990
  407    HA   ASN  50           HA       ASN  50   6.081   8.731   4.328
  408    HB2  ASN  50           HB2      ASN  50   6.272  10.436   2.942
  409    HB3  ASN  50           HB3      ASN  50   6.510   9.180   1.741
  410   HD21  ASN  50          HD21      ASN  50   4.388   8.476   0.580
  411   HD22  ASN  50          HD22      ASN  50   3.379   9.856   0.118
  412    H    CYS  51           H        CYS  51   3.085   7.459   2.834
  413    HA   CYS  51           HA       CYS  51   1.503   9.138   4.707
  414    HB2  CYS  51           HB2      CYS  51   0.583   7.320   2.451
  415    HB3  CYS  51           HB3      CYS  51  -0.431   8.374   3.434
  416    HG   CYS  51           HG       CYS  51   0.911  10.607   2.812
  417    H    PHE  52           H        PHE  52   2.502   5.745   4.408
  418    HA   PHE  52           HA       PHE  52   0.800   5.092   6.780
  419    HB2  PHE  52           HB2      PHE  52   0.945   3.568   4.170
  420    HB3  PHE  52           HB3      PHE  52   0.173   2.972   5.640
  421    HD1  PHE  52           HD1      PHE  52  -1.782   4.224   6.652
  422    HD2  PHE  52           HD2      PHE  52  -0.252   5.111   2.719
  423    HE1  PHE  52           HE1      PHE  52  -3.876   5.434   6.116
  424    HE2  PHE  52           HE2      PHE  52  -2.328   6.374   2.210
  425    HZ   PHE  52           HZ       PHE  52  -4.153   6.520   3.886
  426    H    ARG  53           H        ARG  53   3.936   4.925   5.630
  427    HA   ARG  53           HA       ARG  53   5.837   4.125   6.604
  428    HB2  ARG  53           HB2      ARG  53   5.939   4.791   8.952
  429    HB3  ARG  53           HB3      ARG  53   5.205   5.956   7.856
  430    HG2  ARG  53           HG2      ARG  53   2.945   5.350   8.689
  431    HG3  ARG  53           HG3      ARG  53   3.690   4.245   9.857
  432    HD2  ARG  53           HD2      ARG  53   4.854   6.138  10.900
  433    HD3  ARG  53           HD3      ARG  53   4.269   7.245   9.670
  434    HE   ARG  53           HE       ARG  53   2.799   6.135  11.948
  435   HH11  ARG  53          HH11      ARG  53   2.394   7.874   8.878
  436   HH12  ARG  53          HH12      ARG  53   0.702   8.171   9.241
  437   HH21  ARG  53          HH21      ARG  53   0.730   6.805  12.355
  438   HH22  ARG  53          HH22      ARG  53  -0.050   7.955  11.274
  439    H    MET  54           H        MET  54   5.377   1.910   5.799
  440    HA   MET  54           HA       MET  54   4.806  -0.163   7.776
  441    HB2  MET  54           HB2      MET  54   5.784  -0.206   4.900
  442    HB3  MET  54           HB3      MET  54   5.577  -1.680   5.854
  443    HG2  MET  54           HG2      MET  54   3.351   0.335   5.350
  444    HG3  MET  54           HG3      MET  54   3.628  -1.135   4.422
  445    HE1  MET  54           HE1      MET  54   2.805   0.143   8.209
  446    HE2  MET  54           HE2      MET  54   1.521   0.380   7.012
  447    HE3  MET  54           HE3      MET  54   1.316  -0.807   8.314
  448    H    THR  55           H        THR  55   7.752   1.427   6.913
  449    HA   THR  55           HA       THR  55   9.864   1.272   7.553
  450    HB   THR  55           HB       THR  55  10.488   0.509   9.712
  451    HG1  THR  55           HG1      THR  55   8.149  -1.001   9.502
  452   HG21  THR  55          HG21      THR  55   8.932   1.675  11.145
  453   HG22  THR  55          HG22      THR  55   7.653   1.594   9.922
  454   HG23  THR  55          HG23      THR  55   9.110   2.571   9.627
  455    H    ASP  56           H        ASP  56   8.481  -1.934   7.064
  456    HA   ASP  56           HA       ASP  56  11.207  -3.105   6.802
  457    HB2  ASP  56           HB2      ASP  56   8.491  -4.441   6.896
  458    HB3  ASP  56           HB3      ASP  56  10.060  -5.244   6.935
  459    H    GLN  57           H        GLN  57  12.106  -3.494   4.835
  460    HA   GLN  57           HA       GLN  57  10.727  -2.871   2.399
  461    HB2  GLN  57           HB2      GLN  57  13.319  -2.967   3.056
  462    HB3  GLN  57           HB3      GLN  57  13.199  -4.596   2.397
  463    HG2  GLN  57           HG2      GLN  57  12.562  -1.956   1.021
  464    HG3  GLN  57           HG3      GLN  57  13.923  -3.004   0.678
  465   HE21  GLN  57          HE21      GLN  57  11.044  -2.051  -0.573
  466   HE22  GLN  57          HE22      GLN  57  10.541  -3.540  -1.376
  467    H    GLU  58           H        GLU  58  11.522  -5.956   3.980
  468    HA   GLU  58           HA       GLU  58  10.492  -7.752   2.071
  469    HB2  GLU  58           HB2      GLU  58  10.244  -9.308   3.987
  470    HB3  GLU  58           HB3      GLU  58  11.809  -8.526   3.891
  471    HG2  GLU  58           HG2      GLU  58  11.138  -6.929   5.686
  472    HG3  GLU  58           HG3      GLU  58   9.557  -7.717   5.783
  473    H    ALA  59           H        ALA  59   8.662  -5.753   4.396
  474    HA   ALA  59           HA       ALA  59   6.126  -7.114   3.762
  475    HB1  ALA  59           HB1      ALA  59   6.650  -4.589   5.373
  476    HB2  ALA  59           HB2      ALA  59   5.114  -5.467   5.220
  477    HB3  ALA  59           HB3      ALA  59   6.491  -6.240   6.034
  478    H    ILE  60           H        ILE  60   7.793  -4.029   2.939
  479    HA   ILE  60           HA       ILE  60   5.755  -2.865   1.333
  480    HB   ILE  60           HB       ILE  60   8.771  -2.713   1.291
  481   HG12  ILE  60          HG12      ILE  60   6.704  -0.624   2.094
  482   HG13  ILE  60          HG13      ILE  60   7.383  -1.782   3.229
  483   HG21  ILE  60          HG21      ILE  60   8.031  -2.181  -1.018
  484   HG22  ILE  60          HG22      ILE  60   6.843  -1.025  -0.379
  485   HG23  ILE  60          HG23      ILE  60   8.589  -0.734  -0.205
  486   HD11  ILE  60          HD11      ILE  60   8.601   0.270   3.461
  487   HD12  ILE  60          HD12      ILE  60   9.678  -0.928   2.719
  488   HD13  ILE  60          HD13      ILE  60   8.944   0.350   1.725
  489    H    GLN  61           H        GLN  61   8.313  -5.198   0.330
  490    HA   GLN  61           HA       GLN  61   7.122  -5.430  -2.320
  491    HB2  GLN  61           HB2      GLN  61   8.783  -7.031  -2.817
  492    HB3  GLN  61           HB3      GLN  61   9.511  -5.705  -1.929
  493    HG2  GLN  61           HG2      GLN  61  10.536  -7.533  -0.952
  494    HG3  GLN  61           HG3      GLN  61   9.241  -7.194   0.176
  495   HE21  GLN  61          HE21      GLN  61   8.635  -9.218   0.969
  496   HE22  GLN  61          HE22      GLN  61   8.457 -10.659  -0.034
  497    H    ASP  62           H        ASP  62   6.646  -7.317   0.726
  498    HA   ASP  62           HA       ASP  62   5.089  -9.404  -0.500
  499    HB2  ASP  62           HB2      ASP  62   5.959  -9.365   1.856
  500    HB3  ASP  62           HB3      ASP  62   4.740  -8.163   2.260
  501    H    LEU  63           H        LEU  63   4.276  -6.138   0.578
  502    HA   LEU  63           HA       LEU  63   1.441  -6.256   0.135
  503    HB2  LEU  63           HB2      LEU  63   3.517  -4.132   0.614
  504    HB3  LEU  63           HB3      LEU  63   1.856  -3.659   0.238
  505    HG   LEU  63           HG       LEU  63   2.545  -5.544   2.539
  506   HD11  LEU  63          HD11      LEU  63   2.135  -2.523   2.606
  507   HD12  LEU  63          HD12      LEU  63   3.683  -3.366   2.843
  508   HD13  LEU  63          HD13      LEU  63   2.380  -3.597   4.008
  509   HD21  LEU  63          HD21      LEU  63   0.181  -5.596   1.804
  510   HD22  LEU  63          HD22      LEU  63   0.089  -3.826   1.938
  511   HD23  LEU  63          HD23      LEU  63   0.336  -4.831   3.385
  512    H    TRP  64           H        TRP  64   4.169  -5.033  -1.907
  513    HA   TRP  64           HA       TRP  64   2.486  -4.212  -4.088
  514    HB2  TRP  64           HB2      TRP  64   4.846  -3.537  -3.831
  515    HB3  TRP  64           HB3      TRP  64   5.360  -5.194  -4.127
  516    HD1  TRP  64           HD1      TRP  64   6.226  -5.486  -6.482
  517    HE1  TRP  64           HE1      TRP  64   5.751  -4.511  -8.826
  518    HE3  TRP  64           HE3      TRP  64   2.409  -2.247  -5.305
  519    HZ2  TRP  64           HZ2      TRP  64   4.013  -2.601 -10.001
  520    HZ3  TRP  64           HZ3      TRP  64   1.375  -0.855  -7.079
  521    HH2  TRP  64           HH2      TRP  64   2.169  -1.016  -9.427
  522    H    GLN  65           H        GLN  65   4.096  -7.364  -3.455
  523    HA   GLN  65           HA       GLN  65   3.012  -8.708  -5.755
  524    HB2  GLN  65           HB2      GLN  65   4.340  -9.482  -3.180
  525    HB3  GLN  65           HB3      GLN  65   3.316 -10.696  -3.905
  526    HG2  GLN  65           HG2      GLN  65   5.650 -10.930  -4.637
  527    HG3  GLN  65           HG3      GLN  65   4.539 -10.679  -5.976
  528   HE21  GLN  65          HE21      GLN  65   6.358  -8.394  -3.770
  529   HE22  GLN  65          HE22      GLN  65   7.116  -7.549  -5.105
  530    H    TRP  66           H        TRP  66   1.626  -8.208  -2.479
  531    HA   TRP  66           HA       TRP  66  -0.731  -9.786  -2.932
  532    HB2  TRP  66           HB2      TRP  66   0.147  -9.035  -0.733
  533    HB3  TRP  66           HB3      TRP  66  -0.376  -7.393  -1.094
  534    HD1  TRP  66           HD1      TRP  66  -2.838  -6.829  -0.509
  535    HE1  TRP  66           HE1      TRP  66  -4.807  -8.126   0.562
  536    HE3  TRP  66           HE3      TRP  66  -0.948 -11.592  -0.782
  537    HZ2  TRP  66           HZ2      TRP  66  -5.494 -10.835   1.114
  538    HZ3  TRP  66           HZ3      TRP  66  -2.300 -13.517   0.015
  539    HH2  TRP  66           HH2      TRP  66  -4.575 -13.154   0.956
  540    H    ARG  67           H        ARG  67  -0.158  -6.249  -3.373
  541    HA   ARG  67           HA       ARG  67  -2.691  -5.561  -4.469
  542    HB2  ARG  67           HB2      ARG  67  -1.017  -3.941  -3.701
  543    HB3  ARG  67           HB3      ARG  67   0.105  -4.443  -4.955
  544    HG2  ARG  67           HG2      ARG  67  -0.880  -2.316  -5.494
  545    HG3  ARG  67           HG3      ARG  67  -1.337  -3.512  -6.703
  546    HD2  ARG  67           HD2      ARG  67  -3.577  -3.670  -5.822
  547    HD3  ARG  67           HD3      ARG  67  -3.150  -2.716  -4.382
  548    HE   ARG  67           HE       ARG  67  -2.546  -1.208  -6.736
  549   HH11  ARG  67          HH11      ARG  67  -5.602  -2.290  -5.354
  550   HH12  ARG  67          HH12      ARG  67  -6.315  -0.713  -5.690
  551   HH21  ARG  67          HH21      ARG  67  -3.675   0.520  -7.351
  552   HH22  ARG  67          HH22      ARG  67  -5.359   0.674  -6.896
  553    H    LYS  68           H        LYS  68   0.232  -6.698  -6.234
  554    HA   LYS  68           HA       LYS  68  -1.136  -6.897  -8.793
  555    HB2  LYS  68           HB2      LYS  68   1.443  -8.080  -7.693
  556    HB3  LYS  68           HB3      LYS  68   0.890  -8.409  -9.328
  557    HG2  LYS  68           HG2      LYS  68   1.485  -5.614  -8.261
  558    HG3  LYS  68           HG3      LYS  68   2.587  -6.614  -9.211
  559    HD2  LYS  68           HD2      LYS  68   0.849  -6.675 -11.056
  560    HD3  LYS  68           HD3      LYS  68  -0.090  -5.495 -10.129
  561    HE2  LYS  68           HE2      LYS  68   1.819  -3.910 -10.207
  562    HE3  LYS  68           HE3      LYS  68   2.761  -5.095 -11.130
  563    HZ1  LYS  68           HZ1      LYS  68   0.225  -3.836 -12.016
  564    HZ2  LYS  68           HZ2      LYS  68   1.042  -4.955 -12.889
  565    HZ3  LYS  68           HZ3      LYS  68   1.717  -3.483 -12.624
  566    H    SER  69           H        SER  69  -1.485  -8.877  -6.035
  567    HA   SER  69           HA       SER  69  -2.433 -11.195  -7.632
  568    HB2  SER  69           HB2      SER  69  -1.904 -10.945  -4.654
  569    HB3  SER  69           HB3      SER  69  -2.453 -12.405  -5.485
  570    HG   SER  69           HG       SER  69  -0.005 -11.027  -5.672
  571    H    LEU  70           H        LEU  70  -3.806  -8.472  -6.170
  572    HA   LEU  70           HA       LEU  70  -6.464  -9.619  -5.711
  573    HB2  LEU  70           HB2      LEU  70  -5.311  -6.818  -5.834
  574    HB3  LEU  70           HB3      LEU  70  -7.026  -7.115  -5.578
  575    HG   LEU  70           HG       LEU  70  -4.816  -8.088  -3.719
  576   HD11  LEU  70          HD11      LEU  70  -6.798  -5.797  -3.427
  577   HD12  LEU  70          HD12      LEU  70  -5.058  -5.629  -3.732
  578   HD13  LEU  70          HD13      LEU  70  -5.629  -6.333  -2.205
  579   HD21  LEU  70          HD21      LEU  70  -6.695  -8.486  -2.139
  580   HD22  LEU  70          HD22      LEU  70  -6.785  -9.533  -3.555
  581   HD23  LEU  70          HD23      LEU  70  -7.850  -8.110  -3.434
  Start of MODEL   15
    1    H    GLN   1           H1       GLN   1 -32.713  11.844  -9.384
    2    HA   GLN   1           HA       GLN   1 -34.315   9.479  -8.650
    3    HB2  GLN   1           HB2      GLN   1 -32.996  10.296 -11.254
    4    HB3  GLN   1           HB3      GLN   1 -33.210   8.603 -10.857
    5    HG2  GLN   1           HG2      GLN   1 -34.985   9.360 -12.324
    6    HG3  GLN   1           HG3      GLN   1 -35.625   8.829 -10.775
    7   HE21  GLN   1          HE21      GLN   1 -35.188  11.636 -12.933
    8   HE22  GLN   1          HE22      GLN   1 -36.153  12.708 -11.913
    9    H    GLU   2           H        GLU   2 -33.208   7.618  -8.140
   10    HA   GLU   2           HA       GLU   2 -31.589   6.267  -7.400
   11    HB2  GLU   2           HB2      GLU   2 -30.066   7.640  -9.629
   12    HB3  GLU   2           HB3      GLU   2 -29.533   6.154  -8.843
   13    HG2  GLU   2           HG2      GLU   2 -31.337   4.882  -9.671
   14    HG3  GLU   2           HG3      GLU   2 -32.315   6.295 -10.050
   15    H    SER   3           H        SER   3 -31.434   9.249  -6.310
   16    HA   SER   3           HA       SER   3 -28.789   9.154  -5.005
   17    HB2  SER   3           HB2      SER   3 -31.073  11.142  -4.757
   18    HB3  SER   3           HB3      SER   3 -29.449  11.325  -4.070
   19    HG   SER   3           HG       SER   3 -30.299  11.937  -6.513
   20    H    PHE   4           H        PHE   4 -32.068   8.283  -4.222
   21    HA   PHE   4           HA       PHE   4 -33.142   7.454  -2.473
   22    HB2  PHE   4           HB2      PHE   4 -30.394   6.564  -1.569
   23    HB3  PHE   4           HB3      PHE   4 -31.899   6.015  -0.878
   24    HD1  PHE   4           HD1      PHE   4 -29.885   6.024  -4.017
   25    HD2  PHE   4           HD2      PHE   4 -33.215   4.289  -1.902
   26    HE1  PHE   4           HE1      PHE   4 -30.030   4.224  -5.726
   27    HE2  PHE   4           HE2      PHE   4 -33.348   2.485  -3.598
   28    HZ   PHE   4           HZ       PHE   4 -31.761   2.450  -5.511
   29    H    LYS   5           H        LYS   5 -33.855   7.616  -0.295
   30    HA   LYS   5           HA       LYS   5 -33.381  10.290   0.781
   31    HB2  LYS   5           HB2      LYS   5 -35.624   9.010   0.510
   32    HB3  LYS   5           HB3      LYS   5 -35.194   8.186   2.013
   33    HG2  LYS   5           HG2      LYS   5 -35.089  10.340   3.192
   34    HG3  LYS   5           HG3      LYS   5 -35.273  11.221   1.671
   35    HD2  LYS   5           HD2      LYS   5 -37.575  10.207   1.411
   36    HD3  LYS   5           HD3      LYS   5 -37.353   9.430   2.984
   37    HE2  LYS   5           HE2      LYS   5 -38.572  11.381   3.484
   38    HE3  LYS   5           HE3      LYS   5 -36.914  11.748   3.957
   39    HZ1  LYS   5           HZ1      LYS   5 -37.731  13.596   2.760
   40    HZ2  LYS   5           HZ2      LYS   5 -38.354  12.689   1.535
   41    HZ3  LYS   5           HZ3      LYS   5 -36.736  12.868   1.679
   42    H    LYS   6           H        LYS   6 -32.262   7.110   1.572
   43    HA   LYS   6           HA       LYS   6 -31.583   7.265   4.247
   44    HB2  LYS   6           HB2      LYS   6 -30.098   5.469   3.866
   45    HB3  LYS   6           HB3      LYS   6 -31.394   5.292   2.694
   46    HG2  LYS   6           HG2      LYS   6 -29.857   6.420   0.976
   47    HG3  LYS   6           HG3      LYS   6 -28.576   6.340   2.198
   48    HD2  LYS   6           HD2      LYS   6 -28.984   3.818   2.301
   49    HD3  LYS   6           HD3      LYS   6 -30.014   4.017   0.862
   50    HE2  LYS   6           HE2      LYS   6 -28.040   5.139  -0.284
   51    HE3  LYS   6           HE3      LYS   6 -27.072   4.779   1.152
   52    HZ1  LYS   6           HZ1      LYS   6 -26.637   3.045  -0.297
   53    HZ2  LYS   6           HZ2      LYS   6 -28.202   2.859  -0.785
   54    HZ3  LYS   6           HZ3      LYS   6 -27.730   2.377   0.721
   55    H    GLN   7           H        GLN   7 -29.869   7.802   5.488
   56    HA   GLN   7           HA       GLN   7 -27.524   9.207   4.618
   57    HB2  GLN   7           HB2      GLN   7 -28.038  11.415   5.583
   58    HB3  GLN   7           HB3      GLN   7 -29.075  11.033   4.234
   59    HG2  GLN   7           HG2      GLN   7 -30.812  11.655   5.521
   60    HG3  GLN   7           HG3      GLN   7 -30.631  10.149   6.393
   61   HE21  GLN   7          HE21      GLN   7 -29.420  13.546   6.324
   62   HE22  GLN   7          HE22      GLN   7 -29.197  13.634   8.077
   63    H    GLU   8           H        GLU   8 -26.039   9.584   6.275
   64    HA   GLU   8           HA       GLU   8 -26.803   9.600   9.078
   65    HB2  GLU   8           HB2      GLU   8 -24.834   7.468   8.132
   66    HB3  GLU   8           HB3      GLU   8 -24.991   8.025   9.792
   67    HG2  GLU   8           HG2      GLU   8 -27.370   7.223   9.786
   68    HG3  GLU   8           HG3      GLU   8 -27.076   6.513   8.189
   69    H    LYS   9           H        LYS   9 -25.417  10.912  10.228
   70    HA   LYS   9           HA       LYS   9 -23.012  11.996   8.809
   71    HB2  LYS   9           HB2      LYS   9 -23.164  13.960  10.234
   72    HB3  LYS   9           HB3      LYS   9 -24.589  13.751   9.221
   73    HG2  LYS   9           HG2      LYS   9 -25.878  12.899  11.129
   74    HG3  LYS   9           HG3      LYS   9 -24.440  12.970  12.166
   75    HD2  LYS   9           HD2      LYS   9 -24.339  15.416  11.906
   76    HD3  LYS   9           HD3      LYS   9 -25.759  15.383  10.831
   77    HE2  LYS   9           HE2      LYS   9 -27.171  14.513  12.589
   78    HE3  LYS   9           HE3      LYS   9 -25.785  14.214  13.640
   79    HZ1  LYS   9           HZ1      LYS   9 -26.927  16.180  14.308
   80    HZ2  LYS   9           HZ2      LYS   9 -26.733  16.916  12.833
   81    HZ3  LYS   9           HZ3      LYS   9 -25.442  16.592  13.818
   82    H    THR  10           H        THR  10 -21.137  12.263   9.845
   83    HA   THR  10           HA       THR  10 -19.335  11.334  10.940
   84    HB   THR  10           HB       THR  10 -19.235  12.221  13.239
   85    HG1  THR  10           HG1      THR  10 -21.059  12.258  14.215
   86   HG21  THR  10          HG21      THR  10 -19.495  14.541  12.687
   87   HG22  THR  10          HG22      THR  10 -20.576  14.168  11.328
   88   HG23  THR  10          HG23      THR  10 -18.860  13.696  11.270
   89    HA   PRO  11           HA       PRO  11 -21.423   7.472  12.680
   90    HB2  PRO  11           HB2      PRO  11 -20.485   5.571  10.944
   91    HB3  PRO  11           HB3      PRO  11 -21.997   6.496  10.693
   92    HG2  PRO  11           HG2      PRO  11 -19.242   7.104   9.556
   93    HG3  PRO  11           HG3      PRO  11 -20.806   7.020   8.678
   94    HD2  PRO  11           HD2      PRO  11 -19.838   9.407   9.473
   95    HD3  PRO  11           HD3      PRO  11 -21.574   9.035   9.667
   96    H    LYS  12           H        LYS  12 -20.492   5.967  13.986
   97    HA   LYS  12           HA       LYS  12 -17.749   6.739  14.796
   98    HB2  LYS  12           HB2      LYS  12 -19.945   5.473  16.474
   99    HB3  LYS  12           HB3      LYS  12 -18.414   6.165  17.011
  100    HG2  LYS  12           HG2      LYS  12 -19.729   7.941  17.488
  101    HG3  LYS  12           HG3      LYS  12 -19.326   8.364  15.824
  102    HD2  LYS  12           HD2      LYS  12 -21.540   7.268  15.129
  103    HD3  LYS  12           HD3      LYS  12 -21.885   7.045  16.852
  104    HE2  LYS  12           HE2      LYS  12 -21.646   9.529  17.138
  105    HE3  LYS  12           HE3      LYS  12 -21.399   9.670  15.384
  106    HZ1  LYS  12           HZ1      LYS  12 -23.599   8.765  15.039
  107    HZ2  LYS  12           HZ2      LYS  12 -23.748  10.053  16.018
  108    HZ3  LYS  12           HZ3      LYS  12 -23.841   8.552  16.660
  109    H    THR  13           H        THR  13 -17.297   5.163  12.891
  110    HA   THR  13           HA       THR  13 -17.001   2.344  13.863
  111    HB   THR  13           HB       THR  13 -17.246   3.158  10.959
  112    HG1  THR  13           HG1      THR  13 -19.352   2.705  11.072
  113   HG21  THR  13          HG21      THR  13 -16.381   0.859  11.491
  114   HG22  THR  13          HG22      THR  13 -17.966   0.814  10.718
  115   HG23  THR  13          HG23      THR  13 -17.833   0.567  12.473
  116    HA   PRO  14           HA       PRO  14 -12.671   3.669  12.914
  117    HB2  PRO  14           HB2      PRO  14 -11.416   2.707  15.155
  118    HB3  PRO  14           HB3      PRO  14 -12.247   4.295  15.126
  119    HG2  PRO  14           HG2      PRO  14 -13.357   1.631  16.076
  120    HG3  PRO  14           HG3      PRO  14 -13.382   3.202  16.942
  121    HD2  PRO  14           HD2      PRO  14 -15.514   2.311  15.509
  122    HD3  PRO  14           HD3      PRO  14 -15.074   4.046  15.523
  123    H    LYS  15           H        LYS  15 -11.194   2.502  11.919
  124    HA   LYS  15           HA       LYS  15 -11.268  -0.434  11.876
  125    HB2  LYS  15           HB2      LYS  15 -13.246   0.828  10.462
  126    HB3  LYS  15           HB3      LYS  15 -11.997   0.850   9.248
  127    HG2  LYS  15           HG2      LYS  15 -13.317  -1.109   8.908
  128    HG3  LYS  15           HG3      LYS  15 -11.779  -1.669   9.570
  129    HD2  LYS  15           HD2      LYS  15 -12.834  -1.858  11.828
  130    HD3  LYS  15           HD3      LYS  15 -14.342  -1.211  11.187
  131    HE2  LYS  15           HE2      LYS  15 -14.619  -3.161   9.718
  132    HE3  LYS  15           HE3      LYS  15 -12.998  -3.741  10.100
  133    HZ1  LYS  15           HZ1      LYS  15 -15.241  -3.590  12.045
  134    HZ2  LYS  15           HZ2      LYS  15 -13.728  -4.166  12.380
  135    HZ3  LYS  15           HZ3      LYS  15 -14.696  -4.957  11.351
  136    H    GLY  16           H        GLY  16  -9.177   0.874  12.623
  137    HA2  GLY  16           HA2      GLY  16  -7.206   1.000  10.347
  138    HA3  GLY  16           HA3      GLY  16  -7.382   2.293  11.530
  139    HA   PRO  17           HA       PRO  17  -5.255  -1.630  13.716
  140    HB2  PRO  17           HB2      PRO  17  -3.968  -2.506  11.139
  141    HB3  PRO  17           HB3      PRO  17  -4.395  -3.491  12.572
  142    HG2  PRO  17           HG2      PRO  17  -5.971  -3.540  10.376
  143    HG3  PRO  17           HG3      PRO  17  -6.726  -3.412  11.999
  144    HD2  PRO  17           HD2      PRO  17  -6.214  -1.211   9.992
  145    HD3  PRO  17           HD3      PRO  17  -7.645  -1.517  11.006
  146    H    SER  18           H        SER  18  -2.595  -2.237  13.579
  147    HA   SER  18           HA       SER  18  -1.173   0.374  13.212
  148    HB2  SER  18           HB2      SER  18  -1.146  -1.361  15.696
  149    HB3  SER  18           HB3      SER  18  -0.233   0.142  15.449
  150    HG   SER  18           HG       SER  18  -2.255   0.337  16.614
  151    H    SER  19           H        SER  19  -1.016  -1.980  11.549
  152    HA   SER  19           HA       SER  19   1.868  -2.220  11.284
  153    HB2  SER  19           HB2      SER  19   1.234  -4.009  12.987
  154    HB3  SER  19           HB3      SER  19   0.283  -4.789  11.710
  155    HG   SER  19           HG       SER  19   2.497  -5.539  11.976
  156    H    VAL  20           H        VAL  20   1.752  -4.472   9.433
  157    HA   VAL  20           HA       VAL  20   1.084  -3.180   7.017
  158    HB   VAL  20           HB       VAL  20   0.996  -6.204   7.255
  159   HG11  VAL  20          HG11      VAL  20   2.023  -6.092   5.011
  160   HG12  VAL  20          HG12      VAL  20   0.504  -5.199   5.032
  161   HG13  VAL  20          HG13      VAL  20   2.042  -4.316   5.090
  162   HG21  VAL  20          HG21      VAL  20   3.054  -5.543   8.465
  163   HG22  VAL  20          HG22      VAL  20   3.431  -6.288   6.913
  164   HG23  VAL  20          HG23      VAL  20   3.538  -4.531   7.080
  165    H    GLU  21           H        GLU  21  -0.966  -5.256   9.011
  166    HA   GLU  21           HA       GLU  21  -3.252  -5.478   7.395
  167    HB2  GLU  21           HB2      GLU  21  -4.466  -5.484   9.642
  168    HB3  GLU  21           HB3      GLU  21  -3.310  -6.761   9.305
  169    HG2  GLU  21           HG2      GLU  21  -1.625  -5.692  10.711
  170    HG3  GLU  21           HG3      GLU  21  -2.669  -4.314  10.993
  171    H    ASP  22           H        ASP  22  -2.108  -2.495   8.888
  172    HA   ASP  22           HA       ASP  22  -4.671  -1.059   8.649
  173    HB2  ASP  22           HB2      ASP  22  -2.877  -0.507  10.321
  174    HB3  ASP  22           HB3      ASP  22  -1.839  -0.008   9.002
  175    H    ILE  23           H        ILE  23  -1.601  -1.220   6.860
  176    HA   ILE  23           HA       ILE  23  -2.307   0.466   4.645
  177    HB   ILE  23           HB       ILE  23  -0.374  -1.787   5.157
  178   HG12  ILE  23          HG12      ILE  23   0.305   0.960   4.137
  179   HG13  ILE  23          HG13      ILE  23  -0.149   0.756   5.825
  180   HG21  ILE  23          HG21      ILE  23  -0.934  -2.320   2.925
  181   HG22  ILE  23          HG22      ILE  23  -0.870  -0.608   2.411
  182   HG23  ILE  23          HG23      ILE  23   0.610  -1.472   2.882
  183   HD11  ILE  23          HD11      ILE  23   2.327   0.676   5.413
  184   HD12  ILE  23          HD12      ILE  23   1.674  -0.730   6.274
  185   HD13  ILE  23          HD13      ILE  23   2.098  -0.861   4.555
  186    H    LYS  24           H        LYS  24  -2.816  -3.043   5.175
  187    HA   LYS  24           HA       LYS  24  -4.187  -3.456   2.669
  188    HB2  LYS  24           HB2      LYS  24  -4.047  -5.053   5.253
  189    HB3  LYS  24           HB3      LYS  24  -4.918  -5.636   3.821
  190    HG2  LYS  24           HG2      LYS  24  -2.977  -5.803   2.509
  191    HG3  LYS  24           HG3      LYS  24  -2.113  -4.613   3.482
  192    HD2  LYS  24           HD2      LYS  24  -1.101  -6.763   3.759
  193    HD3  LYS  24           HD3      LYS  24  -1.760  -6.147   5.269
  194    HE2  LYS  24           HE2      LYS  24  -3.720  -7.692   5.014
  195    HE3  LYS  24           HE3      LYS  24  -3.040  -8.270   3.477
  196    HZ1  LYS  24           HZ1      LYS  24  -2.383  -9.773   5.247
  197    HZ2  LYS  24           HZ2      LYS  24  -1.779  -8.549   6.152
  198    HZ3  LYS  24           HZ3      LYS  24  -1.046  -8.984   4.758
  199    H    ALA  25           H        ALA  25  -5.502  -2.776   5.920
  200    HA   ALA  25           HA       ALA  25  -8.264  -2.843   5.188
  201    HB1  ALA  25           HB1      ALA  25  -7.433  -2.992   7.476
  202    HB2  ALA  25           HB2      ALA  25  -6.738  -1.367   7.371
  203    HB3  ALA  25           HB3      ALA  25  -8.509  -1.590   7.329
  204    H    LYS  26           H        LYS  26  -5.973  -0.058   5.359
  205    HA   LYS  26           HA       LYS  26  -7.803   1.957   4.455
  206    HB2  LYS  26           HB2      LYS  26  -4.786   1.692   4.490
  207    HB3  LYS  26           HB3      LYS  26  -5.599   3.149   3.882
  208    HG2  LYS  26           HG2      LYS  26  -6.599   3.597   6.029
  209    HG3  LYS  26           HG3      LYS  26  -6.125   2.018   6.650
  210    HD2  LYS  26           HD2      LYS  26  -4.614   3.624   7.594
  211    HD3  LYS  26           HD3      LYS  26  -3.737   2.624   6.462
  212    HE2  LYS  26           HE2      LYS  26  -2.983   4.869   6.144
  213    HE3  LYS  26           HE3      LYS  26  -3.996   4.501   4.739
  214    HZ1  LYS  26           HZ1      LYS  26  -4.459   6.683   5.681
  215    HZ2  LYS  26           HZ2      LYS  26  -4.853   6.033   7.139
  216    HZ3  LYS  26           HZ3      LYS  26  -5.798   5.755   5.816
  217    H    MET  27           H        MET  27  -5.727  -0.293   2.584
  218    HA   MET  27           HA       MET  27  -6.578   0.741   0.017
  219    HB2  MET  27           HB2      MET  27  -5.412  -1.934   0.842
  220    HB3  MET  27           HB3      MET  27  -5.913  -1.560  -0.812
  221    HG2  MET  27           HG2      MET  27  -4.403   0.428  -0.808
  222    HG3  MET  27           HG3      MET  27  -3.848  -0.022   0.798
  223    HE1  MET  27           HE1      MET  27  -3.690  -0.645  -3.025
  224    HE2  MET  27           HE2      MET  27  -2.854  -2.202  -3.178
  225    HE3  MET  27           HE3      MET  27  -4.521  -2.151  -2.580
  226    H    GLN  28           H        GLN  28  -8.044  -1.889   2.095
  227    HA   GLN  28           HA       GLN  28 -10.067  -2.531   0.151
  228    HB2  GLN  28           HB2      GLN  28 -10.453  -2.652   3.166
  229    HB3  GLN  28           HB3      GLN  28 -11.384  -3.472   1.930
  230    HG2  GLN  28           HG2      GLN  28  -8.722  -4.186   3.076
  231    HG3  GLN  28           HG3      GLN  28 -10.137  -5.174   2.835
  232   HE21  GLN  28          HE21      GLN  28  -7.164  -4.060   1.437
  233   HE22  GLN  28          HE22      GLN  28  -7.279  -5.032  -0.039
  234    H    ALA  29           H        ALA  29 -10.034  -0.114   2.795
  235    HA   ALA  29           HA       ALA  29 -12.643   0.930   2.384
  236    HB1  ALA  29           HB1      ALA  29 -11.795   2.860   3.662
  237    HB2  ALA  29           HB2      ALA  29 -11.283   1.328   4.396
  238    HB3  ALA  29           HB3      ALA  29 -10.130   2.292   3.445
  239    H    SER  30           H        SER  30  -9.509   2.040   0.985
  240    HA   SER  30           HA       SER  30 -10.551   4.134  -0.618
  241    HB2  SER  30           HB2      SER  30  -8.185   2.315  -1.243
  242    HB3  SER  30           HB3      SER  30  -8.519   3.892  -1.974
  243    HG   SER  30           HG       SER  30  -7.950   3.336   0.763
  244    H    ILE  31           H        ILE  31 -10.000   0.696  -1.514
  245    HA   ILE  31           HA       ILE  31 -10.880   0.966  -4.207
  246    HB   ILE  31           HB       ILE  31 -10.485  -1.407  -2.359
  247   HG12  ILE  31          HG12      ILE  31  -8.907  -0.476  -4.810
  248   HG13  ILE  31          HG13      ILE  31  -8.513   0.023  -3.173
  249   HG21  ILE  31          HG21      ILE  31 -10.610  -2.878  -4.365
  250   HG22  ILE  31          HG22      ILE  31 -12.156  -2.140  -3.996
  251   HG23  ILE  31          HG23      ILE  31 -11.167  -1.498  -5.330
  252   HD11  ILE  31          HD11      ILE  31  -8.179  -2.383  -2.537
  253   HD12  ILE  31          HD12      ILE  31  -8.379  -2.815  -4.254
  254   HD13  ILE  31          HD13      ILE  31  -7.046  -1.768  -3.757
  255    H    GLU  32           H        GLU  32 -12.759  -0.070  -1.289
  256    HA   GLU  32           HA       GLU  32 -15.152  -0.438  -3.000
  257    HB2  GLU  32           HB2      GLU  32 -14.740  -0.734  -0.020
  258    HB3  GLU  32           HB3      GLU  32 -16.254  -1.062  -0.853
  259    HG2  GLU  32           HG2      GLU  32 -13.637  -2.524  -1.437
  260    HG3  GLU  32           HG3      GLU  32 -14.900  -3.103  -0.359
  261    H    LYS  33           H        LYS  33 -14.142   1.935  -0.485
  262    HA   LYS  33           HA       LYS  33 -16.779   3.296  -0.767
  263    HB2  LYS  33           HB2      LYS  33 -14.632   3.659   1.349
  264    HB3  LYS  33           HB3      LYS  33 -16.247   4.362   1.345
  265    HG2  LYS  33           HG2      LYS  33 -17.221   2.046   1.376
  266    HG3  LYS  33           HG3      LYS  33 -15.587   1.387   1.554
  267    HD2  LYS  33           HD2      LYS  33 -16.932   3.317   3.491
  268    HD3  LYS  33           HD3      LYS  33 -16.813   1.566   3.696
  269    HE2  LYS  33           HE2      LYS  33 -14.340   1.715   3.723
  270    HE3  LYS  33           HE3      LYS  33 -14.436   3.478   3.538
  271    HZ1  LYS  33           HZ1      LYS  33 -15.605   3.583   5.648
  272    HZ2  LYS  33           HZ2      LYS  33 -14.188   2.764   5.884
  273    HZ3  LYS  33           HZ3      LYS  33 -15.589   1.933   5.787
  274    H    GLY  34           H        GLY  34 -13.508   3.824  -1.740
  275    HA2  GLY  34           HA2      GLY  34 -13.444   5.370  -3.653
  276    HA3  GLY  34           HA3      GLY  34 -14.270   6.575  -2.680
  277    H    GLY  35           H        GLY  35 -11.311   5.593  -3.805
  278    HA2  GLY  35           HA2      GLY  35  -9.927   7.836  -2.703
  279    HA3  GLY  35           HA3      GLY  35  -9.409   6.373  -1.858
  280    H    SER  36           H        SER  36  -8.492   8.340  -4.299
  281    HA   SER  36           HA       SER  36  -7.929   6.314  -6.342
  282    HB2  SER  36           HB2      SER  36  -7.268   8.110  -7.777
