*HEADER    ONCOPROTEIN, VIRUS/VIRAL PROTEIN        02-DEC-05   2F8B              
*TITLE     NMR STRUCTURE OF THE C-TERMINAL DOMAIN (DIMER) OF HPV45               
*TITLE    2 ONCOPROTEIN E7                                                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PROTEIN E7;                                                
*COMPND   3 CHAIN: A, B;                                                         
*COMPND   4 FRAGMENT: C-TERMINAL DOMAIN, RESIDUES 55-106;                        
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HUMAN PAPILLOMAVIRUS TYPE 45;                   
*SOURCE   3 ORGANISM_COMMON: VIRUS;                                              
*SOURCE   4 STRAIN: HPV TYPE 45;                                                 
*SOURCE   5 GENE: E7;                                                            
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21-CODONPLUS(DE3)-RIL;                   
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PET15B                                    
*KEYWDS    E7, DIMER, HPV, ONCOPROTEIN, ZINC BINDING                             
*EXPDTA    NMR, 15 STRUCTURES                                                    
*AUTHOR    O.OHLENSCHLAGER, M.GORLACH                                            
*REVDAT   1   08-AUG-06 2F8B    0                                                

  4 MET  QG      6 GLU  H       5.25 
  6 GLU  H       6 GLU  QB      3.41 
  6 GLU  QB      7 PRO  QD      3.46 
  6 GLU  QB      9 ARG  H       5.25 
  7 PRO  QG      8 GLN  HA      7.29 
  8 GLN  H       8 GLN  QB      3.41 
  8 GLN  QB      8 GLN  QE2     4.67 
  8 GLN  QB     29 SER  H       5.25 
  8 GLN  QG     29 SER  H       5.25 
  9 ARG  H       9 ARG  QD      5.25 
  9 ARG  QB     28 GLU  HA      5.25 
  9 ARG  QB     28 GLU  QG      5.10 
  9 ARG  QG     28 GLU  HA      5.25 
  9 ARG  QD     10 HIS  H       5.25 
  9 ARG  QD     26 THR  HB      7.29 
 10 HIS  H      27 VAL  QQG     6.61 
 10 HIS  HA     10 HIS  QB      2.58 
 10 HIS  QB     27 VAL  QQG     7.30 
 10 HIS  HD2    27 VAL  QQG     8.79 
 11 LYS  H      11 LYS  QB      3.41 
 11 LYS  H      12 ILE  QG1     5.25 
 11 LYS  HA     11 LYS  QB      2.58 
 11 LYS  HA     25 LEU  QB      7.29 
 11 LYS  HA     27 VAL  QQG     6.61 
 11 LYS  QB     11 LYS  QE      4.45 
 11 LYS  QG     26 THR  HB      5.25 
 12 ILE  H      12 ILE  QG1     3.55 
 12 ILE  H      25 LEU  QQD     6.61 
 12 ILE  H      27 VAL  QQG     6.61 
 12 ILE  QG2    25 LEU  QQD     8.52 
 12 ILE  QG2    37 LEU  QQD     8.52 
 12 ILE  QG1    13 LEU  H       5.25 
 12 ILE  QG1    25 LEU  QB      6.97 
 12 ILE  QG1    26 THR  HA      7.29 
 12 ILE  QG1    27 VAL  QQG     7.74 
 12 ILE  QG1    34 LEU  HG      7.29 
 12 ILE  QG1    34 LEU  QQD     5.89 
 12 ILE  QG1    37 LEU  QQD     6.36 
 12 ILE  QD1    27 VAL  QQG     6.69 
 12 ILE  QD1    37 LEU  QB      6.48 
 13 LEU  HA     24 GLU  QB      5.25 
 13 LEU  HG     22 ARG  QG      5.25 
 13 LEU  QQD    22 ARG  QG      5.77 
 13 LEU  QQD    23 ILE  H       6.61 
 13 LEU  QQD    24 GLU  H       6.61 
 13 LEU  QQD    24 GLU  QB      8.26 
 13 LEU  QQD    24 GLU  QG      7.74 
 13 LEU  QQD    25 LEU  H       6.61 
 14 CYS  H      25 LEU  QQD     6.61 
 14 CYS  QB     23 ILE  H       5.25 
 15 VAL  QQG    16 CYSM H       4.80 
 15 VAL  QQG    16 CYSM HA      6.61 
 15 VAL  QQG    16 CYSM QB      8.26 
 15 VAL  QQG    20 ASP  HA      6.61 
 15 VAL  QQG    21 GLY  H       6.61 
 15 VAL  QQG    22 ARG  QG      7.74 
 15 VAL  QQG    23 ILE  H       6.61 
 15 VAL  QQG    23 ILE  HB      6.61 
 15 VAL  QQG    23 ILE  QG2    10.58 
 16 CYSM H      23 ILE  QG1     5.25 
 16 CYSM QB     18 LYS  QB      6.97 
 16 CYSM QB     19 CYSS H       3.55 
 16 CYSM QB     20 ASP  HA      5.25 
 16 CYSM QB     20 ASP  QB      6.97 
 16 CYSM QB     21 GLY  QA      4.68 
 16 CYSM QB     22 ARG  HA      7.29 
 18 LYS  H      18 LYS  QG      3.55 
 18 LYS  H      18 LYS  QD      5.25 
 18 LYS  H      18 LYS  QE      5.25 
 18 LYS  H      19 CYSS QB      5.25 
 18 LYS  HA     18 LYS  QB      2.58 
 18 LYS  QB     48 VAL  QQG     7.74 
 18 LYS  QG     19 CYSS H       3.55 
 18 LYS  QG     49 CYSS H       5.25 
 18 LYS  QD     48 VAL  QQG     6.36 
 20 ASP  H      21 GLY  QA      5.25 
 21 GLY  H      21 GLY  QA      2.56 
 21 GLY  QA     22 ARG  QB      5.09 
 22 ARG  QB     23 ILE  HA      5.25 
 22 ARG  QG     23 ILE  H       5.25 
 22 ARG  QG     23 ILE  HB      7.29 
 22 ARG  QD     23 ILE  H       5.25 
 22 ARG  QD     24 GLU  QG      6.49 
 23 ILE  H      23 ILE  QG1     5.25 
 23 ILE  QG2    25 LEU  QQD     8.52 
 23 ILE  QG1    24 GLU  H       5.25 
 23 ILE  QG1    49 CYSS H       5.25 
 23 ILE  QD1    47 PHE  QB      4.80 
 23 ILE  QD1    48 VAL  QQG     8.52 
 24 GLU  QB     25 LEU  HG      7.29 
 24 GLU  QG     25 LEU  QB      6.49 
 25 LEU  QB     26 THR  HA      5.25 
 25 LEU  QB     27 VAL  H       5.25 
 25 LEU  QB     27 VAL  QQG     5.89 
 25 LEU  QB     47 PHE  QE      9.24 
 25 LEU  QQD    27 VAL  QQG     8.30 
 25 LEU  QQD    41 PHE  HZ      6.61 
 25 LEU  QQD    47 PHE  HZ      6.61 
 26 THR  H      27 VAL  QQG     6.61 
 26 THR  HA     27 VAL  QQG     6.61 
 27 VAL  QQG    28 GLU  H       4.80 
 27 VAL  QQG    28 GLU  HA      6.61 
 27 VAL  QQG    29 SER  H       6.61 
 27 VAL  QQG    34 LEU  QQD     9.42 
 27 VAL  QQG    47 PHE  QD     10.77 
 27 VAL  QQG    47 PHE  QE     10.77 
 28 GLU  H      28 GLU  QB      3.41 
 28 GLU  H      29 SER  QB      5.25 
 28 GLU  QB     29 SER  QB      6.49 
 29 SER  QB     30 SER  H       3.55 
 30 SER  QB     31 ALA  QB      6.48 
 30 SER  QB     32 GLU  H       3.55 
 31 ALA  QB     34 LEU  QQD     8.52 
 32 GLU  HA     32 GLU  QG      3.42 
 32 GLU  HA     35 ARG  QG      7.29 
 32 GLU  QB     34 LEU  H       5.25 
 33 ASP  QB     34 LEU  H       3.55 
 34 LEU  H      37 LEU  QQD     6.61 
 34 LEU  QB     37 LEU  QQD     6.36 
 34 LEU  HG     37 LEU  QB      7.29 
 34 LEU  HG     38 GLN  QB      5.25 
 34 LEU  QQD    35 ARG  HA      6.61 
 34 LEU  QQD    37 LEU  QB      8.26 
 34 LEU  QQD    37 LEU  HG      6.61 
 34 LEU  QQD    38 GLN  H       6.61 
 34 LEU  QQD    38 GLN  QB      7.57 
 34 LEU  QQD    38 GLN  QG      7.74 
 35 ARG  H      35 ARG  QB      3.41 
 35 ARG  H      37 LEU  QQD     6.61 
 35 ARG  HA     38 GLN  QE2     5.25 
 35 ARG  QG     36 THR  HA      7.29 
 36 THR  HA     40 LEU  QQD     6.61 
 36 THR  HB     37 LEU  QB      5.25 
 36 THR  HB     40 LEU  QQD     6.53 
 36 THR  QG2    39 GLN  QB      8.49 
 37 LEU  H      38 GLN  QB      5.25 
 37 LEU  H      40 LEU  QQD     6.61 
 37 LEU  HA     40 LEU  QQD     8.69 
 37 LEU  HA     45 LEU  QQD     8.69 
 37 LEU  QB     38 GLN  HA      7.29 
 37 LEU  QB     40 LEU  QB      7.31 
 37 LEU  QB     40 LEU  HG      7.29 
 37 LEU  QB     40 LEU  QQD     7.57 
 37 LEU  QQD    38 GLN  QB      6.36 
 37 LEU  QQD    41 PHE  H       6.61 
 37 LEU  QQD    41 PHE  QD      8.62 
 37 LEU  QQD    41 PHE  QE      8.51 
 37 LEU  QQD    41 PHE  HZ      8.79 
 37 LEU  QQD    47 PHE  QE     10.68 
 38 GLN  H      39 GLN  QG      5.25 
 38 GLN  HA     38 GLN  QE2     5.25 
 38 GLN  QB     39 GLN  QB      6.97 
 38 GLN  QB     39 GLN  QG      6.97 
 38 GLN  QG     39 GLN  QB      6.97 
 38 GLN  QG     39 GLN  QG      6.97 
 39 GLN  H      39 GLN  QG      5.25 
 39 GLN  H      39 GLN  QE2     5.53 
 39 GLN  H      42 LEU  QQD     6.61 
 39 GLN  HA     39 GLN  QG      3.42 
 40 LEU  QB     41 PHE  H       3.55 
 40 LEU  HG     45 LEU  QQD     8.69 
 40 LEU  QQD    43 SER  H       6.61 
 40 LEU  QQD    45 LEU  QQD     7.21 
 41 PHE  H      41 PHE  QB      3.41 
 41 PHE  H      42 LEU  QB      5.25 
 41 PHE  H      45 LEU  QB      5.25 
 41 PHE  H      45 LEU  QQD     6.61 
 41 PHE  HA     45 LEU  QB      3.55 
 41 PHE  QB     42 LEU  HA      5.25 