  283    HB3  SER  36           HB3      SER  36  -8.816   8.471  -7.012
  284    HG   SER  36           HG       SER  36  -7.412   9.701  -5.408
  285    H    LEU  37           H        LEU  37  -6.008   5.518  -7.011
  286    HA   LEU  37           HA       LEU  37  -3.668   5.943  -5.188
  287    HB2  LEU  37           HB2      LEU  37  -5.217   3.478  -5.930
  288    HB3  LEU  37           HB3      LEU  37  -3.476   3.318  -5.858
  289    HG   LEU  37           HG       LEU  37  -3.412   4.062  -3.539
  290   HD11  LEU  37          HD11      LEU  37  -5.625   4.069  -2.260
  291   HD12  LEU  37          HD12      LEU  37  -6.427   4.215  -3.828
  292   HD13  LEU  37          HD13      LEU  37  -5.315   5.484  -3.266
  293   HD21  LEU  37          HD21      LEU  37  -4.457   2.056  -2.570
  294   HD22  LEU  37          HD22      LEU  37  -3.638   1.666  -4.087
  295   HD23  LEU  37          HD23      LEU  37  -5.410   1.817  -4.053
  296    HA   PRO  38           HA       PRO  38  -1.111   5.636  -8.966
  297    HB2  PRO  38           HB2      PRO  38   1.318   5.236  -7.887
  298    HB3  PRO  38           HB3      PRO  38   0.480   6.814  -7.727
  299    HG2  PRO  38           HG2      PRO  38   0.574   4.537  -5.720
  300    HG3  PRO  38           HG3      PRO  38   0.903   6.275  -5.426
  301    HD2  PRO  38           HD2      PRO  38  -1.527   5.087  -4.938
  302    HD3  PRO  38           HD3      PRO  38  -1.376   6.791  -5.457
  303    H    LYS  39           H        LYS  39  -0.136   3.945 -10.171
  304    HA   LYS  39           HA       LYS  39  -0.205   1.205  -8.939
  305    HB2  LYS  39           HB2      LYS  39  -0.775   0.295 -11.141
  306    HB3  LYS  39           HB3      LYS  39  -2.017   1.328 -10.442
  307    HG2  LYS  39           HG2      LYS  39  -1.390   3.177 -11.939
  308    HG3  LYS  39           HG3      LYS  39  -0.082   2.194 -12.635
  309    HD2  LYS  39           HD2      LYS  39  -1.719   0.578 -13.496
  310    HD3  LYS  39           HD3      LYS  39  -3.049   1.464 -12.714
  311    HE2  LYS  39           HE2      LYS  39  -2.609   3.439 -14.096
  312    HE3  LYS  39           HE3      LYS  39  -1.198   2.654 -14.823
  313    HZ1  LYS  39           HZ1      LYS  39  -4.003   1.713 -15.118
  314    HZ2  LYS  39           HZ2      LYS  39  -2.694   0.981 -15.766
  315    HZ3  LYS  39           HZ3      LYS  39  -3.095   2.460 -16.289
  316    H    VAL  40           H        VAL  40   1.764   3.423 -10.833
  317    HA   VAL  40           HA       VAL  40   3.810   1.510 -11.460
  318    HB   VAL  40           HB       VAL  40   3.574   3.730 -12.541
  319   HG11  VAL  40          HG11      VAL  40   4.549   5.718 -11.576
  320   HG12  VAL  40          HG12      VAL  40   3.280   5.135 -10.494
  321   HG13  VAL  40          HG13      VAL  40   4.990   4.855 -10.092
  322   HG21  VAL  40          HG21      VAL  40   5.626   2.365 -12.769
  323   HG22  VAL  40          HG22      VAL  40   5.953   4.103 -12.852
  324   HG23  VAL  40          HG23      VAL  40   6.340   3.210 -11.374
  325    H    GLU  41           H        GLU  41   5.625   0.849 -10.399
  326    HA   GLU  41           HA       GLU  41   5.170   0.229  -7.741
  327    HB2  GLU  41           HB2      GLU  41   6.495  -1.089  -9.335
  328    HB3  GLU  41           HB3      GLU  41   7.785   0.108  -9.287
  329    HG2  GLU  41           HG2      GLU  41   8.108  -0.385  -6.851
  330    HG3  GLU  41           HG3      GLU  41   6.836  -1.604  -6.946
  331    H    ALA  42           H        ALA  42   7.620   2.688  -8.835
  332    HA   ALA  42           HA       ALA  42   8.524   3.302  -6.240
  333    HB1  ALA  42           HB1      ALA  42   8.418   4.985  -8.779
  334    HB2  ALA  42           HB2      ALA  42   9.336   5.416  -7.319
  335    HB3  ALA  42           HB3      ALA  42   9.748   3.942  -8.215
  336    H    LYS  43           H        LYS  43   5.891   4.956  -8.069
  337    HA   LYS  43           HA       LYS  43   5.315   6.858  -5.960
  338    HB2  LYS  43           HB2      LYS  43   3.545   5.873  -8.235
  339    HB3  LYS  43           HB3      LYS  43   3.154   7.206  -7.133
  340    HG2  LYS  43           HG2      LYS  43   5.295   8.324  -7.826
  341    HG3  LYS  43           HG3      LYS  43   5.480   7.075  -9.074
  342    HD2  LYS  43           HD2      LYS  43   3.235   7.780 -10.011
  343    HD3  LYS  43           HD3      LYS  43   3.195   9.081  -8.800
  344    HE2  LYS  43           HE2      LYS  43   5.395   9.911  -9.719
  345    HE3  LYS  43           HE3      LYS  43   5.276   8.697 -11.002
  346    HZ1  LYS  43           HZ1      LYS  43   4.449  10.866 -11.704
  347    HZ2  LYS  43           HZ2      LYS  43   3.306  10.878 -10.524
  348    HZ3  LYS  43           HZ3      LYS  43   3.200   9.790 -11.728
  349    H    PHE  44           H        PHE  44   4.146   3.568  -6.636
  350    HA   PHE  44           HA       PHE  44   2.174   3.620  -4.582
  351    HB2  PHE  44           HB2      PHE  44   2.099   1.976  -6.375
  352    HB3  PHE  44           HB3      PHE  44   3.631   1.277  -5.858
  353    HD1  PHE  44           HD2      PHE  44   0.077   1.835  -4.829
  354    HD2  PHE  44           HD1      PHE  44   3.720  -0.343  -4.073
  355    HE1  PHE  44           HE2      PHE  44  -1.127   0.387  -3.218
  356    HE2  PHE  44           HE1      PHE  44   2.513  -1.795  -2.457
  357    HZ   PHE  44           HZ       PHE  44   0.088  -1.421  -2.015
  358    H    ILE  45           H        ILE  45   5.650   2.615  -4.500
  359    HA   ILE  45           HA       ILE  45   5.731   1.883  -1.728
  360    HB   ILE  45           HB       ILE  45   7.851   3.004  -3.587
  361   HG12  ILE  45          HG12      ILE  45   7.508   0.200  -2.447
  362   HG13  ILE  45          HG13      ILE  45   6.817   0.677  -3.981
  363   HG21  ILE  45          HG21      ILE  45   9.525   2.275  -1.884
  364   HG22  ILE  45          HG22      ILE  45   8.531   3.583  -1.288
  365   HG23  ILE  45          HG23      ILE  45   8.204   1.918  -0.750
  366   HD11  ILE  45          HD11      ILE  45   8.878  -0.471  -4.414
  367   HD12  ILE  45          HD12      ILE  45   9.098   1.237  -4.840
  368   HD13  ILE  45          HD13      ILE  45   9.787   0.589  -3.331
  369    H    ASN  46           H        ASN  46   6.224   5.114  -3.256
  370    HA   ASN  46           HA       ASN  46   6.454   6.614  -0.853
  371    HB2  ASN  46           HB2      ASN  46   6.994   7.904  -2.648
  372    HB3  ASN  46           HB3      ASN  46   5.839   7.139  -3.719
  373   HD21  ASN  46          HD21      ASN  46   3.623   7.828  -3.714
  374   HD22  ASN  46          HD22      ASN  46   3.196   9.412  -3.071
  375    H    TYR  47           H        TYR  47   3.461   5.585  -2.541
  376    HA   TYR  47           HA       TYR  47   1.617   6.888  -0.785
  377    HB2  TYR  47           HB2      TYR  47   0.836   6.256  -2.904
  378    HB3  TYR  47           HB3      TYR  47   1.435   4.617  -2.761
  379    HD1  TYR  47           HD1      TYR  47  -1.218   6.939  -1.581
  380    HD2  TYR  47           HD2      TYR  47   0.167   2.852  -1.744
  381    HE1  TYR  47           HE1      TYR  47  -3.403   6.158  -0.701
  382    HE2  TYR  47           HE2      TYR  47  -2.028   2.082  -0.832
  383    HH   TYR  47           HH       TYR  47  -4.678   4.381  -0.128
  384    H    VAL  48           H        VAL  48   3.018   3.574  -0.664
  385    HA   VAL  48           HA       VAL  48   1.549   2.762   1.686
  386    HB   VAL  48           HB       VAL  48   4.166   1.741   0.519
  387   HG11  VAL  48          HG11      VAL  48   3.763  -0.270   1.970
  388   HG12  VAL  48          HG12      VAL  48   4.142   1.172   2.919
  389   HG13  VAL  48          HG13      VAL  48   2.462   0.630   2.784
  390   HG21  VAL  48          HG21      VAL  48   2.109   1.354  -0.861
  391   HG22  VAL  48          HG22      VAL  48   2.768  -0.147  -0.214
  392   HG23  VAL  48          HG23      VAL  48   1.331   0.587   0.533
  393    H    LYS  49           H        LYS  49   4.839   4.187   1.315
  394    HA   LYS  49           HA       LYS  49   5.453   4.404   4.110
  395    HB2  LYS  49           HB2      LYS  49   6.258   6.074   1.679
  396    HB3  LYS  49           HB3      LYS  49   6.933   6.345   3.276
  397    HG2  LYS  49           HG2      LYS  49   7.182   3.705   1.762
  398    HG3  LYS  49           HG3      LYS  49   8.382   5.002   1.757
  399    HD2  LYS  49           HD2      LYS  49   8.548   4.805   4.258
  400    HD3  LYS  49           HD3      LYS  49   7.436   3.435   4.190
  401    HE2  LYS  49           HE2      LYS  49   9.599   2.519   4.354
  402    HE3  LYS  49           HE3      LYS  49   9.079   2.248   2.681
  403    HZ1  LYS  49           HZ1      LYS  49  10.523   4.034   1.978
  404    HZ2  LYS  49           HZ2      LYS  49  11.408   3.087   2.999
  405    HZ3  LYS  49           HZ3      LYS  49  10.785   4.525   3.504
  406    H    ASN  50           H        ASN  50   3.473   6.466   2.061
  407    HA   ASN  50           HA       ASN  50   2.910   8.473   4.065
  408    HB2  ASN  50           HB2      ASN  50   2.510   9.251   1.941
  409    HB3  ASN  50           HB3      ASN  50   1.973   7.717   1.325
  410   HD21  ASN  50          HD21      ASN  50  -0.186   7.111   1.422
  411   HD22  ASN  50          HD22      ASN  50  -1.447   8.256   1.858
  412    H    CYS  51           H        CYS  51   1.214   5.418   3.156
  413    HA   CYS  51           HA       CYS  51  -1.032   5.900   4.887
  414    HB2  CYS  51           HB2      CYS  51   0.064   3.386   3.554
  415    HB3  CYS  51           HB3      CYS  51  -1.415   3.406   4.530
  416    HG   CYS  51           HG       CYS  51  -0.675   4.944   1.711
  417    H    PHE  52           H        PHE  52   1.993   4.018   5.435
  418    HA   PHE  52           HA       PHE  52   1.744   4.496   8.280
  419    HB2  PHE  52           HB2      PHE  52   0.292   2.449   7.946
  420    HB3  PHE  52           HB3      PHE  52   1.709   1.608   7.351
  421    HD1  PHE  52           HD1      PHE  52   0.047   3.022  10.327
  422    HD2  PHE  52           HD2      PHE  52   3.464   0.843   8.872
  423    HE1  PHE  52           HE1      PHE  52   0.617   2.358  12.653
  424    HE2  PHE  52           HE2      PHE  52   4.039   0.183  11.196
  425    HZ   PHE  52           HZ       PHE  52   2.618   0.939  13.087
  426    H    ARG  53           H        ARG  53   3.700   4.130   9.407
  427    HA   ARG  53           HA       ARG  53   6.083   4.361   7.793
  428    HB2  ARG  53           HB2      ARG  53   5.459   5.615   9.865
  429    HB3  ARG  53           HB3      ARG  53   5.836   4.169  10.805
  430    HG2  ARG  53           HG2      ARG  53   8.194   4.271  10.058
  431    HG3  ARG  53           HG3      ARG  53   7.820   5.600   8.951
  432    HD2  ARG  53           HD2      ARG  53   7.499   5.711  11.965
  433    HD3  ARG  53           HD3      ARG  53   8.910   6.321  11.090
  434    HE   ARG  53           HE       ARG  53   7.136   7.747   9.813
  435   HH11  ARG  53          HH11      ARG  53   6.917   7.154  13.301
  436   HH12  ARG  53          HH12      ARG  53   6.259   8.767  13.550
  437   HH21  ARG  53          HH21      ARG  53   6.126   9.560  10.214
  438   HH22  ARG  53          HH22      ARG  53   5.677  10.031  11.847
  439    H    MET  54           H        MET  54   5.394   2.101   6.923
  440    HA   MET  54           HA       MET  54   5.953  -0.172   8.540
  441    HB2  MET  54           HB2      MET  54   4.463   0.194   6.346
  442    HB3  MET  54           HB3      MET  54   5.913  -0.392   5.530
  443    HG2  MET  54           HG2      MET  54   4.453  -2.250   5.945
  444    HG3  MET  54           HG3      MET  54   5.829  -2.436   7.027
  445    HE1  MET  54           HE1      MET  54   5.128  -3.737   9.082
  446    HE2  MET  54           HE2      MET  54   5.666  -2.161   9.712
  447    HE3  MET  54           HE3      MET  54   4.204  -2.929  10.364
  448    H    THR  55           H        THR  55   8.178   1.753   6.853
  449    HA   THR  55           HA       THR  55  10.390   1.774   6.720
  450    HB   THR  55           HB       THR  55  10.187  -0.205   9.004
  451    HG1  THR  55           HG1      THR  55   8.966   1.723   9.252
  452   HG21  THR  55          HG21      THR  55  12.254   0.879   9.799
  453   HG22  THR  55          HG22      THR  55  12.357   1.802   8.279
  454   HG23  THR  55          HG23      THR  55  12.515   0.026   8.274
  455    H    ASP  56           H        ASP  56   9.684  -1.761   6.938
  456    HA   ASP  56           HA       ASP  56  12.339  -2.331   5.910
  457    HB2  ASP  56           HB2      ASP  56  10.001  -4.132   6.627
  458    HB3  ASP  56           HB3      ASP  56  11.622  -4.687   6.208
  459    H    GLN  57           H        GLN  57  13.004  -2.750   3.908
  460    HA   GLN  57           HA       GLN  57  11.430  -2.855   1.605
  461    HB2  GLN  57           HB2      GLN  57  13.835  -2.464   1.637
  462    HB3  GLN  57           HB3      GLN  57  14.122  -4.126   2.157
  463    HG2  GLN  57           HG2      GLN  57  14.586  -3.924  -0.212
  464    HG3  GLN  57           HG3      GLN  57  13.186  -4.959   0.030
  465   HE21  GLN  57          HE21      GLN  57  11.087  -4.214  -0.620
  466   HE22  GLN  57          HE22      GLN  57  10.997  -2.999  -1.898
  467    H    GLU  58           H        GLU  58  12.294  -5.645   3.697
  468    HA   GLU  58           HA       GLU  58  11.176  -7.674   2.079
  469    HB2  GLU  58           HB2      GLU  58  10.911  -8.935   4.272
  470    HB3  GLU  58           HB3      GLU  58  12.517  -8.446   3.779
  471    HG2  GLU  58           HG2      GLU  58  12.542  -6.611   5.387
  472    HG3  GLU  58           HG3      GLU  58  10.846  -6.910   5.803
  473    H    ALA  59           H        ALA  59   9.468  -5.539   4.401
  474    HA   ALA  59           HA       ALA  59   6.908  -6.959   4.059
  475    HB1  ALA  59           HB1      ALA  59   7.385  -5.805   6.164
  476    HB2  ALA  59           HB2      ALA  59   7.534  -4.252   5.297
  477    HB3  ALA  59           HB3      ALA  59   5.975  -5.115   5.332
  478    H    ILE  60           H        ILE  60   8.506  -4.031   2.751
  479    HA   ILE  60           HA       ILE  60   6.377  -3.049   1.144
  480    HB   ILE  60           HB       ILE  60   9.379  -2.927   0.892
  481   HG12  ILE  60          HG12      ILE  60   7.385  -0.749   1.643
  482   HG13  ILE  60          HG13      ILE  60   8.193  -1.771   2.820
  483   HG21  ILE  60          HG21      ILE  60   9.052  -1.086  -0.785
  484   HG22  ILE  60          HG22      ILE  60   8.494  -2.627  -1.400
  485   HG23  ILE  60          HG23      ILE  60   7.310  -1.447  -0.800
  486   HD11  ILE  60          HD11      ILE  60   9.469   0.282   0.997
  487   HD12  ILE  60          HD12      ILE  60   9.494   0.180   2.772
  488   HD13  ILE  60          HD13      ILE  60  10.426  -0.978   1.810
  489    H    GLN  61           H        GLN  61   8.962  -5.400   0.176
  490    HA   GLN  61           HA       GLN  61   7.671  -5.850  -2.372
  491    HB2  GLN  61           HB2      GLN  61   9.316  -7.534  -2.793
  492    HB3  GLN  61           HB3      GLN  61  10.051  -6.101  -2.103
  493    HG2  GLN  61           HG2      GLN  61  11.199  -7.744  -0.983
  494    HG3  GLN  61           HG3      GLN  61   9.932  -7.384   0.173
  495   HE21  GLN  61          HE21      GLN  61   9.148  -9.232   1.128
  496   HE22  GLN  61          HE22      GLN  61   9.142 -10.812   0.352
  497    H    ASP  62           H        ASP  62   7.324  -7.512   0.789
  498    HA   ASP  62           HA       ASP  62   5.829  -9.720  -0.301
  499    HB2  ASP  62           HB2      ASP  62   6.935  -9.712   1.919
  500    HB3  ASP  62           HB3      ASP  62   5.760  -8.521   2.499
  501    H    LEU  63           H        LEU  63   4.833  -6.565   1.019
  502    HA   LEU  63           HA       LEU  63   2.032  -6.889   0.671
  503    HB2  LEU  63           HB2      LEU  63   3.167  -5.297   2.151
  504    HB3  LEU  63           HB3      LEU  63   3.762  -4.386   0.777
  505    HG   LEU  63           HG       LEU  63   1.813  -3.466   2.100
  506   HD11  LEU  63          HD11      LEU  63   1.216  -3.743  -0.861
  507   HD12  LEU  63          HD12      LEU  63   2.406  -2.628  -0.150
  508   HD13  LEU  63          HD13      LEU  63   0.687  -2.468   0.244
  509   HD21  LEU  63          HD21      LEU  63  -0.439  -4.218   1.644
  510   HD22  LEU  63          HD22      LEU  63   0.509  -5.563   2.310
  511   HD23  LEU  63          HD23      LEU  63   0.146  -5.491   0.568
  512    H    TRP  64           H        TRP  64   4.621  -5.716  -1.542
  513    HA   TRP  64           HA       TRP  64   2.925  -5.021  -3.722
  514    HB2  TRP  64           HB2      TRP  64   5.465  -4.631  -3.430
  515    HB3  TRP  64           HB3      TRP  64   5.666  -6.249  -4.063
  516    HD1  TRP  64           HD1      TRP  64   4.767  -2.721  -5.065
  517    HE1  TRP  64           HE1      TRP  64   4.639  -2.515  -7.632
  518    HE3  TRP  64           HE3      TRP  64   5.016  -7.684  -6.313
  519    HZ2  TRP  64           HZ2      TRP  64   4.926  -4.248  -9.907
  520    HZ3  TRP  64           HZ3      TRP  64   5.130  -8.368  -8.689
  521    HH2  TRP  64           HH2      TRP  64   5.082  -6.669 -10.497
  522    H    GLN  65           H        GLN  65   4.303  -8.263  -2.841
  523    HA   GLN  65           HA       GLN  65   3.070  -9.590  -5.101
  524    HB2  GLN  65           HB2      GLN  65   3.495 -10.956  -2.443
  525    HB3  GLN  65           HB3      GLN  65   3.414 -11.653  -4.046
  526    HG2  GLN  65           HG2      GLN  65   5.697 -10.286  -2.676
  527    HG3  GLN  65           HG3      GLN  65   5.636 -11.850  -3.446
  528   HE21  GLN  65          HE21      GLN  65   6.541  -8.594  -3.812
  529   HE22  GLN  65          HE22      GLN  65   7.080  -8.699  -5.485
  530    H    TRP  66           H        TRP  66   1.828  -8.670  -1.874
  531    HA   TRP  66           HA       TRP  66  -0.662 -10.077  -2.137
  532    HB2  TRP  66           HB2      TRP  66   0.380  -9.187  -0.013
  533    HB3  TRP  66           HB3      TRP  66  -0.205  -7.596  -0.474
  534    HD1  TRP  66           HD1      TRP  66  -2.680  -7.050   0.088
  535    HE1  TRP  66           HE1      TRP  66  -4.622  -8.298   1.246
  536    HE3  TRP  66           HE3      TRP  66  -0.676 -11.774   0.159
  537    HZ2  TRP  66           HZ2      TRP  66  -5.192 -10.978   2.115
  538    HZ3  TRP  66           HZ3      TRP  66  -1.935 -13.648   1.190
  539    HH2  TRP  66           HH2      TRP  66  -4.183 -13.260   2.183
  540    H    ARG  67           H        ARG  67   0.224  -6.694  -3.126
  541    HA   ARG  67           HA       ARG  67  -2.457  -6.221  -4.175
  542    HB2  ARG  67           HB2      ARG  67  -1.867  -4.188  -4.873
  543    HB3  ARG  67           HB3      ARG  67  -0.705  -4.402  -3.574
  544    HG2  ARG  67           HG2      ARG  67   1.066  -4.867  -5.217
  545    HG3  ARG  67           HG3      ARG  67  -0.086  -4.819  -6.548
  546    HD2  ARG  67           HD2      ARG  67   0.628  -2.486  -4.744
  547    HD3  ARG  67           HD3      ARG  67   1.285  -2.750  -6.349
  548    HE   ARG  67           HE       ARG  67  -1.159  -1.425  -5.728
  549   HH11  ARG  67          HH11      ARG  67   0.128  -3.467  -8.310
  550   HH12  ARG  67          HH12      ARG  67  -1.268  -3.110  -9.314
  551   HH21  ARG  67          HH21      ARG  67  -2.615  -0.832  -7.157
  552   HH22  ARG  67          HH22      ARG  67  -2.653  -1.493  -8.774
  553    H    LYS  68           H        LYS  68   0.447  -7.627  -5.634
  554    HA   LYS  68           HA       LYS  68  -0.901  -8.161  -8.182
  555    HB2  LYS  68           HB2      LYS  68   1.713  -8.988  -6.900
  556    HB3  LYS  68           HB3      LYS  68   1.119  -9.948  -8.227
  557    HG2  LYS  68           HG2      LYS  68   1.809  -7.003  -8.321
  558    HG3  LYS  68           HG3      LYS  68   2.665  -8.352  -9.064
  559    HD2  LYS  68           HD2      LYS  68   0.004  -7.175  -9.894
  560    HD3  LYS  68           HD3      LYS  68   1.500  -7.205 -10.798
  561    HE2  LYS  68           HE2      LYS  68  -0.162  -9.679 -10.101
  562    HE3  LYS  68           HE3      LYS  68  -0.241  -8.793 -11.622
  563    HZ1  LYS  68           HZ1      LYS  68   2.111 -10.303 -10.621
  564    HZ2  LYS  68           HZ2      LYS  68   2.165  -9.303 -11.921
  565    HZ3  LYS  68           HZ3      LYS  68   1.183 -10.610 -11.950
  566    H    SER  69           H        SER  69  -1.750  -9.316  -5.272
  567    HA   SER  69           HA       SER  69  -2.786 -11.856  -6.472
  568    HB2  SER  69           HB2      SER  69  -2.297 -11.256  -3.536
  569    HB3  SER  69           HB3      SER  69  -2.919 -12.765  -4.224
  570    HG   SER  69           HG       SER  69  -0.344 -11.597  -4.598
  571    H    LEU  70           H        LEU  70  -3.808  -8.773  -5.873
  572    HA   LEU  70           HA       LEU  70  -6.341  -9.378  -4.506
  573    HB2  LEU  70           HB2      LEU  70  -4.769  -7.436  -3.992
  574    HB3  LEU  70           HB3      LEU  70  -5.331  -6.689  -5.475
  575    HG   LEU  70           HG       LEU  70  -7.026  -7.435  -3.047
  576   HD11  LEU  70          HD11      LEU  70  -6.108  -4.735  -4.118
  577   HD12  LEU  70          HD12      LEU  70  -5.475  -5.553  -2.672
  578   HD13  LEU  70          HD13      LEU  70  -7.158  -4.994  -2.712
  579   HD21  LEU  70          HD21      LEU  70  -8.790  -5.995  -4.097
  580   HD22  LEU  70          HD22      LEU  70  -8.501  -7.490  -4.976
  581   HD23  LEU  70          HD23      LEU  70  -7.827  -5.958  -5.588
  Start of MODEL   16
    1    H    GLN   1           H1       GLN   1 -36.948   1.347  23.087
    2    HA   GLN   1           HA       GLN   1 -35.332   1.455  24.771
    3    HB2  GLN   1           HB2      GLN   1 -36.256  -1.371  25.388
    4    HB3  GLN   1           HB3      GLN   1 -34.648  -0.798  25.820
    5    HG2  GLN   1           HG2      GLN   1 -35.944  -0.493  27.749
    6    HG3  GLN   1           HG3      GLN   1 -35.654   1.106  27.090
    7   HE21  GLN   1          HE21      GLN   1 -37.532   1.299  28.790
    8   HE22  GLN   1          HE22      GLN   1 -39.166   1.152  28.144
    9    H    GLU   2           H        GLU   2 -33.860   1.913  23.200
   10    HA   GLU   2           HA       GLU   2 -33.134  -0.034  21.165
   11    HB2  GLU   2           HB2      GLU   2 -31.670   1.635  20.322
   12    HB3  GLU   2           HB3      GLU   2 -33.214   2.362  20.651
   13    HG2  GLU   2           HG2      GLU   2 -30.827   2.595  22.564
   14    HG3  GLU   2           HG3      GLU   2 -31.057   3.657  21.198
   15    H    SER   3           H        SER   3 -31.908   0.558  24.348
   16    HA   SER   3           HA       SER   3 -29.146   0.392  23.704
   17    HB2  SER   3           HB2      SER   3 -30.361   0.048  26.458
   18    HB3  SER   3           HB3      SER   3 -28.720   0.585  26.045
   19    HG   SER   3           HG       SER   3 -31.190   1.904  25.758
   20    H    PHE   4           H        PHE   4 -31.190  -2.210  23.747
   21    HA   PHE   4           HA       PHE   4 -28.895  -4.057  23.954
   22    HB2  PHE   4           HB2      PHE   4 -30.565  -5.730  25.029
   23    HB3  PHE   4           HB3      PHE   4 -29.639  -4.596  25.982
   24    HD1  PHE   4           HD2      PHE   4 -33.021  -5.315  24.610
   25    HD2  PHE   4           HD1      PHE   4 -30.716  -2.896  27.332
   26    HE1  PHE   4           HE2      PHE   4 -35.118  -4.551  25.703
   27    HE2  PHE   4           HE1      PHE   4 -32.813  -2.131  28.422
   28    HZ   PHE   4           HZ       PHE   4 -35.015  -2.973  27.622
   29    H    LYS   5           H        LYS   5 -29.183  -6.049  22.917
   30    HA   LYS   5           HA       LYS   5 -30.618  -5.732  20.302
   31    HB2  LYS   5           HB2      LYS   5 -28.739  -4.175  20.479
   32    HB3  LYS   5           HB3      LYS   5 -27.631  -5.481  20.875
   33    HG2  LYS   5           HG2      LYS   5 -27.611  -6.303  18.663
   34    HG3  LYS   5           HG3      LYS   5 -29.160  -5.554  18.260
   35    HD2  LYS   5           HD2      LYS   5 -27.282  -4.409  17.151
   36    HD3  LYS   5           HD3      LYS   5 -28.185  -3.337  18.222
   37    HE2  LYS   5           HE2      LYS   5 -26.426  -3.567  19.957
   38    HE3  LYS   5           HE3      LYS   5 -25.541  -4.696  18.927
   39    HZ1  LYS   5           HZ1      LYS   5 -24.633  -2.482  18.720
   40    HZ2  LYS   5           HZ2      LYS   5 -26.080  -1.842  18.243
   41    HZ3  LYS   5           HZ3      LYS   5 -25.268  -2.925  17.305
   42    H    LYS   6           H        LYS   6 -29.158  -7.849  22.564
   43    HA   LYS   6           HA       LYS   6 -28.713 -10.037  22.644
   44    HB2  LYS   6           HB2      LYS   6 -30.597 -11.428  22.342
   45    HB3  LYS   6           HB3      LYS   6 -31.118  -9.852  22.923
   46    HG2  LYS   6           HG2      LYS   6 -31.939  -9.249  20.669
   47    HG3  LYS   6           HG3      LYS   6 -31.345 -10.794  20.024
   48    HD2  LYS   6           HD2      LYS   6 -32.817 -11.985  21.678
   49    HD3  LYS   6           HD3      LYS   6 -33.476 -10.414  22.170
   50    HE2  LYS   6           HE2      LYS   6 -34.232 -10.045  19.802
   51    HE3  LYS   6           HE3      LYS   6 -33.643 -11.662  19.385
   52    HZ1  LYS   6           HZ1      LYS   6 -36.020 -11.709  19.919
   53    HZ2  LYS   6           HZ2      LYS   6 -35.742 -11.051  21.387
   54    HZ3  LYS   6           HZ3      LYS   6 -35.185 -12.549  21.080
   55    H    GLN   7           H        GLN   7 -27.243  -9.014  20.429
   56    HA   GLN   7           HA       GLN   7 -27.425 -11.060  18.331
   57    HB2  GLN   7           HB2      GLN   7 -25.623  -9.977  17.241
   58    HB3  GLN   7           HB3      GLN   7 -26.779  -8.775  17.764
   59    HG2  GLN   7           HG2      GLN   7 -25.139  -7.615  18.756
   60    HG3  GLN   7           HG3      GLN   7 -24.840  -8.941  19.868
   61   HE21  GLN   7          HE21      GLN   7 -23.843  -7.508  16.752
   62   HE22  GLN   7          HE22      GLN   7 -22.264  -8.305  16.755
   63    H    GLU   8           H        GLU   8 -25.977 -12.706  17.909
   64    HA   GLU   8           HA       GLU   8 -23.899 -13.254  20.000
   65    HB2  GLU   8           HB2      GLU   8 -25.343 -15.223  18.174
   66    HB3  GLU   8           HB3      GLU   8 -24.090 -15.634  19.354
   67    HG2  GLU   8           HG2      GLU   8 -25.534 -14.803  21.188
   68    HG3  GLU   8           HG3      GLU   8 -26.824 -14.463  20.027
   69    H    LYS   9           H        LYS   9 -24.050 -11.746  17.220
   70    HA   LYS   9           HA       LYS   9 -22.548 -13.488  15.482
   71    HB2  LYS   9           HB2      LYS   9 -23.379 -10.611  14.948
   72    HB3  LYS   9           HB3      LYS   9 -22.891 -11.840  13.772
   73    HG2  LYS   9           HG2      LYS   9 -24.877 -13.248  14.755
   74    HG3  LYS   9           HG3      LYS   9 -25.405 -11.727  15.464
   75    HD2  LYS   9           HD2      LYS   9 -26.633 -11.996  13.454
   76    HD3  LYS   9           HD3      LYS   9 -25.466 -10.712  13.172
   77    HE2  LYS   9           HE2      LYS   9 -25.614 -12.164  11.216
   78    HE3  LYS   9           HE3      LYS   9 -24.006 -12.307  11.931
   79    HZ1  LYS   9           HZ1      LYS   9 -26.219 -14.237  12.430
   80    HZ2  LYS   9           HZ2      LYS   9 -24.654 -14.389  12.923
   81    HZ3  LYS   9           HZ3      LYS   9 -25.009 -14.487  11.345
   82    H    THR  10           H        THR  10 -21.570 -10.663  17.380
   83    HA   THR  10           HA       THR  10 -18.753 -11.217  16.599
   84    HB   THR  10           HB       THR  10 -18.364  -8.724  16.344
   85    HG1  THR  10           HG1      THR  10 -20.165  -7.580  15.609
   86   HG21  THR  10          HG21      THR  10 -20.242  -9.734  14.204
   87   HG22  THR  10          HG22      THR  10 -18.649 -10.477  14.458
   88   HG23  THR  10          HG23      THR  10 -18.749  -8.770  14.064
   89    HA   PRO  11           HA       PRO  11 -19.276 -10.209  21.147
   90    HB2  PRO  11           HB2      PRO  11 -18.692 -12.610  22.314
   91    HB3  PRO  11           HB3      PRO  11 -20.318 -12.195  21.694
   92    HG2  PRO  11           HG2      PRO  11 -18.141 -13.763  20.263
   93    HG3  PRO  11           HG3      PRO  11 -19.865 -14.207  20.500
   94    HD2  PRO  11           HD2      PRO  11 -19.056 -13.040  18.202
   95    HD3  PRO  11           HD3      PRO  11 -20.609 -12.598  18.968
   96    H    LYS  12           H        LYS  12 -16.609 -11.975  19.471
   97    HA   LYS  12           HA       LYS  12 -14.706 -10.281  20.915
   98    HB2  LYS  12           HB2      LYS  12 -15.059 -12.308  22.367
   99    HB3  LYS  12           HB3      LYS  12 -14.432 -13.313  21.071
  100    HG2  LYS  12           HG2      LYS  12 -12.802 -12.752  22.915
  101    HG3  LYS  12           HG3      LYS  12 -12.228 -12.389  21.296
  102    HD2  LYS  12           HD2      LYS  12 -11.608 -10.638  22.900
  103    HD3  LYS  12           HD3      LYS  12 -12.627 -10.006  21.617
  104    HE2  LYS  12           HE2      LYS  12 -14.619 -10.326  23.261
  105    HE3  LYS  12           HE3      LYS  12 -13.382 -10.608  24.501
  106    HZ1  LYS  12           HZ1      LYS  12 -13.795  -8.161  22.892
  107    HZ2  LYS  12           HZ2      LYS  12 -12.431  -8.404  23.751
  108    HZ3  LYS  12           HZ3      LYS  12 -13.851  -8.275  24.544
  109    H    THR  13           H        THR  13 -14.967  -9.557  18.690
  110    HA   THR  13           HA       THR  13 -12.685 -10.545  17.048
  111    HB   THR  13           HB       THR  13 -14.503 -11.566  15.976
  112    HG1  THR  13           HG1      THR  13 -13.321 -10.880  14.418
  113   HG21  THR  13          HG21      THR  13 -16.407 -10.428  15.012
  114   HG22  THR  13          HG22      THR  13 -15.968  -8.903  15.786
  115   HG23  THR  13          HG23      THR  13 -16.438 -10.303  16.778
  116    HA   PRO  14           HA       PRO  14 -12.420  -5.997  17.622
  117    HB2  PRO  14           HB2      PRO  14  -9.806  -5.770  18.310
  118    HB3  PRO  14           HB3      PRO  14 -11.069  -6.261  19.482
  119    HG2  PRO  14           HG2      PRO  14  -9.188  -8.040  17.910
  120    HG3  PRO  14           HG3      PRO  14  -9.555  -8.103  19.663
  121    HD2  PRO  14           HD2      PRO  14 -10.785  -9.730  17.824
  122    HD3  PRO  14           HD3      PRO  14 -11.630  -9.141  19.287
  123    H    LYS  15           H        LYS  15 -11.944  -4.633  15.969
  124    HA   LYS  15           HA       LYS  15 -10.505  -5.673  13.558
  125    HB2  LYS  15           HB2      LYS  15 -12.567  -3.470  13.929
  126    HB3  LYS  15           HB3      LYS  15 -11.654  -3.694  12.447
  127    HG2  LYS  15           HG2      LYS  15 -13.793  -4.682  12.144
  128    HG3  LYS  15           HG3      LYS  15 -12.589  -5.971  12.166
  129    HD2  LYS  15           HD2      LYS  15 -13.245  -6.612  14.416
  130    HD3  LYS  15           HD3      LYS  15 -14.277  -5.184  14.576
  131    HE2  LYS  15           HE2      LYS  15 -15.783  -6.902  14.213
  132    HE3  LYS  15           HE3      LYS  15 -15.632  -6.167  12.610
  133    HZ1  LYS  15           HZ1      LYS  15 -14.074  -7.962  12.033
  134    HZ2  LYS  15           HZ2      LYS  15 -15.487  -8.609  12.514
  135    HZ3  LYS  15           HZ3      LYS  15 -14.181  -8.615  13.522
  136    H    GLY  16           H        GLY  16  -9.186  -4.199  12.306
  137    HA2  GLY  16           HA2      GLY  16  -7.461  -2.599  12.073
  138    HA3  GLY  16           HA3      GLY  16  -7.723  -2.076  13.730
  139    HA   PRO  17           HA       PRO  17  -5.347  -6.421  14.046
  140    HB2  PRO  17           HB2      PRO  17  -3.916  -6.144  11.393
  141    HB3  PRO  17           HB3      PRO  17  -4.305  -7.634  12.296
  142    HG2  PRO  17           HG2      PRO  17  -5.889  -6.804  10.254
  143    HG3  PRO  17           HG3      PRO  17  -6.604  -7.474  11.751
  144    HD2  PRO  17           HD2      PRO  17  -6.464  -4.626  10.851
  145    HD3  PRO  17           HD3      PRO  17  -7.684  -5.476  11.824
  146    H    SER  18           H        SER  18  -3.133  -7.062  14.535
  147    HA   SER  18           HA       SER  18  -1.458  -4.842  15.407
  148    HB2  SER  18           HB2      SER  18  -0.212  -6.624  16.569
  149    HB3  SER  18           HB3      SER  18  -1.952  -6.731  16.852
  150    HG   SER  18           HG       SER  18  -1.272  -8.745  16.399
  151    H    SER  19           H        SER  19  -1.463  -6.299  12.423
  152    HA   SER  19           HA       SER  19   1.299  -5.514  11.866
  153    HB2  SER  19           HB2      SER  19   1.348  -7.916  12.754
  154    HB3  SER  19           HB3      SER  19   0.553  -8.390  11.247
  155    HG   SER  19           HG       SER  19   3.010  -8.313  11.481
  156    H    VAL  20           H        VAL  20   1.313  -7.007   9.305
  157    HA   VAL  20           HA       VAL  20   0.570  -4.782   7.796
  158    HB   VAL  20           HB       VAL  20   0.853  -7.454   6.434
  159   HG11  VAL  20          HG11      VAL  20   0.605  -5.340   5.081
  160   HG12  VAL  20          HG12      VAL  20   2.052  -4.704   5.869
  161   HG13  VAL  20          HG13      VAL  20   2.160  -6.138   4.824
  162   HG21  VAL  20          HG21      VAL  20   3.145  -5.960   7.780
  163   HG22  VAL  20          HG22      VAL  20   2.605  -7.625   8.120
  164   HG23  VAL  20          HG23      VAL  20   3.331  -7.248   6.569
  165    H    GLU  21           H        GLU  21  -1.491  -7.531   8.526
  166    HA   GLU  21           HA       GLU  21  -3.535  -7.201   6.550
  167    HB2  GLU  21           HB2      GLU  21  -3.718  -7.966   9.482
  168    HB3  GLU  21           HB3      GLU  21  -5.069  -8.069   8.347
  169    HG2  GLU  21           HG2      GLU  21  -3.920  -9.672   6.957
  170    HG3  GLU  21           HG3      GLU  21  -2.447  -9.521   7.901
  171    H    ASP  22           H        ASP  22  -2.755  -5.136   9.363
  172    HA   ASP  22           HA       ASP  22  -5.299  -3.814   9.420
  173    HB2  ASP  22           HB2      ASP  22  -3.813  -3.824  11.317
  174    HB3  ASP  22           HB3      ASP  22  -2.584  -2.926  10.440
  175    H    ILE  23           H        ILE  23  -2.177  -2.594   8.039
  176    HA   ILE  23           HA       ILE  23  -3.449  -0.400   6.730
  177    HB   ILE  23           HB       ILE  23  -1.040  -0.497   7.162
  178   HG12  ILE  23          HG12      ILE  23  -1.797  -0.104   4.238
  179   HG13  ILE  23          HG13      ILE  23  -2.018   1.067   5.542
  180   HG21  ILE  23          HG21      ILE  23   0.521  -1.745   5.797
  181   HG22  ILE  23          HG22      ILE  23  -0.604  -2.879   6.518
  182   HG23  ILE  23          HG23      ILE  23  -0.783  -2.418   4.805
  183   HD11  ILE  23          HD11      ILE  23   0.616   0.062   4.403
  184   HD12  ILE  23          HD12      ILE  23  -0.066   1.677   4.281
  185   HD13  ILE  23          HD13      ILE  23   0.489   1.073   5.863
  186    H    LYS  24           H        LYS  24  -2.884  -3.775   5.611
  187    HA   LYS  24           HA       LYS  24  -3.781  -3.248   2.923
  188    HB2  LYS  24           HB2      LYS  24  -3.624  -5.822   4.540
  189    HB3  LYS  24           HB3      LYS  24  -4.104  -5.770   2.836
  190    HG2  LYS  24           HG2      LYS  24  -2.014  -4.619   2.240
  191    HG3  LYS  24           HG3      LYS  24  -1.480  -4.683   3.921
  192    HD2  LYS  24           HD2      LYS  24  -1.962  -7.064   2.091
  193    HD3  LYS  24           HD3      LYS  24  -0.383  -6.394   2.516
  194    HE2  LYS  24           HE2      LYS  24  -0.644  -7.006   4.846
  195    HE3  LYS  24           HE3      LYS  24  -2.329  -7.481   4.581
  196    HZ1  LYS  24           HZ1      LYS  24  -0.007  -8.849   3.326
  197    HZ2  LYS  24           HZ2      LYS  24  -1.621  -9.228   3.163
  198    HZ3  LYS  24           HZ3      LYS  24  -0.878  -9.401   4.614
  199    H    ALA  25           H        ALA  25  -5.642  -4.357   5.764
  200    HA   ALA  25           HA       ALA  25  -8.144  -4.490   4.361
  201    HB1  ALA  25           HB1      ALA  25  -7.604  -5.780   6.365
  202    HB2  ALA  25           HB2      ALA  25  -7.490  -4.291   7.321
  203    HB3  ALA  25           HB3      ALA  25  -9.054  -4.783   6.624
  204    H    LYS  26           H        LYS  26  -6.631  -1.874   6.339
  205    HA   LYS  26           HA       LYS  26  -8.807   0.020   6.140
  206    HB2  LYS  26           HB2      LYS  26  -5.817   0.238   6.571
  207    HB3  LYS  26           HB3      LYS  26  -6.839   1.688   6.429
  208    HG2  LYS  26           HG2      LYS  26  -8.103   1.056   8.418
  209    HG3  LYS  26           HG3      LYS  26  -7.397  -0.530   8.390
  210    HD2  LYS  26           HD2      LYS  26  -6.441   0.870  10.149
  211    HD3  LYS  26           HD3      LYS  26  -5.226   0.286   9.006
  212    HE2  LYS  26           HE2      LYS  26  -5.083   2.462   7.936
  213    HE3  LYS  26           HE3      LYS  26  -6.458   3.066   8.871
  214    HZ1  LYS  26           HZ1      LYS  26  -4.249   3.733   9.808
  215    HZ2  LYS  26           HZ2      LYS  26  -3.912   2.164  10.106
  216    HZ3  LYS  26           HZ3      LYS  26  -5.161   2.906  10.873
  217    H    MET  27           H        MET  27  -6.029  -0.623   3.955
  218    HA   MET  27           HA       MET  27  -6.940   1.191   1.904
  219    HB2  MET  27           HB2      MET  27  -5.016  -1.156   1.873
  220    HB3  MET  27           HB3      MET  27  -5.380  -0.187   0.439
  221    HG2  MET  27           HG2      MET  27  -4.634   1.845   1.521
  222    HG3  MET  27           HG3      MET  27  -4.347   0.995   3.041
  223    HE1  MET  27           HE1      MET  27  -0.793   2.085   1.700
  224    HE2  MET  27           HE2      MET  27  -2.310   2.929   1.316
  225    HE3  MET  27           HE3      MET  27  -2.025   2.321   2.960
  226    H    GLN  28           H        GLN  28  -8.088  -2.086   2.697
  227    HA   GLN  28           HA       GLN  28  -9.433  -2.369   0.109
  228    HB2  GLN  28           HB2      GLN  28 -10.126  -3.779   2.713
  229    HB3  GLN  28           HB3      GLN  28 -10.819  -4.078   1.132
  230    HG2  GLN  28           HG2      GLN  28  -8.111  -4.848   2.153
  231    HG3  GLN  28           HG3      GLN  28  -9.329  -5.824   1.369
  232   HE21  GLN  28          HE21      GLN  28  -6.705  -3.543   0.873
  233   HE22  GLN  28          HE22      GLN  28  -6.625  -3.754  -0.894
  234    H    ALA  29           H        ALA  29 -10.467  -1.262   3.400
  235    HA   ALA  29           HA       ALA  29 -13.075  -0.454   2.704
  236    HB1  ALA  29           HB1      ALA  29 -12.923   1.058   4.604
  237    HB2  ALA  29           HB2      ALA  29 -12.094  -0.458   5.008
  238    HB3  ALA  29           HB3      ALA  29 -11.152   0.986   4.590
  239    H    SER  30           H        SER  30 -10.008   1.438   2.332
  240    HA   SER  30           HA       SER  30 -11.181   3.619   0.933
  241    HB2  SER  30           HB2      SER  30  -8.382   2.467   0.702
  242    HB3  SER  30           HB3      SER  30  -8.921   4.003  -0.001
  243    HG   SER  30           HG       SER  30  -8.409   4.786   1.844
  244    H    ILE  31           H        ILE  31  -9.804   0.554  -0.578
  245    HA   ILE  31           HA       ILE  31 -10.232   1.647  -3.163
  246    HB   ILE  31           HB       ILE  31  -8.645  -0.238  -2.492
  247   HG12  ILE  31          HG12      ILE  31 -10.201  -0.459  -5.109
  248   HG13  ILE  31          HG13      ILE  31  -8.942   0.727  -4.765
  249   HG21  ILE  31          HG21      ILE  31 -10.510  -1.807  -1.682
  250   HG22  ILE  31          HG22      ILE  31 -10.926  -2.055  -3.378
  251   HG23  ILE  31          HG23      ILE  31  -9.322  -2.513  -2.777
  252   HD11  ILE  31          HD11      ILE  31  -7.973  -1.052  -6.059
  253   HD12  ILE  31          HD12      ILE  31  -7.305  -1.139  -4.418
  254   HD13  ILE  31          HD13      ILE  31  -8.565  -2.286  -4.942
  255    H    GLU  32           H        GLU  32 -12.485  -0.252  -1.180
  256    HA   GLU  32           HA       GLU  32 -14.468  -0.082  -3.397
  257    HB2  GLU  32           HB2      GLU  32 -15.963  -1.438  -1.890
  258    HB3  GLU  32           HB3      GLU  32 -14.568  -2.192  -2.641
  259    HG2  GLU  32           HG2      GLU  32 -13.324  -2.137  -0.598
  260    HG3  GLU  32           HG3      GLU  32 -14.618  -1.259   0.254
  261    H    LYS  33           H        LYS  33 -13.599   2.085  -0.997
  262    HA   LYS  33           HA       LYS  33 -16.298   3.402  -1.299
  263    HB2  LYS  33           HB2      LYS  33 -14.353   3.697   1.006
  264    HB3  LYS  33           HB3      LYS  33 -15.859   4.588   0.805
  265    HG2  LYS  33           HG2      LYS  33 -17.183   2.550   0.878
  266    HG3  LYS  33           HG3      LYS  33 -15.732   1.545   0.992
  267    HD2  LYS  33           HD2      LYS  33 -15.133   2.573   3.136
  268    HD3  LYS  33           HD3      LYS  33 -16.579   3.599   3.085
  269    HE2  LYS  33           HE2      LYS  33 -16.663   0.550   2.931
  270    HE3  LYS  33           HE3      LYS  33 -16.719   1.429   4.464
  271    HZ1  LYS  33           HZ1      LYS  33 -18.939   0.915   3.680
  272    HZ2  LYS  33           HZ2      LYS  33 -18.720   1.748   2.283
  273    HZ3  LYS  33           HZ3      LYS  33 -18.738   2.519   3.746
  274    H    GLY  34           H        GLY  34 -13.083   3.753  -2.293
  275    HA2  GLY  34           HA2      GLY  34 -13.687   6.208  -3.697
  276    HA3  GLY  34           HA3      GLY  34 -12.696   6.515  -2.269
  277    H    GLY  35           H        GLY  35 -12.010   3.465  -3.874
  278    HA2  GLY  35           HA2      GLY  35 -10.264   2.820  -5.258
  279    HA3  GLY  35           HA3      GLY  35 -10.013   4.496  -5.732
  280    H    SER  36           H        SER  36  -7.799   2.905  -5.388
  281    HA   SER  36           HA       SER  36  -6.431   4.212  -3.182
  282    HB2  SER  36           HB2      SER  36  -7.541   2.339  -1.985
  283    HB3  SER  36           HB3      SER  36  -6.732   1.186  -3.059
  284    HG   SER  36           HG       SER  36  -5.331   3.081  -1.438
  285    H    LEU  37           H        LEU  37  -4.324   4.190  -3.222
  286    HA   LEU  37           HA       LEU  37  -2.239   4.168  -3.852
  287    HB2  LEU  37           HB2      LEU  37  -3.021   1.348  -4.539
  288    HB3  LEU  37           HB3      LEU  37  -1.362   1.873  -4.721
  289    HG   LEU  37           HG       LEU  37  -2.764   2.378  -2.080
  290   HD11  LEU  37          HD11      LEU  37  -1.462  -0.222  -2.965
  291   HD12  LEU  37          HD12      LEU  37  -3.171   0.027  -2.512
  292   HD13  LEU  37          HD13      LEU  37  -1.898   0.193  -1.293
  293   HD21  LEU  37          HD21      LEU  37  -0.501   3.340  -2.579
  294   HD22  LEU  37          HD22      LEU  37   0.126   1.698  -2.784
  295   HD23  LEU  37          HD23      LEU  37  -0.504   2.215  -1.206
  296    HA   PRO  38           HA       PRO  38  -1.138   4.929  -8.209
  297    HB2  PRO  38           HB2      PRO  38   1.603   4.231  -7.182
  298    HB3  PRO  38           HB3      PRO  38   1.090   5.652  -8.138
  299    HG2  PRO  38           HG2      PRO  38   1.645   5.913  -5.507
  300    HG3  PRO  38           HG3      PRO  38   0.214   6.740  -6.209
  301    HD2  PRO  38           HD2      PRO  38   0.302   4.079  -4.741
  302    HD3  PRO  38           HD3      PRO  38  -0.764   5.495  -4.461
  303    H    LYS  39           H        LYS  39   0.462   3.631  -9.764
  304    HA   LYS  39           HA       LYS  39   0.516   0.705  -9.136
  305    HB2  LYS  39           HB2      LYS  39  -0.217   0.168 -11.398
  306    HB3  LYS  39           HB3      LYS  39  -1.441   1.044 -10.479
  307    HG2  LYS  39           HG2      LYS  39  -0.879   3.137 -11.673
  308    HG3  LYS  39           HG3      LYS  39   0.393   2.295 -12.587
  309    HD2  LYS  39           HD2      LYS  39  -1.243   0.847 -13.648
  310    HD3  LYS  39           HD3      LYS  39  -2.526   1.442 -12.577
  311    HE2  LYS  39           HE2      LYS  39  -2.180   3.748 -13.522
  312    HE3  LYS  39           HE3      LYS  39  -1.044   3.056 -14.699
  313    HZ1  LYS  39           HZ1      LYS  39  -3.311   3.215 -15.601
  314    HZ2  LYS  39           HZ2      LYS  39  -3.889   2.308 -14.364
  315    HZ3  LYS  39           HZ3      LYS  39  -2.853   1.640 -15.488
  316    H    VAL  40           H        VAL  40   2.297   3.389 -10.454
  317    HA   VAL  40           HA       VAL  40   4.373   1.516 -11.439
  318    HB   VAL  40           HB       VAL  40   3.821   3.632 -12.658
  319   HG11  VAL  40          HG11      VAL  40   3.794   5.198 -10.710
  320   HG12  VAL  40          HG12      VAL  40   5.550   4.964 -10.536
  321   HG13  VAL  40          HG13      VAL  40   4.891   5.700 -12.006
  322   HG21  VAL  40          HG21      VAL  40   6.734   3.235 -11.872
  323   HG22  VAL  40          HG22      VAL  40   5.838   2.257 -13.059
  324   HG23  VAL  40          HG23      VAL  40   6.098   3.974 -13.356
  325    H    GLU  41           H        GLU  41   6.221   1.003 -10.445
  326    HA   GLU  41           HA       GLU  41   5.944   0.595  -7.748
  327    HB2  GLU  41           HB2      GLU  41   8.123  -0.440  -7.780
  328    HB3  GLU  41           HB3      GLU  41   7.243  -0.793  -9.255
  329    HG2  GLU  41           HG2      GLU  41   8.606   1.227 -10.277
  330    HG3  GLU  41           HG3      GLU  41   9.650   1.014  -8.876
  331    H    ALA  42           H        ALA  42   8.185   3.098  -9.085
  332    HA   ALA  42           HA       ALA  42   9.216   3.785  -6.520
  333    HB1  ALA  42           HB1      ALA  42  10.384   4.230  -8.612
  334    HB2  ALA  42           HB2      ALA  42   9.125   5.397  -9.099
  335    HB3  ALA  42           HB3      ALA  42  10.160   5.731  -7.698
  336    H    LYS  43           H        LYS  43   6.381   5.066  -8.265
  337    HA   LYS  43           HA       LYS  43   5.832   7.204  -6.333
  338    HB2  LYS  43           HB2      LYS  43   3.991   5.889  -8.387
  339    HB3  LYS  43           HB3      LYS  43   3.589   7.285  -7.375
  340    HG2  LYS  43           HG2      LYS  43   5.636   8.438  -8.330
  341    HG3  LYS  43           HG3      LYS  43   5.726   7.130  -9.517
  342    HD2  LYS  43           HD2      LYS  43   3.375   7.742 -10.257
  343    HD3  LYS  43           HD3      LYS  43   3.421   9.099  -9.112
  344    HE2  LYS  43           HE2      LYS  43   5.566   9.864 -10.311
  345    HE3  LYS  43           HE3      LYS  43   5.210   8.633 -11.535
  346    HZ1  LYS  43           HZ1      LYS  43   3.659  11.080 -10.920
  347    HZ2  LYS  43           HZ2      LYS  43   2.971   9.832 -11.733
  348    HZ3  LYS  43           HZ3      LYS  43   4.292  10.579 -12.356
  349    H    PHE  44           H        PHE  44   4.744   3.845  -6.787
  350    HA   PHE  44           HA       PHE  44   2.859   3.784  -4.696
  351    HB2  PHE  44           HB2      PHE  44   3.251   2.111  -6.552
  352    HB3  PHE  44           HB3      PHE  44   4.658   1.525  -5.694
  353    HD1  PHE  44           HD1      PHE  44   4.229   0.625  -3.211
  354    HD2  PHE  44           HD2      PHE  44   1.236   1.007  -6.289
  355    HE1  PHE  44           HE1      PHE  44   2.838  -1.076  -2.074
  356    HE2  PHE  44           HE2      PHE  44  -0.149  -0.701  -5.164
  357    HZ   PHE  44           HZ       PHE  44   0.637  -1.739  -3.039
  358    H    ILE  45           H        ILE  45   6.348   2.950  -4.636
  359    HA   ILE  45           HA       ILE  45   6.551   2.395  -1.837
  360    HB   ILE  45           HB       ILE  45   8.589   3.236  -3.927
  361   HG12  ILE  45          HG12      ILE  45   8.223   0.491  -2.651
  362   HG13  ILE  45          HG13      ILE  45   7.281   0.956  -4.054
  363   HG21  ILE  45          HG21      ILE  45   9.070   2.247  -1.077
  364   HG22  ILE  45          HG22      ILE  45  10.323   2.356  -2.330
  365   HG23  ILE  45          HG23      ILE  45   9.544   3.820  -1.762
  366   HD11  ILE  45          HD11      ILE  45  10.316   0.808  -3.968
  367   HD12  ILE  45          HD12      ILE  45   9.203  -0.297  -4.793
  368   HD13  ILE  45          HD13      ILE  45   9.361   1.380  -5.350
  369    H    ASN  46           H        ASN  46   7.186   5.470  -3.628
  370    HA   ASN  46           HA       ASN  46   7.810   7.112  -1.394
  371    HB2  ASN  46           HB2      ASN  46   8.175   8.046  -3.530
  372    HB3  ASN  46           HB3      ASN  46   6.602   7.556  -4.137
  373   HD21  ASN  46          HD21      ASN  46   4.792   8.863  -3.814
  374   HD22  ASN  46          HD22      ASN  46   4.924  10.487  -3.184
  375    H    TYR  47           H        TYR  47   4.574   6.347  -2.768
  376    HA   TYR  47           HA       TYR  47   3.045   7.984  -1.023
  377    HB2  TYR  47           HB2      TYR  47   2.337   7.075  -3.176
  378    HB3  TYR  47           HB3      TYR  47   2.341   5.443  -2.530
  379    HD1  TYR  47           HD1      TYR  47   0.591   8.675  -2.630
  380    HD2  TYR  47           HD2      TYR  47   0.555   4.683  -1.003
  381    HE1  TYR  47           HE1      TYR  47  -1.799   8.948  -2.027
  382    HE2  TYR  47           HE2      TYR  47  -1.872   4.931  -0.462
  383    HH   TYR  47           HH       TYR  47  -3.586   8.029  -0.990
  384    H    VAL  48           H        VAL  48   3.796   4.468  -0.784
  385    HA   VAL  48           HA       VAL  48   2.509   4.050   1.727
  386    HB   VAL  48           HB       VAL  48   4.727   2.562   0.278
  387   HG11  VAL  48          HG11      VAL  48   3.357   1.757   2.877
  388   HG12  VAL  48          HG12      VAL  48   4.315   0.664   1.864
  389   HG13  VAL  48          HG13      VAL  48   5.097   2.032   2.642
  390   HG21  VAL  48          HG21      VAL  48   1.809   1.857   0.878
  391   HG22  VAL  48          HG22      VAL  48   2.411   2.475  -0.679
  392   HG23  VAL  48          HG23      VAL  48   2.947   0.899  -0.088
  393    H    LYS  49           H        LYS  49   5.994   4.830   1.101
  394    HA   LYS  49           HA       LYS  49   6.695   4.837   3.898
  395    HB2  LYS  49           HB2      LYS  49   7.955   6.119   1.449
  396    HB3  LYS  49           HB3      LYS  49   8.647   6.253   3.072
  397    HG2  LYS  49           HG2      LYS  49   8.967   3.872   3.259
  398    HG3  LYS  49           HG3      LYS  49   8.022   3.560   1.796
  399    HD2  LYS  49           HD2      LYS  49  10.384   3.335   1.289
  400    HD3  LYS  49           HD3      LYS  49   9.693   4.719   0.428
  401    HE2  LYS  49           HE2      LYS  49  10.604   6.206   2.288
  402    HE3  LYS  49           HE3      LYS  49  11.467   4.790   2.913
  403    HZ1  LYS  49           HZ1      LYS  49  12.632   4.655   0.763
  404    HZ2  LYS  49           HZ2      LYS  49  12.816   6.159   1.372
  405    HZ3  LYS  49           HZ3      LYS  49  11.741   5.876   0.163
  406    H    ASN  50           H        ASN  50   5.982   7.641   1.741
  407    HA   ASN  50           HA       ASN  50   6.323   9.413   3.959
  408    HB2  ASN  50           HB2      ASN  50   6.424  11.065   2.473
  409    HB3  ASN  50           HB3      ASN  50   6.640   9.757   1.319
  410   HD21  ASN  50          HD21      ASN  50   4.426   8.932   0.384
  411   HD22  ASN  50          HD22      ASN  50   3.226  10.192   0.038
  412    H    CYS  51           H        CYS  51   3.409   7.808   2.904
  413    HA   CYS  51           HA       CYS  51   1.826   9.672   4.628
  414    HB2  CYS  51           HB2      CYS  51   1.342   9.377   2.114
  415    HB3  CYS  51           HB3      CYS  51   0.712   7.782   2.543
  416    HG   CYS  51           HG       CYS  51  -0.280  10.832   3.170
  417    H    PHE  52           H        PHE  52   2.660   6.233   4.235
  418    HA   PHE  52           HA       PHE  52   0.992   5.590   6.633
  419    HB2  PHE  52           HB2      PHE  52   1.731   3.809   4.296
  420    HB3  PHE  52           HB3      PHE  52   0.835   3.342   5.731
  421    HD1  PHE  52           HD2      PHE  52   0.685   5.440   2.652
  422    HD2  PHE  52           HD1      PHE  52  -1.497   3.874   6.024
  423    HE1  PHE  52           HE2      PHE  52  -1.438   6.278   1.678
  424    HE2  PHE  52           HE1      PHE  52  -3.624   4.661   5.012
  425    HZ   PHE  52           HZ       PHE  52  -3.596   5.868   2.841
  426    H    ARG  53           H        ARG  53   4.210   5.931   5.770
  427    HA   ARG  53           HA       ARG  53   6.114   5.634   6.927
  428    HB2  ARG  53           HB2      ARG  53   4.078   5.779   9.174
  429    HB3  ARG  53           HB3      ARG  53   5.808   5.946   9.448
  430    HG2  ARG  53           HG2      ARG  53   4.274   7.753   7.538
  431    HG3  ARG  53           HG3      ARG  53   4.546   8.126   9.240
  432    HD2  ARG  53           HD2      ARG  53   6.928   8.191   8.977
  433    HD3  ARG  53           HD3      ARG  53   6.833   7.514   7.348
  434    HE   ARG  53           HE       ARG  53   5.362  10.029   7.623
  435   HH11  ARG  53          HH11      ARG  53   8.524   8.713   6.899
  436   HH12  ARG  53          HH12      ARG  53   8.719   9.790   5.541
  437   HH21  ARG  53          HH21      ARG  53   5.786  11.481   6.135
  438   HH22  ARG  53          HH22      ARG  53   7.351  11.546   5.319
  439    H    MET  54           H        MET  54   4.967   3.033   6.137
  440    HA   MET  54           HA       MET  54   6.496   1.278   7.981
  441    HB2  MET  54           HB2      MET  54   5.936  -0.534   6.392
  442    HB3  MET  54           HB3      MET  54   4.541   0.213   7.173
  443    HG2  MET  54           HG2      MET  54   4.272   1.558   5.026
  444    HG3  MET  54           HG3      MET  54   5.509   0.503   4.334
  445    HE1  MET  54           HE1      MET  54   5.163  -2.274   4.417
  446    HE2  MET  54           HE2      MET  54   4.413  -2.344   6.030
  447    HE3  MET  54           HE3      MET  54   3.572  -3.032   4.625
  448    H    THR  55           H        THR  55   8.402   0.337   7.489
  449    HA   THR  55           HA       THR  55   9.899   1.182   5.040
  450    HB   THR  55           HB       THR  55  11.925   1.526   6.353
  451    HG1  THR  55           HG1      THR  55  10.163   1.276   8.581
  452   HG21  THR  55          HG21      THR  55   9.704   3.327   7.375
  453   HG22  THR  55          HG22      THR  55  10.431   3.440   5.758
  454   HG23  THR  55          HG23      THR  55  11.437   3.700   7.187
  455    H    ASP  56           H        ASP  56   8.924  -1.425   6.978
  456    HA   ASP  56           HA       ASP  56  11.129  -3.242   6.519
  457    HB2  ASP  56           HB2      ASP  56   8.169  -3.568   7.157
  458    HB3  ASP  56           HB3      ASP  56   9.201  -4.956   6.816
  459    H    GLN  57           H        GLN  57  11.867  -3.485   4.447
  460    HA   GLN  57           HA       GLN  57  10.316  -3.304   2.130
  461    HB2  GLN  57           HB2      GLN  57  12.969  -4.613   2.743
  462    HB3  GLN  57           HB3      GLN  57  12.220  -4.884   1.169
  463    HG2  GLN  57           HG2      GLN  57  12.825  -2.144   2.329
  464    HG3  GLN  57           HG3      GLN  57  13.821  -2.998   1.143
  465   HE21  GLN  57          HE21      GLN  57  11.171  -0.833   1.491
  466   HE22  GLN  57          HE22      GLN  57  10.412  -1.093  -0.083
  467    H    GLU  58           H        GLU  58  10.880  -6.300   4.025
  468    HA   GLU  58           HA       GLU  58   9.574  -8.055   2.258
  469    HB2  GLU  58           HB2      GLU  58   9.200  -9.523   4.173
  470    HB3  GLU  58           HB3      GLU  58  10.824  -8.844   4.156
  471    HG2  GLU  58           HG2      GLU  58  10.155  -7.193   5.903
  472    HG3  GLU  58           HG3      GLU  58   8.549  -7.926   5.955
  473    H    ALA  59           H        ALA  59   8.026  -5.744   4.498
  474    HA   ALA  59           HA       ALA  59   5.344  -6.889   3.964
  475    HB1  ALA  59           HB1      ALA  59   4.548  -5.193   5.508
  476    HB2  ALA  59           HB2      ALA  59   5.836  -6.173   6.245
  477    HB3  ALA  59           HB3      ALA  59   6.188  -4.522   5.670
  478    H    ILE  60           H        ILE  60   7.290  -4.009   3.110
  479    HA   ILE  60           HA       ILE  60   5.292  -2.602   1.602
  480    HB   ILE  60           HB       ILE  60   8.300  -2.710   1.397
  481   HG12  ILE  60          HG12      ILE  60   6.452  -0.497   2.414
  482   HG13  ILE  60          HG13      ILE  60   7.107  -1.736   3.475
  483   HG21  ILE  60          HG21      ILE  60   8.105  -0.637  -0.018
  484   HG22  ILE  60          HG22      ILE  60   7.458  -2.051  -0.824
  485   HG23  ILE  60          HG23      ILE  60   6.349  -0.877  -0.082
  486   HD11  ILE  60          HD11      ILE  60   8.783   0.239   1.893
  487   HD12  ILE  60          HD12      ILE  60   8.463   0.231   3.629
  488   HD13  ILE  60          HD13      ILE  60   9.398  -1.094   2.909
  489    H    GLN  61           H        GLN  61   7.675  -5.106   0.566
  490    HA   GLN  61           HA       GLN  61   6.500  -5.270  -2.050
  491    HB2  GLN  61           HB2      GLN  61   8.041  -6.969  -2.546
  492    HB3  GLN  61           HB3      GLN  61   8.857  -5.780  -1.544
  493    HG2  GLN  61           HG2      GLN  61   9.616  -7.770  -0.635
  494    HG3  GLN  61           HG3      GLN  61   8.305  -7.339   0.447
  495   HE21  GLN  61          HE21      GLN  61   7.215  -9.163   1.076
  496   HE22  GLN  61          HE22      GLN  61   6.894 -10.533   0.021
  497    H    ASP  62           H        ASP  62   5.708  -7.032   0.994
  498    HA   ASP  62           HA       ASP  62   4.025  -8.970  -0.351
  499    HB2  ASP  62           HB2      ASP  62   4.747  -9.307   1.965
  500    HB3  ASP  62           HB3      ASP  62   3.848  -7.879   2.483
  501    H    LEU  63           H        LEU  63   3.369  -5.725   1.026
  502    HA   LEU  63           HA       LEU  63   0.603  -5.611   0.510
  503    HB2  LEU  63           HB2      LEU  63   2.050  -4.164   1.964
  504    HB3  LEU  63           HB3      LEU  63   2.602  -3.307   0.534
  505    HG   LEU  63           HG       LEU  63  -0.291  -3.471   1.482
  506   HD11  LEU  63          HD11      LEU  63   1.744  -1.234   1.829
  507   HD12  LEU  63          HD12      LEU  63   1.158  -2.312   3.111
  508   HD13  LEU  63          HD13      LEU  63   0.038  -1.189   2.326
  509   HD21  LEU  63          HD21      LEU  63   1.017  -1.644  -0.571
  510   HD22  LEU  63          HD22      LEU  63  -0.617  -1.432   0.077
  511   HD23  LEU  63          HD23      LEU  63  -0.252  -2.857  -0.885
  512    H    TRP  64           H        TRP  64   3.359  -4.459  -1.442
  513    HA   TRP  64           HA       TRP  64   2.015  -3.537  -3.753
  514    HB2  TRP  64           HB2      TRP  64   4.324  -3.035  -3.120
  515    HB3  TRP  64           HB3      TRP  64   4.768  -4.722  -3.318
  516    HD1  TRP  64           HD1      TRP  64   2.811  -2.647  -5.925
  517    HE1  TRP  64           HE1      TRP  64   4.171  -2.549  -8.083
  518    HE3  TRP  64           HE3      TRP  64   7.115  -4.886  -4.263
  519    HZ2  TRP  64           HZ2      TRP  64   6.783  -3.413  -9.008
  520    HZ3  TRP  64           HZ3      TRP  64   9.012  -5.267  -5.820
  521    HH2  TRP  64           HH2      TRP  64   8.852  -4.541  -8.192
  522    H    GLN  65           H        GLN  65   3.437  -6.816  -3.205
  523    HA   GLN  65           HA       GLN  65   2.528  -7.936  -5.681
  524    HB2  GLN  65           HB2      GLN  65   3.594  -8.948  -3.064
  525    HB3  GLN  65           HB3      GLN  65   2.688 -10.084  -3.996
  526    HG2  GLN  65           HG2      GLN  65   5.213 -10.044  -4.392
  527    HG3  GLN  65           HG3      GLN  65   4.157 -10.088  -5.801
  528   HE21  GLN  65          HE21      GLN  65   5.756  -7.541  -3.761
  529   HE22  GLN  65          HE22      GLN  65   6.258  -6.616  -5.191
  530    H    TRP  66           H        TRP  66   0.865  -7.688  -2.506
  531    HA   TRP  66           HA       TRP  66  -1.379  -9.252  -3.376
  532    HB2  TRP  66           HB2      TRP  66  -0.552  -8.265  -0.966
  533    HB3  TRP  66           HB3      TRP  66  -1.884  -7.189  -1.304
  534    HD1  TRP  66           HD1      TRP  66  -4.012  -9.127  -2.476
  535    HE1  TRP  66           HE1      TRP  66  -5.077 -10.978  -1.095
  536    HE3  TRP  66           HE3      TRP  66  -0.280  -9.758   0.971
  537    HZ2  TRP  66           HZ2      TRP  66  -4.377 -12.583   1.221
  538    HZ3  TRP  66           HZ3      TRP  66  -0.503 -11.493   2.751
  539    HH2  TRP  66           HH2      TRP  66  -2.548 -12.883   2.891
  540    H    ARG  67           H        ARG  67  -0.599  -5.814  -3.842
  541    HA   ARG  67           HA       ARG  67  -3.275  -5.305  -5.051
  542    HB2  ARG  67           HB2      ARG  67  -0.941  -3.591  -4.293
  543    HB3  ARG  67           HB3      ARG  67  -2.016  -3.040  -5.576
  544    HG2  ARG  67           HG2      ARG  67  -2.693  -2.169  -3.409
  545    HG3  ARG  67           HG3      ARG  67  -3.962  -3.119  -4.150
  546    HD2  ARG  67           HD2      ARG  67  -2.119  -4.293  -2.031
  547    HD3  ARG  67           HD3      ARG  67  -3.531  -3.316  -1.610
  548    HE   ARG  67           HE       ARG  67  -4.188  -5.518  -3.416
  549   HH11  ARG  67          HH11      ARG  67  -3.686  -4.869  -0.007
  550   HH12  ARG  67          HH12      ARG  67  -4.714  -6.230   0.440
  551   HH21  ARG  67          HH21      ARG  67  -5.480  -7.239  -2.703
  552   HH22  ARG  67          HH22      ARG  67  -5.799  -7.354  -1.017
  553    H    LYS  68           H        LYS  68  -0.136  -6.180  -6.231
  554    HA   LYS  68           HA       LYS  68  -1.048  -6.242  -9.029
  555    HB2  LYS  68           HB2      LYS  68   1.259  -7.539  -7.542
  556    HB3  LYS  68           HB3      LYS  68   0.966  -7.739  -9.276
  557    HG2  LYS  68           HG2      LYS  68   1.306  -5.410  -9.718
  558    HG3  LYS  68           HG3      LYS  68   1.283  -4.994  -8.007
  559    HD2  LYS  68           HD2      LYS  68   3.517  -4.889  -8.878
  560    HD3  LYS  68           HD3      LYS  68   3.414  -6.112  -7.621
  561    HE2  LYS  68           HE2      LYS  68   3.241  -6.785 -10.589
  562    HE3  LYS  68           HE3      LYS  68   4.790  -6.553  -9.785
  563    HZ1  LYS  68           HZ1      LYS  68   4.252  -8.861  -9.789
  564    HZ2  LYS  68           HZ2      LYS  68   2.798  -8.654  -9.069
  565    HZ3  LYS  68           HZ3      LYS  68   4.178  -8.333  -8.239
  566    H    SER  69           H        SER  69  -2.113  -7.906  -6.367
  567    HA   SER  69           HA       SER  69  -3.104 -10.208  -7.981
  568    HB2  SER  69           HB2      SER  69  -2.538 -10.234  -5.002
  569    HB3  SER  69           HB3      SER  69  -3.083 -11.583  -6.005
  570    HG   SER  69           HG       SER  69  -0.574 -10.265  -6.018
  571    H    LEU  70           H        LEU  70  -4.492  -7.698  -7.881
  572    HA   LEU  70           HA       LEU  70  -6.754  -7.993  -6.034
  573    HB2  LEU  70           HB2      LEU  70  -6.005  -6.008  -8.189
  574    HB3  LEU  70           HB3      LEU  70  -7.649  -6.059  -7.566
  575    HG   LEU  70           HG       LEU  70  -5.231  -5.702  -5.764
  576   HD11  LEU  70          HD11      LEU  70  -5.387  -3.792  -7.309
  577   HD12  LEU  70          HD12      LEU  70  -5.906  -3.303  -5.689
  578   HD13  LEU  70          HD13      LEU  70  -7.116  -3.617  -6.944
  579   HD21  LEU  70          HD21      LEU  70  -8.193  -5.155  -5.327
  580   HD22  LEU  70          HD22      LEU  70  -6.902  -4.830  -4.159
  581   HD23  LEU  70          HD23      LEU  70  -7.294  -6.493  -4.604
  Start of MODEL   17
    1    H    GLN   1           H1       GLN   1 -12.780 -34.424  26.231
    2    HA   GLN   1           HA       GLN   1 -15.150 -33.987  26.144
    3    HB2  GLN   1           HB2      GLN   1 -15.705 -34.807  28.331
    4    HB3  GLN   1           HB3      GLN   1 -14.273 -35.617  27.746
    5    HG2  GLN   1           HG2      GLN   1 -12.886 -33.995  29.179
    6    HG3  GLN   1           HG3      GLN   1 -14.409 -33.409  29.850
    7   HE21  GLN   1          HE21      GLN   1 -15.856 -35.221  30.851
    8   HE22  GLN   1          HE22      GLN   1 -14.914 -36.394  31.795
    9    H    GLU   2           H        GLU   2 -16.972 -32.974  27.148
   10    HA   GLU   2           HA       GLU   2 -18.294 -31.369  27.945
   11    HB2  GLU   2           HB2      GLU   2 -16.983 -31.834  29.981
   12    HB3  GLU   2           HB3      GLU   2 -15.936 -30.473  29.618
   13    HG2  GLU   2           HG2      GLU   2 -17.935 -28.952  29.764
   14    HG3  GLU   2           HG3      GLU   2 -18.914 -30.360  30.211
   15    H    SER   3           H        SER   3 -15.398 -30.081  26.400
   16    HA   SER   3           HA       SER   3 -17.181 -28.044  25.208
   17    HB2  SER   3           HB2      SER   3 -15.517 -26.256  25.403
   18    HB3  SER   3           HB3      SER   3 -16.113 -26.801  26.980
   19    HG   SER   3           HG       SER   3 -14.249 -27.830  27.381
   20    H    PHE   4           H        PHE   4 -16.864 -27.571  23.132
   21    HA   PHE   4           HA       PHE   4 -14.891 -29.274  21.672
   22    HB2  PHE   4           HB2      PHE   4 -17.208 -29.704  21.186
   23    HB3  PHE   4           HB3      PHE   4 -17.515 -28.008  20.858
   24    HD1  PHE   4           HD1      PHE   4 -14.893 -30.481  19.659
   25    HD2  PHE   4           HD2      PHE   4 -17.993 -27.668  18.595
   26    HE1  PHE   4           HE1      PHE   4 -14.428 -30.869  17.254
   27    HE2  PHE   4           HE2      PHE   4 -17.582 -28.139  16.195
   28    HZ   PHE   4           HZ       PHE   4 -15.777 -29.708  15.517
   29    H    LYS   5           H        LYS   5 -16.243 -25.932  21.373
   30    HA   LYS   5           HA       LYS   5 -13.555 -24.964  20.488
   31    HB2  LYS   5           HB2      LYS   5 -16.272 -24.421  19.227
   32    HB3  LYS   5           HB3      LYS   5 -14.843 -23.428  18.919
   33    HG2  LYS   5           HG2      LYS   5 -13.642 -25.257  17.925
   34    HG3  LYS   5           HG3      LYS   5 -14.858 -26.438  18.431
   35    HD2  LYS   5           HD2      LYS   5 -16.520 -25.459  16.935
   36    HD3  LYS   5           HD3      LYS   5 -15.363 -24.226  16.406