 41 PHE  QD     45 LEU  QQD     8.62 
 42 LEU  H      42 LEU  QB      3.40 
 45 LEU  QQD    46 SER  H       4.80 
 45 LEU  QQD    46 SER  HA      6.61 
 46 SER  H      46 SER  QB      3.41 
 46 SER  QB     47 PHE  HA      5.25 
 47 PHE  H      48 VAL  QQG     6.61 
 47 PHE  HA     48 VAL  QQG     6.61 
 47 PHE  QB     48 VAL  HA      5.25 
 47 PHE  QB     48 VAL  QQG     7.74 
 48 VAL  QQG    49 CYSS H       4.88 
 48 VAL  QQG    52 CYSS H       6.61 
 49 CYSS QB     52 CYSS H       5.25 
 49 CYSS QB     52 CYSS QB      6.97 
 50 PRO  QB     51 TRP  HA      7.29 
 50 PRO  QB     54 THR  H       5.25 
 50 PRO  QB     54 THR  QG2     8.50 
 51 TRP  H      51 TRP  QB      2.71 
 51 TRP  QB     53 ALA  H       5.25 
 52 CYSS HA     56 GLN  QB      7.29 
 52 CYSS HA     56 GLN  QG      7.29 
 52 CYSS QB     56 GLN  H       5.25 
 55 ASN  H      55 ASN  QB      3.41 
 55 ASN  H      55 ASN  QD2     5.53 
 55 ASN  QB     56 GLN  H       3.55 
 56 GLN  H      56 GLN  QB      3.41 
 56 GLN  HA     56 GLN  QG      3.42 
104 MET  HA    105 ALA  H       2.80 
104 MET  HA    105 ALA  QB      6.72 
104 MET  HB2   105 ALA  H       5.40 
104 MET  HB3   105 ALA  H       5.40 
105 ALA  HA    106 GLU  H       2.80 
105 ALA  H     105 ALA  HA      2.80 
105 ALA  H     106 GLU  HA      5.40 
105 ALA  H     106 GLU  H       4.30 
105 ALA  QB    106 GLU  HG2     6.72 
105 ALA  QB    106 GLU  HG3     6.72 
105 ALA  QB    106 GLU  H       4.92 
106 GLU  HA    107 PRO  HG2     5.40 
106 GLU  HA    107 PRO  HG3     5.40 
106 GLU  HG2   107 PRO  HD2     5.40 
106 GLU  HG2   107 PRO  HD3     5.40 
106 GLU  HG3   107 PRO  HD2     5.40 
106 GLU  HG3   107 PRO  HD3     5.40 
106 GLU  H     106 GLU  HG2     5.40 
106 GLU  H     106 GLU  HG3     5.40 
106 GLU  H     107 PRO  HD2     5.40 
106 GLU  H     107 PRO  HD3     5.40 
106 GLU  H     109 ARG  HB2     5.40 
106 GLU  H     109 ARG  HB3     5.40 
106 GLU  H     109 ARG  H       5.70 
107 PRO  HA    108 GLN  H       2.80 
107 PRO  HA    130 SER  HA      5.40 
108 GLN  HA    108 GLN  HG2     3.60 
108 GLN  HA    108 GLN  HG3     3.60 
108 GLN  HA    110 HIS  H       5.40 
108 GLN  HA    129 SER  H       5.40 
108 GLN  HB2   109 ARG  H       5.40 
108 GLN  HB3   109 ARG  H       5.40 
108 GLN  HE21  110 HIS  HE1     5.40 
108 GLN  HE22  110 HIS  HE1     5.40 
108 GLN  HG2   109 ARG  H       5.40 
108 GLN  HG3   109 ARG  H       5.40 
108 GLN  H     108 GLN  HG2     5.40 
108 GLN  H     108 GLN  HG3     5.40 
108 GLN  H     109 ARG  H       4.30 
108 GLN  H     110 HIS  HD2     5.40 
108 GLN  H     128 GLU  HA      5.40 
108 GLN  H     129 SER  H       5.70 
109 ARG  HA    109 ARG  HD2     5.40 
109 ARG  HA    109 ARG  HD3     5.40 
109 ARG  HA    109 ARG  HG2     3.60 
109 ARG  HA    109 ARG  HG3     3.60 
109 ARG  HA    110 HIS  H       2.80 
109 ARG  HA    126 THR  QG2     6.72 
109 ARG  HA    127 VAL  H       5.40 
109 ARG  HA    128 GLU  HA      3.60 
109 ARG  HA    128 GLU  HG2     5.40 
109 ARG  HA    128 GLU  HG3     5.40 
109 ARG  HA    128 GLU  H       5.40 
109 ARG  HA    129 SER  H       5.40 
109 ARG  HB2   109 ARG  HG2     2.80 
109 ARG  HB2   109 ARG  HG3     2.80 
109 ARG  HB2   110 HIS  H       5.40 
109 ARG  HB2   126 THR  QG2     6.72 
109 ARG  HB3   109 ARG  HG2     2.80 
109 ARG  HB3   109 ARG  HG3     2.80 
109 ARG  HB3   110 HIS  H       5.40 
109 ARG  HB3   126 THR  QG2     6.72 
109 ARG  HD2   126 THR  QG2     6.72 
109 ARG  HD3   126 THR  QG2     6.72 
109 ARG  HG2   110 HIS  H       5.40 
109 ARG  HG2   126 THR  QG2     6.72 
109 ARG  HG2   128 GLU  HG2     5.40 
109 ARG  HG2   128 GLU  HG3     5.40 
109 ARG  HG3   110 HIS  H       5.40 
109 ARG  HG3   126 THR  QG2     6.72 
109 ARG  HG3   128 GLU  HG2     5.40 
109 ARG  HG3   128 GLU  HG3     5.40 
109 ARG  H     109 ARG  HB2     3.60 
109 ARG  H     109 ARG  HB3     3.60 
109 ARG  H     109 ARG  HG2     5.40 
109 ARG  H     109 ARG  HG3     5.40 
109 ARG  H     110 HIS  H       4.30 
109 ARG  H     128 GLU  HA      5.40 
109 ARG  H     128 GLU  HB2     5.40 
109 ARG  H     128 GLU  HB3     5.40 
109 ARG  H     129 SER  H       5.70 
110 HIS  HA    111 LYS  H       2.80 
110 HIS  HA    127 VAL  H       5.40 
110 HIS  HB2   111 LYS  H       5.40 
110 HIS  HB2   112 ILE  H       5.40 
110 HIS  HB2   112 ILE  QD1     6.72 
110 HIS  HB2   127 VAL  H       5.40 
110 HIS  HB2   134 LEU  QD1     6.72 
110 HIS  HB2   134 LEU  QD2     6.72 
110 HIS  HB3   111 LYS  H       5.40 
110 HIS  HB3   112 ILE  H       5.40 
110 HIS  HB3   112 ILE  QD1     6.72 
110 HIS  HB3   127 VAL  H       5.40 
110 HIS  HB3   134 LEU  QD1     6.72 
110 HIS  HB3   134 LEU  QD2     6.72 
110 HIS  HD2   111 LYS  H       5.40 
110 HIS  HD2   129 SER  H       5.40 
110 HIS  H     110 HIS  HD2     5.40 
110 HIS  H     111 LYS  HA      5.40 
110 HIS  H     111 LYS  H       5.70 
110 HIS  H     126 THR  HA      5.40 
110 HIS  H     126 THR  QG2     6.72 
110 HIS  H     127 VAL  HA      5.40 
110 HIS  H     127 VAL  H       4.30 
110 HIS  H     128 GLU  HA      3.60 
110 HIS  H     128 GLU  HB2     5.40 
110 HIS  H     128 GLU  HB3     5.40 
110 HIS  H     128 GLU  HG2     5.40 
110 HIS  H     128 GLU  HG3     5.40 
110 HIS  H     128 GLU  H       5.70 
110 HIS  H     129 SER  H       4.30 
111 LYS  HA    111 LYS  HD2     5.40 
111 LYS  HA    111 LYS  HD3     5.40 
111 LYS  HA    111 LYS  HG2     3.60 
111 LYS  HA    111 LYS  HG3     3.60 
111 LYS  HA    112 ILE  HA      5.40 
111 LYS  HA    112 ILE  HB      5.40 
111 LYS  HA    112 ILE  HG12    5.40 
111 LYS  HA    112 ILE  HG13    5.40 
111 LYS  HA    112 ILE  QD1     6.72 
111 LYS  HA    113 LEU  H       5.40 
111 LYS  HA    125 LEU  H       5.40 
111 LYS  HA    126 THR  HA      5.40 
111 LYS  HA    126 THR  H       5.40 
111 LYS  HA    126 THR  QG2     6.72 
111 LYS  HA    127 VAL  H       3.60 
111 LYS  HB2   112 ILE  H       5.40 
111 LYS  HB2   113 LEU  H       5.40 
111 LYS  HB3   112 ILE  H       5.40 
111 LYS  HB3   113 LEU  H       5.40 
111 LYS  HD2   126 THR  HA      5.40 
111 LYS  HD2   126 THR  QG2     6.72 
111 LYS  HD3   126 THR  HA      5.40 
111 LYS  HD3   126 THR  QG2     6.72 
111 LYS  HE2   126 THR  QG2     6.72 
111 LYS  HE3   126 THR  QG2     6.72 
111 LYS  HG2   112 ILE  H       5.40 
111 LYS  HG2   126 THR  QG2     6.72 
111 LYS  HG3   112 ILE  H       5.40 
111 LYS  HG3   126 THR  QG2     6.72 
111 LYS  H     111 LYS  HD2     5.40 
111 LYS  H     111 LYS  HD3     5.40 
111 LYS  H     111 LYS  HE2     5.40 
111 LYS  H     111 LYS  HE3     5.40 
111 LYS  H     111 LYS  HG2     5.40 
111 LYS  H     111 LYS  HG3     5.40 
111 LYS  H     112 ILE  HA      5.40 
111 LYS  H     112 ILE  H       4.30 
111 LYS  H     112 ILE  QD1     6.72 
111 LYS  H     126 THR  HA      5.40 
112 ILE  HA    112 ILE  QD1     4.92 
112 ILE  HA    113 LEU  HA      5.40 
112 ILE  HB    113 LEU  H       5.40 
112 ILE  HB    114 CYS  H       5.40 
112 ILE  HB    125 LEU  HB2     5.40 
112 ILE  HB    125 LEU  HB3     5.40 
112 ILE  HB    125 LEU  HG      5.40 
112 ILE  HB    125 LEU  H       5.40 
112 ILE  HB    125 LEU  QD1     6.72 
112 ILE  HB    125 LEU  QD2     6.72 
112 ILE  HB    127 VAL  H       5.40 
112 ILE  H     112 ILE  HB      3.60 
112 ILE  H     112 ILE  QD1     6.72 
112 ILE  H     112 ILE  QG2     6.72 
112 ILE  H     113 LEU  HA      5.40 
112 ILE  H     113 LEU  H       4.30 
112 ILE  H     125 LEU  HB2     5.40 
112 ILE  H     125 LEU  HB3     5.40 
112 ILE  H     125 LEU  H       5.70 
112 ILE  H     126 THR  HA      5.40 
112 ILE  H     127 VAL  H       4.30 
112 ILE  QD1   113 LEU  H       6.72 
112 ILE  QD1   125 LEU  HB2     6.72 
112 ILE  QD1   125 LEU  HB3     6.72 
112 ILE  QD1   125 LEU  HG      6.72 
112 ILE  QD1   125 LEU  QD1     8.74 
112 ILE  QD1   125 LEU  QD2     8.74 
112 ILE  QD1   127 VAL  HB      8.92 