   37    HE2  LYS   5           HE2      LYS   5 -13.843 -26.002  15.554
   38    HE3  LYS   5           HE3      LYS   5 -14.962 -27.239  16.137
   39    HZ1  LYS   5           HZ1      LYS   5 -15.410 -26.917  13.832
   40    HZ2  LYS   5           HZ2      LYS   5 -15.448 -25.282  13.968
   41    HZ3  LYS   5           HZ3      LYS   5 -16.652 -26.195  14.615
   42    H    LYS   6           H        LYS   6 -12.989 -22.932  21.168
   43    HA   LYS   6           HA       LYS   6 -14.857 -21.357  22.891
   44    HB2  LYS   6           HB2      LYS   6 -12.141 -22.341  23.866
   45    HB3  LYS   6           HB3      LYS   6 -13.161 -21.149  24.685
   46    HG2  LYS   6           HG2      LYS   6 -15.008 -22.911  24.736
   47    HG3  LYS   6           HG3      LYS   6 -13.781 -24.093  24.260
   48    HD2  LYS   6           HD2      LYS   6 -13.749 -22.354  26.762
   49    HD3  LYS   6           HD3      LYS   6 -14.193 -24.064  26.690
   50    HE2  LYS   6           HE2      LYS   6 -11.909 -24.650  25.938
   51    HE3  LYS   6           HE3      LYS   6 -11.447 -22.944  25.972
   52    HZ1  LYS   6           HZ1      LYS   6 -11.902 -22.936  28.370
   53    HZ2  LYS   6           HZ2      LYS   6 -10.782 -24.082  28.011
   54    HZ3  LYS   6           HZ3      LYS   6 -12.305 -24.526  28.343
   55    H    GLN   7           H        GLN   7 -13.928 -20.864  20.276
   56    HA   GLN   7           HA       GLN   7 -11.761 -18.909  20.365
   57    HB2  GLN   7           HB2      GLN   7 -12.083 -20.565  18.549
   58    HB3  GLN   7           HB3      GLN   7 -13.600 -19.768  18.109
   59    HG2  GLN   7           HG2      GLN   7 -12.309 -17.674  17.598
   60    HG3  GLN   7           HG3      GLN   7 -10.812 -18.532  17.984
   61   HE21  GLN   7          HE21      GLN   7 -10.831 -17.494  15.497
   62   HE22  GLN   7          HE22      GLN   7 -11.081 -18.792  14.325
   63    H    GLU   8           H        GLU   8 -15.314 -18.691  19.613
   64    HA   GLU   8           HA       GLU   8 -15.073 -15.882  18.974
   65    HB2  GLU   8           HB2      GLU   8 -16.709 -17.377  17.886
   66    HB3  GLU   8           HB3      GLU   8 -17.578 -17.548  19.416
   67    HG2  GLU   8           HG2      GLU   8 -17.949 -15.040  19.417
   68    HG3  GLU   8           HG3      GLU   8 -17.161 -14.960  17.844
   69    H    LYS   9           H        LYS   9 -14.760 -14.350  20.401
   70    HA   LYS   9           HA       LYS   9 -16.613 -14.066  22.749
   71    HB2  LYS   9           HB2      LYS   9 -13.596 -13.683  22.643
   72    HB3  LYS   9           HB3      LYS   9 -14.572 -12.889  23.863
   73    HG2  LYS   9           HG2      LYS   9 -14.276 -15.890  23.471
   74    HG3  LYS   9           HG3      LYS   9 -13.565 -14.905  24.743
   75    HD2  LYS   9           HD2      LYS   9 -16.517 -15.533  24.369
   76    HD3  LYS   9           HD3      LYS   9 -15.442 -16.134  25.622
   77    HE2  LYS   9           HE2      LYS   9 -15.210 -13.892  26.594
   78    HE3  LYS   9           HE3      LYS   9 -16.158 -13.189  25.266
   79    HZ1  LYS   9           HZ1      LYS   9 -17.185 -15.133  27.249
   80    HZ2  LYS   9           HZ2      LYS   9 -18.045 -14.484  25.972
   81    HZ3  LYS   9           HZ3      LYS   9 -17.557 -13.529  27.192
   82    H    THR  10           H        THR  10 -15.038 -12.522  20.044
   83    HA   THR  10           HA       THR  10 -16.784 -10.177  20.404
   84    HB   THR  10           HB       THR  10 -15.065  -9.411  21.747
   85    HG1  THR  10           HG1      THR  10 -13.975  -8.027  19.809
   86   HG21  THR  10          HG21      THR  10 -13.000 -10.252  19.688
   87   HG22  THR  10          HG22      THR  10 -13.212 -10.869  21.332
   88   HG23  THR  10          HG23      THR  10 -12.695  -9.204  21.097
   89    HA   PRO  11           HA       PRO  11 -16.167 -11.331  15.995
   90    HB2  PRO  11           HB2      PRO  11 -18.717 -11.856  15.255
   91    HB3  PRO  11           HB3      PRO  11 -17.725 -13.026  16.175
   92    HG2  PRO  11           HG2      PRO  11 -19.827 -11.121  17.243
   93    HG3  PRO  11           HG3      PRO  11 -19.601 -12.855  17.622
   94    HD2  PRO  11           HD2      PRO  11 -18.631 -10.782  19.180
   95    HD3  PRO  11           HD3      PRO  11 -17.868 -12.399  19.106
   96    H    LYS  12           H        LYS  12 -15.689  -9.566  14.907
   97    HA   LYS  12           HA       LYS  12 -17.728  -7.577  14.126
   98    HB2  LYS  12           HB2      LYS  12 -15.080  -6.714  15.412
   99    HB3  LYS  12           HB3      LYS  12 -16.170  -5.669  14.516
  100    HG2  LYS  12           HG2      LYS  12 -16.857  -5.137  16.614
  101    HG3  LYS  12           HG3      LYS  12 -17.984  -6.441  16.260
  102    HD2  LYS  12           HD2      LYS  12 -16.008  -7.902  17.395
  103    HD3  LYS  12           HD3      LYS  12 -15.589  -6.366  18.118
  104    HE2  LYS  12           HE2      LYS  12 -18.400  -7.572  18.219
  105    HE3  LYS  12           HE3      LYS  12 -17.156  -7.929  19.423
  106    HZ1  LYS  12           HZ1      LYS  12 -18.216  -5.214  18.874
  107    HZ2  LYS  12           HZ2      LYS  12 -17.029  -5.593  19.965
  108    HZ3  LYS  12           HZ3      LYS  12 -18.562  -6.152  20.159
  109    H    THR  13           H        THR  13 -17.014  -6.291  12.286
  110    HA   THR  13           HA       THR  13 -14.866  -7.624  10.640
  111    HB   THR  13           HB       THR  13 -17.332  -6.148   9.685
  112    HG1  THR  13           HG1      THR  13 -17.518  -8.371  10.544
  113   HG21  THR  13          HG21      THR  13 -16.655  -6.969   7.459
  114   HG22  THR  13          HG22      THR  13 -15.159  -7.647   8.138
  115   HG23  THR  13          HG23      THR  13 -15.418  -5.887   8.097
  116    HA   PRO  14           HA       PRO  14 -13.310  -3.399  11.679
  117    HB2  PRO  14           HB2      PRO  14 -10.705  -3.968  12.170
  118    HB3  PRO  14           HB3      PRO  14 -11.998  -4.387  13.340
  119    HG2  PRO  14           HG2      PRO  14 -10.747  -6.196  11.237
  120    HG3  PRO  14           HG3      PRO  14 -10.938  -6.515  12.989
  121    HD2  PRO  14           HD2      PRO  14 -12.746  -7.417  11.158
  122    HD3  PRO  14           HD3      PRO  14 -13.263  -6.839  12.771
  123    H    LYS  15           H        LYS  15 -12.188  -1.882  10.449
  124    HA   LYS  15           HA       LYS  15 -11.571  -2.715   7.665
  125    HB2  LYS  15           HB2      LYS  15 -12.391  -0.103   8.959
  126    HB3  LYS  15           HB3      LYS  15 -11.680  -0.137   7.357
  127    HG2  LYS  15           HG2      LYS  15 -14.011  -0.057   7.127
  128    HG3  LYS  15           HG3      LYS  15 -13.459  -1.626   6.536
  129    HD2  LYS  15           HD2      LYS  15 -14.277  -2.719   8.579
  130    HD3  LYS  15           HD3      LYS  15 -14.719  -1.156   9.279
  131    HE2  LYS  15           HE2      LYS  15 -15.947  -2.502   6.830
  132    HE3  LYS  15           HE3      LYS  15 -16.683  -2.339   8.433
  133    HZ1  LYS  15           HZ1      LYS  15 -16.033  -0.132   6.574
  134    HZ2  LYS  15           HZ2      LYS  15 -16.557   0.107   8.108
  135    HZ3  LYS  15           HZ3      LYS  15 -17.530  -0.636   6.972
  136    H    GLY  16           H        GLY  16  -9.749  -1.609  10.416
  137    HA2  GLY  16           HA2      GLY  16  -7.243  -1.833   8.917
  138    HA3  GLY  16           HA3      GLY  16  -7.676  -0.180   9.307
  139    HA   PRO  17           HA       PRO  17  -7.449  -2.570  13.377
  140    HB2  PRO  17           HB2      PRO  17  -5.312  -4.641  12.863
  141    HB3  PRO  17           HB3      PRO  17  -6.746  -4.736  13.929
  142    HG2  PRO  17           HG2      PRO  17  -6.835  -5.866  11.501
  143    HG3  PRO  17           HG3      PRO  17  -8.222  -4.852  12.027
  144    HD2  PRO  17           HD2      PRO  17  -5.881  -4.064  10.266
  145    HD3  PRO  17           HD3      PRO  17  -7.624  -3.813   9.982
  146    H    SER  18           H        SER  18  -3.894  -2.848  12.530
  147    HA   SER  18           HA       SER  18  -3.302  -0.227  13.487
  148    HB2  SER  18           HB2      SER  18  -2.750  -2.460  15.470
  149    HB3  SER  18           HB3      SER  18  -1.729  -1.011  15.407
  150    HG   SER  18           HG       SER  18  -4.550  -0.942  15.615
  151    H    SER  19           H        SER  19  -1.810  -3.480  13.192
  152    HA   SER  19           HA       SER  19   0.839  -2.390  12.642
  153    HB2  SER  19           HB2      SER  19   0.092  -4.545  13.918
  154    HB3  SER  19           HB3      SER  19  -0.012  -5.276  12.310
  155    HG   SER  19           HG       SER  19   2.157  -4.458  13.832
  156    H    VAL  20           H        VAL  20   1.677  -4.378  10.535
  157    HA   VAL  20           HA       VAL  20   0.947  -2.978   8.144
  158    HB   VAL  20           HB       VAL  20   1.759  -5.902   8.211
  159   HG11  VAL  20          HG11      VAL  20   2.022  -3.732   6.063
  160   HG12  VAL  20          HG12      VAL  20   2.722  -5.362   5.964
  161   HG13  VAL  20          HG13      VAL  20   0.981  -5.169   5.993
  162   HG21  VAL  20          HG21      VAL  20   4.083  -5.101   7.833
  163   HG22  VAL  20          HG22      VAL  20   3.547  -3.431   8.131
  164   HG23  VAL  20          HG23      VAL  20   3.482  -4.644   9.430
  165    H    GLU  21           H        GLU  21  -0.771  -5.469   9.894
  166    HA   GLU  21           HA       GLU  21  -2.787  -6.279   8.122
  167    HB2  GLU  21           HB2      GLU  21  -3.133  -5.552  11.051
  168    HB3  GLU  21           HB3      GLU  21  -4.105  -6.689  10.116
  169    HG2  GLU  21           HG2      GLU  21  -2.063  -8.132   9.832
  170    HG3  GLU  21           HG3      GLU  21  -1.169  -7.033  10.886
  171    H    ASP  22           H        ASP  22  -2.492  -3.102   9.760
  172    HA   ASP  22           HA       ASP  22  -5.163  -2.151   9.072
  173    HB2  ASP  22           HB2      ASP  22  -4.191  -1.104  10.917
  174    HB3  ASP  22           HB3      ASP  22  -2.629  -0.895  10.137
  175    H    ILE  23           H        ILE  23  -1.918  -1.822   7.671
  176    HA   ILE  23           HA       ILE  23  -2.679  -0.220   5.418
  177    HB   ILE  23           HB       ILE  23  -0.292  -2.029   5.975
  178   HG12  ILE  23          HG12      ILE  23  -0.523   1.011   6.003
  179   HG13  ILE  23          HG13      ILE  23  -0.620  -0.004   7.438
  180   HG21  ILE  23          HG21      ILE  23   0.848  -0.915   4.076
  181   HG22  ILE  23          HG22      ILE  23  -0.514  -1.901   3.577
  182   HG23  ILE  23          HG23      ILE  23  -0.688  -0.128   3.636
  183   HD11  ILE  23          HD11      ILE  23   1.590   0.875   7.360
  184   HD12  ILE  23          HD12      ILE  23   1.700  -0.850   6.983
  185   HD13  ILE  23          HD13      ILE  23   1.831   0.363   5.685
  186    H    LYS  24           H        LYS  24  -2.401  -3.761   5.835
  187    HA   LYS  24           HA       LYS  24  -3.092  -4.594   3.181
  188    HB2  LYS  24           HB2      LYS  24  -3.626  -5.871   5.903
  189    HB3  LYS  24           HB3      LYS  24  -3.892  -6.702   4.386
  190    HG2  LYS  24           HG2      LYS  24  -1.153  -5.606   5.137
  191    HG3  LYS  24           HG3      LYS  24  -1.733  -7.180   5.688
  192    HD2  LYS  24           HD2      LYS  24  -2.072  -7.839   3.304
  193    HD3  LYS  24           HD3      LYS  24  -1.401  -6.269   2.811
  194    HE2  LYS  24           HE2      LYS  24   0.342  -7.908   2.617
  195    HE3  LYS  24           HE3      LYS  24   0.737  -6.893   4.013
  196    HZ1  LYS  24           HZ1      LYS  24   1.016  -9.286   4.409
  197    HZ2  LYS  24           HZ2      LYS  24  -0.583  -9.564   4.201
  198    HZ3  LYS  24           HZ3      LYS  24  -0.045  -8.654   5.462
  199    H    ALA  25           H        ALA  25  -5.239  -4.135   6.026
  200    HA   ALA  25           HA       ALA  25  -7.637  -4.727   4.584
  201    HB1  ALA  25           HB1      ALA  25  -8.735  -4.003   6.643
  202    HB2  ALA  25           HB2      ALA  25  -7.344  -5.034   7.000
  203    HB3  ALA  25           HB3      ALA  25  -7.212  -3.276   7.216
  204    H    LYS  26           H        LYS  26  -6.132  -1.544   5.425
  205    HA   LYS  26           HA       LYS  26  -8.151   0.046   4.106
  206    HB2  LYS  26           HB2      LYS  26  -5.295   0.545   4.969
  207    HB3  LYS  26           HB3      LYS  26  -6.203   1.763   4.068
  208    HG2  LYS  26           HG2      LYS  26  -7.787   2.102   5.751
  209    HG3  LYS  26           HG3      LYS  26  -7.505   0.532   6.501
  210    HD2  LYS  26           HD2      LYS  26  -6.648   2.390   7.881
  211    HD3  LYS  26           HD3      LYS  26  -5.441   1.196   7.419
  212    HE2  LYS  26           HE2      LYS  26  -4.637   2.724   5.611
  213    HE3  LYS  26           HE3      LYS  26  -5.776   3.953   6.167
  214    HZ1  LYS  26           HZ1      LYS  26  -3.470   4.153   7.062
  215    HZ2  LYS  26           HZ2      LYS  26  -3.720   2.757   7.934
  216    HZ3  LYS  26           HZ3      LYS  26  -4.603   4.104   8.223
  217    H    MET  27           H        MET  27  -5.271  -1.619   2.754
  218    HA   MET  27           HA       MET  27  -5.709  -0.512   0.110
  219    HB2  MET  27           HB2      MET  27  -4.240  -2.940   1.142
  220    HB3  MET  27           HB3      MET  27  -4.585  -2.785  -0.581
  221    HG2  MET  27           HG2      MET  27  -3.095  -0.717   1.075
  222    HG3  MET  27           HG3      MET  27  -2.372  -1.916   0.004
  223    HE1  MET  27           HE1      MET  27  -3.912   2.176  -1.145
  224    HE2  MET  27           HE2      MET  27  -4.476   1.323   0.303
  225    HE3  MET  27           HE3      MET  27  -2.749   1.704   0.115
  226    H    GLN  28           H        GLN  28  -7.224  -3.362   1.756
  227    HA   GLN  28           HA       GLN  28  -8.669  -4.133  -0.624
  228    HB2  GLN  28           HB2      GLN  28  -9.724  -4.506   2.195
  229    HB3  GLN  28           HB3      GLN  28 -10.133  -5.399   0.741
  230    HG2  GLN  28           HG2      GLN  28  -7.673  -5.614   2.458
  231    HG3  GLN  28           HG3      GLN  28  -8.798  -6.860   1.964
  232   HE21  GLN  28          HE21      GLN  28  -5.854  -5.176   1.135
  233   HE22  GLN  28          HE22      GLN  28  -5.570  -6.105  -0.361
  234    H    ALA  29           H        ALA  29  -9.534  -1.896   2.051
  235    HA   ALA  29           HA       ALA  29 -12.027  -1.000   1.030
  236    HB1  ALA  29           HB1      ALA  29 -11.694   0.927   2.476
  237    HB2  ALA  29           HB2      ALA  29 -11.220  -0.558   3.310
  238    HB3  ALA  29           HB3      ALA  29  -9.975   0.540   2.663
  239    H    SER  30           H        SER  30  -8.717   0.184   0.313
  240    HA   SER  30           HA       SER  30  -9.446   2.357  -1.385
  241    HB2  SER  30           HB2      SER  30  -6.952   0.614  -1.565
  242    HB3  SER  30           HB3      SER  30  -7.167   2.225  -2.260
  243    HG   SER  30           HG       SER  30  -7.247   1.544   0.513
  244    H    ILE  31           H        ILE  31  -9.283  -1.122  -2.085
  245    HA   ILE  31           HA       ILE  31  -9.618  -0.766  -4.977
  246    HB   ILE  31           HB       ILE  31  -9.900  -3.204  -3.195
  247   HG12  ILE  31          HG12      ILE  31  -7.731  -2.450  -5.204
  248   HG13  ILE  31          HG13      ILE  31  -7.600  -2.092  -3.494
  249   HG21  ILE  31          HG21      ILE  31 -11.302  -3.491  -5.216
  250   HG22  ILE  31          HG22      ILE  31  -9.938  -3.013  -6.247
  251   HG23  ILE  31          HG23      ILE  31  -9.887  -4.520  -5.308
  252   HD11  ILE  31          HD11      ILE  31  -7.749  -4.865  -4.696
  253   HD12  ILE  31          HD12      ILE  31  -6.369  -4.090  -3.905
  254   HD13  ILE  31          HD13      ILE  31  -7.802  -4.507  -2.950
  255    H    GLU  32           H        GLU  32 -11.872  -1.661  -2.275
  256    HA   GLU  32           HA       GLU  32 -14.105  -1.562  -4.156
  257    HB2  GLU  32           HB2      GLU  32 -15.533  -2.149  -2.287
  258    HB3  GLU  32           HB3      GLU  32 -14.142  -3.212  -2.460
  259    HG2  GLU  32           HG2      GLU  32 -12.992  -1.907  -0.644
  260    HG3  GLU  32           HG3      GLU  32 -14.474  -0.980  -0.409
  261    H    LYS  33           H        LYS  33 -12.550   0.972  -2.664
  262    HA   LYS  33           HA       LYS  33 -14.903   2.773  -3.152
  263    HB2  LYS  33           HB2      LYS  33 -12.288   3.295  -1.688
  264    HB3  LYS  33           HB3      LYS  33 -13.557   4.493  -1.990
  265    HG2  LYS  33           HG2      LYS  33 -15.194   3.054  -0.759
  266    HG3  LYS  33           HG3      LYS  33 -13.897   1.921  -0.367
  267    HD2  LYS  33           HD2      LYS  33 -12.669   3.721   0.829
  268    HD3  LYS  33           HD3      LYS  33 -13.986   4.851   0.441
  269    HE2  LYS  33           HE2      LYS  33 -15.584   3.328   1.654
  270    HE3  LYS  33           HE3      LYS  33 -14.212   2.316   2.130
  271    HZ1  LYS  33           HZ1      LYS  33 -13.285   4.227   3.310
  272    HZ2  LYS  33           HZ2      LYS  33 -14.816   3.956   3.844
  273    HZ3  LYS  33           HZ3      LYS  33 -14.533   5.187   2.821
  274    H    GLY  34           H        GLY  34 -11.519   2.262  -4.226
  275    HA2  GLY  34           HA2      GLY  34 -10.664   2.522  -6.318
  276    HA3  GLY  34           HA3      GLY  34 -12.314   2.737  -6.891
  277    H    GLY  35           H        GLY  35 -10.803   5.070  -4.647
  278    HA2  GLY  35           HA2      GLY  35 -10.146   6.920  -6.906
  279    HA3  GLY  35           HA3      GLY  35 -11.170   7.455  -5.570
  280    H    SER  36           H        SER  36  -8.456   5.279  -4.972
  281    HA   SER  36           HA       SER  36  -7.048   7.485  -3.517
  282    HB2  SER  36           HB2      SER  36  -8.619   6.057  -2.108
  283    HB3  SER  36           HB3      SER  36  -7.495   4.713  -2.387
  284    HG   SER  36           HG       SER  36  -6.953   5.768  -0.487
  285    H    LEU  37           H        LEU  37  -4.927   7.217  -2.996
  286    HA   LEU  37           HA       LEU  37  -2.802   7.007  -3.404
  287    HB2  LEU  37           HB2      LEU  37  -3.620   4.124  -3.661
  288    HB3  LEU  37           HB3      LEU  37  -1.981   4.572  -4.028
  289    HG   LEU  37           HG       LEU  37  -2.232   3.714  -1.769
  290   HD11  LEU  37          HD11      LEU  37  -1.377   6.631  -1.757
  291   HD12  LEU  37          HD12      LEU  37  -0.377   5.237  -2.255
  292   HD13  LEU  37          HD13      LEU  37  -0.928   5.380  -0.583
  293   HD21  LEU  37          HD21      LEU  37  -4.487   4.629  -1.242
  294   HD22  LEU  37          HD22      LEU  37  -3.764   6.245  -1.075
  295   HD23  LEU  37          HD23      LEU  37  -3.283   4.939   0.022
  296    HA   PRO  38           HA       PRO  38  -1.601   7.716  -7.601
  297    HB2  PRO  38           HB2      PRO  38   1.004   6.374  -6.869
  298    HB3  PRO  38           HB3      PRO  38   0.740   7.945  -7.694
  299    HG2  PRO  38           HG2      PRO  38   1.408   7.918  -5.082
  300    HG3  PRO  38           HG3      PRO  38   0.088   8.995  -5.641
  301    HD2  PRO  38           HD2      PRO  38  -0.146   6.259  -4.360
  302    HD3  PRO  38           HD3      PRO  38  -0.999   7.783  -3.957
  303    H    LYS  39           H        LYS  39  -0.959   6.662  -9.636
  304    HA   LYS  39           HA       LYS  39  -2.043   3.945  -9.863
  305    HB2  LYS  39           HB2      LYS  39  -2.637   5.592 -11.495
  306    HB3  LYS  39           HB3      LYS  39  -0.950   5.955 -11.868
  307    HG2  LYS  39           HG2      LYS  39  -0.624   3.849 -12.964
  308    HG3  LYS  39           HG3      LYS  39  -2.165   3.208 -12.367
  309    HD2  LYS  39           HD2      LYS  39  -3.436   4.671 -13.770
  310    HD3  LYS  39           HD3      LYS  39  -2.011   5.632 -14.212
  311    HE2  LYS  39           HE2      LYS  39  -1.069   3.812 -15.470
  312    HE3  LYS  39           HE3      LYS  39  -2.277   2.670 -14.861
  313    HZ1  LYS  39           HZ1      LYS  39  -3.925   3.621 -16.175
  314    HZ2  LYS  39           HZ2      LYS  39  -2.634   3.654 -17.188
  315    HZ3  LYS  39           HZ3      LYS  39  -3.137   5.026 -16.418
  316    H    VAL  40           H        VAL  40   1.208   5.323  -9.978
  317    HA   VAL  40           HA       VAL  40   2.321   2.686 -10.789
  318    HB   VAL  40           HB       VAL  40   2.706   4.570 -12.264
  319   HG11  VAL  40          HG11      VAL  40   4.248   6.359 -11.720
  320   HG12  VAL  40          HG12      VAL  40   2.900   6.382 -10.581
  321   HG13  VAL  40          HG13      VAL  40   4.480   5.729 -10.079
  322   HG21  VAL  40          HG21      VAL  40   5.054   4.212 -12.693
  323   HG22  VAL  40          HG22      VAL  40   5.317   3.571 -11.067
  324   HG23  VAL  40          HG23      VAL  40   4.302   2.680 -12.227
  325    H    GLU  41           H        GLU  41   3.923   1.654  -9.809
  326    HA   GLU  41           HA       GLU  41   3.923   1.540  -7.086
  327    HB2  GLU  41           HB2      GLU  41   5.926   0.080  -7.278
  328    HB3  GLU  41           HB3      GLU  41   4.543  -0.311  -8.272
  329    HG2  GLU  41           HG2      GLU  41   6.381  -0.781  -9.613
  330    HG3  GLU  41           HG3      GLU  41   5.696   0.691 -10.268
  331    H    ALA  42           H        ALA  42   6.455   3.403  -8.854
  332    HA   ALA  42           HA       ALA  42   7.975   3.955  -6.525
  333    HB1  ALA  42           HB1      ALA  42   8.841   4.136  -8.771
  334    HB2  ALA  42           HB2      ALA  42   7.695   5.442  -9.175
  335    HB3  ALA  42           HB3      ALA  42   8.991   5.712  -7.999
  336    H    LYS  43           H        LYS  43   5.377   5.926  -8.002
  337    HA   LYS  43           HA       LYS  43   5.454   8.073  -6.037
  338    HB2  LYS  43           HB2      LYS  43   3.199   7.079  -7.846
  339    HB3  LYS  43           HB3      LYS  43   3.137   8.548  -6.853
  340    HG2  LYS  43           HG2      LYS  43   5.059   9.475  -8.085
  341    HG3  LYS  43           HG3      LYS  43   5.091   8.023  -9.111
  342    HD2  LYS  43           HD2      LYS  43   2.734   8.519  -9.824
  343    HD3  LYS  43           HD3      LYS  43   2.778  10.012  -8.873
  344    HE2  LYS  43           HE2      LYS  43   4.580  10.904 -10.242
  345    HE3  LYS  43           HE3      LYS  43   4.765   9.363 -11.094
  346    HZ1  LYS  43           HZ1      LYS  43   2.286  11.006 -11.201
  347    HZ2  LYS  43           HZ2      LYS  43   2.623   9.654 -12.092
  348    HZ3  LYS  43           HZ3      LYS  43   3.447  11.053 -12.328
  349    H    PHE  44           H        PHE  44   3.648   5.029  -6.327
  350    HA   PHE  44           HA       PHE  44   1.973   5.351  -4.086
  351    HB2  PHE  44           HB2      PHE  44   1.642   3.714  -5.888
  352    HB3  PHE  44           HB3      PHE  44   3.096   2.858  -5.421
  353    HD1  PHE  44           HD1      PHE  44   3.191   1.633  -3.188
  354    HD2  PHE  44           HD2      PHE  44  -0.451   3.139  -4.936
  355    HE1  PHE  44           HE1      PHE  44   1.875   0.076  -1.784
  356    HE2  PHE  44           HE2      PHE  44  -1.767   1.598  -3.507
  357    HZ   PHE  44           HZ       PHE  44  -0.603   0.063  -1.927
  358    H    ILE  45           H        ILE  45   5.184   3.688  -4.283
  359    HA   ILE  45           HA       ILE  45   5.397   3.092  -1.496
  360    HB   ILE  45           HB       ILE  45   7.427   3.386  -3.725
  361   HG12  ILE  45          HG12      ILE  45   6.431   0.981  -2.107
  362   HG13  ILE  45          HG13      ILE  45   5.748   1.471  -3.652
  363   HG21  ILE  45          HG21      ILE  45   7.985   2.536  -0.840
  364   HG22  ILE  45          HG22      ILE  45   9.120   2.383  -2.200
  365   HG23  ILE  45          HG23      ILE  45   8.642   3.976  -1.662
  366   HD11  ILE  45          HD11      ILE  45   7.243  -0.348  -4.033
  367   HD12  ILE  45          HD12      ILE  45   7.957   1.112  -4.745
  368   HD13  ILE  45          HD13      ILE  45   8.578   0.461  -3.204
  369    H    ASN  46           H        ASN  46   6.479   6.052  -3.286
  370    HA   ASN  46           HA       ASN  46   7.516   7.420  -1.016
  371    HB2  ASN  46           HB2      ASN  46   7.980   8.746  -2.739
  372    HB3  ASN  46           HB3      ASN  46   6.720   8.071  -3.753
  373   HD21  ASN  46          HD21      ASN  46   4.563   9.044  -3.684
  374   HD22  ASN  46          HD22      ASN  46   4.453  10.738  -3.186
  375    H    TYR  47           H        TYR  47   4.099   7.266  -2.128
  376    HA   TYR  47           HA       TYR  47   3.228   9.056  -0.051
  377    HB2  TYR  47           HB2      TYR  47   2.172   8.529  -2.380
  378    HB3  TYR  47           HB3      TYR  47   1.346   7.229  -1.534
  379    HD1  TYR  47           HD2      TYR  47  -0.229   7.829   0.395
  380    HD2  TYR  47           HD1      TYR  47   1.621  10.845  -2.077
  381    HE1  TYR  47           HE2      TYR  47  -1.822   9.521   1.269
  382    HE2  TYR  47           HE1      TYR  47   0.002  12.538  -1.209
  383    HH   TYR  47           HH       TYR  47  -2.490  11.706   1.232
  384    H    VAL  48           H        VAL  48   3.259   5.480  -0.299
  385    HA   VAL  48           HA       VAL  48   1.924   5.040   2.232
  386    HB   VAL  48           HB       VAL  48   3.694   3.253   0.533
  387   HG11  VAL  48          HG11      VAL  48   2.128   2.555   3.061
  388   HG12  VAL  48          HG12      VAL  48   2.790   1.366   1.914
  389   HG13  VAL  48          HG13      VAL  48   3.882   2.409   2.824
  390   HG21  VAL  48          HG21      VAL  48   1.465   3.838  -0.424
  391   HG22  VAL  48          HG22      VAL  48   1.539   2.137   0.036
  392   HG23  VAL  48          HG23      VAL  48   0.683   3.296   1.072
  393    H    LYS  49           H        LYS  49   5.424   5.351   1.394
  394    HA   LYS  49           HA       LYS  49   6.288   5.010   4.158
  395    HB2  LYS  49           HB2      LYS  49   7.639   6.223   1.711
  396    HB3  LYS  49           HB3      LYS  49   8.404   6.123   3.302
  397    HG2  LYS  49           HG2      LYS  49   8.163   3.674   3.328
  398    HG3  LYS  49           HG3      LYS  49   7.333   3.712   1.774
  399    HD2  LYS  49           HD2      LYS  49   9.608   3.025   1.427
  400    HD3  LYS  49           HD3      LYS  49   9.365   4.615   0.690
  401    HE2  LYS  49           HE2      LYS  49  10.462   5.691   2.638
  402    HE3  LYS  49           HE3      LYS  49  10.693   4.112   3.404
  403    HZ1  LYS  49           HZ1      LYS  49  12.163   3.488   1.584
  404    HZ2  LYS  49           HZ2      LYS  49  12.670   4.980   2.086
  405    HZ3  LYS  49           HZ3      LYS  49  11.794   4.797   0.727
  406    H    ASN  50           H        ASN  50   4.855   7.708   2.499
  407    HA   ASN  50           HA       ASN  50   5.287   9.526   4.767
  408    HB2  ASN  50           HB2      ASN  50   4.717  10.881   3.087
  409    HB3  ASN  50           HB3      ASN  50   3.890   9.644   2.175
  410   HD21  ASN  50          HD21      ASN  50   1.641   9.408   2.387
  411   HD22  ASN  50          HD22      ASN  50   0.678  10.608   3.252
  412    H    CYS  51           H        CYS  51   2.438   7.537   3.716
  413    HA   CYS  51           HA       CYS  51   0.842   8.183   5.890
  414    HB2  CYS  51           HB2      CYS  51   0.873   5.663   4.173
  415    HB3  CYS  51           HB3      CYS  51  -0.433   6.090   5.292
  416    HG   CYS  51           HG       CYS  51  -0.900   8.481   4.245
  417    H    PHE  52           H        PHE  52   3.334   5.631   5.905
  418    HA   PHE  52           HA       PHE  52   3.114   5.658   8.797
  419    HB2  PHE  52           HB2      PHE  52   1.454   3.859   7.990
  420    HB3  PHE  52           HB3      PHE  52   2.856   2.948   7.456
  421    HD1  PHE  52           HD1      PHE  52   1.628   4.816  10.519
  422    HD2  PHE  52           HD2      PHE  52   3.653   1.326   8.990
  423    HE1  PHE  52           HE1      PHE  52   1.818   3.914  12.824
  424    HE2  PHE  52           HE2      PHE  52   3.828   0.424  11.288
  425    HZ   PHE  52           HZ       PHE  52   2.896   1.700  13.211
  426    H    ARG  53           H        ARG  53   4.788   4.343   9.848
  427    HA   ARG  53           HA       ARG  53   7.403   4.936   8.723
  428    HB2  ARG  53           HB2      ARG  53   6.411   3.767  11.339
  429    HB3  ARG  53           HB3      ARG  53   8.132   3.962  10.968
  430    HG2  ARG  53           HG2      ARG  53   7.760   6.409  10.542
  431    HG3  ARG  53           HG3      ARG  53   6.069   6.215  11.013
  432    HD2  ARG  53           HD2      ARG  53   7.311   7.132  12.856
  433    HD3  ARG  53           HD3      ARG  53   6.781   5.498  13.282
  434    HE   ARG  53           HE       ARG  53   9.332   5.123  12.252
  435   HH11  ARG  53          HH11      ARG  53   8.136   7.163  14.898
  436   HH12  ARG  53          HH12      ARG  53   9.661   6.949  15.759
  437   HH21  ARG  53          HH21      ARG  53  11.138   4.931  13.493
  438   HH22  ARG  53          HH22      ARG  53  11.221   5.823  15.030
  439    H    MET  54           H        MET  54   6.899   3.526   6.868
  440    HA   MET  54           HA       MET  54   7.704   0.693   7.269
  441    HB2  MET  54           HB2      MET  54   6.674   2.119   4.791
  442    HB3  MET  54           HB3      MET  54   7.076   0.406   4.900
  443    HG2  MET  54           HG2      MET  54   4.858   1.878   6.355
  444    HG3  MET  54           HG3      MET  54   4.684   0.682   5.081
  445    HE1  MET  54           HE1      MET  54   5.253  -1.973   5.433
  446    HE2  MET  54           HE2      MET  54   6.854  -1.615   6.129
  447    HE3  MET  54           HE3      MET  54   5.721  -2.657   7.006
  448    H    THR  55           H        THR  55   9.628  -0.058   6.799
  449    HA   THR  55           HA       THR  55  11.232   1.096   4.603
  450    HB   THR  55           HB       THR  55  12.012   2.170   6.730
  451    HG1  THR  55           HG1      THR  55  14.123   1.983   6.150
  452   HG21  THR  55          HG21      THR  55  13.205  -0.573   7.284
  453   HG22  THR  55          HG22      THR  55  11.882   0.174   8.211
  454   HG23  THR  55          HG23      THR  55  13.490   0.923   8.197
  455    H    ASP  56           H        ASP  56   9.981  -1.628   6.203
  456    HA   ASP  56           HA       ASP  56  11.961  -3.574   5.321
  457    HB2  ASP  56           HB2      ASP  56   9.108  -3.879   6.301
  458    HB3  ASP  56           HB3      ASP  56  10.218  -5.213   6.017
  459    H    GLN  57           H        GLN  57  12.291  -3.867   3.200
  460    HA   GLN  57           HA       GLN  57  10.290  -3.582   1.173
  461    HB2  GLN  57           HB2      GLN  57  12.734  -3.351   0.804
  462    HB3  GLN  57           HB3      GLN  57  12.918  -5.092   1.035
  463    HG2  GLN  57           HG2      GLN  57  12.870  -4.456  -1.362
  464    HG3  GLN  57           HG3      GLN  57  11.560  -5.547  -0.946
  465   HE21  GLN  57          HE21      GLN  57  10.206  -4.896  -2.681
  466   HE22  GLN  57          HE22      GLN  57   9.424  -3.321  -2.701
  467    H    GLU  58           H        GLU  58  11.105  -6.267   3.272
  468    HA   GLU  58           HA       GLU  58   9.729  -8.395   1.929
  469    HB2  GLU  58           HB2      GLU  58  11.203  -8.776   3.836
  470    HB3  GLU  58           HB3      GLU  58  10.193  -7.749   4.858
  471    HG2  GLU  58           HG2      GLU  58   9.771 -10.043   5.406
  472    HG3  GLU  58           HG3      GLU  58   8.337  -9.327   4.726
  473    H    ALA  59           H        ALA  59   8.511  -5.945   4.308
  474    HA   ALA  59           HA       ALA  59   5.790  -6.993   4.216
  475    HB1  ALA  59           HB1      ALA  59   6.871  -4.382   5.293
  476    HB2  ALA  59           HB2      ALA  59   5.241  -5.065   5.548
  477    HB3  ALA  59           HB3      ALA  59   6.675  -5.915   6.191
  478    H    ILE  60           H        ILE  60   7.581  -4.421   2.500
  479    HA   ILE  60           HA       ILE  60   5.354  -3.306   1.059
  480    HB   ILE  60           HB       ILE  60   8.304  -3.476   0.477
  481   HG12  ILE  60          HG12      ILE  60   6.528  -1.126   1.274
  482   HG13  ILE  60          HG13      ILE  60   7.468  -2.087   2.412
  483   HG21  ILE  60          HG21      ILE  60   7.938  -1.790  -1.332
  484   HG22  ILE  60          HG22      ILE  60   7.167  -3.310  -1.713
  485   HG23  ILE  60          HG23      ILE  60   6.179  -1.956  -1.118
  486   HD11  ILE  60          HD11      ILE  60   9.557  -1.462   1.182
  487   HD12  ILE  60          HD12      ILE  60   8.589  -0.323   0.210
  488   HD13  ILE  60          HD13      ILE  60   8.716  -0.105   1.963
  489    H    GLN  61           H        GLN  61   7.590  -6.010   0.060
  490    HA   GLN  61           HA       GLN  61   5.943  -6.513  -2.249
  491    HB2  GLN  61           HB2      GLN  61   7.297  -8.403  -2.729
  492    HB3  GLN  61           HB3      GLN  61   8.279  -7.026  -2.263
  493    HG2  GLN  61           HG2      GLN  61   9.353  -8.761  -1.181
  494    HG3  GLN  61           HG3      GLN  61   8.376  -8.068   0.080
  495   HE21  GLN  61          HE21      GLN  61   7.394  -9.615   1.348
  496   HE22  GLN  61          HE22      GLN  61   6.943 -11.219   0.807
  497    H    ASP  62           H        ASP  62   5.732  -7.861   1.060
  498    HA   ASP  62           HA       ASP  62   3.776  -9.861   0.367
  499    HB2  ASP  62           HB2      ASP  62   5.129  -9.738   2.502
  500    HB3  ASP  62           HB3      ASP  62   4.110  -8.397   3.018
  501    H    LEU  63           H        LEU  63   3.520  -6.420   1.211
  502    HA   LEU  63           HA       LEU  63   0.671  -6.266   1.247
  503    HB2  LEU  63           HB2      LEU  63   2.158  -4.700   2.321
  504    HB3  LEU  63           HB3      LEU  63   2.816  -4.170   0.788
  505    HG   LEU  63           HG       LEU  63   1.207  -2.645   1.954
  506   HD11  LEU  63          HD11      LEU  63   0.164  -1.800  -0.028
  507   HD12  LEU  63          HD12      LEU  63   0.259  -3.365  -0.849
  508   HD13  LEU  63          HD13      LEU  63   1.741  -2.453  -0.496
  509   HD21  LEU  63          HD21      LEU  63  -0.465  -4.241   2.693
  510   HD22  LEU  63          HD22      LEU  63  -0.926  -4.595   0.998
  511   HD23  LEU  63          HD23      LEU  63  -1.204  -2.991   1.687
  512    H    TRP  64           H        TRP  64   3.088  -5.613  -1.381
  513    HA   TRP  64           HA       TRP  64   1.232  -5.201  -3.492
  514    HB2  TRP  64           HB2      TRP  64   4.003  -6.439  -3.508
  515    HB3  TRP  64           HB3      TRP  64   3.061  -6.183  -4.958
  516    HD1  TRP  64           HD1      TRP  64   5.803  -4.664  -3.383
  517    HE1  TRP  64           HE1      TRP  64   6.124  -2.247  -4.070
  518    HE3  TRP  64           HE3      TRP  64   1.140  -3.771  -5.317
  519    HZ2  TRP  64           HZ2      TRP  64   4.498  -0.093  -5.141
  520    HZ3  TRP  64           HZ3      TRP  64   0.558  -1.511  -6.164
  521    HH2  TRP  64           HH2      TRP  64   2.204   0.329  -6.067
  522    H    GLN  65           H        GLN  65   2.522  -8.368  -2.259
  523    HA   GLN  65           HA       GLN  65   1.070  -9.907  -4.192
  524    HB2  GLN  65           HB2      GLN  65   1.905 -10.784  -1.406
  525    HB3  GLN  65           HB3      GLN  65   1.352 -11.814  -2.713
  526    HG2  GLN  65           HG2      GLN  65   4.031 -10.702  -2.220
  527    HG3  GLN  65           HG3      GLN  65   3.553 -12.186  -2.978
  528   HE21  GLN  65          HE21      GLN  65   4.517  -8.903  -3.515
  529   HE22  GLN  65          HE22      GLN  65   4.543  -8.959  -5.278
  530    H    TRP  66           H        TRP  66   0.045  -8.602  -1.028
  531    HA   TRP  66           HA       TRP  66  -2.543  -9.901  -1.117
  532    HB2  TRP  66           HB2      TRP  66  -1.212  -8.835   0.883
  533    HB3  TRP  66           HB3      TRP  66  -2.066  -7.368   0.426
  534    HD1  TRP  66           HD1      TRP  66  -4.331  -7.133   1.661
  535    HE1  TRP  66           HE1      TRP  66  -6.014  -8.700   2.853
  536    HE3  TRP  66           HE3      TRP  66  -2.103 -11.636   0.673
  537    HZ2  TRP  66           HZ2      TRP  66  -6.236 -11.479   3.450
  538    HZ3  TRP  66           HZ3      TRP  66  -3.068 -13.736   1.584
  539    HH2  TRP  66           HH2      TRP  66  -5.125 -13.675   2.974
  540    H    ARG  67           H        ARG  67  -1.312  -7.055  -2.740
  541    HA   ARG  67           HA       ARG  67  -4.014  -6.277  -3.684
  542    HB2  ARG  67           HB2      ARG  67  -1.604  -4.919  -3.500
  543    HB3  ARG  67           HB3      ARG  67  -1.650  -5.293  -5.212
  544    HG2  ARG  67           HG2      ARG  67  -4.015  -4.005  -3.764
  545    HG3  ARG  67           HG3      ARG  67  -2.634  -3.070  -4.294
  546    HD2  ARG  67           HD2      ARG  67  -4.338  -2.796  -5.903
  547    HD3  ARG  67           HD3      ARG  67  -3.017  -3.698  -6.637
  548    HE   ARG  67           HE       ARG  67  -4.474  -5.777  -6.193
  549   HH11  ARG  67          HH11      ARG  67  -5.985  -2.673  -7.019
  550   HH12  ARG  67          HH12      ARG  67  -7.233  -3.478  -7.913
  551   HH21  ARG  67          HH21      ARG  67  -6.090  -6.678  -7.312
  552   HH22  ARG  67          HH22      ARG  67  -7.258  -5.674  -8.108
  553    H    LYS  68           H        LYS  68  -1.210  -8.079  -4.943
  554    HA   LYS  68           HA       LYS  68  -2.585  -8.979  -7.337
  555    HB2  LYS  68           HB2      LYS  68  -0.095  -8.572  -7.030
  556    HB3  LYS  68           HB3      LYS  68  -0.034 -10.044  -6.074
  557    HG2  LYS  68           HG2      LYS  68   0.787 -10.382  -8.333
  558    HG3  LYS  68           HG3      LYS  68  -0.615 -11.392  -8.040
  559    HD2  LYS  68           HD2      LYS  68  -2.033  -9.754  -9.305
  560    HD3  LYS  68           HD3      LYS  68  -0.575  -8.776  -9.606
  561    HE2  LYS  68           HE2      LYS  68   0.458 -10.814 -10.702
  562    HE3  LYS  68           HE3      LYS  68  -1.073 -11.666 -10.463
  563    HZ1  LYS  68           HZ1      LYS  68  -2.140  -9.908 -11.816
  564    HZ2  LYS  68           HZ2      LYS  68  -1.008 -10.742 -12.677
  565    HZ3  LYS  68           HZ3      LYS  68  -0.673  -9.233 -12.106
  566    H    SER  69           H        SER  69  -3.880  -9.532  -4.766
  567    HA   SER  69           HA       SER  69  -4.387 -12.465  -5.077
  568    HB2  SER  69           HB2      SER  69  -4.474 -10.786  -2.549
  569    HB3  SER  69           HB3      SER  69  -5.084 -12.440  -2.685
  570    HG   SER  69           HG       SER  69  -2.405 -11.584  -3.133
  571    H    LEU  70           H        LEU  70  -5.693  -9.547  -5.842
  572    HA   LEU  70           HA       LEU  70  -8.230 -10.723  -6.463
  573    HB2  LEU  70           HB2      LEU  70  -9.723  -9.271  -5.361
  574    HB3  LEU  70           HB3      LEU  70  -8.686  -9.939  -4.121
  575    HG   LEU  70           HG       LEU  70  -8.506  -7.115  -5.268
  576   HD11  LEU  70          HD11      LEU  70  -9.398  -6.458  -3.072
  577   HD12  LEU  70          HD12      LEU  70  -9.484  -8.159  -2.576
  578   HD13  LEU  70          HD13      LEU  70 -10.516  -7.553  -3.893
  579   HD21  LEU  70          HD21      LEU  70  -6.937  -8.554  -3.109
  580   HD22  LEU  70          HD22      LEU  70  -7.043  -6.791  -3.172
  581   HD23  LEU  70          HD23      LEU  70  -6.314  -7.672  -4.520
  Start of MODEL   18
    1    H    GLN   1           H1       GLN   1 -45.424   7.052  30.881
    2    HA   GLN   1           HA       GLN   1 -44.988   8.261  28.236
    3    HB2  GLN   1           HB2      GLN   1 -46.340   9.691  29.735
    4    HB3  GLN   1           HB3      GLN   1 -45.103   9.580  30.970
    5    HG2  GLN   1           HG2      GLN   1 -44.857  11.688  29.958
    6    HG3  GLN   1           HG3      GLN   1 -43.499  10.743  29.391
    7   HE21  GLN   1          HE21      GLN   1 -44.210  13.076  28.059
    8   HE22  GLN   1          HE22      GLN   1 -44.879  12.657  26.498
    9    H    GLU   2           H        GLU   2 -43.401   7.906  31.488
   10    HA   GLU   2           HA       GLU   2 -40.868   8.624  30.151
   11    HB2  GLU   2           HB2      GLU   2 -41.593   8.719  33.088
   12    HB3  GLU   2           HB3      GLU   2 -40.131   9.362  32.326
   13    HG2  GLU   2           HG2      GLU   2 -41.617  10.864  30.923
   14    HG3  GLU   2           HG3      GLU   2 -42.986  10.341  31.912
   15    H    SER   3           H        SER   3 -41.868   5.695  30.234
   16    HA   SER   3           HA       SER   3 -39.856   4.376  31.897
   17    HB2  SER   3           HB2      SER   3 -40.637   2.311  31.004
   18    HB3  SER   3           HB3      SER   3 -42.020   3.324  31.452
   19    HG   SER   3           HG       SER   3 -42.062   2.174  29.364
   20    H    PHE   4           H        PHE   4 -40.139   4.975  28.392
   21    HA   PHE   4           HA       PHE   4 -38.729   4.880  26.660
   22    HB2  PHE   4           HB2      PHE   4 -36.823   5.733  28.837
   23    HB3  PHE   4           HB3      PHE   4 -36.388   5.757  27.148
   24    HD1  PHE   4           HD1      PHE   4 -38.218   6.922  25.528
   25    HD2  PHE   4           HD2      PHE   4 -37.681   7.746  29.728
   26    HE1  PHE   4           HE1      PHE   4 -39.333   9.119  25.237
   27    HE2  PHE   4           HE2      PHE   4 -38.787   9.947  29.427
   28    HZ   PHE   4           HZ       PHE   4 -39.614  10.636  27.190
   29    H    LYS   5           H        LYS   5 -36.466   4.128  25.807
   30    HA   LYS   5           HA       LYS   5 -36.119   1.208  26.427
   31    HB2  LYS   5           HB2      LYS   5 -37.167   2.523  23.932
   32    HB3  LYS   5           HB3      LYS   5 -36.040   1.191  23.712
   33    HG2  LYS   5           HG2      LYS   5 -37.439  -0.294  25.092
   34    HG3  LYS   5           HG3      LYS   5 -38.555   1.030  25.419
   35    HD2  LYS   5           HD2      LYS   5 -39.486  -0.435  23.731
   36    HD3  LYS   5           HD3      LYS   5 -39.176   1.159  23.061
   37    HE2  LYS   5           HE2      LYS   5 -38.602  -0.501  21.417
   38    HE3  LYS   5           HE3      LYS   5 -37.125   0.308  21.951
   39    HZ1  LYS   5           HZ1      LYS   5 -36.910  -2.143  21.808
   40    HZ2  LYS   5           HZ2      LYS   5 -38.024  -2.348  22.972
   41    HZ3  LYS   5           HZ3      LYS   5 -36.592  -1.580  23.292
   42    H    LYS   6           H        LYS   6 -34.685   4.099  24.936
   43    HA   LYS   6           HA       LYS   6 -32.197   2.877  24.151
   44    HB2  LYS   6           HB2      LYS   6 -33.197   5.137  23.401
   45    HB3  LYS   6           HB3      LYS   6 -32.584   5.794  24.926
   46    HG2  LYS   6           HG2      LYS   6 -30.281   4.883  24.212
   47    HG3  LYS   6           HG3      LYS   6 -30.994   4.536  22.641
   48    HD2  LYS   6           HD2      LYS   6 -30.741   7.281  23.951
   49    HD3  LYS   6           HD3      LYS   6 -29.716   6.637  22.667
   50    HE2  LYS   6           HE2      LYS   6 -31.752   6.502  21.171
   51    HE3  LYS   6           HE3      LYS   6 -32.674   7.306  22.449
   52    HZ1  LYS   6           HZ1      LYS   6 -30.986   9.153  22.299
   53    HZ2  LYS   6           HZ2      LYS   6 -31.927   8.990  20.966
   54    HZ3  LYS   6           HZ3      LYS   6 -30.376   8.454  20.955
   55    H    GLN   7           H        GLN   7 -30.307   2.530  25.264
   56    HA   GLN   7           HA       GLN   7 -30.022   3.538  28.045
   57    HB2  GLN   7           HB2      GLN   7 -31.280   1.319  28.035
   58    HB3  GLN   7           HB3      GLN   7 -29.845   0.581  27.328
   59    HG2  GLN   7           HG2      GLN   7 -29.799   0.124  29.660
   60    HG3  GLN   7           HG3      GLN   7 -28.548   1.321  29.392
   61   HE21  GLN   7          HE21      GLN   7 -31.407   0.568  31.195
   62   HE22  GLN   7          HE22      GLN   7 -31.498   2.118  32.018
   63    H    GLU   8           H        GLU   8 -28.445   1.872  25.260
   64    HA   GLU   8           HA       GLU   8 -25.885   1.805  26.605
   65    HB2  GLU   8           HB2      GLU   8 -26.584   1.356  23.681
   66    HB3  GLU   8           HB3      GLU   8 -25.036   0.975  24.453
   67    HG2  GLU   8           HG2      GLU   8 -26.266  -0.556  26.036
   68    HG3  GLU   8           HG3      GLU   8 -27.735  -0.291  25.090
   69    H    LYS   9           H        LYS   9 -27.051   3.868  23.919
   70    HA   LYS   9           HA       LYS   9 -26.380   5.902  23.140
   71    HB2  LYS   9           HB2      LYS   9 -25.660   6.428  26.028
   72    HB3  LYS   9           HB3      LYS   9 -26.243   7.594  24.831
   73    HG2  LYS   9           HG2      LYS   9 -28.425   6.271  24.792
   74    HG3  LYS   9           HG3      LYS   9 -27.819   5.381  26.186
   75    HD2  LYS   9           HD2      LYS   9 -28.444   8.339  26.022
   76    HD3  LYS   9           HD3      LYS   9 -29.258   7.117  26.998
   77    HE2  LYS   9           HE2      LYS   9 -27.215   6.834  28.375
   78    HE3  LYS   9           HE3      LYS   9 -26.356   7.994  27.350
   79    HZ1  LYS   9           HZ1      LYS   9 -27.114   9.166  29.243
   80    HZ2  LYS   9           HZ2      LYS   9 -28.655   8.589  29.119
   81    HZ3  LYS   9           HZ3      LYS   9 -28.077   9.649  28.009
   82    H    THR  10           H        THR  10 -24.011   3.956  23.231
   83    HA   THR  10           HA       THR  10 -21.752   5.908  23.109
   84    HB   THR  10           HB       THR  10 -20.394   4.227  24.470
   85    HG1  THR  10           HG1      THR  10 -22.995   3.538  25.380
   86   HG21  THR  10          HG21      THR  10 -21.152   6.424  25.367
   87   HG22  THR  10          HG22      THR  10 -21.031   5.152  26.595
   88   HG23  THR  10          HG23      THR  10 -22.624   5.639  25.986
   89    HA   PRO  11           HA       PRO  11 -21.584   2.640  19.817
   90    HB2  PRO  11           HB2      PRO  11 -21.887   4.086  17.574
   91    HB3  PRO  11           HB3      PRO  11 -23.282   3.674  18.623
   92    HG2  PRO  11           HG2      PRO  11 -21.723   6.276  18.526
   93    HG3  PRO  11           HG3      PRO  11 -23.494   6.039  18.576
   94    HD2  PRO  11           HD2      PRO  11 -21.895   6.569  20.789
   95    HD3  PRO  11           HD3      PRO  11 -23.453   5.710  20.874
   96    H    LYS  12           H        LYS  12 -20.030   2.218  18.094
   97    HA   LYS  12           HA       LYS  12 -17.400   3.616  18.503
   98    HB2  LYS  12           HB2      LYS  12 -17.944   0.619  18.607
   99    HB3  LYS  12           HB3      LYS  12 -16.395   1.401  18.844
  100    HG2  LYS  12           HG2      LYS  12 -18.812   1.612  20.687
  101    HG3  LYS  12           HG3      LYS  12 -17.389   0.619  20.954
  102    HD2  LYS  12           HD2      LYS  12 -15.966   2.555  21.265
  103    HD3  LYS  12           HD3      LYS  12 -17.256   3.658  20.752
  104    HE2  LYS  12           HE2      LYS  12 -18.673   2.828  22.634
  105    HE3  LYS  12           HE3      LYS  12 -17.289   1.883  23.228
  106    HZ1  LYS  12           HZ1      LYS  12 -17.348   3.996  24.377
  107    HZ2  LYS  12           HZ2      LYS  12 -17.491   4.829  22.985
  108    HZ3  LYS  12           HZ3      LYS  12 -16.067   4.061  23.343
  109    H    THR  13           H        THR  13 -15.785   3.263  16.972
  110    HA   THR  13           HA       THR  13 -16.468   1.809  14.462
  111    HB   THR  13           HB       THR  13 -14.919   4.384  14.213
  112    HG1  THR  13           HG1      THR  13 -16.875   5.329  13.502
  113   HG21  THR  13          HG21      THR  13 -15.612   4.224  11.932
  114   HG22  THR  13          HG22      THR  13 -16.894   3.059  12.320
  115   HG23  THR  13          HG23      THR  13 -15.201   2.560  12.378
  116    HA   PRO  14           HA       PRO  14 -12.431   0.850  16.514
  117    HB2  PRO  14           HB2      PRO  14 -12.617  -1.818  16.879
  118    HB3  PRO  14           HB3      PRO  14 -13.474  -0.651  17.933
  119    HG2  PRO  14           HG2      PRO  14 -14.583  -2.211  15.568
  120    HG3  PRO  14           HG3      PRO  14 -15.304  -2.003  17.187
  121    HD2  PRO  14           HD2      PRO  14 -16.011  -0.448  15.044
  122    HD3  PRO  14           HD3      PRO  14 -15.979   0.187  16.717
  123    H    LYS  15           H        LYS  15 -10.755   0.988  15.091
  124    HA   LYS  15           HA       LYS  15 -10.279  -1.137  13.076
  125    HB2  LYS  15           HB2      LYS  15 -10.300   0.442  11.192
  126    HB3  LYS  15           HB3      LYS  15 -11.859   0.293  11.971
  127    HG2  LYS  15           HG2      LYS  15 -10.846   2.492  13.324
  128    HG3  LYS  15           HG3      LYS  15 -10.028   2.650  11.771
  129    HD2  LYS  15           HD2      LYS  15 -12.306   2.435  10.648
  130    HD3  LYS  15           HD3      LYS  15 -13.000   2.294  12.269
  131    HE2  LYS  15           HE2      LYS  15 -13.350   4.559  11.705
  132    HE3  LYS  15           HE3      LYS  15 -11.961   4.581  12.792
  133    HZ1  LYS  15           HZ1      LYS  15 -11.564   5.980  10.889
  134    HZ2  LYS  15           HZ2      LYS  15 -11.885   4.764   9.826
  135    HZ3  LYS  15           HZ3      LYS  15 -10.538   4.707  10.753
  136    H    GLY  16           H        GLY  16  -8.357  -0.857  11.813
  137    HA2  GLY  16           HA2      GLY  16  -6.127  -0.475  11.502
  138    HA3  GLY  16           HA3      GLY  16  -6.212   0.920  12.574
  139    HA   PRO  17           HA       PRO  17  -5.248  -2.996  15.304
  140    HB2  PRO  17           HB2      PRO  17  -4.083  -4.749  13.142
  141    HB3  PRO  17           HB3      PRO  17  -4.943  -5.231  14.637
  142    HG2  PRO  17           HG2      PRO  17  -6.266  -5.253  12.299
  143    HG3  PRO  17           HG3      PRO  17  -7.051  -4.503  13.734
  144    HD2  PRO  17           HD2      PRO  17  -5.507  -3.145  11.519
  145    HD3  PRO  17           HD3      PRO  17  -7.125  -2.739  12.153
  146    H    SER  18           H        SER  18  -3.025  -4.340  15.765
  147    HA   SER  18           HA       SER  18  -0.856  -2.385  15.781
  148    HB2  SER  18           HB2      SER  18   0.254  -4.152  17.172
  149    HB3  SER  18           HB3      SER  18  -1.325  -3.620  17.773
  150    HG   SER  18           HG       SER  18  -0.516  -6.056  16.683
  151    H    SER  19           H        SER  19  -1.575  -5.207  13.849
  152    HA   SER  19           HA       SER  19   1.178  -5.660  12.940
  153    HB2  SER  19           HB2      SER  19  -0.455  -7.454  13.349
  154    HB3  SER  19           HB3      SER  19  -1.510  -6.786  12.091
  155    HG   SER  19           HG       SER  19  -0.198  -8.602  11.491
  156    H    VAL  20           H        VAL  20   1.548  -5.892  10.494
  157    HA   VAL  20           HA       VAL  20   1.004  -3.644   8.831
  158    HB   VAL  20           HB       VAL  20   1.605  -6.548   8.129
  159   HG11  VAL  20          HG11      VAL  20   0.661  -5.563   6.142
  160   HG12  VAL  20          HG12      VAL  20   1.640  -4.088   6.335
  161   HG13  VAL  20          HG13      VAL  20   2.405  -5.646   5.931
  162   HG21  VAL  20          HG21      VAL  20   3.394  -4.077   8.261
  163   HG22  VAL  20          HG22      VAL  20   3.424  -5.443   9.383
  164   HG23  VAL  20          HG23      VAL  20   3.900  -5.678   7.698
  165    H    GLU  21           H        GLU  21  -1.023  -6.323   9.733
  166    HA   GLU  21           HA       GLU  21  -3.006  -6.379   7.772
  167    HB2  GLU  21           HB2      GLU  21  -3.247  -6.624  10.796
  168    HB3  GLU  21           HB3      GLU  21  -4.528  -7.043   9.674
  169    HG2  GLU  21           HG2      GLU  21  -1.770  -8.346   9.750
  170    HG3  GLU  21           HG3      GLU  21  -3.262  -9.039  10.387
  171    H    ASP  22           H        ASP  22  -2.466  -3.764  10.081
  172    HA   ASP  22           HA       ASP  22  -4.945  -2.313   9.736
  173    HB2  ASP  22           HB2      ASP  22  -3.469  -1.716  11.520
  174    HB3  ASP  22           HB3      ASP  22  -2.074  -1.636  10.449
  175    H    ILE  23           H        ILE  23  -1.836  -2.146   7.963
  176    HA   ILE  23           HA       ILE  23  -2.843  -0.184   6.094
  177    HB   ILE  23           HB       ILE  23  -0.378  -1.977   5.863
  178   HG12  ILE  23          HG12      ILE  23   0.824   0.256   6.384
  179   HG13  ILE  23          HG13      ILE  23  -0.707   0.827   7.023
  180   HG21  ILE  23          HG21      ILE  23   0.392  -0.297   4.215
  181   HG22  ILE  23          HG22      ILE  23  -1.116  -1.041   3.693
  182   HG23  ILE  23          HG23      ILE  23  -1.143   0.587   4.394
  183   HD11  ILE  23          HD11      ILE  23   0.921  -0.027   8.730
  184   HD12  ILE  23          HD12      ILE  23  -0.612  -0.876   8.800
  185   HD13  ILE  23          HD13      ILE  23   0.783  -1.641   8.013
  186    H    LYS  24           H        LYS  24  -2.580  -3.749   6.095
  187    HA   LYS  24           HA       LYS  24  -3.500  -4.208   3.401
  188    HB2  LYS  24           HB2      LYS  24  -4.011  -5.846   5.918
  189    HB3  LYS  24           HB3      LYS  24  -4.282  -6.426   4.295
  190    HG2  LYS  24           HG2      LYS  24  -1.563  -5.668   5.451
  191    HG3  LYS  24           HG3      LYS  24  -2.219  -7.304   5.334
  192    HD2  LYS  24           HD2      LYS  24  -2.301  -7.107   2.880
  193    HD3  LYS  24           HD3      LYS  24  -1.677  -5.455   2.987
  194    HE2  LYS  24           HE2      LYS  24   0.131  -6.866   2.344
  195    HE3  LYS  24           HE3      LYS  24   0.432  -6.364   4.017
  196    HZ1  LYS  24           HZ1      LYS  24   0.770  -8.790   3.455
  197    HZ2  LYS  24           HZ2      LYS  24  -0.835  -8.943   3.282
  198    HZ3  LYS  24           HZ3      LYS  24  -0.231  -8.531   4.758
  199    H    ALA  25           H        ALA  25  -5.440  -3.990   6.427
  200    HA   ALA  25           HA       ALA  25  -7.960  -4.218   5.144
  201    HB1  ALA  25           HB1      ALA  25  -8.828  -3.352   7.309
  202    HB2  ALA  25           HB2      ALA  25  -7.600  -4.605   7.545
  203    HB3  ALA  25           HB3      ALA  25  -7.180  -2.897   7.792
  204    H    LYS  26           H        LYS  26  -6.136  -1.274   6.115
  205    HA   LYS  26           HA       LYS  26  -8.120   0.566   5.133
  206    HB2  LYS  26           HB2      LYS  26  -5.234   0.926   5.978
  207    HB3  LYS  26           HB3      LYS  26  -6.298   2.262   5.504
  208    HG2  LYS  26           HG2      LYS  26  -7.904   1.711   7.268
  209    HG3  LYS  26           HG3      LYS  26  -7.010   0.259   7.702
  210    HD2  LYS  26           HD2      LYS  26  -6.562   1.899   9.345
  211    HD3  LYS  26           HD3      LYS  26  -5.090   1.643   8.411
  212    HE2  LYS  26           HE2      LYS  26  -5.382   3.726   7.207
  213    HE3  LYS  26           HE3      LYS  26  -7.036   3.906   7.799
  214    HZ1  LYS  26           HZ1      LYS  26  -5.524   5.328   9.008
  215    HZ2  LYS  26           HZ2      LYS  26  -4.635   4.044   9.547
  216    HZ3  LYS  26           HZ3      LYS  26  -6.187   4.237  10.024
  217    H    MET  27           H        MET  27  -5.282  -0.875   3.500
  218    HA   MET  27           HA       MET  27  -5.571   0.652   1.073
  219    HB2  MET  27           HB2      MET  27  -4.399  -2.080   1.664
  220    HB3  MET  27           HB3      MET  27  -4.580  -1.488   0.012
  221    HG2  MET  27           HG2      MET  27  -3.278   0.523   0.531
  222    HG3  MET  27           HG3      MET  27  -3.029  -0.047   2.184
  223    HE1  MET  27           HE1      MET  27  -0.669   0.774  -0.038
  224    HE2  MET  27           HE2      MET  27  -0.491   0.462   1.703
  225    HE3  MET  27           HE3      MET  27   0.515  -0.419   0.531
  226    H    GLN  28           H        GLN  28  -7.180  -2.483   2.059
  227    HA   GLN  28           HA       GLN  28  -8.573  -2.601  -0.499
  228    HB2  GLN  28           HB2      GLN  28  -9.439  -3.900   2.102
  229    HB3  GLN  28           HB3      GLN  28 -10.030  -4.258   0.481
  230    HG2  GLN  28           HG2      GLN  28  -7.323  -4.863   1.651
  231    HG3  GLN  28           HG3      GLN  28  -8.531  -5.989   1.081
  232   HE21  GLN  28          HE21      GLN  28  -5.893  -3.866   0.091
  233   HE22  GLN  28          HE22      GLN  28  -5.732  -4.602  -1.480
  234    H    ALA  29           H        ALA  29  -9.517  -1.278   2.708
  235    HA   ALA  29           HA       ALA  29 -12.104  -0.370   1.993
  236    HB1  ALA  29           HB1      ALA  29 -11.767   1.216   3.886
  237    HB2  ALA  29           HB2      ALA  29 -11.254  -0.427   4.305
  238    HB3  ALA  29           HB3      ALA  29 -10.048   0.818   3.911
  239    H    SER  30           H        SER  30  -8.918   1.259   1.561
  240    HA   SER  30           HA       SER  30  -9.971   3.686   0.461
  241    HB2  SER  30           HB2      SER  30  -7.252   2.367   0.056
  242    HB3  SER  30           HB3      SER  30  -7.658   4.031  -0.365
  243    HG   SER  30           HG       SER  30  -7.549   2.810   2.177
  244    H    ILE  31           H        ILE  31  -8.747   0.729  -1.261
  245    HA   ILE  31           HA       ILE  31  -9.298   1.976  -3.810
  246    HB   ILE  31           HB       ILE  31  -7.444   0.377  -3.306
  247   HG12  ILE  31          HG12      ILE  31  -9.062  -0.462  -5.731
  248   HG13  ILE  31          HG13      ILE  31  -8.306   1.133  -5.618
  249   HG21  ILE  31          HG21      ILE  31  -8.929  -1.358  -2.201
  250   HG22  ILE  31          HG22      ILE  31  -9.474  -1.828  -3.816
  251   HG23  ILE  31          HG23      ILE  31  -7.762  -1.984  -3.366
  252   HD11  ILE  31          HD11      ILE  31  -6.765  -1.479  -5.395
  253   HD12  ILE  31          HD12      ILE  31  -6.916  -0.496  -6.867
  254   HD13  ILE  31          HD13      ILE  31  -6.094   0.164  -5.443
  255    H    GLU  32           H        GLU  32 -11.300  -0.045  -1.741
  256    HA   GLU  32           HA       GLU  32 -13.348  -0.105  -3.912
  257    HB2  GLU  32           HB2      GLU  32 -13.261  -1.829  -1.429
  258    HB3  GLU  32           HB3      GLU  32 -14.448  -1.886  -2.744
  259    HG2  GLU  32           HG2      GLU  32 -12.361  -2.227  -4.302
  260    HG3  GLU  32           HG3      GLU  32 -11.524  -2.681  -2.816
  261    H    LYS  33           H        LYS  33 -12.706   1.908  -1.275
  262    HA   LYS  33           HA       LYS  33 -15.503   2.918  -1.533
  263    HB2  LYS  33           HB2      LYS  33 -13.876   3.226   0.985
  264    HB3  LYS  33           HB3      LYS  33 -15.561   3.679   0.713
  265    HG2  LYS  33           HG2      LYS  33 -16.099   1.257   0.285
  266    HG3  LYS  33           HG3      LYS  33 -14.457   0.824   0.768
  267    HD2  LYS  33           HD2      LYS  33 -16.533   2.183   2.522
  268    HD3  LYS  33           HD3      LYS  33 -16.088   0.489   2.544
  269    HE2  LYS  33           HE2      LYS  33 -13.730   1.164   3.104
  270    HE3  LYS  33           HE3      LYS  33 -14.308   2.833   3.298
  271    HZ1  LYS  33           HZ1      LYS  33 -15.812   2.052   5.049
  272    HZ2  LYS  33           HZ2      LYS  33 -14.290   1.545   5.430
  273    HZ3  LYS  33           HZ3      LYS  33 -15.346   0.495   4.817
  274    H    GLY  34           H        GLY  34 -12.698   3.614  -2.736
  275    HA2  GLY  34           HA2      GLY  34 -13.503   6.349  -3.349
  276    HA3  GLY  34           HA3      GLY  34 -12.036   6.275  -2.381
  277    H    GLY  35           H        GLY  35 -11.073   3.761  -3.735
  278    HA2  GLY  35           HA2      GLY  35 -10.320   3.001  -5.893
  279    HA3  GLY  35           HA3      GLY  35 -10.711   4.573  -6.582
  280    H    SER  36           H        SER  36  -8.661   4.997  -7.459
  281    HA   SER  36           HA       SER  36  -6.495   5.570  -7.569
  282    HB2  SER  36           HB2      SER  36  -7.289   7.378  -6.039
  283    HB3  SER  36           HB3      SER  36  -6.624   6.456  -4.681
  284    HG   SER  36           HG       SER  36  -5.119   7.984  -5.509
  285    H    LEU  37           H        LEU  37  -4.734   5.429  -5.143
  286    HA   LEU  37           HA       LEU  37  -2.933   4.306  -4.520
  287    HB2  LEU  37           HB2      LEU  37  -4.305   1.729  -5.361
  288    HB3  LEU  37           HB3      LEU  37  -2.704   1.849  -4.674
  289    HG   LEU  37           HG       LEU  37  -3.610   2.753  -2.597
  290   HD11  LEU  37          HD11      LEU  37  -5.704   3.787  -3.086
  291   HD12  LEU  37          HD12      LEU  37  -6.079   2.386  -2.101
  292   HD13  LEU  37          HD13      LEU  37  -6.329   2.319  -3.863
  293   HD21  LEU  37          HD21      LEU  37  -4.594   0.650  -1.782
  294   HD22  LEU  37          HD22      LEU  37  -3.185   0.375  -2.809
  295   HD23  LEU  37          HD23      LEU  37  -4.823   0.114  -3.460
  296    HA   PRO  38           HA       PRO  38  -1.076   4.124  -8.623
  297    HB2  PRO  38           HB2      PRO  38   1.489   4.621  -8.043
  298    HB3  PRO  38           HB3      PRO  38   0.232   5.881  -7.851
  299    HG2  PRO  38           HG2      PRO  38   1.383   4.056  -5.727
  300    HG3  PRO  38           HG3      PRO  38   1.173   5.836  -5.637
  301    HD2  PRO  38           HD2      PRO  38  -0.625   4.029  -4.580
  302    HD3  PRO  38           HD3      PRO  38  -1.128   5.612  -5.240
  303    H    LYS  39           H        LYS  39   0.468   2.767  -9.790
  304    HA   LYS  39           HA       LYS  39   0.846   0.085  -8.501
  305    HB2  LYS  39           HB2      LYS  39  -0.729   0.194 -10.429
  306    HB3  LYS  39           HB3      LYS  39   0.600   0.786 -11.447
  307    HG2  LYS  39           HG2      LYS  39   1.869  -1.321 -10.995
  308    HG3  LYS  39           HG3      LYS  39   0.578  -1.862  -9.913
  309    HD2  LYS  39           HD2      LYS  39   0.420  -2.967 -12.054
  310    HD3  LYS  39           HD3      LYS  39  -0.994  -1.932 -11.811
  311    HE2  LYS  39           HE2      LYS  39  -0.057  -0.235 -13.312
  312    HE3  LYS  39           HE3      LYS  39   1.469  -1.126 -13.432
  313    HZ1  LYS  39           HZ1      LYS  39  -1.164  -2.151 -14.323
  314    HZ2  LYS  39           HZ2      LYS  39   0.269  -2.934 -14.494
  315    HZ3  LYS  39           HZ3      LYS  39   0.005  -1.546 -15.333
  316    H    VAL  40           H        VAL  40   2.490   2.567 -10.476
  317    HA   VAL  40           HA       VAL  40   4.922   1.112 -10.832
  318    HB   VAL  40           HB       VAL  40   4.365   4.094 -10.836
  319   HG11  VAL  40          HG11      VAL  40   6.505   4.303 -12.085
  320   HG12  VAL  40          HG12      VAL  40   6.767   3.805 -10.415
  321   HG13  VAL  40          HG13      VAL  40   6.868   2.605 -11.729
  322   HG21  VAL  40          HG21      VAL  40   3.264   2.715 -12.633
  323   HG22  VAL  40          HG22      VAL  40   4.478   3.829 -13.278
  324   HG23  VAL  40          HG23      VAL  40   4.856   2.102 -13.101
  325    H    GLU  41           H        GLU  41   6.703   0.844  -9.650
  326    HA   GLU  41           HA       GLU  41   6.201   0.403  -6.985
  327    HB2  GLU  41           HB2      GLU  41   7.701  -0.813  -8.488
  328    HB3  GLU  41           HB3      GLU  41   8.866   0.519  -8.428
  329    HG2  GLU  41           HG2      GLU  41   9.242   0.111  -6.034
  330    HG3  GLU  41           HG3      GLU  41   8.002  -1.158  -6.052
  331    H    ALA  42           H        ALA  42   8.379   3.048  -8.170
  332    HA   ALA  42           HA       ALA  42   9.035   4.025  -5.569
  333    HB1  ALA  42           HB1      ALA  42   9.749   6.062  -6.789
  334    HB2  ALA  42           HB2      ALA  42  10.316   4.587  -7.586
  335    HB3  ALA  42           HB3      ALA  42   8.927   5.479  -8.253
  336    H    LYS  43           H        LYS  43   6.272   4.725  -7.664
  337    HA   LYS  43           HA       LYS  43   5.168   6.921  -6.100
  338    HB2  LYS  43           HB2      LYS  43   3.661   5.064  -7.973
  339    HB3  LYS  43           HB3      LYS  43   3.198   6.683  -7.435
  340    HG2  LYS  43           HG2      LYS  43   5.308   7.518  -8.598
  341    HG3  LYS  43           HG3      LYS  43   5.463   5.891  -9.293
  342    HD2  LYS  43           HD2      LYS  43   3.152   6.172 -10.298
  343    HD3  LYS  43           HD3      LYS  43   3.152   7.839  -9.675
  344    HE2  LYS  43           HE2      LYS  43   5.387   8.138 -10.919
  345    HE3  LYS  43           HE3      LYS  43   5.044   6.609 -11.736
  346    HZ1  LYS  43           HZ1      LYS  43   4.300   8.576 -12.994
  347    HZ2  LYS  43           HZ2      LYS  43   3.356   9.047 -11.769
  348    HZ3  LYS  43           HZ3      LYS  43   2.974   7.675 -12.603
  349    H    PHE  44           H        PHE  44   4.640   3.409  -6.255
  350    HA   PHE  44           HA       PHE  44   2.675   3.326  -4.201
  351    HB2  PHE  44           HB2      PHE  44   3.109   1.520  -5.852
  352    HB3  PHE  44           HB3      PHE  44   4.625   1.152  -5.038
  353    HD1  PHE  44           HD1      PHE  44   0.928   1.460  -4.422
  354    HD2  PHE  44           HD2      PHE  44   4.628  -0.409  -3.230
  355    HE1  PHE  44           HE1      PHE  44  -0.311   0.011  -2.827
  356    HE2  PHE  44           HE2      PHE  44   3.383  -1.872  -1.664
  357    HZ   PHE  44           HZ       PHE  44   0.902  -1.681  -1.483
  358    H    ILE  45           H        ILE  45   6.257   3.221  -4.000
  359    HA   ILE  45           HA       ILE  45   6.359   2.837  -1.165
  360    HB   ILE  45           HB       ILE  45   8.341   4.007  -3.132
  361   HG12  ILE  45          HG12      ILE  45   8.392   1.419  -1.510
  362   HG13  ILE  45          HG13      ILE  45   7.696   1.505  -3.115
  363   HG21  ILE  45          HG21      ILE  45   8.770   3.462  -0.155
  364   HG22  ILE  45          HG22      ILE  45  10.048   3.863  -1.325
  365   HG23  ILE  45          HG23      ILE  45   8.823   5.055  -0.947
  366   HD11  ILE  45          HD11      ILE  45   9.921   0.629  -3.309
  367   HD12  ILE  45          HD12      ILE  45   9.900   2.250  -4.034
  368   HD13  ILE  45          HD13      ILE  45  10.616   1.993  -2.422
  369    H    ASN  46           H        ASN  46   6.325   6.037  -2.996
  370    HA   ASN  46           HA       ASN  46   6.255   7.420  -0.451