112 ILE  QD1   127 VAL  H       6.72 
112 ILE  QD1   134 LEU  HG      6.72 
112 ILE  QD1   134 LEU  QD1     8.74 
112 ILE  QD1   134 LEU  QD2     8.74 
112 ILE  QD1   137 LEU  HG      6.72 
112 ILE  QD1   137 LEU  QD1     8.74 
112 ILE  QD1   137 LEU  QD2     8.74 
112 ILE  QD1   138 GLN  HA      6.72 
112 ILE  QD1   141 PHE  QD      8.85 
112 ILE  QD1   141 PHE  QE      8.85 
112 ILE  QG2   113 LEU  H       6.72 
112 ILE  QG2   113 LEU  QD1     8.74 
112 ILE  QG2   113 LEU  QD2     8.74 
112 ILE  QG2   114 CYS  HB2     6.72 
112 ILE  QG2   114 CYS  HB3     6.72 
112 ILE  QG2   114 CYS  H       6.72 
112 ILE  QG2   125 LEU  HB2     6.72 
112 ILE  QG2   125 LEU  HB3     6.72 
112 ILE  QG2   125 LEU  H       6.72 
112 ILE  QG2   127 VAL  QG1     8.74 
112 ILE  QG2   127 VAL  QG2     8.74 
112 ILE  QG2   134 LEU  QD1     8.74 
112 ILE  QG2   134 LEU  QD2     8.74 
112 ILE  QG2   141 PHE  QD      8.85 
112 ILE  QG2   141 PHE  QE      8.85 
112 ILE  QG2   141 PHE  HZ      8.92 
113 LEU  HA    113 LEU  QD1     6.72 
113 LEU  HA    113 LEU  QD2     6.72 
113 LEU  HA    114 CYS  H       2.80 
113 LEU  HA    123 ILE  H       5.40 
113 LEU  HA    124 GLU  HG2     5.40 
113 LEU  HA    124 GLU  HG3     5.40 
113 LEU  HA    124 GLU  H       5.40 
113 LEU  HA    125 LEU  H       3.60 
113 LEU  HG    114 CYS  H       5.40 
113 LEU  HG    122 ARG  HD2     5.40 
113 LEU  HG    122 ARG  HD3     5.40 
113 LEU  H     113 LEU  HA      2.80 
113 LEU  H     113 LEU  HB2     3.60 
113 LEU  H     113 LEU  HB3     3.60 
113 LEU  H     113 LEU  HG      5.40 
113 LEU  H     113 LEU  QD1     6.72 
113 LEU  H     113 LEU  QD2     6.72 
113 LEU  H     114 CYS  HA      5.40 
113 LEU  H     114 CYS  H       4.30 
113 LEU  H     124 GLU  HA      5.40 
113 LEU  H     125 LEU  HG      5.40 
113 LEU  H     125 LEU  H       4.30 
113 LEU  QD1   114 CYS  H       6.72 
113 LEU  QD1   122 ARG  HB2     6.72 
113 LEU  QD1   122 ARG  HB3     6.72 
113 LEU  QD1   122 ARG  HD2     6.72 
113 LEU  QD1   122 ARG  HD3     6.72 
113 LEU  QD1   123 ILE  QG2     8.74 
113 LEU  QD1   124 GLU  HA      6.72 
113 LEU  QD2   114 CYS  H       6.72 
113 LEU  QD2   122 ARG  HB2     6.72 
113 LEU  QD2   122 ARG  HB3     6.72 
113 LEU  QD2   122 ARG  HD2     6.72 
113 LEU  QD2   122 ARG  HD3     6.72 
113 LEU  QD2   123 ILE  QG2     8.74 
113 LEU  QD2   124 GLU  HA      6.72 
114 CYS  HA    115 VAL  QG1     6.72 
114 CYS  HA    115 VAL  QG2     6.72 
114 CYS  HA    123 ILE  H       5.40 
114 CYS  HB2   115 VAL  H       5.40 
114 CYS  HB2   123 ILE  HB      5.40 
114 CYS  HB2   123 ILE  QG2     6.72 
114 CYS  HB3   115 VAL  H       5.40 
114 CYS  HB3   123 ILE  HB      5.40 
114 CYS  HB3   123 ILE  QG2     6.72 
114 CYS  H     115 VAL  H       5.70 
114 CYS  H     123 ILE  HB      5.40 
114 CYS  H     123 ILE  H       4.30 
114 CYS  H     123 ILE  QG2     6.72 
114 CYS  H     124 GLU  HA      5.40 
114 CYS  H     124 GLU  H       5.70 
114 CYS  H     125 LEU  HA      5.40 
114 CYS  H     125 LEU  HG      5.40 
114 CYS  H     125 LEU  H       5.70 
115 VAL  HA    116 CYSM H       2.80 
115 VAL  HA    123 ILE  H       3.60 
115 VAL  HB    116 CYSM H       3.60 
115 VAL  HB    120 ASP  HA      5.40 
115 VAL  HB    121 GLY  H       5.40 
115 VAL  HB    122 ARG  HA      5.40 
115 VAL  HB    122 ARG  H       5.40 
115 VAL  H     116 CYSM H       5.70 
115 VAL  H     123 ILE  HB      5.40 
115 VAL  H     123 ILE  H       5.70 
115 VAL  H     123 ILE  QD1     6.72 
115 VAL  QG1   122 ARG  HA      6.72 
115 VAL  QG2   122 ARG  HA      6.72 
116 CYSM HA    117 CYS  H       2.80 
116 CYSM HA    118 LYS  H       5.40 
116 CYSM HA    119 CYSS H       5.40 
116 CYSM HA    120 ASP  H       5.40 
116 CYSM HA    121 GLY  H       5.40 
116 CYSM HA    123 ILE  QD1     4.92 
116 CYSM HA    147 PHE  HB2     5.40 
116 CYSM HA    147 PHE  HB3     5.40 
116 CYSM HA    147 PHE  QD      7.53 
116 CYSM HA    147 PHE  H       5.40 
116 CYSM HA    149 CYSS H       5.40 
116 CYSM HB2   117 CYS  H       5.40 
116 CYSM HB2   118 LYS  H       5.40 
116 CYSM HB2   120 ASP  H       5.40 
116 CYSM HB2   121 GLY  H       5.40 
116 CYSM HB2   123 ILE  QD1     6.72 
116 CYSM HB2   149 CYSS HB2     7.60 
116 CYSM HB2   149 CYSS HB3     7.60 
116 CYSM HB2   149 CYSS H       5.40 
116 CYSM HB3   117 CYS  H       5.40 
116 CYSM HB3   118 LYS  H       5.40 
116 CYSM HB3   120 ASP  H       5.40 
116 CYSM HB3   121 GLY  H       5.40 
116 CYSM HB3   123 ILE  QD1     6.72 
116 CYSM HB3   149 CYSS HB2     7.60 
116 CYSM HB3   149 CYSS HB3     7.60 
116 CYSM HB3   149 CYSS H       5.40 
116 CYSM H     116 CYSM HB2     3.60 
116 CYSM H     116 CYSM HB3     3.60 
116 CYSM H     117 CYS  H       5.70 
116 CYSM H     120 ASP  HA      5.40 
116 CYSM H     120 ASP  H       5.70 
116 CYSM H     121 GLY  HA2     5.40 
116 CYSM H     121 GLY  HA3     5.40 
116 CYSM H     121 GLY  H       4.30 
116 CYSM H     122 ARG  HA      5.40 
116 CYSM H     122 ARG  H       5.70 
116 CYSM H     123 ILE  HB      5.40 
116 CYSM H     123 ILE  H       4.30 
116 CYSM H     123 ILE  QD1     6.72 
117 CYS  HA    118 LYS  HA      5.40 
117 CYS  HA    119 CYSS H       5.40 
117 CYS  HA    120 ASP  H       5.40 
117 CYS  HA    146 SER  HB2     5.40 
117 CYS  HA    146 SER  HB3     5.40 
117 CYS  HB2   118 LYS  H       5.40 
117 CYS  HB2   146 SER  HB2     5.40 
117 CYS  HB2   146 SER  HB3     5.40 
117 CYS  HB2   147 PHE  H       5.40 
117 CYS  HB3   118 LYS  H       5.40 
117 CYS  HB3   146 SER  HB2     5.40 
117 CYS  HB3   146 SER  HB3     5.40 
117 CYS  HB3   147 PHE  H       5.40 
117 CYS  H     117 CYS  HB2     3.60 
117 CYS  H     117 CYS  HB3     3.60 
117 CYS  H     118 LYS  HG2     5.40 
117 CYS  H     118 LYS  HG3     5.40 
117 CYS  H     118 LYS  H       4.30 
117 CYS  H     119 CYSS H       5.70 
117 CYS  H     121 GLY  H       5.70 
117 CYS  H     123 ILE  QD1     6.72 
117 CYS  H     146 SER  HB2     5.40 
117 CYS  H     146 SER  HB3     5.40 
117 CYS  H     147 PHE  H       5.70 
117 CYS  H     148 VAL  HA      5.40 
118 LYS  HA    120 ASP  H       5.40 
118 LYS  HB2   118 LYS  HE2     5.40 
118 LYS  HB2   118 LYS  HE3     5.40 
118 LYS  HB2   119 CYSS H       5.40 
118 LYS  HB3   118 LYS  HE2     5.40 
118 LYS  HB3   118 LYS  HE3     5.40 
118 LYS  HB3   119 CYSS H       5.40 
118 LYS  HD2   119 CYSS H       5.40 
118 LYS  HD2   156 GLN  HA      5.40 
118 LYS  HD3   119 CYSS H       5.40 
118 LYS  HD3   156 GLN  HA      5.40 
118 LYS  HE2   148 VAL  QG1     6.72 
118 LYS  HE2   148 VAL  QG2     6.72 
118 LYS  HE3   148 VAL  QG1     6.72 
118 LYS  HE3   148 VAL  QG2     6.72 
118 LYS  HG2   148 VAL  QG1     6.72 
118 LYS  HG2   148 VAL  QG2     6.72 
118 LYS  HG2   152 CYSS HB2     5.40 
118 LYS  HG2   152 CYSS HB3     5.40 
118 LYS  HG2   153 ALA  QB      8.92 
118 LYS  HG3   148 VAL  QG1     6.72 
118 LYS  HG3   148 VAL  QG2     6.72 
118 LYS  HG3   152 CYSS HB2     5.40 
118 LYS  HG3   152 CYSS HB3     5.40 
118 LYS  HG3   153 ALA  QB      8.92 
118 LYS  H     118 LYS  HB2     3.60 
118 LYS  H     118 LYS  HB3     3.60 
118 LYS  H     119 CYSS HA      5.40 
118 LYS  H     119 CYSS H       4.30 
118 LYS  H     120 ASP  H       4.30 
118 LYS  H     121 GLY  H       5.40 
118 LYS  H     148 VAL  HA      5.40 
118 LYS  H     148 VAL  QG1     6.72 
118 LYS  H     148 VAL  QG2     6.72 
119 CYSS HA    119 CYSS HB2     2.80 
119 CYSS HA    119 CYSS HB3     2.80 
119 CYSS HB2   120 ASP  H       5.40 
119 CYSS HB2   121 GLY  H       5.40 
119 CYSS HB3   120 ASP  H       5.40 
119 CYSS HB3   121 GLY  H       5.40 
119 CYSS H     119 CYSS HB2     3.60 
119 CYSS H     119 CYSS HB3     3.60 
119 CYSS H     120 ASP  HA      5.40 
119 CYSS H     120 ASP  HB2     5.40 
119 CYSS H     120 ASP  HB3     5.40 
119 CYSS H     120 ASP  H       4.30 
119 CYSS H     121 GLY  H       4.30 
119 CYSS H     152 CYSS HB2     5.40 
119 CYSS H     152 CYSS HB3     5.40 
120 ASP  HB2   121 GLY  H       5.40 
120 ASP  HB3   121 GLY  H       5.40 
120 ASP  H     120 ASP  HA      2.80 
120 ASP  H     120 ASP  HB2     3.60 
120 ASP  H     120 ASP  HB3     3.60 
120 ASP  H     121 GLY  H       4.30 
121 GLY  HA2   122 ARG  HA      5.40 
121 GLY  HA2   122 ARG  H       2.80 
121 GLY  HA3   122 ARG  HA      5.40 
121 GLY  HA3   122 ARG  H       2.80 
121 GLY  H     122 ARG  H       5.70 
121 GLY  H     123 ILE  QD1     6.72 
122 ARG  HA    122 ARG  HD2     5.40 
122 ARG  HA    122 ARG  HD3     5.40 
122 ARG  HA    123 ILE  H       2.80 
122 ARG  HB2   123 ILE  H       5.40 
122 ARG  HB3   123 ILE  H       5.40 
122 ARG  HD2   123 ILE  HA      5.40 
122 ARG  HD2   124 GLU  HB2     5.40 
122 ARG  HD2   124 GLU  HB3     5.40 
122 ARG  HD2   124 GLU  H       5.40 
122 ARG  HD3   123 ILE  HA      5.40 
122 ARG  HD3   124 GLU  HB2     5.40 
122 ARG  HD3   124 GLU  HB3     5.40 
122 ARG  HD3   124 GLU  H       5.40 
122 ARG  H     122 ARG  HB2     3.60 
122 ARG  H     122 ARG  HB3     3.60 
122 ARG  H     122 ARG  HD2     5.40 
122 ARG  H     122 ARG  HD3     5.40 
122 ARG  H     122 ARG  HG2     5.40 
122 ARG  H     122 ARG  HG3     5.40 
122 ARG  H     123 ILE  HA      5.40 
122 ARG  H     123 ILE  H       5.70 
123 ILE  HA    123 ILE  QD1     6.72 
123 ILE  HA    123 ILE  QG2     4.12 
123 ILE  HA    124 GLU  HA      5.40 
123 ILE  HA    124 GLU  HB2     5.40 
123 ILE  HA    124 GLU  HB3     5.40 
123 ILE  HB    124 GLU  H       5.40 
123 ILE  HB    147 PHE  HB2     5.40 
123 ILE  HB    147 PHE  HB3     5.40 
123 ILE  H     123 ILE  HB      3.60 
123 ILE  H     123 ILE  QD1     6.72 
123 ILE  H     123 ILE  QG2     6.72 
123 ILE  H     124 GLU  HA      5.40 
123 ILE  H     124 GLU  H       5.70 
123 ILE  QD1   124 GLU  H       6.72 
123 ILE  QD1   147 PHE  QD      8.85 
123 ILE  QD1   147 PHE  H       6.72 
123 ILE  QD1   148 VAL  HA      6.72 
123 ILE  QD1   148 VAL  H       6.72 
123 ILE  QD1   149 CYSS HA      6.72 
123 ILE  QD1   149 CYSS HB2     6.72 
123 ILE  QD1   149 CYSS HB3     6.72 
123 ILE  QD1   149 CYSS H       4.92 
123 ILE  QD1   150 PRO  QD      9.61 
123 ILE  QG2   123 ILE  QD1     6.94 
123 ILE  QG2   124 GLU  HB2     6.72 
123 ILE  QG2   124 GLU  HB3     6.72 
123 ILE  QG2   124 GLU  H       6.72 
123 ILE  QG2   125 LEU  HA      6.72 
123 ILE  QG2   125 LEU  HG      6.72 
123 ILE  QG2   125 LEU  H       6.72 
123 ILE  QG2   147 PHE  HB2     6.72 
123 ILE  QG2   147 PHE  HB3     6.72 
123 ILE  QG2   147 PHE  QD      8.85 
123 ILE  QG2   147 PHE  QE      8.85 
123 ILE  QG2   149 CYSS HA      6.72 
123 ILE  QG2   150 PRO  QD      9.61 
124 GLU  HB2   125 LEU  H       5.40 
124 GLU  HB3   125 LEU  H       5.40 
124 GLU  HG2   125 LEU  H       5.40 
124 GLU  HG3   125 LEU  H       5.40 
124 GLU  H     124 GLU  HB2     3.60 
124 GLU  H     124 GLU  HB3     3.60 
124 GLU  H     124 GLU  HG2     5.40 
124 GLU  H     124 GLU  HG3     5.40 
124 GLU  H     125 LEU  HG      5.40 
124 GLU  H     125 LEU  H       4.30 
125 LEU  HA    125 LEU  QD1     6.72 
125 LEU  HA    125 LEU  QD2     6.72 
125 LEU  HA    126 THR  HB      5.40 
125 LEU  HA    126 THR  H       2.80 
125 LEU  HB2   126 THR  H       5.40 
125 LEU  HB3   126 THR  H       5.40 
125 LEU  HG    126 THR  H       5.40 
125 LEU  H     125 LEU  HG      5.40 
125 LEU  H     125 LEU  QD1     6.72 
125 LEU  H     125 LEU  QD2     6.72 
125 LEU  H     126 THR  H       4.30 
125 LEU  QD1   126 THR  H       6.72 
125 LEU  QD1   147 PHE  QD      8.85 
125 LEU  QD1   147 PHE  QE      8.85 
125 LEU  QD2   126 THR  H       6.72 
125 LEU  QD2   147 PHE  QD      8.85 
125 LEU  QD2   147 PHE  QE      8.85 
126 THR  HA    127 VAL  H       2.80 
126 THR  HB    127 VAL  H       5.40 
126 THR  H     126 THR  HB      3.60 
126 THR  H     126 THR  QG2     6.72 
126 THR  H     127 VAL  HA      5.40 
126 THR  H     127 VAL  H       4.30 
126 THR  QG2   127 VAL  HA      6.72 
126 THR  QG2   127 VAL  H       6.72 
126 THR  QG2   127 VAL  QG1     8.74 
126 THR  QG2   127 VAL  QG2     8.74 
126 THR  QG2   128 GLU  H       6.72 
127 VAL  HA    127 VAL  HB      2.80 
127 VAL  HA    128 GLU  HA      5.40 
127 VAL  HA    128 GLU  H       2.80 
127 VAL  HB    128 GLU  H       3.60 
127 VAL  H     128 GLU  HA      5.40 
127 VAL  H     128 GLU  H       5.70 
127 VAL  QG1   137 LEU  QD1     8.74 
127 VAL  QG1   137 LEU  QD2     8.74 
127 VAL  QG2   137 LEU  QD1     8.74 
127 VAL  QG2   137 LEU  QD2     8.74 
128 GLU  HA    128 GLU  HG2     3.60 
128 GLU  HA    128 GLU  HG3     3.60 
128 GLU  HA    129 SER  H       2.80 
128 GLU  HB2   129 SER  H       5.40 
128 GLU  HB3   129 SER  H       5.40 
128 GLU  H     128 GLU  HG2     5.40 
128 GLU  H     128 GLU  HG3     5.40 
128 GLU  H     129 SER  HA      5.40 
128 GLU  H     129 SER  H       4.30 
129 SER  HA    130 SER  H       2.80 
129 SER  HB2   134 LEU  H       5.40 
129 SER  HB3   134 LEU  H       5.40 
129 SER  H     129 SER  HB2     3.60 
129 SER  H     129 SER  HB3     3.60 
129 SER  H     130 SER  H       5.70 
130 SER  HA    131 ALA  QB      6.72 
130 SER  HA    132 GLU  H       5.40 
130 SER  HA    133 ASP  H       5.40 
130 SER  HB2   133 ASP  H       5.40 
130 SER  HB2   134 LEU  H       5.40 
130 SER  HB3   133 ASP  H       5.40 
130 SER  HB3   134 LEU  H       5.40 
130 SER  H     130 SER  HB2     3.60 
130 SER  H     130 SER  HB3     3.60 
130 SER  H     133 ASP  HB2     5.40 
130 SER  H     133 ASP  HB3     5.40 
130 SER  H     133 ASP  H       5.40 
130 SER  H     134 LEU  H       5.70 
131 ALA  HA    133 ASP  H       5.40 
131 ALA  HA    134 LEU  HA      5.40 
131 ALA  HA    134 LEU  HB2     5.40 
131 ALA  HA    134 LEU  HB3     5.40 
131 ALA  HA    134 LEU  HG      5.40 
131 ALA  HA    134 LEU  H       3.60 
131 ALA  HA    134 LEU  QD1     6.72 
131 ALA  HA    134 LEU  QD2     6.72 
131 ALA  HA    135 ARG  H       5.40 
131 ALA  QB    132 GLU  HA      6.72 
131 ALA  QB    132 GLU  HG2     6.72 
131 ALA  QB    132 GLU  HG3     6.72 
131 ALA  QB    132 GLU  H       4.92 
131 ALA  QB    133 ASP  H       6.72 
131 ALA  QB    134 LEU  H       6.72 
131 ALA  QB    135 ARG  H       6.72 
132 GLU  HA    134 LEU  H       5.40 
132 GLU  HA    135 ARG  HB2     5.40 
132 GLU  HA    135 ARG  HB3     5.40 
132 GLU  HA    135 ARG  HD2     5.40 
132 GLU  HA    135 ARG  HD3     5.40 
132 GLU  HA    135 ARG  H       3.60 
132 GLU  HA    136 THR  H       5.40 
132 GLU  HB2   133 ASP  H       5.40 
132 GLU  HB3   133 ASP  H       5.40 
132 GLU  HG2   133 ASP  H       5.40 
132 GLU  HG3   133 ASP  H       5.40 
132 GLU  H     132 GLU  HA      2.80 
132 GLU  H     132 GLU  HB2     3.60 
132 GLU  H     132 GLU  HB3     3.60 
132 GLU  H     132 GLU  HG2     5.40 
132 GLU  H     132 GLU  HG3     5.40 
132 GLU  H     133 ASP  HA      5.40 
132 GLU  H     133 ASP  HB2     5.40 
132 GLU  H     133 ASP  HB3     5.40 
132 GLU  H     133 ASP  H       4.30 
132 GLU  H     134 LEU  H       4.30 
133 ASP  HA    135 ARG  H       5.40 
133 ASP  HA    136 THR  HB      5.40 
133 ASP  HA    136 THR  H       3.60 
133 ASP  HA    136 THR  QG2     6.72 
133 ASP  HA    137 LEU  H       5.40 
133 ASP  H     133 ASP  HA      2.80 
133 ASP  H     134 LEU  HA      5.40 
133 ASP  H     134 LEU  H       4.30 
133 ASP  H     135 ARG  H       4.30 
134 LEU  HA    134 LEU  HG      3.60 
134 LEU  HA    134 LEU  QD1     6.72 
134 LEU  HA    134 LEU  QD2     6.72 
134 LEU  HA    135 ARG  HA      5.40 
134 LEU  HA    136 THR  H       5.40 
134 LEU  HA    137 LEU  HB2     5.40 
134 LEU  HA    137 LEU  HB3     5.40 
134 LEU  HA    137 LEU  HG      5.40 
134 LEU  HA    137 LEU  H       5.40 
134 LEU  HA    137 LEU  QD1     6.72 
134 LEU  HA    137 LEU  QD2     6.72 
134 LEU  HA    138 GLN  H       5.40 