  371    HB2  ASN  46           HB2      ASN  46   5.867   9.443  -1.567
  372    HB3  ASN  46           HB3      ASN  46   7.064   8.536  -2.469
  373   HD21  ASN  46          HD21      ASN  46   3.571   9.523  -2.484
  374   HD22  ASN  46          HD22      ASN  46   3.422   9.317  -4.221
  375    H    TYR  47           H        TYR  47   3.613   6.155  -2.490
  376    HA   TYR  47           HA       TYR  47   1.475   7.171  -0.912
  377    HB2  TYR  47           HB2      TYR  47   1.140   6.188  -3.102
  378    HB3  TYR  47           HB3      TYR  47   1.714   4.620  -2.535
  379    HD1  TYR  47           HD2      TYR  47  -1.023   7.130  -2.215
  380    HD2  TYR  47           HD1      TYR  47   0.281   3.110  -1.328
  381    HE1  TYR  47           HE2      TYR  47  -3.299   6.580  -1.378
  382    HE2  TYR  47           HE1      TYR  47  -2.017   2.570  -0.487
  383    HH   TYR  47           HH       TYR  47  -4.663   4.955  -0.482
  384    H    VAL  48           H        VAL  48   3.359   4.117  -0.475
  385    HA   VAL  48           HA       VAL  48   1.980   3.228   1.874
  386    HB   VAL  48           HB       VAL  48   4.729   2.668   0.720
  387   HG11  VAL  48          HG11      VAL  48   4.960   0.825   2.388
  388   HG12  VAL  48          HG12      VAL  48   5.109   2.423   3.110
  389   HG13  VAL  48          HG13      VAL  48   3.594   1.507   3.306
  390   HG21  VAL  48          HG21      VAL  48   2.646   1.666  -0.312
  391   HG22  VAL  48          HG22      VAL  48   3.766   0.461   0.325
  392   HG23  VAL  48          HG23      VAL  48   2.303   0.887   1.242
  393    H    LYS  49           H        LYS  49   4.839   5.386   1.560
  394    HA   LYS  49           HA       LYS  49   5.190   5.765   4.394
  395    HB2  LYS  49           HB2      LYS  49   5.958   7.454   1.983
  396    HB3  LYS  49           HB3      LYS  49   6.429   7.847   3.642
  397    HG2  LYS  49           HG2      LYS  49   7.601   5.744   3.906
  398    HG3  LYS  49           HG3      LYS  49   7.077   5.183   2.314
  399    HD2  LYS  49           HD2      LYS  49   8.289   7.080   1.265
  400    HD3  LYS  49           HD3      LYS  49   8.906   7.561   2.868
  401    HE2  LYS  49           HE2      LYS  49   9.965   5.318   3.119
  402    HE3  LYS  49           HE3      LYS  49   9.305   4.839   1.554
  403    HZ1  LYS  49           HZ1      LYS  49  11.428   6.813   2.074
  404    HZ2  LYS  49           HZ2      LYS  49  10.596   6.824   0.651
  405    HZ3  LYS  49           HZ3      LYS  49  11.476   5.509   1.086
  406    H    ASN  50           H        ASN  50   3.069   7.421   2.092
  407    HA   ASN  50           HA       ASN  50   1.964   9.286   4.024
  408    HB2  ASN  50           HB2      ASN  50   1.803   9.894   1.769
  409    HB3  ASN  50           HB3      ASN  50   1.294   8.306   1.241
  410   HD21  ASN  50          HD21      ASN  50  -0.888   7.730   1.284
  411   HD22  ASN  50          HD22      ASN  50  -2.125   8.942   1.583
  412    H    CYS  51           H        CYS  51   1.152   5.909   3.217
  413    HA   CYS  51           HA       CYS  51  -1.333   5.922   4.766
  414    HB2  CYS  51           HB2      CYS  51   0.334   3.656   3.584
  415    HB3  CYS  51           HB3      CYS  51  -1.246   3.467   4.371
  416    HG   CYS  51           HG       CYS  51  -0.435   5.191   1.661
  417    H    PHE  52           H        PHE  52   2.019   4.840   5.419
  418    HA   PHE  52           HA       PHE  52   1.492   5.219   8.253
  419    HB2  PHE  52           HB2      PHE  52   0.737   2.880   7.953
  420    HB3  PHE  52           HB3      PHE  52   2.291   2.443   7.285
  421    HD1  PHE  52           HD2      PHE  52   1.392   4.533  10.339
  422    HD2  PHE  52           HD1      PHE  52   3.252   0.935   8.826
  423    HE1  PHE  52           HE2      PHE  52   2.007   3.874  12.636
  424    HE2  PHE  52           HE1      PHE  52   3.819   0.267  11.136
  425    HZ   PHE  52           HZ       PHE  52   3.180   1.722  13.043
  426    H    ARG  53           H        ARG  53   4.110   3.183   7.025
  427    HA   ARG  53           HA       ARG  53   5.991   5.344   6.648
  428    HB2  ARG  53           HB2      ARG  53   5.725   5.138   9.220
  429    HB3  ARG  53           HB3      ARG  53   6.587   3.623   9.107
  430    HG2  ARG  53           HG2      ARG  53   8.538   4.754   8.161
  431    HG3  ARG  53           HG3      ARG  53   7.612   6.258   7.995
  432    HD2  ARG  53           HD2      ARG  53   7.325   6.179  10.561
  433    HD3  ARG  53           HD3      ARG  53   8.557   4.914  10.549
  434    HE   ARG  53           HE       ARG  53  10.204   6.493   9.975
  435   HH11  ARG  53          HH11      ARG  53   7.040   8.089   9.712
  436   HH12  ARG  53          HH12      ARG  53   7.763   9.652   9.545
  437   HH21  ARG  53          HH21      ARG  53  11.007   8.594   9.666
  438   HH22  ARG  53          HH22      ARG  53   9.885   9.912   9.500
  439    H    MET  54           H        MET  54   6.606   2.100   7.920
  440    HA   MET  54           HA       MET  54   7.619   0.294   7.196
  441    HB2  MET  54           HB2      MET  54   6.771   1.010   4.377
  442    HB3  MET  54           HB3      MET  54   7.369  -0.551   4.929
  443    HG2  MET  54           HG2      MET  54   4.802   0.797   5.826
  444    HG3  MET  54           HG3      MET  54   4.947  -0.589   4.745
  445    HE1  MET  54           HE1      MET  54   3.172  -2.113   6.381
  446    HE2  MET  54           HE2      MET  54   3.273  -1.839   8.135
  447    HE3  MET  54           HE3      MET  54   3.021  -0.466   7.038
  448    H    THR  55           H        THR  55   9.544  -0.323   7.113
  449    HA   THR  55           HA       THR  55  11.611   0.984   5.370
  450    HB   THR  55           HB       THR  55  13.239   0.081   7.067
  451    HG1  THR  55           HG1      THR  55  12.326  -0.437   9.108
  452   HG21  THR  55          HG21      THR  55  12.863   1.845   8.712
  453   HG22  THR  55          HG22      THR  55  11.186   2.052   8.161
  454   HG23  THR  55          HG23      THR  55  12.537   2.456   7.086
  455    H    ASP  56           H        ASP  56  10.099  -2.051   6.326
  456    HA   ASP  56           HA       ASP  56  12.095  -3.813   5.166
  457    HB2  ASP  56           HB2      ASP  56   9.174  -4.273   5.879
  458    HB3  ASP  56           HB3      ASP  56  10.321  -5.528   5.415
  459    H    GLN  57           H        GLN  57  12.489  -3.932   2.997
  460    HA   GLN  57           HA       GLN  57  10.541  -3.356   0.944
  461    HB2  GLN  57           HB2      GLN  57  12.907  -3.128   0.551
  462    HB3  GLN  57           HB3      GLN  57  13.165  -4.833   0.890
  463    HG2  GLN  57           HG2      GLN  57  13.256  -4.387  -1.514
  464    HG3  GLN  57           HG3      GLN  57  11.930  -5.469  -1.124
  465   HE21  GLN  57          HE21      GLN  57   9.820  -4.822  -1.601
  466   HE22  GLN  57          HE22      GLN  57   9.518  -3.444  -2.658
  467    H    GLU  58           H        GLU  58  11.245  -6.210   2.866
  468    HA   GLU  58           HA       GLU  58   9.621  -8.150   1.560
  469    HB2  GLU  58           HB2      GLU  58  11.082  -8.653   3.472
  470    HB3  GLU  58           HB3      GLU  58  10.154  -7.568   4.495
  471    HG2  GLU  58           HG2      GLU  58   9.454  -9.660   5.158
  472    HG3  GLU  58           HG3      GLU  58   8.132  -9.124   4.141
  473    H    ALA  59           H        ALA  59   8.627  -5.642   4.019
  474    HA   ALA  59           HA       ALA  59   5.832  -6.425   3.828
  475    HB1  ALA  59           HB1      ALA  59   5.378  -4.450   5.153
  476    HB2  ALA  59           HB2      ALA  59   6.735  -5.357   5.858
  477    HB3  ALA  59           HB3      ALA  59   7.037  -3.860   4.931
  478    H    ILE  60           H        ILE  60   7.846  -3.909   2.254
  479    HA   ILE  60           HA       ILE  60   5.718  -2.565   0.897
  480    HB   ILE  60           HB       ILE  60   8.637  -2.916   0.206
  481   HG12  ILE  60          HG12      ILE  60   7.205  -0.458   1.300
  482   HG13  ILE  60          HG13      ILE  60   7.932  -1.669   2.344
  483   HG21  ILE  60          HG21      ILE  60   8.403  -1.012  -1.363
  484   HG22  ILE  60          HG22      ILE  60   7.407  -2.349  -1.883
  485   HG23  ILE  60          HG23      ILE  60   6.650  -0.967  -1.062
  486   HD11  ILE  60          HD11      ILE  60   9.500   0.131   2.098
  487   HD12  ILE  60          HD12      ILE  60  10.147  -1.286   1.253
  488   HD13  ILE  60          HD13      ILE  60   9.428   0.048   0.330
  489    H    GLN  61           H        GLN  61   7.742  -5.367  -0.258
  490    HA   GLN  61           HA       GLN  61   6.246  -5.504  -2.723
  491    HB2  GLN  61           HB2      GLN  61   7.478  -7.452  -3.256
  492    HB3  GLN  61           HB3      GLN  61   8.553  -6.296  -2.505
  493    HG2  GLN  61           HG2      GLN  61   9.213  -8.310  -1.553
  494    HG3  GLN  61           HG3      GLN  61   8.219  -7.583  -0.319
  495   HE21  GLN  61          HE21      GLN  61   7.938  -9.828   0.610
  496   HE22  GLN  61          HE22      GLN  61   6.758 -10.870  -0.156
  497    H    ASP  62           H        ASP  62   5.828  -7.128   0.429
  498    HA   ASP  62           HA       ASP  62   3.716  -8.896  -0.312
  499    HB2  ASP  62           HB2      ASP  62   5.166  -8.772   1.799
  500    HB3  ASP  62           HB3      ASP  62   4.093  -7.505   2.376
  501    H    LEU  63           H        LEU  63   3.638  -5.538   0.956
  502    HA   LEU  63           HA       LEU  63   0.834  -5.087   0.759
  503    HB2  LEU  63           HB2      LEU  63   3.291  -3.322   0.717
  504    HB3  LEU  63           HB3      LEU  63   1.681  -2.627   0.559
  505    HG   LEU  63           HG       LEU  63   2.505  -4.347   2.943
  506   HD11  LEU  63          HD11      LEU  63   2.708  -2.203   4.156
  507   HD12  LEU  63          HD12      LEU  63   2.430  -1.306   2.645
  508   HD13  LEU  63          HD13      LEU  63   3.888  -2.304   2.843
  509   HD21  LEU  63          HD21      LEU  63   0.198  -2.424   2.502
  510   HD22  LEU  63          HD22      LEU  63   0.549  -3.313   4.005
  511   HD23  LEU  63          HD23      LEU  63   0.070  -4.181   2.542
  512    H    TRP  64           H        TRP  64   3.443  -4.705  -1.668
  513    HA   TRP  64           HA       TRP  64   1.784  -3.533  -3.679
  514    HB2  TRP  64           HB2      TRP  64   4.330  -3.543  -3.417
  515    HB3  TRP  64           HB3      TRP  64   4.310  -5.148  -4.123
  516    HD1  TRP  64           HD1      TRP  64   2.400  -1.979  -5.313
  517    HE1  TRP  64           HE1      TRP  64   3.306  -1.293  -7.644
  518    HE3  TRP  64           HE3      TRP  64   6.216  -5.367  -5.801
  519    HZ2  TRP  64           HZ2      TRP  64   5.330  -2.092  -9.450
  520    HZ3  TRP  64           HZ3      TRP  64   7.677  -5.316  -7.808
  521    HH2  TRP  64           HH2      TRP  64   7.244  -3.696  -9.639
  522    H    GLN  65           H        GLN  65   2.531  -6.971  -2.953
  523    HA   GLN  65           HA       GLN  65   0.931  -7.982  -5.165
  524    HB2  GLN  65           HB2      GLN  65   1.610  -9.406  -2.576
  525    HB3  GLN  65           HB3      GLN  65   0.974 -10.122  -4.050
  526    HG2  GLN  65           HG2      GLN  65   3.752  -9.348  -3.360
  527    HG3  GLN  65           HG3      GLN  65   3.161 -10.720  -4.279
  528   HE21  GLN  65          HE21      GLN  65   4.572  -7.617  -4.420
  529   HE22  GLN  65          HE22      GLN  65   4.545  -7.423  -6.179
  530    H    TRP  66           H        TRP  66   0.176  -7.109  -1.764
  531    HA   TRP  66           HA       TRP  66  -2.614  -7.852  -1.955
  532    HB2  TRP  66           HB2      TRP  66  -1.302  -7.510   0.143
  533    HB3  TRP  66           HB3      TRP  66  -1.295  -5.779  -0.178
  534    HD1  TRP  66           HD1      TRP  66  -3.116  -4.517   1.019
  535    HE1  TRP  66           HE1      TRP  66  -5.336  -5.097   2.201
  536    HE3  TRP  66           HE3      TRP  66  -3.572  -9.412  -0.424
  537    HZ2  TRP  66           HZ2      TRP  66  -7.083  -7.374   2.464
  538    HZ3  TRP  66           HZ3      TRP  66  -5.539 -10.738   0.256
  539    HH2  TRP  66           HH2      TRP  66  -7.321  -9.728   1.682
  540    H    ARG  67           H        ARG  67  -0.856  -5.164  -3.227
  541    HA   ARG  67           HA       ARG  67  -3.320  -3.775  -4.080
  542    HB2  ARG  67           HB2      ARG  67  -1.297  -2.571  -3.231
  543    HB3  ARG  67           HB3      ARG  67  -0.413  -3.066  -4.666
  544    HG2  ARG  67           HG2      ARG  67  -3.052  -1.723  -5.146
  545    HG3  ARG  67           HG3      ARG  67  -1.830  -0.728  -4.376
  546    HD2  ARG  67           HD2      ARG  67  -0.280  -0.971  -6.165
  547    HD3  ARG  67           HD3      ARG  67  -1.225  -2.228  -6.950
  548    HE   ARG  67           HE       ARG  67  -1.644   0.654  -7.056
  549   HH11  ARG  67          HH11      ARG  67  -3.212  -2.466  -7.629
  550   HH12  ARG  67          HH12      ARG  67  -4.398  -1.714  -8.690
  551   HH21  ARG  67          HH21      ARG  67  -3.467   1.497  -8.222
  552   HH22  ARG  67          HH22      ARG  67  -4.544   0.349  -8.968
  553    H    LYS  68           H        LYS  68  -1.784  -6.498  -5.185
  554    HA   LYS  68           HA       LYS  68  -2.818  -6.022  -7.968
  555    HB2  LYS  68           HB2      LYS  68  -0.363  -6.479  -7.796
  556    HB3  LYS  68           HB3      LYS  68  -0.738  -8.080  -7.141
  557    HG2  LYS  68           HG2      LYS  68  -2.018  -8.603  -9.214
  558    HG3  LYS  68           HG3      LYS  68  -1.676  -6.987  -9.837
  559    HD2  LYS  68           HD2      LYS  68   0.754  -7.514  -9.868
  560    HD3  LYS  68           HD3      LYS  68   0.403  -9.139  -9.234
  561    HE2  LYS  68           HE2      LYS  68  -1.049  -9.587 -11.211
  562    HE3  LYS  68           HE3      LYS  68  -0.680  -7.973 -11.833
  563    HZ1  LYS  68           HZ1      LYS  68   1.650  -8.618 -11.974
  564    HZ2  LYS  68           HZ2      LYS  68   0.729  -9.628 -12.882
  565    HZ3  LYS  68           HZ3      LYS  68   1.294 -10.135 -11.432
  566    H    SER  69           H        SER  69  -2.720  -8.515  -5.387
  567    HA   SER  69           HA       SER  69  -4.722 -10.182  -6.653
  568    HB2  SER  69           HB2      SER  69  -3.518 -10.292  -3.869
  569    HB3  SER  69           HB3      SER  69  -4.533 -11.546  -4.616
  570    HG   SER  69           HG       SER  69  -2.311 -12.005  -4.878
  571    H    LEU  70           H        LEU  70  -5.990  -8.000  -6.736
  572    HA   LEU  70           HA       LEU  70  -7.562  -7.274  -4.378
  573    HB2  LEU  70           HB2      LEU  70  -7.437  -6.213  -7.235
  574    HB3  LEU  70           HB3      LEU  70  -8.388  -5.486  -5.956
  575    HG   LEU  70           HG       LEU  70  -5.353  -5.733  -5.840
  576   HD11  LEU  70          HD11      LEU  70  -7.163  -3.433  -6.663
  577   HD12  LEU  70          HD12      LEU  70  -5.999  -4.299  -7.689
  578   HD13  LEU  70          HD13      LEU  70  -5.418  -3.296  -6.353
  579   HD21  LEU  70          HD21      LEU  70  -6.350  -5.534  -3.631
  580   HD22  LEU  70          HD22      LEU  70  -7.403  -4.208  -4.176
  581   HD23  LEU  70          HD23      LEU  70  -5.643  -3.977  -4.071
  Start of MODEL   19
    1    H    GLN   1           H1       GLN   1 -42.711  22.252  15.794
    2    HA   GLN   1           HA       GLN   1 -45.164  21.058  16.871
    3    HB2  GLN   1           HB2      GLN   1 -45.470  23.063  15.414
    4    HB3  GLN   1           HB3      GLN   1 -44.747  22.170  14.070
    5    HG2  GLN   1           HG2      GLN   1 -46.559  20.529  14.123
    6    HG3  GLN   1           HG3      GLN   1 -47.178  21.198  15.631
    7   HE21  GLN   1          HE21      GLN   1 -48.331  23.251  15.600
    8   HE22  GLN   1          HE22      GLN   1 -49.107  23.718  14.096
    9    H    GLU   2           H        GLU   2 -42.782  20.588  14.144
   10    HA   GLU   2           HA       GLU   2 -43.438  17.984  13.480
   11    HB2  GLU   2           HB2      GLU   2 -40.622  19.152  13.645
   12    HB3  GLU   2           HB3      GLU   2 -41.116  17.726  12.742
   13    HG2  GLU   2           HG2      GLU   2 -41.118  19.214  11.046
   14    HG3  GLU   2           HG3      GLU   2 -42.794  19.381  11.536
   15    H    SER   3           H        SER   3 -42.982  15.921  14.070
   16    HA   SER   3           HA       SER   3 -42.195  15.463  16.874
   17    HB2  SER   3           HB2      SER   3 -43.262  13.536  14.797
   18    HB3  SER   3           HB3      SER   3 -43.024  13.197  16.522
   19    HG   SER   3           HG       SER   3 -44.494  14.891  16.989
   20    H    PHE   4           H        PHE   4 -39.962  16.326  15.868
   21    HA   PHE   4           HA       PHE   4 -38.197  13.959  15.826
   22    HB2  PHE   4           HB2      PHE   4 -38.732  14.619  13.410
   23    HB3  PHE   4           HB3      PHE   4 -37.957  16.168  13.765
   24    HD1  PHE   4           HD2      PHE   4 -37.405  12.518  13.326
   25    HD2  PHE   4           HD1      PHE   4 -35.522  16.356  13.912
   26    HE1  PHE   4           HE2      PHE   4 -35.203  11.528  12.752
   27    HE2  PHE   4           HE1      PHE   4 -33.321  15.360  13.343
   28    HZ   PHE   4           HZ       PHE   4 -33.153  12.949  12.764
   29    H    LYS   5           H        LYS   5 -36.185  14.364  16.681
   30    HA   LYS   5           HA       LYS   5 -35.087  17.068  16.803
   31    HB2  LYS   5           HB2      LYS   5 -36.538  17.072  18.778
   32    HB3  LYS   5           HB3      LYS   5 -35.697  15.666  19.440
   33    HG2  LYS   5           HG2      LYS   5 -33.632  16.939  19.686
   34    HG3  LYS   5           HG3      LYS   5 -34.324  18.310  18.789
   35    HD2  LYS   5           HD2      LYS   5 -35.968  18.705  20.563
   36    HD3  LYS   5           HD3      LYS   5 -35.442  17.255  21.426
   37    HE2  LYS   5           HE2      LYS   5 -34.555  19.276  22.477
   38    HE3  LYS   5           HE3      LYS   5 -33.253  18.242  21.877
   39    HZ1  LYS   5           HZ1      LYS   5 -32.930  19.708  20.034
   40    HZ2  LYS   5           HZ2      LYS   5 -32.968  20.632  21.375
   41    HZ3  LYS   5           HZ3      LYS   5 -34.281  20.588  20.363
   42    H    LYS   6           H        LYS   6 -34.631  13.767  18.154
   43    HA   LYS   6           HA       LYS   6 -31.903  13.760  16.953
   44    HB2  LYS   6           HB2      LYS   6 -30.916  12.709  18.864
   45    HB3  LYS   6           HB3      LYS   6 -31.583  14.275  19.313
   46    HG2  LYS   6           HG2      LYS   6 -33.491  13.198  20.426
   47    HG3  LYS   6           HG3      LYS   6 -32.975  11.609  19.841
   48    HD2  LYS   6           HD2      LYS   6 -30.803  11.912  21.101
   49    HD3  LYS   6           HD3      LYS   6 -31.474  13.395  21.807
   50    HE2  LYS   6           HE2      LYS   6 -33.340  12.072  22.787
   51    HE3  LYS   6           HE3      LYS   6 -32.697  10.605  22.018
   52    HZ1  LYS   6           HZ1      LYS   6 -31.972  10.684  24.282
   53    HZ2  LYS   6           HZ2      LYS   6 -31.315  12.190  24.120
   54    HZ3  LYS   6           HZ3      LYS   6 -30.652  10.919  23.342
   55    H    GLN   7           H        GLN   7 -30.953  11.816  16.442
   56    HA   GLN   7           HA       GLN   7 -32.554   9.353  16.391
   57    HB2  GLN   7           HB2      GLN   7 -33.298  10.735  14.429
   58    HB3  GLN   7           HB3      GLN   7 -31.633  10.772  13.848
   59    HG2  GLN   7           HG2      GLN   7 -31.688   8.302  13.651
   60    HG3  GLN   7           HG3      GLN   7 -33.366   8.283  14.221
   61   HE21  GLN   7          HE21      GLN   7 -31.249   9.576  11.618
   62   HE22  GLN   7          HE22      GLN   7 -32.521   9.573  10.384
   63    H    GLU   8           H        GLU   8 -31.239   7.482  15.984
   64    HA   GLU   8           HA       GLU   8 -28.350   7.981  16.550
   65    HB2  GLU   8           HB2      GLU   8 -29.920   7.194  18.388
   66    HB3  GLU   8           HB3      GLU   8 -30.030   5.654  17.537
   67    HG2  GLU   8           HG2      GLU   8 -27.625   5.284  17.860
   68    HG3  GLU   8           HG3      GLU   8 -27.416   6.925  18.472
   69    H    LYS   9           H        LYS   9 -29.430   7.620  13.834
   70    HA   LYS   9           HA       LYS   9 -28.749   4.857  13.025
   71    HB2  LYS   9           HB2      LYS   9 -29.853   7.207  11.449
   72    HB3  LYS   9           HB3      LYS   9 -29.674   5.579  10.829
   73    HG2  LYS   9           HG2      LYS   9 -31.449   6.243  13.207
   74    HG3  LYS   9           HG3      LYS   9 -31.983   6.249  11.526
   75    HD2  LYS   9           HD2      LYS   9 -31.285   3.824  11.392
   76    HD3  LYS   9           HD3      LYS   9 -30.994   3.869  13.150
   77    HE2  LYS   9           HE2      LYS   9 -33.327   4.553  13.554
   78    HE3  LYS   9           HE3      LYS   9 -33.609   4.692  11.807
   79    HZ1  LYS   9           HZ1      LYS   9 -33.149   2.311  11.628
   80    HZ2  LYS   9           HZ2      LYS   9 -34.475   2.618  12.530
   81    HZ3  LYS   9           HZ3      LYS   9 -33.064   2.182  13.278
   82    H    THR  10           H        THR  10 -26.692   7.224  13.638
   83    HA   THR  10           HA       THR  10 -25.182   7.269  11.146
   84    HB   THR  10           HB       THR  10 -23.554   8.637  12.631
   85    HG1  THR  10           HG1      THR  10 -24.364   8.173  14.658
   86   HG21  THR  10          HG21      THR  10 -26.385   9.639  12.115
   87   HG22  THR  10          HG22      THR  10 -25.059   9.598  10.932
   88   HG23  THR  10          HG23      THR  10 -24.935  10.643  12.350
   89    HA   PRO  11           HA       PRO  11 -22.150   4.094  11.814
   90    HB2  PRO  11           HB2      PRO  11 -20.089   6.232  11.247
   91    HB3  PRO  11           HB3      PRO  11 -20.227   4.590  10.552
   92    HG2  PRO  11           HG2      PRO  11 -21.039   6.699   9.103
   93    HG3  PRO  11           HG3      PRO  11 -22.079   5.238   9.180
   94    HD2  PRO  11           HD2      PRO  11 -22.339   7.799  10.770
   95    HD3  PRO  11           HD3      PRO  11 -23.592   6.868   9.892
   96    H    LYS  12           H        LYS  12 -20.405   3.347  13.284
   97    HA   LYS  12           HA       LYS  12 -19.694   5.187  15.504
   98    HB2  LYS  12           HB2      LYS  12 -20.650   3.788  17.225
   99    HB3  LYS  12           HB3      LYS  12 -21.885   4.370  16.146
  100    HG2  LYS  12           HG2      LYS  12 -20.667   1.620  15.688
  101    HG3  LYS  12           HG3      LYS  12 -21.803   1.850  16.994
  102    HD2  LYS  12           HD2      LYS  12 -22.415   2.359  14.054
  103    HD3  LYS  12           HD3      LYS  12 -22.899   0.965  15.021
  104    HE2  LYS  12           HE2      LYS  12 -24.110   2.591  16.574
  105    HE3  LYS  12           HE3      LYS  12 -23.792   3.858  15.372
  106    HZ1  LYS  12           HZ1      LYS  12 -25.966   2.824  15.009
  107    HZ2  LYS  12           HZ2      LYS  12 -25.282   1.351  14.871
  108    HZ3  LYS  12           HZ3      LYS  12 -24.980   2.520  13.737
  109    H    THR  13           H        THR  13 -18.113   3.402  13.481
  110    HA   THR  13           HA       THR  13 -16.319   2.219  15.568
  111    HB   THR  13           HB       THR  13 -15.842   0.361  13.920
  112    HG1  THR  13           HG1      THR  13 -18.441   1.041  13.029
  113   HG21  THR  13          HG21      THR  13 -16.957  -0.054  16.021
  114   HG22  THR  13          HG22      THR  13 -17.652  -1.041  14.726
  115   HG23  THR  13          HG23      THR  13 -18.530   0.393  15.316
  116    HA   PRO  14           HA       PRO  14 -13.526   4.633  12.839
  117    HB2  PRO  14           HB2      PRO  14 -12.152   5.944  14.801
  118    HB3  PRO  14           HB3      PRO  14 -13.685   6.546  14.098
  119    HG2  PRO  14           HG2      PRO  14 -13.302   5.001  16.681
  120    HG3  PRO  14           HG3      PRO  14 -14.271   6.482  16.408
  121    HD2  PRO  14           HD2      PRO  14 -15.374   3.981  16.426
  122    HD3  PRO  14           HD3      PRO  14 -15.994   5.276  15.362
  123    H    LYS  15           H        LYS  15 -11.945   3.391  12.150
  124    HA   LYS  15           HA       LYS  15 -10.331   1.676  14.001
  125    HB2  LYS  15           HB2      LYS  15 -11.840   0.900  11.491
  126    HB3  LYS  15           HB3      LYS  15 -10.275   0.170  11.803
  127    HG2  LYS  15           HG2      LYS  15 -11.681  -1.370  12.716
  128    HG3  LYS  15           HG3      LYS  15 -11.105  -0.473  14.110
  129    HD2  LYS  15           HD2      LYS  15 -13.316   0.814  14.079
  130    HD3  LYS  15           HD3      LYS  15 -13.822  -0.224  12.736
  131    HE2  LYS  15           HE2      LYS  15 -14.728  -1.285  14.645
  132    HE3  LYS  15           HE3      LYS  15 -13.274  -2.217  14.272
  133    HZ1  LYS  15           HZ1      LYS  15 -13.317  -1.710  16.627
  134    HZ2  LYS  15           HZ2      LYS  15 -13.549  -0.121  16.361
  135    HZ3  LYS  15           HZ3      LYS  15 -12.114  -0.798  15.963
  136    H    GLY  16           H        GLY  16  -8.230   1.412  13.618
  137    HA2  GLY  16           HA2      GLY  16  -6.822   1.918  11.189
  138    HA3  GLY  16           HA3      GLY  16  -6.740   3.371  12.188
  139    HA   PRO  17           HA       PRO  17  -4.648  -0.307  14.651
  140    HB2  PRO  17           HB2      PRO  17  -3.612  -1.795  12.235
  141    HB3  PRO  17           HB3      PRO  17  -4.055  -2.439  13.845
  142    HG2  PRO  17           HG2      PRO  17  -5.791  -2.686  11.793
  143    HG3  PRO  17           HG3      PRO  17  -6.397  -2.144  13.394
  144    HD2  PRO  17           HD2      PRO  17  -5.719  -0.454  10.971
  145    HD3  PRO  17           HD3      PRO  17  -7.146  -0.381  12.041
  146    H    SER  18           H        SER  18  -2.307  -1.033  14.927
  147    HA   SER  18           HA       SER  18  -0.481   1.162  14.169
  148    HB2  SER  18           HB2      SER  18   0.729   0.402  16.253
  149    HB3  SER  18           HB3      SER  18  -0.895   1.044  16.480
  150    HG   SER  18           HG       SER  18  -0.148  -1.714  16.435
  151    H    SER  19           H        SER  19  -0.798  -1.059  12.255
  152    HA   SER  19           HA       SER  19   2.015  -1.860  11.981
  153    HB2  SER  19           HB2      SER  19   0.746  -3.514  13.568
  154    HB3  SER  19           HB3      SER  19  -0.031  -4.088  12.098
  155    HG   SER  19           HG       SER  19   2.526  -4.354  13.048
  156    H    VAL  20           H        VAL  20   2.024  -3.653  10.065
  157    HA   VAL  20           HA       VAL  20   1.231  -2.404   7.635
  158    HB   VAL  20           HB       VAL  20   1.917  -5.298   8.254
  159   HG11  VAL  20          HG11      VAL  20   0.758  -5.341   6.137
  160   HG12  VAL  20          HG12      VAL  20   1.690  -3.946   5.535
  161   HG13  VAL  20          HG13      VAL  20   2.483  -5.513   5.832
  162   HG21  VAL  20          HG21      VAL  20   4.121  -4.702   7.339
  163   HG22  VAL  20          HG22      VAL  20   3.579  -3.036   7.060
  164   HG23  VAL  20          HG23      VAL  20   3.733  -3.678   8.714
  165    H    GLU  21           H        GLU  21  -0.583  -4.741   9.633
  166    HA   GLU  21           HA       GLU  21  -2.678  -5.234   7.846
  167    HB2  GLU  21           HB2      GLU  21  -3.967  -5.923   9.689
  168    HB3  GLU  21           HB3      GLU  21  -2.299  -6.363  10.027
  169    HG2  GLU  21           HG2      GLU  21  -2.086  -4.435  11.549
  170    HG3  GLU  21           HG3      GLU  21  -3.725  -3.911  11.153
  171    H    ASP  22           H        ASP  22  -2.043  -2.178   9.466
  172    HA   ASP  22           HA       ASP  22  -4.657  -0.941   9.036
  173    HB2  ASP  22           HB2      ASP  22  -2.970  -0.144  10.707
  174    HB3  ASP  22           HB3      ASP  22  -1.871   0.257   9.388
  175    H    ILE  23           H        ILE  23  -1.645  -1.332   7.176
  176    HA   ILE  23           HA       ILE  23  -2.416   0.517   5.064
  177    HB   ILE  23           HB       ILE  23  -0.408  -1.787   4.938
  178   HG12  ILE  23          HG12      ILE  23   0.219   1.120   5.569
  179   HG13  ILE  23          HG13      ILE  23   0.075  -0.126   6.813
  180   HG21  ILE  23          HG21      ILE  23  -0.683   0.728   3.240
  181   HG22  ILE  23          HG22      ILE  23   0.594  -0.496   3.080
  182   HG23  ILE  23          HG23      ILE  23  -1.072  -0.932   2.731
  183   HD11  ILE  23          HD11      ILE  23   2.400   0.102   6.382
  184   HD12  ILE  23          HD12      ILE  23   1.890  -1.437   5.671
  185   HD13  ILE  23          HD13      ILE  23   2.170  -0.021   4.638
  186    H    LYS  24           H        LYS  24  -2.506  -3.018   5.516
  187    HA   LYS  24           HA       LYS  24  -3.947  -3.749   3.125
  188    HB2  LYS  24           HB2      LYS  24  -3.585  -4.920   5.886
  189    HB3  LYS  24           HB3      LYS  24  -4.920  -5.511   4.912
  190    HG2  LYS  24           HG2      LYS  24  -2.977  -6.929   4.690
  191    HG3  LYS  24           HG3      LYS  24  -3.507  -6.219   3.165
  192    HD2  LYS  24           HD2      LYS  24  -1.680  -4.633   3.184
  193    HD3  LYS  24           HD3      LYS  24  -1.162  -5.132   4.784
  194    HE2  LYS  24           HE2      LYS  24  -1.084  -6.831   2.236
  195    HE3  LYS  24           HE3      LYS  24   0.294  -6.015   2.988
  196    HZ1  LYS  24           HZ1      LYS  24  -0.320  -7.460   5.016
  197    HZ2  LYS  24           HZ2      LYS  24   0.450  -8.200   3.731
  198    HZ3  LYS  24           HZ3      LYS  24  -1.178  -8.355   3.985
  199    H    ALA  25           H        ALA  25  -5.347  -3.074   6.386
  200    HA   ALA  25           HA       ALA  25  -7.991  -3.300   5.487
  201    HB1  ALA  25           HB1      ALA  25  -6.855  -1.720   7.826
  202    HB2  ALA  25           HB2      ALA  25  -8.550  -2.243   7.639
  203    HB3  ALA  25           HB3      ALA  25  -7.257  -3.453   7.801
  204    H    LYS  26           H        LYS  26  -6.028  -0.254   5.673
  205    HA   LYS  26           HA       LYS  26  -8.235   1.376   4.717
  206    HB2  LYS  26           HB2      LYS  26  -5.288   1.866   5.131
  207    HB3  LYS  26           HB3      LYS  26  -6.237   2.999   4.184
  208    HG2  LYS  26           HG2      LYS  26  -6.189   3.818   6.427
  209    HG3  LYS  26           HG3      LYS  26  -7.830   3.295   6.050
  210    HD2  LYS  26           HD2      LYS  26  -7.357   1.173   7.331
  211    HD3  LYS  26           HD3      LYS  26  -5.771   1.810   7.727
  212    HE2  LYS  26           HE2      LYS  26  -8.259   3.426   8.321
  213    HE3  LYS  26           HE3      LYS  26  -7.705   2.157   9.424
  214    HZ1  LYS  26           HZ1      LYS  26  -5.601   3.231   9.600
  215    HZ2  LYS  26           HZ2      LYS  26  -6.760   4.327  10.001
  216    HZ3  LYS  26           HZ3      LYS  26  -6.013   4.427   8.535
  217    H    MET  27           H        MET  27  -5.636  -0.354   2.946
  218    HA   MET  27           HA       MET  27  -6.441   0.748   0.370
  219    HB2  MET  27           HB2      MET  27  -4.859  -1.722   1.155
  220    HB3  MET  27           HB3      MET  27  -5.276  -1.324  -0.519
  221    HG2  MET  27           HG2      MET  27  -4.188   0.899  -0.254
  222    HG3  MET  27           HG3      MET  27  -3.643   0.418   1.354
  223    HE1  MET  27           HE1      MET  27  -1.758   1.523  -0.948
  224    HE2  MET  27           HE2      MET  27  -1.188   1.058   0.670
  225    HE3  MET  27           HE3      MET  27  -0.360   0.439  -0.777
  226    H    GLN  28           H        GLN  28  -7.445  -2.196   2.194
  227    HA   GLN  28           HA       GLN  28  -9.173  -3.122   0.084
  228    HB2  GLN  28           HB2      GLN  28  -9.330  -3.690   3.066
  229    HB3  GLN  28           HB3      GLN  28 -10.140  -4.580   1.791
  230    HG2  GLN  28           HG2      GLN  28  -7.498  -4.983   2.889
  231    HG3  GLN  28           HG3      GLN  28  -8.441  -6.016   1.849
  232   HE21  GLN  28          HE21      GLN  28  -8.346  -5.360  -0.615
  233   HE22  GLN  28          HE22      GLN  28  -6.731  -4.890  -1.152
  234    H    ALA  29           H        ALA  29  -9.802  -0.977   2.894
  235    HA   ALA  29           HA       ALA  29 -12.544  -0.435   2.292
  236    HB1  ALA  29           HB1      ALA  29 -10.426   1.315   3.614
  237    HB2  ALA  29           HB2      ALA  29 -12.182   1.561   3.683
  238    HB3  ALA  29           HB3      ALA  29 -11.460   0.124   4.434
  239    H    SER  30           H        SER  30  -9.517   1.163   1.057
  240    HA   SER  30           HA       SER  30 -10.849   3.014  -0.650
  241    HB2  SER  30           HB2      SER  30  -8.128   1.688  -0.799
  242    HB3  SER  30           HB3      SER  30  -8.686   2.845  -2.013
  243    HG   SER  30           HG       SER  30  -7.507   3.613   0.032
  244    H    ILE  31           H        ILE  31 -10.021  -0.426  -1.304
  245    HA   ILE  31           HA       ILE  31 -11.152  -0.417  -3.963
  246    HB   ILE  31           HB       ILE  31 -10.552  -2.636  -1.980
  247   HG12  ILE  31          HG12      ILE  31  -9.246  -1.695  -4.573