134 LEU  HB2   135 ARG  H       5.40 
134 LEU  HB3   135 ARG  H       5.40 
134 LEU  HG    135 ARG  HA      5.40 
134 LEU  HG    135 ARG  H       5.40 
134 LEU  HG    137 LEU  QD1     6.72 
134 LEU  HG    137 LEU  QD2     6.72 
134 LEU  HG    138 GLN  HA      5.40 
134 LEU  HG    138 GLN  HE21    5.40 
134 LEU  HG    138 GLN  HE22    5.40 
134 LEU  HG    138 GLN  H       5.40 
134 LEU  H     134 LEU  HB2     3.60 
134 LEU  H     134 LEU  HB3     3.60 
134 LEU  H     134 LEU  HG      5.40 
134 LEU  H     134 LEU  QD1     6.72 
134 LEU  H     134 LEU  QD2     6.72 
134 LEU  H     135 ARG  HB2     5.40 
134 LEU  H     135 ARG  HB3     5.40 
134 LEU  H     135 ARG  H       4.30 
134 LEU  H     136 THR  HB      5.40 
134 LEU  H     136 THR  H       5.70 
134 LEU  QD1   135 ARG  H       6.72 
134 LEU  QD1   137 LEU  QD1     8.74 
134 LEU  QD1   137 LEU  QD2     8.74 
134 LEU  QD1   138 GLN  HE21    6.72 
134 LEU  QD1   138 GLN  HE22    6.72 
134 LEU  QD2   135 ARG  H       6.72 
134 LEU  QD2   137 LEU  QD1     8.74 
134 LEU  QD2   137 LEU  QD2     8.74 
134 LEU  QD2   138 GLN  HE21    6.72 
134 LEU  QD2   138 GLN  HE22    6.72 
135 ARG  HA    135 ARG  HD2     5.40 
135 ARG  HA    135 ARG  HD3     5.40 
135 ARG  HA    137 LEU  H       5.40 
135 ARG  HA    138 GLN  HB2     5.40 
135 ARG  HA    138 GLN  HB3     5.40 
135 ARG  HA    138 GLN  HG2     5.40 
135 ARG  HA    138 GLN  HG3     5.40 
135 ARG  HA    138 GLN  H       3.60 
135 ARG  HA    139 GLN  H       5.40 
135 ARG  HB2   136 THR  H       3.60 
135 ARG  HB2   139 GLN  HE21    5.40 
135 ARG  HB2   139 GLN  HE22    5.40 
135 ARG  HB3   136 THR  H       3.60 
135 ARG  HB3   139 GLN  HE21    5.40 
135 ARG  HB3   139 GLN  HE22    5.40 
135 ARG  HG2   136 THR  H       5.40 
135 ARG  HG2   139 GLN  HE21    5.40 
135 ARG  HG2   139 GLN  HE22    5.40 
135 ARG  HG3   136 THR  H       5.40 
135 ARG  HG3   139 GLN  HE21    5.40 
135 ARG  HG3   139 GLN  HE22    5.40 
135 ARG  H     135 ARG  HD2     5.40 
135 ARG  H     135 ARG  HD3     5.40 
135 ARG  H     135 ARG  HG2     5.40 
135 ARG  H     135 ARG  HG3     5.40 
135 ARG  H     136 THR  HB      5.40 
135 ARG  H     136 THR  H       4.30 
135 ARG  H     137 LEU  HG      5.40 
135 ARG  H     137 LEU  H       4.30 
136 THR  HA    138 GLN  H       5.40 
136 THR  HA    139 GLN  HB2     5.40 
136 THR  HA    139 GLN  HB3     5.40 
136 THR  HA    139 GLN  HE21    5.40 
136 THR  HA    139 GLN  HE22    5.40 
136 THR  HA    139 GLN  HG2     5.40 
136 THR  HA    139 GLN  HG3     5.40 
136 THR  HA    139 GLN  H       3.60 
136 THR  HB    137 LEU  HA      5.40 
136 THR  HB    137 LEU  H       3.60 
136 THR  HB    138 GLN  H       5.40 
136 THR  HB    139 GLN  H       5.40 
136 THR  H     136 THR  HB      3.60 
136 THR  H     136 THR  QG2     6.72 
136 THR  H     137 LEU  HA      5.40 
136 THR  H     137 LEU  H       5.70 
136 THR  H     138 GLN  H       4.30 
136 THR  H     139 GLN  H       5.70 
136 THR  QG2   137 LEU  HA      6.72 
136 THR  QG2   137 LEU  H       6.72 
136 THR  QG2   139 GLN  H       6.72 
136 THR  QG2   140 LEU  HG      4.92 
136 THR  QG2   140 LEU  H       6.72 
136 THR  QG2   140 LEU  QD1     8.74 
136 THR  QG2   140 LEU  QD2     8.74 
137 LEU  HA    137 LEU  QD1     6.72 
137 LEU  HA    137 LEU  QD2     6.72 
137 LEU  HA    139 GLN  H       5.40 
137 LEU  HA    140 LEU  HB2     5.40 
137 LEU  HA    140 LEU  HB3     5.40 
137 LEU  HA    140 LEU  HG      5.40 
137 LEU  HA    140 LEU  H       3.60 
137 LEU  HA    141 PHE  H       5.40 
137 LEU  HB2   138 GLN  H       5.40 
137 LEU  HB3   138 GLN  H       5.40 
137 LEU  HG    138 GLN  HA      5.40 
137 LEU  HG    138 GLN  H       5.40 
137 LEU  HG    141 PHE  QE      7.53 
137 LEU  H     137 LEU  HB2     3.60 
137 LEU  H     137 LEU  HB3     3.60 
137 LEU  H     137 LEU  HG      5.40 
137 LEU  H     137 LEU  QD1     6.72 
137 LEU  H     137 LEU  QD2     6.72 
137 LEU  H     138 GLN  HA      5.40 
137 LEU  H     138 GLN  H       4.30 
137 LEU  H     139 GLN  H       5.70 
137 LEU  H     140 LEU  HG      5.40 
137 LEU  H     140 LEU  H       5.70 
137 LEU  QD1   138 GLN  HA      6.72 
137 LEU  QD1   138 GLN  H       6.72 
137 LEU  QD2   138 GLN  HA      6.72 
137 LEU  QD2   138 GLN  H       6.72 
138 GLN  HA    141 PHE  HB2     5.40 
138 GLN  HA    141 PHE  HB3     5.40 
138 GLN  HA    141 PHE  QD      7.53 
138 GLN  HA    141 PHE  H       3.60 
138 GLN  HB2   138 GLN  HE21    5.40 
138 GLN  HB2   138 GLN  HE22    5.40 
138 GLN  HB2   139 GLN  H       5.40 
138 GLN  HB3   138 GLN  HE21    5.40 
138 GLN  HB3   138 GLN  HE22    5.40 
138 GLN  HB3   139 GLN  H       5.40 
138 GLN  HG2   139 GLN  HA      5.40 
138 GLN  HG2   139 GLN  HE21    5.40 
138 GLN  HG2   139 GLN  HE22    5.40 
138 GLN  HG2   139 GLN  H       5.40 
138 GLN  HG3   139 GLN  HA      5.40 
138 GLN  HG3   139 GLN  HE21    5.40 
138 GLN  HG3   139 GLN  HE22    5.40 
138 GLN  HG3   139 GLN  H       5.40 
138 GLN  H     138 GLN  HB2     3.60 
138 GLN  H     138 GLN  HB3     3.60 
138 GLN  H     138 GLN  HE21    5.70 
138 GLN  H     138 GLN  HE22    5.70 
138 GLN  H     138 GLN  HG2     5.40 
138 GLN  H     138 GLN  HG3     5.40 
138 GLN  H     139 GLN  H       4.30 
138 GLN  H     140 LEU  H       4.30 
138 GLN  H     141 PHE  QD      7.83 
138 GLN  H     141 PHE  H       5.70 
139 GLN  HA    139 GLN  HE21    5.40 
139 GLN  HA    139 GLN  HE22    5.40 
139 GLN  HA    140 LEU  HA      5.40 
139 GLN  HA    141 PHE  H       5.40 
139 GLN  HA    142 LEU  HB2     5.40 
139 GLN  HA    142 LEU  HB3     5.40 
139 GLN  HA    142 LEU  HG      5.40 
139 GLN  HA    142 LEU  H       3.60 
139 GLN  HA    142 LEU  QD1     6.72 
139 GLN  HA    142 LEU  QD2     6.72 
139 GLN  HA    143 SER  H       5.40 
139 GLN  HB2   139 GLN  HE21    5.40 
139 GLN  HB2   139 GLN  HE22    5.40 
139 GLN  HB2   140 LEU  HA      5.40 
139 GLN  HB2   140 LEU  H       5.40 
139 GLN  HB2   142 LEU  H       5.40 
139 GLN  HB3   139 GLN  HE21    5.40 
139 GLN  HB3   139 GLN  HE22    5.40 
139 GLN  HB3   140 LEU  HA      5.40 
139 GLN  HB3   140 LEU  H       5.40 
139 GLN  HB3   142 LEU  H       5.40 
139 GLN  H     139 GLN  HA      2.80 
139 GLN  H     139 GLN  HB2     3.60 
139 GLN  H     139 GLN  HB3     3.60 
139 GLN  H     140 LEU  HA      5.40 
139 GLN  H     140 LEU  HG      5.20 
139 GLN  H     140 LEU  H       4.30 
139 GLN  H     140 LEU  QD1     6.72 
139 GLN  H     140 LEU  QD2     6.72 
139 GLN  H     141 PHE  QD      7.53 
139 GLN  H     141 PHE  H       4.30 
140 LEU  HA    140 LEU  HG      3.60 
140 LEU  HA    141 PHE  HA      5.40 
140 LEU  HA    142 LEU  H       5.40 
140 LEU  HA    143 SER  HB2     5.40 
140 LEU  HA    143 SER  HB3     5.40 
140 LEU  HA    143 SER  H       3.60 
140 LEU  HA    144 THR  H       5.40 
140 LEU  HA    144 THR  QG2     8.92 
140 LEU  HA    145 LEU  HB2     5.40 
140 LEU  HA    145 LEU  HB3     5.40 
140 LEU  HA    145 LEU  H       5.40 
140 LEU  HB2   145 LEU  HB2     5.40 
140 LEU  HB2   145 LEU  HB3     5.40 
140 LEU  HB2   145 LEU  QD1     6.72 
140 LEU  HB2   145 LEU  QD2     6.72 
140 LEU  HB3   145 LEU  HB2     5.40 
140 LEU  HB3   145 LEU  HB3     5.40 
140 LEU  HB3   145 LEU  QD1     6.72 
140 LEU  HB3   145 LEU  QD2     6.72 
140 LEU  HG    141 PHE  H       5.40 
140 LEU  H     140 LEU  HB2     3.60 
140 LEU  H     140 LEU  HB3     3.60 
140 LEU  H     140 LEU  HG      2.80 
140 LEU  H     140 LEU  QD1     4.92 
140 LEU  H     140 LEU  QD2     4.92 
140 LEU  H     141 PHE  H       4.30 
140 LEU  H     142 LEU  H       4.30 
140 LEU  H     143 SER  H       5.70 
140 LEU  QD1   141 PHE  H       6.72 
140 LEU  QD2   141 PHE  H       6.72 
141 PHE  HA    143 SER  H       5.40 
141 PHE  HA    145 LEU  HG      5.40 
141 PHE  HA    145 LEU  H       3.60 
141 PHE  HA    145 LEU  QD1     6.72 
141 PHE  HA    145 LEU  QD2     6.72 
141 PHE  HA    146 SER  H       5.40 
141 PHE  HB2   142 LEU  H       5.40 
141 PHE  HB3   142 LEU  H       5.40 
141 PHE  QE    145 LEU  QD1     8.85 
141 PHE  QE    145 LEU  QD2     8.85 
141 PHE  H     141 PHE  QD      7.53 
141 PHE  H     142 LEU  HA      5.40 
141 PHE  H     142 LEU  H       4.30 
141 PHE  H     143 SER  H       5.40 
142 LEU  HA    142 LEU  HG      3.60 
142 LEU  HA    144 THR  H       5.40 
142 LEU  HB2   143 SER  H       5.40 
142 LEU  HB3   143 SER  H       5.40 
142 LEU  HG    143 SER  H       5.40 
142 LEU  H     142 LEU  HG      5.40 
142 LEU  H     142 LEU  QD1     6.72 
142 LEU  H     142 LEU  QD2     6.72 
142 LEU  H     143 SER  HA      5.40 
142 LEU  H     143 SER  HB2     5.40 
142 LEU  H     143 SER  HB3     5.40 
142 LEU  H     143 SER  H       4.30 
142 LEU  H     144 THR  H       5.40 
142 LEU  H     145 LEU  H       5.70 
142 LEU  QD1   143 SER  H       6.72 
142 LEU  QD2   143 SER  H       6.72 
143 SER  HA    145 LEU  H       5.40 
143 SER  HB2   144 THR  H       3.60 
143 SER  HB2   145 LEU  H       5.40 
143 SER  HB3   144 THR  H       3.60 
143 SER  HB3   145 LEU  H       5.40 
143 SER  H     143 SER  HA      2.80 
143 SER  H     143 SER  HB2     3.60 
143 SER  H     143 SER  HB3     3.60 
143 SER  H     144 THR  HA      5.40 
143 SER  H     144 THR  H       4.30 
143 SER  H     145 LEU  H       4.30 
144 THR  HB    145 LEU  H       5.40 
144 THR  H     144 THR  HA      2.80 
144 THR  H     144 THR  QG2     4.92 
144 THR  H     145 LEU  HA      5.40 
144 THR  H     145 LEU  HB2     5.40 
144 THR  H     145 LEU  HB3     5.40 
144 THR  H     145 LEU  H       4.30 
144 THR  QG2   145 LEU  H       4.92 
145 LEU  HA    146 SER  H       2.80 
145 LEU  HB2   146 SER  H       5.40 
145 LEU  HB3   146 SER  H       5.40 
145 LEU  HG    146 SER  H       5.40 
145 LEU  H     145 LEU  HB2     3.60 
145 LEU  H     145 LEU  HB3     3.60 
145 LEU  H     145 LEU  QD1     6.72 
145 LEU  H     145 LEU  QD2     6.72 
145 LEU  H     146 SER  H       5.70 
146 SER  HA    147 PHE  HB2     5.40 
146 SER  HA    147 PHE  HB3     5.40 
146 SER  HA    147 PHE  QD      7.53 
146 SER  HB2   147 PHE  H       3.60 
146 SER  HB3   147 PHE  H       3.60 
146 SER  H     147 PHE  HA      5.40 
146 SER  H     147 PHE  H       4.30 
147 PHE  HA    147 PHE  QD      7.53 
147 PHE  HB2   148 VAL  H       5.40 
147 PHE  HB3   148 VAL  H       5.40 
147 PHE  QD    148 VAL  H       7.53 
147 PHE  H     147 PHE  HB2     3.60 
147 PHE  H     147 PHE  HB3     3.60 
147 PHE  H     147 PHE  QD      6.43 
147 PHE  H     148 VAL  HA      5.40 
147 PHE  H     148 VAL  H       4.30 
148 VAL  HA    149 CYSS H       2.80 
148 VAL  HB    149 CYSS H       5.40 
148 VAL  HB    153 ALA  QB      6.72 
148 VAL  H     148 VAL  HA      2.80 
148 VAL  H     148 VAL  HB      3.60 
148 VAL  H     149 CYSS HA      5.40 
148 VAL  H     149 CYSS H       4.30 
148 VAL  QG1   152 CYSS HB2     6.72 
148 VAL  QG1   152 CYSS HB3     6.72 
148 VAL  QG1   153 ALA  HA      8.92 
148 VAL  QG1   153 ALA  H       6.72 
148 VAL  QG1   153 ALA  QB      8.74 
148 VAL  QG2   152 CYSS HB2     6.72 
148 VAL  QG2   152 CYSS HB3     6.72 
148 VAL  QG2   153 ALA  HA      8.92 
148 VAL  QG2   153 ALA  H       6.72 
148 VAL  QG2   153 ALA  QB      8.74 
149 CYSS HA    150 PRO  HG2     5.40 
149 CYSS HA    150 PRO  HG3     5.40 
149 CYSS HA    151 TRP  H       5.40 
149 CYSS HB2   150 PRO  QD      7.89 
149 CYSS HB2   151 TRP  H       5.40 
149 CYSS HB3   150 PRO  QD      7.89 
149 CYSS HB3   151 TRP  H       5.40 
149 CYSS H     149 CYSS HB2     3.60 
149 CYSS H     149 CYSS HB3     3.60 
149 CYSS H     150 PRO  QD      7.89 
149 CYSS H     151 TRP  H       5.40 
149 CYSS H     152 CYSS HB2     5.40 
149 CYSS H     152 CYSS HB3     5.40 
149 CYSS H     152 CYSS H       5.70 
149 CYSS H     153 ALA  H       5.70 
150 PRO  HA    151 TRP  HA      5.40 
150 PRO  HA    152 CYSS H       5.40 
150 PRO  HA    153 ALA  H       5.40 
150 PRO  HA    153 ALA  QB      4.92 
150 PRO  HA    154 THR  H       5.40 
150 PRO  HB2   153 ALA  QB      6.72 
150 PRO  HB3   153 ALA  QB      6.72 
150 PRO  HG2   151 TRP  H       5.40 
150 PRO  HG3   151 TRP  H       5.40 
150 PRO  QD    152 CYSS H       7.89 
151 TRP  HA    151 TRP  HE1     5.40 
151 TRP  HA    153 ALA  H       5.40 
151 TRP  HA    154 THR  H       5.40 
151 TRP  HA    154 THR  QG2     6.72 
151 TRP  HA    155 ASN  HD21    5.40 
151 TRP  HA    155 ASN  HD22    5.40 
151 TRP  HB2   152 CYSS H       5.40 
151 TRP  HB3   152 CYSS H       5.40 
151 TRP  HD1   152 CYSS H       5.70 
151 TRP  HD1   155 ASN  HD21    5.40 
151 TRP  HD1   155 ASN  HD22    5.40 
151 TRP  HE1   155 ASN  HB2     5.40 
151 TRP  HE1   155 ASN  HB3     5.40 
151 TRP  HE3   152 CYSS H       5.70 
151 TRP  H     151 TRP  HA      2.80 
151 TRP  H     151 TRP  HD1     5.40 
151 TRP  H     152 CYSS HA      5.40 
151 TRP  H     152 CYSS H       4.30 
151 TRP  H     153 ALA  H       5.70 
151 TRP  H     153 ALA  QB      6.72 
151 TRP  H     154 THR  HB      5.40 
151 TRP  H     154 THR  H       5.40 
152 CYSS HB2   153 ALA  HA      5.40 
152 CYSS HB2   153 ALA  H       5.40  
152 CYSS HB3   153 ALA  HA      5.40 
152 CYSS HB3   153 ALA  H       5.40  
152 CYSS H     152 CYSS HB2     3.60 
152 CYSS H     152 CYSS HB3     3.60 
152 CYSS H     153 ALA  HA      5.40 
152 CYSS H     153 ALA  H       4.30 
152 CYSS H     153 ALA  QB      6.72 
152 CYSS H     154 THR  H       5.70 
153 ALA  HA    156 GLN  H       5.40 
153 ALA  H     153 ALA  HA      2.80 
153 ALA  H     154 THR  H       4.30 
153 ALA  H     156 GLN  H       5.70 
153 ALA  QB    154 THR  H       4.92 
154 THR  HA    156 GLN  H       5.40 
154 THR  HB    155 ASN  HD21    5.40 
154 THR  HB    155 ASN  HD22    5.40 
154 THR  H     154 THR  QG2     4.92 
154 THR  H     155 ASN  HA      5.40 
154 THR  H     155 ASN  H       4.30 
154 THR  H     156 GLN  H       4.30 
154 THR  QG2   155 ASN  HD21    6.72 
154 THR  QG2   155 ASN  HD22    6.72 
154 THR  QG2   155 ASN  H       6.72 
154 THR  QG2   156 GLN  H       6.72 
155 ASN  HD21  156 GLN  H       5.70 
155 ASN  HD22  156 GLN  H       5.70 
155 ASN  H     156 GLN  H       4.30 
156 GLN  H     156 GLN  HG2     5.40 
156 GLN  H     156 GLN  HG3     5.40 
104 MET  QG    106 GLU  H       5.25 
106 GLU  H     106 GLU  QB      3.41 
106 GLU  QB    107 PRO  QD      3.46 
106 GLU  QB    109 ARG  H       5.25 
107 PRO  QG    108 GLN  HA      7.29 
108 GLN  H     108 GLN  QB      3.41 
108 GLN  QB    108 GLN  QE2     4.67 
108 GLN  QB    129 SER  H       5.25 
108 GLN  QG    129 SER  H       5.25 
109 ARG  H     109 ARG  QD      5.25 
109 ARG  QB    128 GLU  HA      5.25 
109 ARG  QB    128 GLU  QG      5.10 
109 ARG  QG    128 GLU  HA      5.25 
109 ARG  QD    110 HIS  H       5.25 
109 ARG  QD    126 THR  HB      7.29 
110 HIS  H     127 VAL  QQG     6.61 
110 HIS  HA    110 HIS  QB      2.58 
110 HIS  QB    127 VAL  QQG     7.30 
110 HIS  HD2   127 VAL  QQG     8.79 
111 LYS  H     111 LYS  QB      3.41 
111 LYS  H     112 ILE  QG1     5.25 
111 LYS  HA    111 LYS  QB      2.58 
111 LYS  HA    125 LEU  QB      7.29 
111 LYS  HA    127 VAL  QQG     6.61 
111 LYS  QB    111 LYS  QE      4.45 
111 LYS  QG    126 THR  HB      5.25 
112 ILE  H     112 ILE  QG1     3.55 
112 ILE  H     125 LEU  QQD     6.61 
112 ILE  H     127 VAL  QQG     6.61 
112 ILE  QG2   125 LEU  QQD     8.52 
112 ILE  QG2   137 LEU  QQD     8.52 
112 ILE  QG1   113 LEU  H       5.25 
112 ILE  QG1   125 LEU  QB      6.97 
112 ILE  QG1   126 THR  HA      7.29 
112 ILE  QG1   127 VAL  QQG     7.74 
112 ILE  QG1   134 LEU  HG      7.29 
112 ILE  QG1   134 LEU  QQD     5.89 
112 ILE  QG1   137 LEU  QQD     6.36 
112 ILE  QD1   127 VAL  QQG     6.69 
112 ILE  QD1   137 LEU  QB      6.48 