  248   HG13  ILE  31          HG13      ILE  31  -8.663  -1.362  -2.945
  249   HG21  ILE  31          HG21      ILE  31 -12.379  -3.485  -3.386
  250   HG22  ILE  31          HG22      ILE  31 -11.521  -2.958  -4.854
  251   HG23  ILE  31          HG23      ILE  31 -10.878  -4.261  -3.830
  252   HD11  ILE  31          HD11      ILE  31  -7.303  -3.103  -3.796
  253   HD12  ILE  31          HD12      ILE  31  -8.387  -3.849  -2.603
  254   HD13  ILE  31          HD13      ILE  31  -8.692  -4.048  -4.345
  255    H    GLU  32           H        GLU  32 -12.707  -0.460  -0.810
  256    HA   GLU  32           HA       GLU  32 -15.328  -1.099  -2.043
  257    HB2  GLU  32           HB2      GLU  32 -14.595  -0.287   0.793
  258    HB3  GLU  32           HB3      GLU  32 -16.224  -0.641   0.236
  259    HG2  GLU  32           HG2      GLU  32 -13.875  -2.554   0.312
  260    HG3  GLU  32           HG3      GLU  32 -15.286  -2.552   1.380
  261    H    LYS  33           H        LYS  33 -13.545   1.824  -1.204
  262    HA   LYS  33           HA       LYS  33 -16.011   3.482  -1.666
  263    HB2  LYS  33           HB2      LYS  33 -13.806   3.787   0.420
  264    HB3  LYS  33           HB3      LYS  33 -15.188   4.860   0.242
  265    HG2  LYS  33           HG2      LYS  33 -15.358   1.911   1.007
  266    HG3  LYS  33           HG3      LYS  33 -15.448   3.261   2.117
  267    HD2  LYS  33           HD2      LYS  33 -17.492   4.091   0.985
  268    HD3  LYS  33           HD3      LYS  33 -17.416   2.743  -0.157
  269    HE2  LYS  33           HE2      LYS  33 -17.588   1.129   1.729
  270    HE3  LYS  33           HE3      LYS  33 -17.728   2.480   2.858
  271    HZ1  LYS  33           HZ1      LYS  33 -19.907   1.592   2.194
  272    HZ2  LYS  33           HZ2      LYS  33 -19.602   1.946   0.618
  273    HZ3  LYS  33           HZ3      LYS  33 -19.758   3.160   1.704
  274    H    GLY  34           H        GLY  34 -12.843   3.229  -2.881
  275    HA2  GLY  34           HA2      GLY  34 -12.725   4.809  -4.887
  276    HA3  GLY  34           HA3      GLY  34 -12.831   6.117  -3.711
  277    H    GLY  35           H        GLY  35 -11.079   6.189  -2.004
  278    HA2  GLY  35           HA2      GLY  35  -8.840   6.283  -1.415
  279    HA3  GLY  35           HA3      GLY  35  -8.526   4.906  -2.463
  280    H    SER  36           H        SER  36  -6.506   6.049  -2.838
  281    HA   SER  36           HA       SER  36  -6.630   7.750  -5.248
  282    HB2  SER  36           HB2      SER  36  -6.638   9.190  -3.106
  283    HB3  SER  36           HB3      SER  36  -4.966   8.650  -2.878
  284    HG   SER  36           HG       SER  36  -4.473  10.153  -4.201
  285    H    LEU  37           H        LEU  37  -5.844   5.023  -5.103
  286    HA   LEU  37           HA       LEU  37  -3.067   4.743  -4.460
  287    HB2  LEU  37           HB2      LEU  37  -5.094   2.989  -5.867
  288    HB3  LEU  37           HB3      LEU  37  -3.392   2.570  -5.909
  289    HG   LEU  37           HG       LEU  37  -3.299   2.557  -3.430
  290   HD11  LEU  37          HD11      LEU  37  -5.393   2.360  -2.138
  291   HD12  LEU  37          HD12      LEU  37  -6.340   2.737  -3.592
  292   HD13  LEU  37          HD13      LEU  37  -5.266   3.958  -2.873
  293   HD21  LEU  37          HD21      LEU  37  -4.436   0.399  -3.186
  294   HD22  LEU  37          HD22      LEU  37  -3.613   0.493  -4.753
  295   HD23  LEU  37          HD23      LEU  37  -5.375   0.704  -4.664
  296    HA   PRO  38           HA       PRO  38  -1.274   5.733  -8.555
  297    HB2  PRO  38           HB2      PRO  38   1.332   5.395  -8.002
  298    HB3  PRO  38           HB3      PRO  38   0.401   6.737  -7.258
  299    HG2  PRO  38           HG2      PRO  38   0.996   4.002  -6.086
  300    HG3  PRO  38           HG3      PRO  38   1.293   5.607  -5.331
  301    HD2  PRO  38           HD2      PRO  38  -0.949   4.109  -4.825
  302    HD3  PRO  38           HD3      PRO  38  -0.995   5.900  -4.869
  303    H    LYS  39           H        LYS  39   0.161   4.534 -10.130
  304    HA   LYS  39           HA       LYS  39  -0.501   1.614 -10.050
  305    HB2  LYS  39           HB2      LYS  39  -1.427   3.134 -11.827
  306    HB3  LYS  39           HB3      LYS  39   0.217   3.314 -12.462
  307    HG2  LYS  39           HG2      LYS  39   0.319   0.878 -12.900
  308    HG3  LYS  39           HG3      LYS  39  -1.237   0.653 -12.092
  309    HD2  LYS  39           HD2      LYS  39  -1.584   0.547 -14.467
  310    HD3  LYS  39           HD3      LYS  39  -2.350   2.020 -13.854
  311    HE2  LYS  39           HE2      LYS  39  -0.380   3.349 -14.622
  312    HE3  LYS  39           HE3      LYS  39   0.398   1.863 -15.180
  313    HZ1  LYS  39           HZ1      LYS  39  -1.478   1.577 -16.742
  314    HZ2  LYS  39           HZ2      LYS  39  -0.618   2.942 -17.009
  315    HZ3  LYS  39           HZ3      LYS  39  -2.112   3.007 -16.286
  316    H    VAL  40           H        VAL  40   2.305   3.736 -10.477
  317    HA   VAL  40           HA       VAL  40   4.025   1.430 -11.140
  318    HB   VAL  40           HB       VAL  40   4.135   3.430 -12.499
  319   HG11  VAL  40          HG11      VAL  40   3.795   5.168 -10.786
  320   HG12  VAL  40          HG12      VAL  40   5.410   4.819 -10.117
  321   HG13  VAL  40          HG13      VAL  40   5.238   5.462 -11.763
  322   HG21  VAL  40          HG21      VAL  40   6.754   2.898 -11.036
  323   HG22  VAL  40          HG22      VAL  40   6.079   1.897 -12.345
  324   HG23  VAL  40          HG23      VAL  40   6.566   3.567 -12.659
  325    H    GLU  41           H        GLU  41   5.701   0.661 -10.023
  326    HA   GLU  41           HA       GLU  41   5.492   0.337  -7.325
  327    HB2  GLU  41           HB2      GLU  41   7.710  -0.720  -7.422
  328    HB3  GLU  41           HB3      GLU  41   6.622  -1.180  -8.723
  329    HG2  GLU  41           HG2      GLU  41   7.897   0.673 -10.115
  330    HG3  GLU  41           HG3      GLU  41   9.128   0.504  -8.866
  331    H    ALA  42           H        ALA  42   7.967   2.698  -8.670
  332    HA   ALA  42           HA       ALA  42   8.919   3.427  -6.112
  333    HB1  ALA  42           HB1      ALA  42   9.806   5.426  -7.260
  334    HB2  ALA  42           HB2      ALA  42  10.041   3.966  -8.234
  335    HB3  ALA  42           HB3      ALA  42   8.749   5.110  -8.653
  336    H    LYS  43           H        LYS  43   6.151   4.775  -7.901
  337    HA   LYS  43           HA       LYS  43   5.563   6.885  -5.951
  338    HB2  LYS  43           HB2      LYS  43   3.872   5.682  -8.189
  339    HB3  LYS  43           HB3      LYS  43   3.403   7.062  -7.185
  340    HG2  LYS  43           HG2      LYS  43   5.470   8.262  -7.917
  341    HG3  LYS  43           HG3      LYS  43   5.819   6.913  -9.018
  342    HD2  LYS  43           HD2      LYS  43   3.523   7.322 -10.065
  343    HD3  LYS  43           HD3      LYS  43   3.419   8.788  -9.079
  344    HE2  LYS  43           HE2      LYS  43   5.452   9.683 -10.152
  345    HE3  LYS  43           HE3      LYS  43   5.649   8.183 -11.082
  346    HZ1  LYS  43           HZ1      LYS  43   3.523   8.651 -12.165
  347    HZ2  LYS  43           HZ2      LYS  43   4.546   9.924 -12.381
  348    HZ3  LYS  43           HZ3      LYS  43   3.327  10.016 -11.292
  349    H    PHE  44           H        PHE  44   4.464   3.559  -6.520
  350    HA   PHE  44           HA       PHE  44   2.434   3.546  -4.544
  351    HB2  PHE  44           HB2      PHE  44   2.534   1.839  -6.257
  352    HB3  PHE  44           HB3      PHE  44   4.137   1.340  -5.753
  353    HD1  PHE  44           HD1      PHE  44   0.557   1.388  -4.696
  354    HD2  PHE  44           HD2      PHE  44   4.470  -0.320  -4.069
  355    HE1  PHE  44           HE1      PHE  44  -0.428  -0.330  -3.198
  356    HE2  PHE  44           HE2      PHE  44   3.483  -2.038  -2.581
  357    HZ   PHE  44           HZ       PHE  44   1.030  -2.051  -2.143
  358    H    ILE  45           H        ILE  45   5.924   2.678  -4.300
  359    HA   ILE  45           HA       ILE  45   5.986   2.138  -1.504
  360    HB   ILE  45           HB       ILE  45   8.063   3.170  -3.461
  361   HG12  ILE  45          HG12      ILE  45   7.791   0.467  -2.078
  362   HG13  ILE  45          HG13      ILE  45   7.074   0.801  -3.645
  363   HG21  ILE  45          HG21      ILE  45   9.785   2.595  -1.733
  364   HG22  ILE  45          HG22      ILE  45   8.792   3.963  -1.278
  365   HG23  ILE  45          HG23      ILE  45   8.484   2.363  -0.547
  366   HD11  ILE  45          HD11      ILE  45   9.140  -0.350  -4.011
  367   HD12  ILE  45          HD12      ILE  45   9.338   1.322  -4.570
  368   HD13  ILE  45          HD13      ILE  45  10.050   0.798  -3.022
  369    H    ASN  46           H        ASN  46   6.416   5.316  -3.192
  370    HA   ASN  46           HA       ASN  46   6.606   6.886  -0.816
  371    HB2  ASN  46           HB2      ASN  46   7.078   8.281  -2.513
  372    HB3  ASN  46           HB3      ASN  46   6.167   7.355  -3.690
  373   HD21  ASN  46          HD21      ASN  46   3.888   7.782  -3.966
  374   HD22  ASN  46          HD22      ASN  46   3.220   9.318  -3.443
  375    H    TYR  47           H        TYR  47   3.657   5.785  -2.535
  376    HA   TYR  47           HA       TYR  47   1.825   7.243  -0.887
  377    HB2  TYR  47           HB2      TYR  47   1.324   6.503  -3.150
  378    HB3  TYR  47           HB3      TYR  47   1.436   4.815  -2.669
  379    HD1  TYR  47           HD1      TYR  47  -0.505   7.973  -2.094
  380    HD2  TYR  47           HD2      TYR  47  -0.482   3.668  -1.833
  381    HE1  TYR  47           HE1      TYR  47  -2.944   7.989  -1.600
  382    HE2  TYR  47           HE2      TYR  47  -2.931   3.697  -1.338
  383    HH   TYR  47           HH       TYR  47  -4.765   6.744  -0.998
  384    H    VAL  48           H        VAL  48   2.925   3.830  -0.756
  385    HA   VAL  48           HA       VAL  48   1.493   2.971   1.555
  386    HB   VAL  48           HB       VAL  48   4.196   2.191   0.391
  387   HG11  VAL  48          HG11      VAL  48   4.117   0.190   1.888
  388   HG12  VAL  48          HG12      VAL  48   4.378   1.679   2.787
  389   HG13  VAL  48          HG13      VAL  48   2.764   0.950   2.772
  390   HG21  VAL  48          HG21      VAL  48   1.549   0.682   0.592
  391   HG22  VAL  48          HG22      VAL  48   2.100   1.554  -0.855
  392   HG23  VAL  48          HG23      VAL  48   3.012   0.161  -0.271
  393    H    LYS  49           H        LYS  49   4.768   4.523   1.380
  394    HA   LYS  49           HA       LYS  49   4.984   4.592   4.259
  395    HB2  LYS  49           HB2      LYS  49   6.553   5.978   2.054
  396    HB3  LYS  49           HB3      LYS  49   6.936   6.129   3.775
  397    HG2  LYS  49           HG2      LYS  49   7.009   3.610   3.938
  398    HG3  LYS  49           HG3      LYS  49   6.875   3.526   2.183
  399    HD2  LYS  49           HD2      LYS  49   9.105   4.916   3.727
  400    HD3  LYS  49           HD3      LYS  49   9.185   3.286   3.049
  401    HE2  LYS  49           HE2      LYS  49   8.804   4.221   0.776
  402    HE3  LYS  49           HE3      LYS  49   8.831   5.861   1.446
  403    HZ1  LYS  49           HZ1      LYS  49  11.037   5.048   0.545
  404    HZ2  LYS  49           HZ2      LYS  49  11.087   3.955   1.757
  405    HZ3  LYS  49           HZ3      LYS  49  11.106   5.545   2.111
  406    H    ASN  50           H        ASN  50   3.380   6.769   2.092
  407    HA   ASN  50           HA       ASN  50   2.827   8.783   4.144
  408    HB2  ASN  50           HB2      ASN  50   2.522   9.746   2.118
  409    HB3  ASN  50           HB3      ASN  50   2.043   8.265   1.320
  410   HD21  ASN  50          HD21      ASN  50  -0.164   7.527   1.473
  411   HD22  ASN  50          HD22      ASN  50  -1.425   8.712   1.806
  412    H    CYS  51           H        CYS  51   1.004   5.872   2.946
  413    HA   CYS  51           HA       CYS  51  -1.239   6.193   4.653
  414    HB2  CYS  51           HB2      CYS  51   0.020   3.688   3.457
  415    HB3  CYS  51           HB3      CYS  51  -1.571   3.738   4.231
  416    HG   CYS  51           HG       CYS  51  -2.793   5.211   2.601
  417    H    PHE  52           H        PHE  52   1.771   4.273   5.262
  418    HA   PHE  52           HA       PHE  52   1.520   4.820   8.101
  419    HB2  PHE  52           HB2      PHE  52   0.039   2.749   7.647
  420    HB3  PHE  52           HB3      PHE  52   1.544   1.921   7.283
  421    HD1  PHE  52           HD2      PHE  52  -0.448   3.571   9.946
  422    HD2  PHE  52           HD1      PHE  52   3.028   1.197   9.051
  423    HE1  PHE  52           HE2      PHE  52  -0.135   3.116  12.370
  424    HE2  PHE  52           HE1      PHE  52   3.351   0.750  11.476
  425    HZ   PHE  52           HZ       PHE  52   1.795   1.738  13.137
  426    H    ARG  53           H        ARG  53   3.466   4.312   9.293
  427    HA   ARG  53           HA       ARG  53   5.795   4.765   7.604
  428    HB2  ARG  53           HB2      ARG  53   5.093   6.028   9.671
  429    HB3  ARG  53           HB3      ARG  53   5.586   4.632  10.632
  430    HG2  ARG  53           HG2      ARG  53   7.916   4.879   9.722
  431    HG3  ARG  53           HG3      ARG  53   7.388   6.304   8.816
  432    HD2  ARG  53           HD2      ARG  53   7.260   5.989  11.846
  433    HD3  ARG  53           HD3      ARG  53   8.509   6.881  10.972
  434    HE   ARG  53           HE       ARG  53   6.547   8.305  10.056
  435   HH11  ARG  53          HH11      ARG  53   6.323   6.969  13.351
  436   HH12  ARG  53          HH12      ARG  53   5.487   8.436  13.846
  437   HH21  ARG  53          HH21      ARG  53   5.285   9.798  10.747
  438   HH22  ARG  53          HH22      ARG  53   4.611   9.780  12.375
  439    H    MET  54           H        MET  54   5.915   2.705   6.579
  440    HA   MET  54           HA       MET  54   7.396   0.637   8.171
  441    HB2  MET  54           HB2      MET  54   5.013   0.295   6.348
  442    HB3  MET  54           HB3      MET  54   6.199  -1.005   6.500
  443    HG2  MET  54           HG2      MET  54   5.019   0.273   8.969
  444    HG3  MET  54           HG3      MET  54   4.147  -0.990   8.102
  445    HE1  MET  54           HE1      MET  54   5.411  -0.771  11.236
  446    HE2  MET  54           HE2      MET  54   4.216  -1.986  10.724
  447    HE3  MET  54           HE3      MET  54   5.734  -2.495  11.499
  448    H    THR  55           H        THR  55   9.375   0.893   7.524
  449    HA   THR  55           HA       THR  55  10.087   1.146   4.652
  450    HB   THR  55           HB       THR  55  12.345   1.677   5.479
  451    HG1  THR  55           HG1      THR  55  11.152   1.639   8.057
  452   HG21  THR  55          HG21      THR  55  10.712   3.514   5.189
  453   HG22  THR  55          HG22      THR  55  11.868   3.837   6.489
  454   HG23  THR  55          HG23      THR  55  10.211   3.336   6.885
  455    H    ASP  56           H        ASP  56   9.512  -1.460   6.555
  456    HA   ASP  56           HA       ASP  56  11.824  -3.133   6.115
  457    HB2  ASP  56           HB2      ASP  56   8.907  -3.808   6.649
  458    HB3  ASP  56           HB3      ASP  56  10.194  -5.009   6.549
  459    H    GLN  57           H        GLN  57  12.575  -3.781   4.206
  460    HA   GLN  57           HA       GLN  57  11.179  -3.571   1.776
  461    HB2  GLN  57           HB2      GLN  57  13.664  -3.685   2.118
  462    HB3  GLN  57           HB3      GLN  57  13.512  -5.420   2.407
  463    HG2  GLN  57           HG2      GLN  57  14.231  -4.973   0.107
  464    HG3  GLN  57           HG3      GLN  57  12.641  -5.730   0.107
  465   HE21  GLN  57          HE21      GLN  57  10.835  -4.529  -0.669
  466   HE22  GLN  57          HE22      GLN  57  11.049  -2.957  -1.438
  467    H    GLU  58           H        GLU  58  11.315  -6.359   3.999
  468    HA   GLU  58           HA       GLU  58  10.017  -8.206   2.229
  469    HB2  GLU  58           HB2      GLU  58   9.516  -9.542   4.186
  470    HB3  GLU  58           HB3      GLU  58  11.205  -9.055   4.105
  471    HG2  GLU  58           HG2      GLU  58  10.891  -7.400   5.866
  472    HG3  GLU  58           HG3      GLU  58   9.148  -7.693   5.889
  473    H    ALA  59           H        ALA  59   8.609  -5.703   4.381
  474    HA   ALA  59           HA       ALA  59   5.881  -6.729   3.937
  475    HB1  ALA  59           HB1      ALA  59   6.830  -4.142   5.223
  476    HB2  ALA  59           HB2      ALA  59   5.165  -4.767   5.175
  477    HB3  ALA  59           HB3      ALA  59   6.418  -5.657   6.075
  478    H    ILE  60           H        ILE  60   7.974  -4.146   2.656
  479    HA   ILE  60           HA       ILE  60   6.079  -2.864   0.940
  480    HB   ILE  60           HB       ILE  60   9.075  -3.265   0.815
  481   HG12  ILE  60          HG12      ILE  60   7.423  -0.762   1.372
  482   HG13  ILE  60          HG13      ILE  60   8.008  -1.846   2.632
  483   HG21  ILE  60          HG21      ILE  60   9.099  -1.471  -0.967
  484   HG22  ILE  60          HG22      ILE  60   8.362  -2.962  -1.525
  485   HG23  ILE  60          HG23      ILE  60   7.330  -1.598  -1.061
  486   HD11  ILE  60          HD11      ILE  60  10.355  -1.477   1.825
  487   HD12  ILE  60          HD12      ILE  60   9.729  -0.199   0.752
  488   HD13  ILE  60          HD13      ILE  60   9.555  -0.042   2.506
  489    H    GLN  61           H        GLN  61   8.239  -5.690   0.281
  490    HA   GLN  61           HA       GLN  61   6.986  -6.109  -2.296
  491    HB2  GLN  61           HB2      GLN  61   8.387  -7.970  -2.565
  492    HB3  GLN  61           HB3      GLN  61   9.310  -6.712  -1.768
  493    HG2  GLN  61           HG2      GLN  61   9.975  -8.641  -0.652
  494    HG3  GLN  61           HG3      GLN  61   8.822  -7.885   0.425
  495   HE21  GLN  61          HE21      GLN  61   7.639  -9.521   1.436
  496   HE22  GLN  61          HE22      GLN  61   6.970 -10.908   0.616
  497    H    ASP  62           H        ASP  62   6.238  -7.437   0.978
  498    HA   ASP  62           HA       ASP  62   4.362  -9.389   0.119
  499    HB2  ASP  62           HB2      ASP  62   5.100  -9.100   2.490
  500    HB3  ASP  62           HB3      ASP  62   4.178  -7.604   2.592
  501    H    LEU  63           H        LEU  63   3.909  -5.951   0.883
  502    HA   LEU  63           HA       LEU  63   1.170  -5.670   0.306
  503    HB2  LEU  63           HB2      LEU  63   3.584  -3.861   0.356
  504    HB3  LEU  63           HB3      LEU  63   2.061  -3.205  -0.229
  505    HG   LEU  63           HG       LEU  63   2.261  -4.590   2.476
  506   HD11  LEU  63          HD11      LEU  63   2.566  -1.623   1.848
  507   HD12  LEU  63          HD12      LEU  63   3.855  -2.695   2.435
  508   HD13  LEU  63          HD13      LEU  63   2.465  -2.350   3.471
  509   HD21  LEU  63          HD21      LEU  63   0.250  -3.259   2.945
  510   HD22  LEU  63          HD22      LEU  63  -0.018  -4.235   1.484
  511   HD23  LEU  63          HD23      LEU  63   0.335  -2.510   1.337
  512    H    TRP  64           H        TRP  64   4.004  -5.079  -1.851
  513    HA   TRP  64           HA       TRP  64   2.491  -4.329  -4.127
  514    HB2  TRP  64           HB2      TRP  64   4.970  -4.007  -3.644
  515    HB3  TRP  64           HB3      TRP  64   5.214  -5.679  -4.113
  516    HD1  TRP  64           HD1      TRP  64   3.061  -3.004  -5.939
  517    HE1  TRP  64           HE1      TRP  64   3.983  -2.644  -8.307
  518    HE3  TRP  64           HE3      TRP  64   7.187  -6.033  -5.673
  519    HZ2  TRP  64           HZ2      TRP  64   6.240  -3.513  -9.858
  520    HZ3  TRP  64           HZ3      TRP  64   8.747  -6.199  -7.607
  521    HH2  TRP  64           HH2      TRP  64   8.273  -4.949  -9.705
  522    H    GLN  65           H        GLN  65   3.772  -7.594  -3.265
  523    HA   GLN  65           HA       GLN  65   2.602  -8.904  -5.545
  524    HB2  GLN  65           HB2      GLN  65   3.785  -9.779  -2.915
  525    HB3  GLN  65           HB3      GLN  65   2.806 -10.928  -3.808
  526    HG2  GLN  65           HG2      GLN  65   5.187 -11.148  -4.380
  527    HG3  GLN  65           HG3      GLN  65   4.178 -10.781  -5.772
  528   HE21  GLN  65          HE21      GLN  65   6.581  -9.352  -3.527
  529   HE22  GLN  65          HE22      GLN  65   7.112  -8.159  -4.712
  530    H    TRP  66           H        TRP  66   1.206  -8.135  -2.324
  531    HA   TRP  66           HA       TRP  66  -1.278  -9.519  -2.962
  532    HB2  TRP  66           HB2      TRP  66  -0.139  -8.562  -0.625
  533    HB3  TRP  66           HB3      TRP  66  -1.451  -7.444  -0.884
  534    HD1  TRP  66           HD1      TRP  66  -3.723  -9.377  -1.875
  535    HE1  TRP  66           HE1      TRP  66  -4.707 -11.195  -0.368
  536    HE3  TRP  66           HE3      TRP  66   0.163  -9.883   1.441
  537    HZ2  TRP  66           HZ2      TRP  66  -3.928 -12.675   1.975
  538    HZ3  TRP  66           HZ3      TRP  66   0.016 -11.532   3.282
  539    HH2  TRP  66           HH2      TRP  66  -2.007 -12.941   3.555
  540    H    ARG  67           H        ARG  67  -0.033  -6.615  -4.208
  541    HA   ARG  67           HA       ARG  67  -2.791  -5.768  -5.079
  542    HB2  ARG  67           HB2      ARG  67  -0.126  -4.391  -5.567
  543    HB3  ARG  67           HB3      ARG  67  -1.706  -3.819  -6.073
  544    HG2  ARG  67           HG2      ARG  67  -0.652  -3.963  -3.228
  545    HG3  ARG  67           HG3      ARG  67  -0.970  -2.549  -4.208
  546    HD2  ARG  67           HD2      ARG  67  -2.734  -2.593  -2.707
  547    HD3  ARG  67           HD3      ARG  67  -3.435  -3.220  -4.199
  548    HE   ARG  67           HE       ARG  67  -3.056  -5.539  -3.192
  549   HH11  ARG  67          HH11      ARG  67  -3.442  -2.903  -0.874
  550   HH12  ARG  67          HH12      ARG  67  -4.369  -3.969   0.178
  551   HH21  ARG  67          HH21      ARG  67  -3.971  -6.772  -1.696
  552   HH22  ARG  67          HH22      ARG  67  -4.431  -6.123  -0.143
  553    H    LYS  68           H        LYS  68   0.070  -7.402  -6.276
  554    HA   LYS  68           HA       LYS  68  -0.924  -7.545  -9.037
  555    HB2  LYS  68           HB2      LYS  68   1.148  -9.207  -7.551
  556    HB3  LYS  68           HB3      LYS  68   0.811  -9.323  -9.282
  557    HG2  LYS  68           HG2      LYS  68   1.505  -6.994  -9.635
  558    HG3  LYS  68           HG3      LYS  68   1.768  -6.782  -7.896
  559    HD2  LYS  68           HD2      LYS  68   3.427  -8.711  -8.012
  560    HD3  LYS  68           HD3      LYS  68   3.314  -8.606  -9.781
  561    HE2  LYS  68           HE2      LYS  68   4.094  -6.286  -9.736
  562    HE3  LYS  68           HE3      LYS  68   3.999  -6.257  -7.967
  563    HZ1  LYS  68           HZ1      LYS  68   5.712  -7.990  -7.907
  564    HZ2  LYS  68           HZ2      LYS  68   6.263  -6.632  -8.631
  565    HZ3  LYS  68           HZ3      LYS  68   5.873  -7.943  -9.544
  566    H    SER  69           H        SER  69  -1.417  -9.486  -6.143
  567    HA   SER  69           HA       SER  69  -3.750 -10.680  -7.528
  568    HB2  SER  69           HB2      SER  69  -2.011 -12.434  -7.556
  569    HB3  SER  69           HB3      SER  69  -1.896 -12.335  -5.787
  570    HG   SER  69           HG       SER  69  -3.299 -13.987  -6.451
  571    H    LEU  70           H        LEU  70  -5.262  -9.584  -6.524
  572    HA   LEU  70           HA       LEU  70  -5.272  -8.756  -3.753
  573    HB2  LEU  70           HB2      LEU  70  -7.402  -8.905  -5.931
  574    HB3  LEU  70           HB3      LEU  70  -7.708  -8.213  -4.348
  575    HG   LEU  70           HG       LEU  70  -5.589  -7.130  -6.248
  576   HD11  LEU  70          HD11      LEU  70  -7.226  -5.343  -6.704
  577   HD12  LEU  70          HD12      LEU  70  -8.432  -6.175  -5.698
  578   HD13  LEU  70          HD13      LEU  70  -7.858  -6.918  -7.206
  579   HD21  LEU  70          HD21      LEU  70  -5.733  -5.135  -4.786
  580   HD22  LEU  70          HD22      LEU  70  -5.222  -6.561  -3.869
  581   HD23  LEU  70          HD23      LEU  70  -6.893  -5.988  -3.735
  Start of MODEL   20
    1    H    GLN   1           H1       GLN   1 -42.032  -6.269  29.202
    2    HA   GLN   1           HA       GLN   1 -42.634  -4.529  27.737
    3    HB2  GLN   1           HB2      GLN   1 -41.141  -2.950  26.859
    4    HB3  GLN   1           HB3      GLN   1 -41.076  -2.805  28.604
    5    HG2  GLN   1           HG2      GLN   1 -38.953  -4.138  26.840
    6    HG3  GLN   1           HG3      GLN   1 -38.874  -2.517  27.511
    7   HE21  GLN   1          HE21      GLN   1 -38.435  -5.950  28.264
    8   HE22  GLN   1          HE22      GLN   1 -37.964  -5.653  29.934
    9    H    GLU   2           H        GLU   2 -42.721  -5.102  25.608
   10    HA   GLU   2           HA       GLU   2 -41.119  -7.381  24.621
   11    HB2  GLU   2           HB2      GLU   2 -43.484  -7.072  24.026
   12    HB3  GLU   2           HB3      GLU   2 -43.138  -5.529  23.262
   13    HG2  GLU   2           HG2      GLU   2 -41.886  -8.164  22.384
   14    HG3  GLU   2           HG3      GLU   2 -43.430  -7.605  21.768
   15    H    SER   3           H        SER   3 -41.421  -3.889  24.029
   16    HA   SER   3           HA       SER   3 -38.699  -3.777  22.838
   17    HB2  SER   3           HB2      SER   3 -39.788  -1.895  21.370
   18    HB3  SER   3           HB3      SER   3 -39.882  -3.596  20.905
   19    HG   SER   3           HG       SER   3 -41.917  -3.723  21.363
   20    H    PHE   4           H        PHE   4 -37.447  -2.108  23.375
   21    HA   PHE   4           HA       PHE   4 -38.183  -0.701  25.837
   22    HB2  PHE   4           HB2      PHE   4 -35.599  -0.980  24.267
   23    HB3  PHE   4           HB3      PHE   4 -35.751  -0.029  25.732
   24    HD1  PHE   4           HD1      PHE   4 -35.839  -3.504  24.386
   25    HD2  PHE   4           HD2      PHE   4 -35.846  -1.041  27.926
   26    HE1  PHE   4           HE1      PHE   4 -35.413  -5.508  25.785
   27    HE2  PHE   4           HE2      PHE   4 -35.393  -3.043  29.317
   28    HZ   PHE   4           HZ       PHE   4 -35.189  -5.285  28.250
   29    H    LYS   5           H        LYS   5 -37.735   1.517  26.225
   30    HA   LYS   5           HA       LYS   5 -38.918   3.303  24.258
   31    HB2  LYS   5           HB2      LYS   5 -37.959   3.656  27.117
   32    HB3  LYS   5           HB3      LYS   5 -38.759   4.929  26.177
   33    HG2  LYS   5           HG2      LYS   5 -40.763   3.585  25.912
   34    HG3  LYS   5           HG3      LYS   5 -40.010   2.185  26.682
   35    HD2  LYS   5           HD2      LYS   5 -39.904   3.319  28.829
   36    HD3  LYS   5           HD3      LYS   5 -40.414   4.845  28.090
   37    HE2  LYS   5           HE2      LYS   5 -42.340   3.941  29.164
   38    HE3  LYS   5           HE3      LYS   5 -42.571   3.802  27.423
   39    HZ1  LYS   5           HZ1      LYS   5 -41.830   1.571  29.250
   40    HZ2  LYS   5           HZ2      LYS   5 -41.948   1.428  27.613
   41    HZ3  LYS   5           HZ3      LYS   5 -43.268   1.832  28.489
   42    H    LYS   6           H        LYS   6 -37.060   2.719  22.852
   43    HA   LYS   6           HA       LYS   6 -35.123   4.952  22.583
   44    HB2  LYS   6           HB2      LYS   6 -33.224   3.405  22.302
   45    HB3  LYS   6           HB3      LYS   6 -33.928   3.322  23.900
   46    HG2  LYS   6           HG2      LYS   6 -33.509   1.112  23.456
   47    HG3  LYS   6           HG3      LYS   6 -35.216   1.219  23.072
   48    HD2  LYS   6           HD2      LYS   6 -34.629   1.345  20.629
   49    HD3  LYS   6           HD3      LYS   6 -32.910   1.238  21.069
   50    HE2  LYS   6           HE2      LYS   6 -33.373  -0.966  22.156
   51    HE3  LYS   6           HE3      LYS   6 -35.071  -0.840  21.661
   52    HZ1  LYS   6           HZ1      LYS   6 -32.740  -0.944  19.813
   53    HZ2  LYS   6           HZ2      LYS   6 -34.298  -0.747  19.349
   54    HZ3  LYS   6           HZ3      LYS   6 -33.862  -2.146  20.036
   55    H    GLN   7           H        GLN   7 -33.874   4.670  20.430
   56    HA   GLN   7           HA       GLN   7 -35.543   3.362  18.306
   57    HB2  GLN   7           HB2      GLN   7 -34.240   6.107  18.267
   58    HB3  GLN   7           HB3      GLN   7 -34.766   5.255  16.814
   59    HG2  GLN   7           HG2      GLN   7 -37.089   5.212  17.609
   60    HG3  GLN   7           HG3      GLN   7 -36.616   6.018  19.111
   61   HE21  GLN   7          HE21      GLN   7 -35.792   8.246  18.978
   62   HE22  GLN   7          HE22      GLN   7 -36.154   9.218  17.550
   63    H    GLU   8           H        GLU   8 -32.238   4.679  18.987
   64    HA   GLU   8           HA       GLU   8 -31.045   2.257  17.797
   65    HB2  GLU   8           HB2      GLU   8 -30.384   5.037  16.717
   66    HB3  GLU   8           HB3      GLU   8 -29.466   3.565  16.417
   67    HG2  GLU   8           HG2      GLU   8 -31.602   2.583  15.393
   68    HG3  GLU   8           HG3      GLU   8 -32.250   4.229  15.414
   69    H    LYS   9           H        LYS   9 -28.915   1.838  18.493
   70    HA   LYS   9           HA       LYS   9 -28.049   3.165  20.947
   71    HB2  LYS   9           HB2      LYS   9 -26.752   0.948  19.308
   72    HB3  LYS   9           HB3      LYS   9 -26.181   1.535  20.869
   73    HG2  LYS   9           HG2      LYS   9 -28.517   0.962  21.791
   74    HG3  LYS   9           HG3      LYS   9 -28.767   0.053  20.295
   75    HD2  LYS   9           HD2      LYS   9 -26.672  -1.257  20.813
   76    HD3  LYS   9           HD3      LYS   9 -26.543  -0.366  22.344
   77    HE2  LYS   9           HE2      LYS   9 -28.867  -1.215  22.924
   78    HE3  LYS   9           HE3      LYS   9 -28.791  -2.225  21.473
   79    HZ1  LYS   9           HZ1      LYS   9 -26.776  -3.266  22.447
   80    HZ2  LYS   9           HZ2      LYS   9 -28.122  -3.503  23.358
   81    HZ3  LYS   9           HZ3      LYS   9 -27.011  -2.377  23.831
   82    H    THR  10           H        THR  10 -27.409   3.928  17.690
   83    HA   THR  10           HA       THR  10 -25.856   5.226  16.625
   84    HB   THR  10           HB       THR  10 -25.523   7.436  17.634
   85    HG1  THR  10           HG1      THR  10 -25.470   6.467  19.833
   86   HG21  THR  10          HG21      THR  10 -27.857   8.072  17.756
   87   HG22  THR  10          HG22      THR  10 -28.358   6.398  18.057
   88   HG23  THR  10          HG23      THR  10 -27.663   6.853  16.483
   89    HA   PRO  11           HA       PRO  11 -22.028   3.757  18.910
   90    HB2  PRO  11           HB2      PRO  11 -21.181   1.768  17.268
   91    HB3  PRO  11           HB3      PRO  11 -22.486   1.511  18.468
   92    HG2  PRO  11           HG2      PRO  11 -22.771   2.161  15.507
   93    HG3  PRO  11           HG3      PRO  11 -23.559   0.835  16.426
   94    HD2  PRO  11           HD2      PRO  11 -24.811   3.211  15.964
   95    HD3  PRO  11           HD3      PRO  11 -25.026   2.318  17.499
   96    H    LYS  12           H        LYS  12 -19.760   3.773  18.188
   97    HA   LYS  12           HA       LYS  12 -19.191   5.182  15.604
   98    HB2  LYS  12           HB2      LYS  12 -18.014   5.900  18.330
   99    HB3  LYS  12           HB3      LYS  12 -17.396   6.439  16.772
  100    HG2  LYS  12           HG2      LYS  12 -18.701   8.244  17.195
  101    HG3  LYS  12           HG3      LYS  12 -19.901   7.247  16.383
  102    HD2  LYS  12           HD2      LYS  12 -20.522   6.444  18.834
  103    HD3  LYS  12           HD3      LYS  12 -19.581   7.857  19.342
  104    HE2  LYS  12           HE2      LYS  12 -21.018   9.252  17.775
  105    HE3  LYS  12           HE3      LYS  12 -21.978   7.793  17.463
  106    HZ1  LYS  12           HZ1      LYS  12 -21.708   9.203  20.062
  107    HZ2  LYS  12           HZ2      LYS  12 -22.427   7.723  19.890
  108    HZ3  LYS  12           HZ3      LYS  12 -23.040   9.072  19.131
  109    H    THR  13           H        THR  13 -18.229   3.700  14.452
  110    HA   THR  13           HA       THR  13 -16.594   1.590  15.783
  111    HB   THR  13           HB       THR  13 -18.211   1.351  13.232
  112    HG1  THR  13           HG1      THR  13 -19.668   1.795  14.694
  113   HG21  THR  13          HG21      THR  13 -16.537  -0.449  13.614
  114   HG22  THR  13          HG22      THR  13 -18.188  -1.040  13.770
  115   HG23  THR  13          HG23      THR  13 -17.217  -0.732  15.227
  116    HA   PRO  14           HA       PRO  14 -13.415   2.900  12.710
  117    HB2  PRO  14           HB2      PRO  14 -11.416   3.711  14.319
  118    HB3  PRO  14           HB3      PRO  14 -12.784   4.796  13.914
  119    HG2  PRO  14           HG2      PRO  14 -12.412   3.113  16.420
  120    HG3  PRO  14           HG3      PRO  14 -12.870   4.839  16.314
  121    HD2  PRO  14           HD2      PRO  14 -14.694   2.776  16.577
  122    HD3  PRO  14           HD3      PRO  14 -15.066   4.322  15.752
  123    H    LYS  15           H        LYS  15 -11.662   1.532  12.187
  124    HA   LYS  15           HA       LYS  15 -10.713  -0.466  14.185
  125    HB2  LYS  15           HB2      LYS  15 -11.655  -1.195  11.377
  126    HB3  LYS  15           HB3      LYS  15 -10.649  -2.213  12.396
  127    HG2  LYS  15           HG2      LYS  15 -12.603  -3.146  12.996
  128    HG3  LYS  15           HG3      LYS  15 -12.597  -1.866  14.180
  129    HD2  LYS  15           HD2      LYS  15 -14.793  -1.981  13.242
  130    HD3  LYS  15           HD3      LYS  15 -14.062  -0.503  12.626
  131    HE2  LYS  15           HE2      LYS  15 -15.211  -1.491  10.797
  132    HE3  LYS  15           HE3      LYS  15 -13.493  -1.753  10.489
  133    HZ1  LYS  15           HZ1      LYS  15 -15.352  -3.762  11.649
  134    HZ2  LYS  15           HZ2      LYS  15 -13.743  -4.014  11.303
  135    HZ3  LYS  15           HZ3      LYS  15 -14.806  -3.752  10.097
  136    H    GLY  16           H        GLY  16  -8.623  -1.287  13.793
  137    HA2  GLY  16           HA2      GLY  16  -6.819  -0.526  11.756
  138    HA3  GLY  16           HA3      GLY  16  -6.835   0.804  12.899
  139    HA   PRO  17           HA       PRO  17  -4.857  -3.196  15.069
  140    HB2  PRO  17           HB2      PRO  17  -3.605  -4.022  12.430
  141    HB3  PRO  17           HB3      PRO  17  -3.947  -5.037  13.864
  142    HG2  PRO  17           HG2      PRO  17  -5.644  -5.084  11.768
  143    HG3  PRO  17           HG3      PRO  17  -6.304  -4.972  13.433
  144    HD2  PRO  17           HD2      PRO  17  -5.951  -2.766  11.403
  145    HD3  PRO  17           HD3      PRO  17  -7.311  -3.073  12.512
  146    H    SER  18           H        SER  18  -2.614  -3.353  15.721
  147    HA   SER  18           HA       SER  18  -0.861  -1.125  14.799
  148    HB2  SER  18           HB2      SER  18  -0.702  -2.801  17.291
  149    HB3  SER  18           HB3      SER  18   0.455  -1.536  16.818
  150    HG   SER  18           HG       SER  18  -1.801  -1.210  18.095
  151    H    SER  19           H        SER  19  -1.294  -3.253  13.063
  152    HA   SER  19           HA       SER  19   1.348  -4.430  12.530
  153    HB2  SER  19           HB2      SER  19  -1.188  -6.059  13.058
  154    HB3  SER  19           HB3      SER  19   0.245  -6.702  12.242
  155    HG   SER  19           HG       SER  19  -0.044  -5.822  14.924
  156    H    VAL  20           H        VAL  20   1.280  -5.603  10.317
  157    HA   VAL  20           HA       VAL  20   0.491  -3.658   8.440
  158    HB   VAL  20           HB       VAL  20   1.286  -6.552   7.958
  159   HG11  VAL  20          HG11      VAL  20   2.084  -5.743   5.734
  160   HG12  VAL  20          HG12      VAL  20   0.334  -5.660   5.879
  161   HG13  VAL  20          HG13      VAL  20   1.301  -4.175   6.037
  162   HG21  VAL  20          HG21      VAL  20   2.937  -3.978   7.968
  163   HG22  VAL  20          HG22      VAL  20   3.006  -5.252   9.201
  164   HG23  VAL  20          HG23      VAL  20   3.538  -5.600   7.562
  165    H    GLU  21           H        GLU  21  -1.462  -6.318   9.583
  166    HA   GLU  21           HA       GLU  21  -3.434  -6.465   7.559
  167    HB2  GLU  21           HB2      GLU  21  -3.772  -6.656  10.581
  168    HB3  GLU  21           HB3      GLU  21  -4.948  -7.171   9.366
  169    HG2  GLU  21           HG2      GLU  21  -3.208  -8.766   8.451
  170    HG3  GLU  21           HG3      GLU  21  -2.183  -8.358   9.835
  171    H    ASP  22           H        ASP  22  -2.821  -3.800   9.772
  172    HA   ASP  22           HA       ASP  22  -5.318  -2.343   9.388
  173    HB2  ASP  22           HB2      ASP  22  -3.853  -1.805  11.221
  174    HB3  ASP  22           HB3      ASP  22  -2.473  -1.579  10.156
  175    H    ILE  23           H        ILE  23  -2.084  -2.114   7.846
  176    HA   ILE  23           HA       ILE  23  -2.788  -0.123   5.942
  177    HB   ILE  23           HB       ILE  23  -0.645  -2.291   5.756
  178   HG12  ILE  23          HG12      ILE  23  -0.427   0.565   6.816
  179   HG13  ILE  23          HG13      ILE  23  -0.460  -0.883   7.817
  180   HG21  ILE  23          HG21      ILE  23  -1.093  -1.254   3.560
  181   HG22  ILE  23          HG22      ILE  23  -0.894   0.362   4.272
  182   HG23  ILE  23          HG23      ILE  23   0.480  -0.759   4.162
  183   HD11  ILE  23          HD11      ILE  23   1.806  -0.226   7.681
  184   HD12  ILE  23          HD12      ILE  23   1.652  -1.667   6.666
  185   HD13  ILE  23          HD13      ILE  23   1.759  -0.047   5.925
  186    H    LYS  24           H        LYS  24  -2.860  -3.688   5.752
  187    HA   LYS  24           HA       LYS  24  -3.865  -3.955   3.073
  188    HB2  LYS  24           HB2      LYS  24  -4.364  -5.695   5.524
  189    HB3  LYS  24           HB3      LYS  24  -4.732  -6.161   3.874
  190    HG2  LYS  24           HG2      LYS  24  -1.907  -5.536   4.848
  191    HG3  LYS  24           HG3      LYS  24  -2.634  -7.139   4.877
  192    HD2  LYS  24           HD2      LYS  24  -2.902  -7.071   2.410
  193    HD3  LYS  24           HD3      LYS  24  -2.185  -5.452   2.386
  194    HE2  LYS  24           HE2      LYS  24  -0.523  -7.097   1.725
  195    HE3  LYS  24           HE3      LYS  24  -0.059  -6.342   3.255
  196    HZ1  LYS  24           HZ1      LYS  24  -1.314  -9.039   3.032
  197    HZ2  LYS  24           HZ2      LYS  24  -0.773  -8.318   4.416
  198    HZ3  LYS  24           HZ3      LYS  24   0.297  -8.723   3.275
  199    H    ALA  25           H        ALA  25  -5.764  -3.856   6.156
  200    HA   ALA  25           HA       ALA  25  -8.274  -3.950   4.793
  201    HB1  ALA  25           HB1      ALA  25  -9.194  -3.528   7.032
  202    HB2  ALA  25           HB2      ALA  25  -7.915  -4.750   7.074
  203    HB3  ALA  25           HB3      ALA  25  -7.579  -3.093   7.632
  204    H    LYS  26           H        LYS  26  -6.393  -1.149   5.983
  205    HA   LYS  26           HA       LYS  26  -8.423   0.853   5.399
  206    HB2  LYS  26           HB2      LYS  26  -5.409   1.071   5.736
  207    HB3  LYS  26           HB3      LYS  26  -6.497   2.428   5.593
  208    HG2  LYS  26           HG2      LYS  26  -5.594   1.108   7.915
  209    HG3  LYS  26           HG3      LYS  26  -6.556   2.544   7.781
  210    HD2  LYS  26           HD2      LYS  26  -7.699  -0.275   7.998
  211    HD3  LYS  26           HD3      LYS  26  -7.416   0.832   9.331
  212    HE2  LYS  26           HE2      LYS  26  -8.969   2.498   8.245
  213    HE3  LYS  26           HE3      LYS  26  -9.372   1.272   7.043
  214    HZ1  LYS  26           HZ1      LYS  26 -11.002   1.103   8.763
  215    HZ2  LYS  26           HZ2      LYS  26  -9.885   1.156   9.959
  216    HZ3  LYS  26           HZ3      LYS  26 -10.013  -0.174   9.008
  217    H    MET  27           H        MET  27  -5.688  -0.470   3.459
  218    HA   MET  27           HA       MET  27  -6.252   1.130   1.126
  219    HB2  MET  27           HB2      MET  27  -5.070  -1.651   1.445
  220    HB3  MET  27           HB3      MET  27  -5.340  -0.910  -0.133
  221    HG2  MET  27           HG2      MET  27  -3.959   1.058   0.606
  222    HG3  MET  27           HG3      MET  27  -3.523   0.153   2.050
  223    HE1  MET  27           HE1      MET  27  -2.370  -2.359   1.841
  224    HE2  MET  27           HE2      MET  27  -3.384  -2.898   0.480
  225    HE3  MET  27           HE3      MET  27  -1.618  -2.954   0.340
  226    H    GLN  28           H        GLN  28  -7.728  -2.005   2.239
  227    HA   GLN  28           HA       GLN  28  -9.436  -2.190  -0.063
  228    HB2  GLN  28           HB2      GLN  28 -10.124  -3.232   2.703
  229    HB3  GLN  28           HB3      GLN  28 -10.828  -3.691   1.160
  230    HG2  GLN  28           HG2      GLN  28  -8.262  -4.552   2.390
  231    HG3  GLN  28           HG3      GLN  28  -9.456  -5.481   1.522
  232   HE21  GLN  28          HE21      GLN  28  -6.411  -4.010   1.304
  233   HE22  GLN  28          HE22      GLN  28  -6.211  -4.269  -0.453
  234    H    ALA  29           H        ALA  29  -9.960  -0.460   3.051
  235    HA   ALA  29           HA       ALA  29 -12.619   0.405   2.448
  236    HB1  ALA  29           HB1      ALA  29 -10.464   1.754   4.132
  237    HB2  ALA  29           HB2      ALA  29 -12.205   2.097   4.175
  238    HB3  ALA  29           HB3      ALA  29 -11.606   0.512   4.689
  239    H    SER  30           H        SER  30  -9.442   1.970   1.617
  240    HA   SER  30           HA       SER  30 -10.615   4.193   0.232
  241    HB2  SER  30           HB2      SER  30  -7.942   2.798  -0.126
  242    HB3  SER  30           HB3      SER  30  -8.397   4.295  -0.962
  243    HG   SER  30           HG       SER  30  -8.395   5.396   0.876
  244    H    ILE  31           H        ILE  31  -9.906   0.879  -0.919
  245    HA   ILE  31           HA       ILE  31 -10.666   1.369  -3.654
  246    HB   ILE  31           HB       ILE  31 -10.530  -1.177  -2.016
  247   HG12  ILE  31          HG12      ILE  31  -8.776  -0.297  -4.336
  248   HG13  ILE  31          HG13      ILE  31  -8.405   0.196  -2.690
  249   HG21  ILE  31          HG21      ILE  31 -12.179  -1.581  -3.774
  250   HG22  ILE  31          HG22      ILE  31 -11.113  -0.844  -4.995
  251   HG23  ILE  31          HG23      ILE  31 -10.676  -2.373  -4.218
  252   HD11  ILE  31          HD11      ILE  31  -7.075  -1.719  -3.241
  253   HD12  ILE  31          HD12      ILE  31  -8.251  -2.192  -2.008
  254   HD13  ILE  31          HD13      ILE  31  -8.496  -2.668  -3.706
  255    H    GLU  32           H        GLU  32 -12.583   0.186  -0.847
  256    HA   GLU  32           HA       GLU  32 -15.117   0.100  -2.200
  257    HB2  GLU  32           HB2      GLU  32 -14.436   0.527   0.730
  258    HB3  GLU  32           HB3      GLU  32 -16.049   0.178   0.126
  259    HG2  GLU  32           HG2      GLU  32 -13.714  -1.727  -0.325
  260    HG3  GLU  32           HG3      GLU  32 -14.701  -1.766   1.120
  261    H    LYS  33           H        LYS  33 -13.271   2.822  -1.224
  262    HA   LYS  33           HA       LYS  33 -15.575   4.700  -1.594
  263    HB2  LYS  33           HB2      LYS  33 -12.967   5.021  -0.091
  264    HB3  LYS  33           HB3      LYS  33 -14.168   6.299  -0.294
  265    HG2  LYS  33           HG2      LYS  33 -15.867   4.988   0.889
  266    HG3  LYS  33           HG3      LYS  33 -14.752   3.651   1.111
  267    HD2  LYS  33           HD2      LYS  33 -14.270   6.453   2.215
  268    HD3  LYS  33           HD3      LYS  33 -14.977   5.103   3.132
  269    HE2  LYS  33           HE2      LYS  33 -12.950   3.749   2.698
  270    HE3  LYS  33           HE3      LYS  33 -12.220   5.101   1.820
  271    HZ1  LYS  33           HZ1      LYS  33 -11.414   5.025   4.035
  272    HZ2  LYS  33           HZ2      LYS  33 -12.922   5.075   4.699
  273    HZ3  LYS  33           HZ3      LYS  33 -12.303   6.384   3.889
  274    H    GLY  34           H        GLY  34 -13.592   3.461  -3.674
  275    HA2  GLY  34           HA2      GLY  34 -14.197   4.918  -5.730
  276    HA3  GLY  34           HA3      GLY  34 -13.034   6.062  -5.084
  277    H    GLY  35           H        GLY  35 -12.292   2.612  -4.929
  278    HA2  GLY  35           HA2      GLY  35 -10.708   1.337  -6.062
  279    HA3  GLY  35           HA3      GLY  35 -10.641   2.556  -7.341
  280    H    SER  36           H        SER  36  -9.587   4.643  -6.718
  281    HA   SER  36           HA       SER  36  -7.823   5.900  -6.034
  282    HB2  SER  36           HB2      SER  36  -9.335   5.439  -3.954
  283    HB3  SER  36           HB3      SER  36  -7.967   4.481  -3.374
  284    HG   SER  36           HG       SER  36  -8.344   7.180  -3.547
  285    H    LEU  37           H        LEU  37  -5.753   5.678  -4.411
  286    HA   LEU  37           HA       LEU  37  -3.646   5.060  -4.086
  287    HB2  LEU  37           HB2      LEU  37  -4.367   2.246  -4.935
  288    HB3  LEU  37           HB3      LEU  37  -2.999   2.728  -3.954
  289    HG   LEU  37           HG       LEU  37  -5.933   2.931  -3.116
  290   HD11  LEU  37          HD11      LEU  37  -5.102   0.620  -3.276
  291   HD12  LEU  37          HD12      LEU  37  -5.419   1.103  -1.608
  292   HD13  LEU  37          HD13      LEU  37  -3.742   1.032  -2.202
  293   HD21  LEU  37          HD21      LEU  37  -3.381   3.456  -1.528
  294   HD22  LEU  37          HD22      LEU  37  -5.026   3.391  -0.858
  295   HD23  LEU  37          HD23      LEU  37  -4.600   4.670  -1.995
  296    HA   PRO  38           HA       PRO  38  -1.534   5.526  -7.958
  297    HB2  PRO  38           HB2      PRO  38   1.082   5.068  -7.280
  298    HB3  PRO  38           HB3      PRO  38   0.176   6.529  -6.775
  299    HG2  PRO  38           HG2      PRO  38   0.569   3.960  -5.210
  300    HG3  PRO  38           HG3      PRO  38   0.906   5.641  -4.669
  301    HD2  PRO  38           HD2      PRO  38  -1.408   4.408  -4.030
  302    HD3  PRO  38           HD3      PRO  38  -1.424   6.128  -4.522
  303    H    LYS  39           H        LYS  39  -0.198   4.376  -9.524
  304    HA   LYS  39           HA       LYS  39  -0.765   1.432  -9.467
  305    HB2  LYS  39           HB2      LYS  39  -1.517   1.619 -11.764
  306    HB3  LYS  39           HB3      LYS  39  -2.439   2.688 -10.711
  307    HG2  LYS  39           HG2      LYS  39  -1.221   4.644 -11.495
  308    HG3  LYS  39           HG3      LYS  39  -0.101   3.632 -12.430
  309    HD2  LYS  39           HD2      LYS  39  -2.018   2.856 -13.815
  310    HD3  LYS  39           HD3      LYS  39  -3.096   3.944 -12.920
  311    HE2  LYS  39           HE2      LYS  39  -1.764   5.898 -13.648
  312    HE3  LYS  39           HE3      LYS  39  -0.606   4.832 -14.451
  313    HZ1  LYS  39           HZ1      LYS  39  -3.455   5.162 -15.216
  314    HZ2  LYS  39           HZ2      LYS  39  -2.403   4.079 -15.900
  315    HZ3  LYS  39           HZ3      LYS  39  -2.158   5.694 -16.063
  316    H    VAL  40           H        VAL  40   1.917   2.999  -9.182
  317    HA   VAL  40           HA       VAL  40   3.449   1.114 -10.865
  318    HB   VAL  40           HB       VAL  40   3.182   3.140 -12.220
  319   HG11  VAL  40          HG11      VAL  40   3.055   4.851 -10.443
  320   HG12  VAL  40          HG12      VAL  40   4.780   4.587 -10.070
  321   HG13  VAL  40          HG13      VAL  40   4.294   5.236 -11.645
  322   HG21  VAL  40          HG21      VAL  40   6.066   2.824 -11.308
  323   HG22  VAL  40          HG22      VAL  40   5.208   1.737 -12.433
  324   HG23  VAL  40          HG23      VAL  40   5.479   3.435 -12.859
  325    H    GLU  41           H        GLU  41   5.454   0.578 -10.114
  326    HA   GLU  41           HA       GLU  41   5.659   0.064  -7.492
  327    HB2  GLU  41           HB2      GLU  41   7.992  -0.589  -7.865
  328    HB3  GLU  41           HB3      GLU  41   6.902  -1.107  -9.136
  329    HG2  GLU  41           HG2      GLU  41   7.759   1.100 -10.368
  330    HG3  GLU  41           HG3      GLU  41   9.109   0.948  -9.251
  331    H    ALA  42           H        ALA  42   7.762   2.783  -8.754
  332    HA   ALA  42           HA       ALA  42   8.693   3.356  -6.134
  333    HB1  ALA  42           HB1      ALA  42   9.648   5.380  -7.167
  334    HB2  ALA  42           HB2      ALA  42   9.900   3.938  -8.165
  335    HB3  ALA  42           HB3      ALA  42   8.649   5.117  -8.613
  336    H    LYS  43           H        LYS  43   5.992   4.862  -7.935
  337    HA   LYS  43           HA       LYS  43   5.343   6.867  -5.951
  338    HB2  LYS  43           HB2      LYS  43   3.505   5.508  -7.980
  339    HB3  LYS  43           HB3      LYS  43   3.108   6.928  -7.004
  340    HG2  LYS  43           HG2      LYS  43   5.066   8.120  -8.066
  341    HG3  LYS  43           HG3      LYS  43   5.220   6.735  -9.164
  342    HD2  LYS  43           HD2      LYS  43   2.816   7.126  -9.872
  343    HD3  LYS  43           HD3      LYS  43   2.818   8.597  -8.884
  344    HE2  LYS  43           HE2      LYS  43   4.759   9.433 -10.256
  345    HE3  LYS  43           HE3      LYS  43   4.618   7.995 -11.274
  346    HZ1  LYS  43           HZ1      LYS  43   2.505  10.069 -10.931
  347    HZ2  LYS  43           HZ2      LYS  43   2.347   8.706 -11.839
  348    HZ3  LYS  43           HZ3      LYS  43   3.423   9.842 -12.281
  349    H    PHE  44           H        PHE  44   4.339   3.466  -6.373
  350    HA   PHE  44           HA       PHE  44   2.449   3.537  -4.237
  351    HB2  PHE  44           HB2      PHE  44   2.341   1.844  -5.983
  352    HB3  PHE  44           HB3      PHE  44   3.924   1.221  -5.540
  353    HD1  PHE  44           HD1      PHE  44   0.434   1.692  -4.229
  354    HD2  PHE  44           HD2      PHE  44   4.148  -0.473  -3.884
  355    HE1  PHE  44           HE1      PHE  44  -0.612   0.151  -2.578
  356    HE2  PHE  44           HE2      PHE  44   3.099  -2.009  -2.247
  357    HZ   PHE  44           HZ       PHE  44   0.711  -1.709  -1.603
  358    H    ILE  45           H        ILE  45   5.894   2.453  -4.244
  359    HA   ILE  45           HA       ILE  45   6.023   1.838  -1.449
  360    HB   ILE  45           HB       ILE  45   8.227   2.872  -3.270
  361   HG12  ILE  45          HG12      ILE  45   7.651  -0.018  -2.483
  362   HG13  ILE  45          HG13      ILE  45   6.999   0.667  -3.944
  363   HG21  ILE  45          HG21      ILE  45   8.342   1.384  -0.590
  364   HG22  ILE  45          HG22      ILE  45   9.747   1.781  -1.602
  365   HG23  ILE  45          HG23      ILE  45   8.816   3.073  -0.866
  366   HD11  ILE  45          HD11      ILE  45   9.301   1.193  -4.750
  367   HD12  ILE  45          HD12      ILE  45   9.956   0.357  -3.321
  368   HD13  ILE  45          HD13      ILE  45   8.994  -0.537  -4.508
  369    H    ASN  46           H        ASN  46   6.635   4.981  -3.139
  370    HA   ASN  46           HA       ASN  46   7.158   6.525  -0.803
  371    HB2  ASN  46           HB2      ASN  46   7.669   7.480  -2.910
  372    HB3  ASN  46           HB3      ASN  46   6.071   7.142  -3.568
  373   HD21  ASN  46          HD21      ASN  46   4.395   8.572  -3.226
  374   HD22  ASN  46          HD22      ASN  46   4.585  10.108  -2.425
  375    H    TYR  47           H        TYR  47   3.977   5.748  -2.322
  376    HA   TYR  47           HA       TYR  47   2.526   7.453  -0.507
  377    HB2  TYR  47           HB2      TYR  47   1.903   6.813  -2.843
  378    HB3  TYR  47           HB3      TYR  47   1.436   5.220  -2.238
  379    HD1  TYR  47           HD1      TYR  47   0.760   8.875  -2.125
  380    HD2  TYR  47           HD2      TYR  47  -0.695   4.965  -1.014
  381    HE1  TYR  47           HE1      TYR  47  -1.441   9.859  -1.534
  382    HE2  TYR  47           HE2      TYR  47  -2.905   5.961  -0.431
  383    HH   TYR  47           HH       TYR  47  -4.107   7.880  -0.208
  384    H    VAL  48           H        VAL  48   3.273   3.955  -0.478
  385    HA   VAL  48           HA       VAL  48   1.832   3.346   1.950
  386    HB   VAL  48           HB       VAL  48   4.296   2.131   0.636
  387   HG11  VAL  48          HG11      VAL  48   2.818   1.094   3.092
  388   HG12  VAL  48          HG12      VAL  48   4.044   0.203   2.156
  389   HG13  VAL  48          HG13      VAL  48   4.501   1.660   3.027
  390   HG21  VAL  48          HG21      VAL  48   2.763   0.282   0.108
  391   HG22  VAL  48          HG22      VAL  48   1.439   1.099   0.969
  392   HG23  VAL  48          HG23      VAL  48   2.105   1.793  -0.521
  393    H    LYS  49           H        LYS  49   5.208   4.527   1.415
  394    HA   LYS  49           HA       LYS  49   5.818   4.858   4.196
  395    HB2  LYS  49           HB2      LYS  49   6.946   6.105   1.674
  396    HB3  LYS  49           HB3      LYS  49   7.575   6.477   3.283
  397    HG2  LYS  49           HG2      LYS  49   8.145   4.167   3.706
  398    HG3  LYS  49           HG3      LYS  49   7.373   3.631   2.205
  399    HD2  LYS  49           HD2      LYS  49   9.000   4.935   0.878
  400    HD3  LYS  49           HD3      LYS  49   9.779   5.497   2.374
  401    HE2  LYS  49           HE2      LYS  49  10.270   3.124   2.986
  402    HE3  LYS  49           HE3      LYS  49   9.521   2.590   1.474
  403    HZ1  LYS  49           HZ1      LYS  49  11.863   2.713   1.145
  404    HZ2  LYS  49           HZ2      LYS  49  11.953   4.270   1.726
  405    HZ3  LYS  49           HZ3      LYS  49  11.220   3.935   0.288
  406    H    ASN  50           H        ASN  50   3.858   6.872   2.149
  407    HA   ASN  50           HA       ASN  50   3.760   9.128   4.010
  408    HB2  ASN  50           HB2      ASN  50   3.338   9.624   1.733
  409    HB3  ASN  50           HB3      ASN  50   2.222   8.294   1.532
  410   HD21  ASN  50          HD21      ASN  50   0.068   8.431   2.656
  411   HD22  ASN  50          HD22      ASN  50  -0.603  10.044   2.820
  412    H    CYS  51           H        CYS  51   1.851   6.134   3.532
  413    HA   CYS  51           HA       CYS  51  -0.152   6.956   5.524
  414    HB2  CYS  51           HB2      CYS  51   0.211   4.330   4.023
  415    HB3  CYS  51           HB3      CYS  51  -1.194   4.815   4.984
  416    HG   CYS  51           HG       CYS  51   0.004   6.015   2.147
  417    H    PHE  52           H        PHE  52   2.783   4.982   5.595
  418    HA   PHE  52           HA       PHE  52   2.635   4.736   8.535
  419    HB2  PHE  52           HB2      PHE  52   1.365   2.752   7.668
  420    HB3  PHE  52           HB3      PHE  52   2.740   2.321   6.663
  421    HD1  PHE  52           HD1      PHE  52   1.477   2.542  10.150
  422    HD2  PHE  52           HD2      PHE  52   4.674   1.177   7.611
  423    HE1  PHE  52           HE1      PHE  52   2.423   1.234  12.031
  424    HE2  PHE  52           HE2      PHE  52   5.662  -0.068   9.524
  425    HZ   PHE  52           HZ       PHE  52   4.529  -0.047  11.734
  426    H    ARG  53           H        ARG  53   4.614   4.147   9.480
  427    HA   ARG  53           HA       ARG  53   6.979   4.983   8.056
  428    HB2  ARG  53           HB2      ARG  53   6.385   5.372  10.504
  429    HB3  ARG  53           HB3      ARG  53   6.736   3.666  10.781
  430    HG2  ARG  53           HG2      ARG  53   8.691   4.896  11.387
  431    HG3  ARG  53           HG3      ARG  53   9.070   4.122   9.844
  432    HD2  ARG  53           HD2      ARG  53   8.188   6.469   8.879
  433    HD3  ARG  53           HD3      ARG  53   8.589   7.026  10.488
  434    HE   ARG  53           HE       ARG  53  10.901   6.455  10.113
  435   HH11  ARG  53          HH11      ARG  53   9.044   6.509   7.065
  436   HH12  ARG  53          HH12      ARG  53  10.533   6.294   6.153
  437   HH21  ARG  53          HH21      ARG  53  12.585   6.660   8.861
  438   HH22  ARG  53          HH22      ARG  53  12.419   6.786   7.115
  439    H    MET  54           H        MET  54   6.510   3.316   6.372
  440    HA   MET  54           HA       MET  54   7.272   0.556   6.935
  441    HB2  MET  54           HB2      MET  54   5.369   1.362   5.415
  442    HB3  MET  54           HB3      MET  54   6.607   1.844   4.268
  443    HG2  MET  54           HG2      MET  54   6.205  -0.213   3.452
  444    HG3  MET  54           HG3      MET  54   7.408  -0.706   4.635
  445    HE1  MET  54           HE1      MET  54   6.928  -2.222   6.668
  446    HE2  MET  54           HE2      MET  54   5.912  -0.996   7.464
  447    HE3  MET  54           HE3      MET  54   5.314  -2.653   7.275
  448    H    THR  55           H        THR  55   9.427   0.644   7.532
  449    HA   THR  55           HA       THR  55  11.438   1.664   5.601
  450    HB   THR  55           HB       THR  55  12.996   1.420   7.579
  451    HG1  THR  55           HG1      THR  55  11.579  -0.119   8.668
  452   HG21  THR  55          HG21      THR  55  11.909   3.573   7.018
  453   HG22  THR  55          HG22      THR  55  12.132   3.367   8.762
  454   HG23  THR  55          HG23      THR  55  10.523   3.138   8.045
  455    H    ASP  56           H        ASP  56  10.021  -1.134   5.571
  456    HA   ASP  56           HA       ASP  56  12.451  -2.883   5.632
  457    HB2  ASP  56           HB2      ASP  56   9.723  -3.290   6.874
  458    HB3  ASP  56           HB3      ASP  56  10.950  -4.536   6.741
  459    H    GLN  57           H        GLN  57  12.764  -4.083   3.916
  460    HA   GLN  57           HA       GLN  57  10.976  -3.829   1.729
  461    HB2  GLN  57           HB2      GLN  57  13.444  -5.561   1.961
  462    HB3  GLN  57           HB3      GLN  57  12.564  -5.215   0.475
  463    HG2  GLN  57           HG2      GLN  57  14.217  -3.318   2.151
  464    HG3  GLN  57           HG3      GLN  57  14.403  -3.735   0.446
  465   HE21  GLN  57          HE21      GLN  57  12.053  -3.160  -0.820
  466   HE22  GLN  57          HE22      GLN  57  11.472  -1.560  -0.390
  467    H    GLU  58           H        GLU  58  11.286  -6.516   4.011
  468    HA   GLU  58           HA       GLU  58   9.866  -8.495   2.544
  469    HB2  GLU  58           HB2      GLU  58  10.987  -9.080   4.571
  470    HB3  GLU  58           HB3      GLU  58  10.132  -7.841   5.481
  471    HG2  GLU  58           HG2      GLU  58   9.288  -9.911   6.182
  472    HG3  GLU  58           HG3      GLU  58   8.022  -9.097   5.300
  473    H    ALA  59           H        ALA  59   8.507  -5.870   4.628
  474    HA   ALA  59           HA       ALA  59   5.770  -6.693   3.970
  475    HB1  ALA  59           HB1      ALA  59   6.805  -4.229   5.395
  476    HB2  ALA  59           HB2      ALA  59   5.101  -4.733   5.237
  477    HB3  ALA  59           HB3      ALA  59   6.246  -5.744   6.156
  478    H    ILE  60           H        ILE  60   8.071  -4.187   2.801
  479    HA   ILE  60           HA       ILE  60   6.232  -2.776   1.121
  480    HB   ILE  60           HB       ILE  60   9.191  -3.230   0.996
  481   HG12  ILE  60          HG12      ILE  60   7.535  -0.728   1.527
  482   HG13  ILE  60          HG13      ILE  60   8.067  -1.844   2.792
  483   HG21  ILE  60          HG21      ILE  60   9.226  -1.383  -0.768
  484   HG22  ILE  60          HG22      ILE  60   8.566  -2.900  -1.346
  485   HG23  ILE  60          HG23      ILE  60   7.466  -1.579  -0.897
  486   HD11  ILE  60          HD11      ILE  60   9.618  -0.020   2.724
  487   HD12  ILE  60          HD12      ILE  60  10.410  -1.497   2.135
  488   HD13  ILE  60          HD13      ILE  60   9.883  -0.232   0.985
  489    H    GLN  61           H        GLN  61   8.259  -5.666   0.316
  490    HA   GLN  61           HA       GLN  61   6.990  -5.904  -2.274
  491    HB2  GLN  61           HB2      GLN  61   8.279  -7.857  -2.597
  492    HB3  GLN  61           HB3      GLN  61   9.271  -6.685  -1.758
  493    HG2  GLN  61           HG2      GLN  61   9.772  -8.691  -0.663
  494    HG3  GLN  61           HG3      GLN  61   8.659  -7.876   0.404
  495   HE21  GLN  61          HE21      GLN  61   7.393  -9.400   1.360
  496   HE22  GLN  61          HE22      GLN  61   6.479 -10.620   0.497
  497    H    ASP  62           H        ASP  62   6.138  -7.234   0.957
  498    HA   ASP  62           HA       ASP  62   4.169  -9.084  -0.014
  499    HB2  ASP  62           HB2      ASP  62   5.023  -8.921   2.360
  500    HB3  ASP  62           HB3      ASP  62   4.069  -7.458   2.566
  501    H    LEU  63           H        LEU  63   3.994  -5.641   0.837
  502    HA   LEU  63           HA       LEU  63   1.242  -5.270   0.187
  503    HB2  LEU  63           HB2      LEU  63   3.632  -3.480   0.579
  504    HB3  LEU  63           HB3      LEU  63   2.064  -2.796   0.131
  505    HG   LEU  63           HG       LEU  63   2.479  -4.554   2.596
  506   HD11  LEU  63          HD11      LEU  63   3.810  -2.473   2.747
  507   HD12  LEU  63          HD12      LEU  63   2.463  -2.475   3.891
  508   HD13  LEU  63          HD13      LEU  63   2.351  -1.516   2.394
  509   HD21  LEU  63          HD21      LEU  63   0.117  -4.400   1.795
  510   HD22  LEU  63          HD22      LEU  63   0.239  -2.629   1.852
  511   HD23  LEU  63          HD23      LEU  63   0.357  -3.583   3.345
  512    H    TRP  64           H        TRP  64   4.243  -4.888  -1.794
  513    HA   TRP  64           HA       TRP  64   2.906  -3.902  -4.122
  514    HB2  TRP  64           HB2      TRP  64   5.428  -3.899  -3.681
  515    HB3  TRP  64           HB3      TRP  64   5.424  -5.597  -4.087
  516    HD1  TRP  64           HD1      TRP  64   3.350  -3.066  -6.143
  517    HE1  TRP  64           HE1      TRP  64   4.259  -2.958  -8.524
  518    HE3  TRP  64           HE3      TRP  64   7.551  -5.969  -5.553
  519    HZ2  TRP  64           HZ2      TRP  64   6.520  -3.947  -9.990
  520    HZ3  TRP  64           HZ3      TRP  64   9.067  -6.354  -7.479
  521    HH2  TRP  64           HH2      TRP  64   8.568  -5.354  -9.699
  522    H    GLN  65           H        GLN  65   3.765  -7.281  -3.217
  523    HA   GLN  65           HA       GLN  65   2.557  -8.512  -5.514
  524    HB2  GLN  65           HB2      GLN  65   3.413  -9.412  -2.758
  525    HB3  GLN  65           HB3      GLN  65   2.370 -10.461  -3.704
  526    HG2  GLN  65           HG2      GLN  65   4.751 -11.024  -4.005
  527    HG3  GLN  65           HG3      GLN  65   3.928 -10.626  -5.504
  528   HE21  GLN  65          HE21      GLN  65   6.552  -9.578  -3.306
  529   HE22  GLN  65          HE22      GLN  65   7.138  -8.389  -4.474
  530    H    TRP  66           H        TRP  66   1.132  -7.516  -2.355
  531    HA   TRP  66           HA       TRP  66  -1.483  -8.541  -2.953
  532    HB2  TRP  66           HB2      TRP  66  -0.417  -7.664  -0.714
  533    HB3  TRP  66           HB3      TRP  66  -1.074  -6.111  -1.210
  534    HD1  TRP  66           HD1      TRP  66  -3.574  -5.769  -0.524
  535    HE1  TRP  66           HE1      TRP  66  -5.479  -7.261   0.366
  536    HE3  TRP  66           HE3      TRP  66  -1.297 -10.341  -0.939
  537    HZ2  TRP  66           HZ2      TRP  66  -6.001 -10.069   0.683
  538    HZ3  TRP  66           HZ3      TRP  66  -2.543 -12.411  -0.375
  539    HH2  TRP  66           HH2      TRP  66  -4.888 -12.293   0.423
  540    H    ARG  67           H        ARG  67  -0.018  -5.332  -3.576
  541    HA   ARG  67           HA       ARG  67  -2.298  -4.118  -4.810
  542    HB2  ARG  67           HB2      ARG  67  -0.346  -2.882  -3.897
  543    HB3  ARG  67           HB3      ARG  67   0.694  -3.586  -5.127
  544    HG2  ARG  67           HG2      ARG  67   0.227  -1.342  -5.775
  545    HG3  ARG  67           HG3      ARG  67  -0.621  -2.399  -6.900
  546    HD2  ARG  67           HD2      ARG  67  -2.724  -2.041  -5.509
  547    HD3  ARG  67           HD3      ARG  67  -1.819  -0.876  -4.549
  548    HE   ARG  67           HE       ARG  67  -1.716   0.622  -6.432
  549   HH11  ARG  67          HH11      ARG  67  -3.366  -2.304  -7.474
  550   HH12  ARG  67          HH12      ARG  67  -4.345  -1.425  -8.620
  551   HH21  ARG  67          HH21      ARG  67  -2.821   1.598  -7.975
  552   HH22  ARG  67          HH22      ARG  67  -3.837   0.672  -9.078
  553    H    LYS  68           H        LYS  68   0.346  -6.035  -6.258
  554    HA   LYS  68           HA       LYS  68  -0.703  -5.831  -8.979
  555    HB2  LYS  68           HB2      LYS  68   1.348  -7.657  -7.677
  556    HB3  LYS  68           HB3      LYS  68   0.919  -7.730  -9.394
  557    HG2  LYS  68           HG2      LYS  68   1.531  -5.328  -9.656
  558    HG3  LYS  68           HG3      LYS  68   2.067  -5.281  -7.977
  559    HD2  LYS  68           HD2      LYS  68   3.241  -7.026 -10.185
  560    HD3  LYS  68           HD3      LYS  68   3.936  -5.530  -9.546
  561    HE2  LYS  68           HE2      LYS  68   4.004  -6.650  -7.256
  562    HE3  LYS  68           HE3      LYS  68   3.540  -8.155  -8.052
  563    HZ1  LYS  68           HZ1      LYS  68   5.886  -8.099  -7.832
  564    HZ2  LYS  68           HZ2      LYS  68   6.031  -6.614  -8.489
  565    HZ3  LYS  68           HZ3      LYS  68   5.596  -7.865  -9.453
  566    H    SER  69           H        SER  69  -1.471  -7.921  -6.286
  567    HA   SER  69           HA       SER  69  -2.942  -9.844  -7.883
  568    HB2  SER  69           HB2      SER  69  -3.145  -9.299  -4.905
  569    HB3  SER  69           HB3      SER  69  -3.777 -10.711  -5.765
  570    HG   SER  69           HG       SER  69  -1.033  -9.946  -5.561
  571    H    LEU  70           H        LEU  70  -3.646  -6.688  -7.523
  572    HA   LEU  70           HA       LEU  70  -6.608  -6.982  -7.585
  573    HB2  LEU  70           HB2      LEU  70  -4.745  -4.589  -7.524
  574    HB3  LEU  70           HB3      LEU  70  -6.491  -4.466  -7.632
  575    HG   LEU  70           HG       LEU  70  -4.938  -5.617  -5.276
  576   HD11  LEU  70          HD11      LEU  70  -4.761  -3.159  -5.568
  577   HD12  LEU  70          HD12      LEU  70  -5.687  -3.598  -4.125
  578   HD13  LEU  70          HD13      LEU  70  -6.534  -3.041  -5.581
  579   HD21  LEU  70          HD21      LEU  70  -7.919  -5.186  -5.741
  580   HD22  LEU  70          HD22      LEU  70  -7.208  -5.503  -4.154
  581   HD23  LEU  70          HD23      LEU  70  -7.096  -6.729  -5.419