113 LEU  HA    124 GLU  QB      5.25 
113 LEU  HG    122 ARG  QG      5.25 
113 LEU  QQD   122 ARG  QG      5.77 
113 LEU  QQD   123 ILE  H       6.61 
113 LEU  QQD   124 GLU  H       6.61 
113 LEU  QQD   124 GLU  QB      8.26 
113 LEU  QQD   124 GLU  QG      7.74 
113 LEU  QQD   125 LEU  H       6.61 
114 CYS  H     125 LEU  QQD     6.61 
114 CYS  QB    123 ILE  H       5.25 
115 VAL  QQG   116 CYSM H       4.80 
115 VAL  QQG   116 CYSM HA      6.61 
115 VAL  QQG   116 CYSM QB      8.26 
115 VAL  QQG   120 ASP  HA      6.61 
115 VAL  QQG   121 GLY  H       6.61 
115 VAL  QQG   122 ARG  QG      7.74 
115 VAL  QQG   123 ILE  H       6.61 
115 VAL  QQG   123 ILE  HB      6.61 
115 VAL  QQG   123 ILE  QG2    10.58 
116 CYSM H     123 ILE  QG1     5.25 
116 CYSM QB    118 LYS  QB      6.97 
116 CYSM QB    119 CYSS H       3.55 
116 CYSM QB    120 ASP  HA      5.25 
116 CYSM QB    120 ASP  QB      6.97 
116 CYSM QB    121 GLY  QA      4.68 
116 CYSM QB    122 ARG  HA      7.29 
118 LYS  H     118 LYS  QG      3.55 
118 LYS  H     118 LYS  QD      5.25 
118 LYS  H     118 LYS  QE      5.25 
118 LYS  H     119 CYSS QB      5.25 
118 LYS  HA    118 LYS  QB      2.58 
118 LYS  QB    148 VAL  QQG     7.74 
118 LYS  QG    119 CYSS H       3.55 
118 LYS  QG    149 CYSS H       5.25 
118 LYS  QD    148 VAL  QQG     6.36 
120 ASP  H     121 GLY  QA      5.25 
121 GLY  H     121 GLY  QA      2.56 
121 GLY  QA    122 ARG  QB      5.09 
122 ARG  QB    123 ILE  HA      5.25 
122 ARG  QG    123 ILE  H       5.25 
122 ARG  QG    123 ILE  HB      7.29 
122 ARG  QD    123 ILE  H       5.25 
122 ARG  QD    124 GLU  QG      6.49 
123 ILE  H     123 ILE  QG1     5.25 
123 ILE  QG2   125 LEU  QQD     8.52 
123 ILE  QG1   124 GLU  H       5.25 
123 ILE  QG1   149 CYSS H       5.25 
123 ILE  QD1   147 PHE  QB      4.80 
123 ILE  QD1   148 VAL  QQG     8.52 
124 GLU  QB    125 LEU  HG      7.29 
124 GLU  QG    125 LEU  QB      6.49 
125 LEU  QB    126 THR  HA      5.25 
125 LEU  QB    127 VAL  H       5.25 
125 LEU  QB    127 VAL  QQG     5.89 
125 LEU  QB    147 PHE  QE      9.24 
125 LEU  QQD   127 VAL  QQG     8.30 
125 LEU  QQD   141 PHE  HZ      6.61 
125 LEU  QQD   147 PHE  HZ      6.61 
126 THR  H     127 VAL  QQG     6.61 
126 THR  HA    127 VAL  QQG     6.61 
127 VAL  QQG   128 GLU  H       4.80 
127 VAL  QQG   128 GLU  HA      6.61 
127 VAL  QQG   129 SER  H       6.61 
127 VAL  QQG   134 LEU  QQD     9.42 
127 VAL  QQG   147 PHE  QD     10.77 
127 VAL  QQG   147 PHE  QE     10.77 
128 GLU  H     128 GLU  QB      3.41 
128 GLU  H     129 SER  QB      5.25 
128 GLU  QB    129 SER  QB      6.49 
129 SER  QB    130 SER  H       3.55 
130 SER  QB    131 ALA  QB      6.48 
130 SER  QB    132 GLU  H       3.55 
131 ALA  QB    134 LEU  QQD     8.52 
132 GLU  HA    132 GLU  QG      3.42 
132 GLU  HA    135 ARG  QG      7.29 
132 GLU  QB    134 LEU  H       5.25 
133 ASP  QB    134 LEU  H       3.55 
134 LEU  H     137 LEU  QQD     6.61 
134 LEU  QB    137 LEU  QQD     6.36 
134 LEU  HG    137 LEU  QB      7.29 
134 LEU  HG    138 GLN  QB      5.25 
134 LEU  QQD   135 ARG  HA      6.61 
134 LEU  QQD   137 LEU  QB      8.26 
134 LEU  QQD   137 LEU  HG      6.61 
134 LEU  QQD   138 GLN  H       6.61 
134 LEU  QQD   138 GLN  QB      7.57 
134 LEU  QQD   138 GLN  QG      7.74 
135 ARG  H     135 ARG  QB      3.41 
135 ARG  H     137 LEU  QQD     6.61 
135 ARG  HA    138 GLN  QE2     5.25 
135 ARG  QG    136 THR  HA      7.29 
136 THR  HA    140 LEU  QQD     6.61 
136 THR  HB    137 LEU  QB      5.25 
136 THR  HB    140 LEU  QQD     6.53 
136 THR  QG2   139 GLN  QB      8.49 
137 LEU  H     138 GLN  QB      5.25 
137 LEU  H     140 LEU  QQD     6.61 
137 LEU  HA    140 LEU  QQD     8.69 
137 LEU  HA    145 LEU  QQD     8.69 
137 LEU  QB    138 GLN  HA      7.29 
137 LEU  QB    140 LEU  QB      7.31 
137 LEU  QB    140 LEU  HG      7.29 
137 LEU  QB    140 LEU  QQD     7.57 
137 LEU  QQD   138 GLN  QB      6.36 
137 LEU  QQD   141 PHE  H       6.61 
137 LEU  QQD   141 PHE  QD      8.62 
137 LEU  QQD   141 PHE  QE      8.51 
137 LEU  QQD   141 PHE  HZ      8.79 
137 LEU  QQD   147 PHE  QE     10.68 
138 GLN  H     139 GLN  QG      5.25 
138 GLN  HA    138 GLN  QE2     5.25 
138 GLN  QB    139 GLN  QB      6.97 
138 GLN  QB    139 GLN  QG      6.97 
138 GLN  QG    139 GLN  QB      6.97 
138 GLN  QG    139 GLN  QG      6.97 
139 GLN  H     139 GLN  QG      5.25 
139 GLN  H     139 GLN  QE2     5.53 
139 GLN  H     142 LEU  QQD     6.61 
139 GLN  HA    139 GLN  QG      3.42 
140 LEU  QB    141 PHE  H       3.55 
140 LEU  HG    145 LEU  QQD     8.69 
140 LEU  QQD   143 SER  H       6.61 
140 LEU  QQD   145 LEU  QQD     7.21 
141 PHE  H     141 PHE  QB      3.41 
141 PHE  H     142 LEU  QB      5.25 
141 PHE  H     145 LEU  QB      5.25 
141 PHE  H     145 LEU  QQD     6.61 
141 PHE  HA    145 LEU  QB      3.55 
141 PHE  QB    142 LEU  HA      5.25 
141 PHE  QD    145 LEU  QQD     8.62 
142 LEU  H     142 LEU  QB      3.40 
145 LEU  QQD   146 SER  H       4.80 
145 LEU  QQD   146 SER  HA      6.61 
146 SER  H     146 SER  QB      3.41 
146 SER  QB    147 PHE  HA      5.25 
147 PHE  H     148 VAL  QQG     6.61 
147 PHE  HA    148 VAL  QQG     6.61 
147 PHE  QB    148 VAL  HA      5.25 
147 PHE  QB    148 VAL  QQG     7.74 
148 VAL  QQG   149 CYSS H       4.88 
148 VAL  QQG   152 CYSS H       6.61 
149 CYSS QB    152 CYSS H       5.25 
149 CYSS QB    152 CYSS QB      6.97 
150 PRO  QB    151 TRP  HA      7.29 
150 PRO  QB    154 THR  H       5.25 
150 PRO  QB    154 THR  QG2     8.50 
151 TRP  H     151 TRP  QB      2.71 
151 TRP  QB    153 ALA  H       5.25 
152 CYSS HA    156 GLN  QB      7.29 
152 CYSS HA    156 GLN  QG      7.29 
152 CYSS QB    156 GLN  H       5.25 
155 ASN  H     155 ASN  QB      3.41 
155 ASN  H     155 ASN  QD2     5.53 
155 ASN  QB    156 GLN  H       3.55 
156 GLN  H     156 GLN  QB      3.41 
156 GLN  HA    156 GLN  QG      3.42 
 25 LEU  HB3   147 PHE  HZ      5.80  
 26 THR  HA    148 VAL  HB      5.80  
 26 THR  HB    148 VAL  H       5.80  
 26 THR  HB    148 VAL  HB      5.80  
 26 THR  QG2   148 VAL  HB      6.10  
 27 VAL  HA    147 PHE  HA      5.80  
 27 VAL  HA    148 VAL  H       5.80  
 27 VAL  HA    148 VAL  HA      5.80  
 27 VAL  HA    148 VAL  QG1     6.10  
 27 VAL  HB    137 LEU  QD1     6.10  
 27 VAL  HB    146 SER  H       5.80  
 27 VAL  HB    147 PHE  HA      5.80  
 28 GLU  H     146 SER  HB2     5.80  
 28 GLU  H     148 VAL  HB      5.80  
 28 GLU  HB2   146 SER  HB2     5.80  
 28 GLU  HB2   148 VAL  QG1     6.10  
 28 GLU  HB3   146 SER  HB2     5.80  
 28 GLU  HB3   148 VAL  QG1     6.10  
 28 GLU  HG2   148 VAL  QG1     6.10  
 28 GLU  HG3   148 VAL  QG1     6.10  
 29 SER  HA    144 THR  HB      5.80  
 29 SER  HB2   145 LEU  HA      5.80  
 29 SER  HB2   145 LEU  HG      5.80  
 29 SER  HB3   145 LEU  HA      5.80  
 29 SER  HB3   145 LEU  HG      5.80  
 29 SER  HB3   146 SER  H       5.80  
 37 LEU  HA    137 LEU  HB3     5.80  
 37 LEU  HA    140 LEU  QD2     6.10  
 37 LEU  HB2   137 LEU  QD1     6.10  
 37 LEU  HB2   140 LEU  QD2     6.10  
 37 LEU  HB3   137 LEU  QD1     6.10  
 37 LEU  HB3   140 LEU  QD2     6.10  
 49 CYSS HA    150 PRO  QD      6.10  
125 LEU  HB3    47 PHE  HZ      5.80  
126 THR  HA     48 VAL  HB      5.80  
126 THR  HB     48 VAL  H       5.80  
126 THR  HB     48 VAL  HB      5.80  
126 THR  QG2    48 VAL  HB      6.10  
127 VAL  HA     47 PHE  HA      5.80  
127 VAL  HA     48 VAL  H       5.80  
127 VAL  HA     48 VAL  HA      5.80  
127 VAL  HA     48 VAL  QG1     6.10  
127 VAL  HB     37 LEU  QD1     6.10  
127 VAL  HB     46 SER  H       5.80  
127 VAL  HB     47 PHE  HA      5.80  
128 GLU  H      46 SER  HB2     5.80  
128 GLU  H      48 VAL  HB      5.80  
128 GLU  HB2    46 SER  HB2     5.80  
128 GLU  HB2    48 VAL  QG1     6.10  
128 GLU  HB3    46 SER  HB2     5.80  
128 GLU  HB3    48 VAL  QG1     6.10  
128 GLU  HG2    48 VAL  QG1     6.10  
128 GLU  HG3    48 VAL  QG1     6.10  
129 SER  HA     44 THR  HB      5.80  
129 SER  HB2    45 LEU  HA      5.80  
129 SER  HB2    45 LEU  HG      5.80  
129 SER  HB3    45 LEU  HA      5.80  
129 SER  HB3    45 LEU  HG      5.80  
129 SER  HB3    46 SER  H       5.80  
137 LEU  HA     37 LEU  HB3     5.80  
137 LEU  HA     40 LEU  QD2     6.10  
137 LEU  HB2    37 LEU  QD1     6.10  
137 LEU  HB2    40 LEU  QD2     6.10  
137 LEU  HB3    37 LEU  QD1     6.10  
137 LEU  HB3    40 LEU  QD2     6.10  
149 CYSS HA     50 PRO  QD      6.10  
 10 HIS  H      27 VAL  O       2.00
 12 ILE  H      25 LEU  O       2.00
 14 CYS  H      23 ILE  O       2.00
 16 CYSM H      21 GLY  O       2.00
  8 GLN  O      29 SER  H       2.00
 10 HIS  O      27 VAL  H       2.00
 12 ILE  O      25 LEU  H       2.00
 14 CYS  O      23 ILE  H       2.00
 10 HIS  N      27 VAL  O       3.00
 12 ILE  N      25 LEU  O       3.00
 14 CYS  N      23 ILE  O       3.00
 16 CYSM N      21 GLY  O       3.00
  8 GLN  O      29 SER  N       3.00
 10 HIS  O      27 VAL  N       3.00
 12 ILE  O      25 LEU  N       3.00
 14 CYS  O      23 ILE  N       3.00
 35 ARG  H      31 ALA  O       2.00
 35 ARG  N      31 ALA  O       3.00
 36 THR  H      32 GLU  O       2.00
 36 THR  N      32 GLU  O       3.00
 37 LEU  H      33 ASP  O       2.00
 37 LEU  N      33 ASP  O       3.00
 38 GLN  H      34 LEU  O       2.00
 38 GLN  N      34 LEU  O       3.00
 39 GLN  H      35 ARG  O       2.00
 39 GLN  N      35 ARG  O       3.00
 40 LEU  H      36 THR  O       2.00
 40 LEU  N      36 THR  O       3.00
 41 PHE  H      37 LEU  O       2.00
 41 PHE  N      37 LEU  O       3.00
 42 LEU  H      38 GLN  O       2.00 
 42 LEU  N      38 GLN  O       3.00 
 43 SER  H      39 GLN  O       2.00 
 43 SER  N      39 GLN  O       3.00 
 54 THR  H      50 PRO  O       2.00
 54 THR  N      50 PRO  O       3.00
 55 ASN  H      51 TRP  O       2.00
 55 ASN  N      51 TRP  O       3.00
 56 GLN  H      52 CYSS O       2.00
 56 GLN  N      52 CYSS O       3.00
110 HIS  H     127 VAL  O       2.00
112 ILE  H     125 LEU  O       2.00
114 CYS  H     123 ILE  O       2.00
116 CYSM H     121 GLY  O       2.00
108 GLN  O     129 SER  H       2.00
110 HIS  O     127 VAL  H       2.00
112 ILE  O     125 LEU  H       2.00
114 CYS  O     123 ILE  H       2.00
110 HIS  N     127 VAL  O       3.00
112 ILE  N     125 LEU  O       3.00
114 CYS  N     123 ILE  O       3.00
116 CYSM N     121 GLY  O       3.00
108 GLN  O     129 SER  N       3.00
110 HIS  O     127 VAL  N       3.00
112 ILE  O     125 LEU  N       3.00
114 CYS  O     123 ILE  N       3.00
135 ARG  H     131 ALA  O       2.00
135 ARG  N     131 ALA  O       3.00
136 THR  H     132 GLU  O       2.00
136 THR  N     132 GLU  O       3.00
137 LEU  H     133 ASP  O       2.00
137 LEU  N     133 ASP  O       3.00
138 GLN  H     134 LEU  O       2.00
138 GLN  N     134 LEU  O       3.00
139 GLN  H     135 ARG  O       2.00
139 GLN  N     135 ARG  O       3.00
140 LEU  H     136 THR  O       2.00
140 LEU  N     136 THR  O       3.00
141 PHE  H     137 LEU  O       2.00
141 PHE  N     137 LEU  O       3.00
142 LEU  H     138 GLN  O       2.00 
142 LEU  N     138 GLN  O       3.00 
143 SER  H     139 GLN  O       2.00 
143 SER  N     139 GLN  O       3.00 
154 THR  H     150 PRO  O       2.00
154 THR  N     150 PRO  O       3.00
155 ASN  H     151 TRP  O       2.00
155 ASN  N     151 TRP  O       3.00
156 GLN  H     152 CYSS O       2.00
156 GLN  N     152 CYSS O       3.00
 28 GLU  H     146 SER  O       2.00 
 28 GLU  N     146 SER  O       3.00 
128 GLU  H      46 SER  O       2.00 
128 GLU  N      46 SER  O       3.00 
 16 CYSM ME     19 CYSS SG      2.40  
 16 CYSM ME     49 CYSS SG      2.40  
 16 CYSM ME     52 CYSS SG      2.40  
 16 CYSM SG     19 CYSS SG      3.85  
 16 CYSM SG     49 CYSS SG      3.85  
 16 CYSM SG     52 CYSS SG      3.85  
 19 CYSS SG     49 CYSS SG      3.85  
 19 CYSS SG     52 CYSS SG      3.85  
 49 CYSS SG     52 CYSS SG      3.85  
116 CYSM ME    119 CYSS SG      2.40 
116 CYSM ME    149 CYSS SG      2.40 
116 CYSM ME    152 CYSS SG      2.40 
116 CYSM SG    119 CYSS SG      3.85  
116 CYSM SG    149 CYSS SG      3.85  
116 CYSM SG    152 CYSS SG      3.85  
119 CYSS SG    149 CYSS SG      3.85  
119 CYSS SG    152 CYSS SG      3.85  
149 CYSS SG    152 CYSS SG      3.85  


  4 MET  HA      5 ALA  H       2.80 
  4 MET  HA      5 ALA  QB      6.72 
  4 MET  HB2     5 ALA  H       5.40 
  4 MET  HB3     5 ALA  H       5.40 
  5 ALA  HA      6 GLU  H       2.80 
  5 ALA  H       5 ALA  HA      2.80 
  5 ALA  H       6 GLU  HA      5.40 
  5 ALA  H       6 GLU  H       4.30 
  5 ALA  QB      6 GLU  HG2     6.72 
  5 ALA  QB      6 GLU  HG3     6.72 
  5 ALA  QB      6 GLU  H       4.92 
  6 GLU  HA      7 PRO  HG2     5.40 
  6 GLU  HA      7 PRO  HG3     5.40 
  6 GLU  HG2     7 PRO  HD2     5.40 
  6 GLU  HG2     7 PRO  HD3     5.40 
  6 GLU  HG3     7 PRO  HD2     5.40 
  6 GLU  HG3     7 PRO  HD3     5.40 
  6 GLU  H       6 GLU  HG2     5.40 
  6 GLU  H       6 GLU  HG3     5.40 
  6 GLU  H       7 PRO  HD2     5.40 
  6 GLU  H       7 PRO  HD3     5.40 
  6 GLU  H       9 ARG  HB2     5.40 
  6 GLU  H       9 ARG  HB3     5.40 
  6 GLU  H       9 ARG  H       5.70 
  7 PRO  HA      8 GLN  H       2.80 
  7 PRO  HA     30 SER  HA      5.40 
  8 GLN  HA      8 GLN  HG2     3.60 
  8 GLN  HA      8 GLN  HG3     3.60 
  8 GLN  HA     10 HIS  H       5.40 
  8 GLN  HA     29 SER  H       5.40 
  8 GLN  HB2     9 ARG  H       5.40 
  8 GLN  HB3     9 ARG  H       5.40 
  8 GLN  HE21   10 HIS  HE1     5.40 
  8 GLN  HE22   10 HIS  HE1     5.40 
  8 GLN  HG2     9 ARG  H       5.40 
  8 GLN  HG3     9 ARG  H       5.40 
  8 GLN  H       8 GLN  HG2     5.40 
  8 GLN  H       8 GLN  HG3     5.40 
  8 GLN  H       9 ARG  H       4.30 
  8 GLN  H      10 HIS  HD2     5.40 
  8 GLN  H      28 GLU  HA      5.40 
  8 GLN  H      29 SER  H       5.70 
  9 ARG  HA      9 ARG  HD2     5.40 
  9 ARG  HA      9 ARG  HD3     5.40 
  9 ARG  HA      9 ARG  HG2     3.60 
  9 ARG  HA      9 ARG  HG3     3.60 
  9 ARG  HA     10 HIS  H       2.80 
  9 ARG  HA     26 THR  QG2     6.72 
  9 ARG  HA     27 VAL  H       5.40 
  9 ARG  HA     28 GLU  HA      3.60 
  9 ARG  HA     28 GLU  HG2     5.40 
  9 ARG  HA     28 GLU  HG3     5.40 
  9 ARG  HA     28 GLU  H       5.40 
  9 ARG  HA     29 SER  H       5.40 
  9 ARG  HB2     9 ARG  HG2     2.80 
  9 ARG  HB2     9 ARG  HG3     2.80 
  9 ARG  HB2    10 HIS  H       5.40 
  9 ARG  HB2    26 THR  QG2     6.72 
  9 ARG  HB3     9 ARG  HG2     2.80 
  9 ARG  HB3     9 ARG  HG3     2.80 
  9 ARG  HB3    10 HIS  H       5.40 
  9 ARG  HB3    26 THR  QG2     6.72 
  9 ARG  HD2    26 THR  QG2     6.72 
  9 ARG  HD3    26 THR  QG2     6.72 
  9 ARG  HG2    10 HIS  H       5.40 
  9 ARG  HG2    26 THR  QG2     6.72 
  9 ARG  HG2    28 GLU  HG2     5.40 
  9 ARG  HG2    28 GLU  HG3     5.40 
  9 ARG  HG3    10 HIS  H       5.40 
  9 ARG  HG3    26 THR  QG2     6.72 
  9 ARG  HG3    28 GLU  HG2     5.40 
  9 ARG  HG3    28 GLU  HG3     5.40 
  9 ARG  H       9 ARG  HB2     3.60 
  9 ARG  H       9 ARG  HB3     3.60 
  9 ARG  H       9 ARG  HG2     5.40 
  9 ARG  H       9 ARG  HG3     5.40 
  9 ARG  H      10 HIS  H       4.30 
  9 ARG  H      28 GLU  HA      5.40 
  9 ARG  H      28 GLU  HB2     5.40 
  9 ARG  H      28 GLU  HB3     5.40 
  9 ARG  H      29 SER  H       5.70 
 10 HIS  HA     11 LYS  H       2.80 
 10 HIS  HA     27 VAL  H       5.40 
 10 HIS  HB2    11 LYS  H       5.40 
 10 HIS  HB2    12 ILE  H       5.40 
 10 HIS  HB2    12 ILE  QD1     6.72 
 10 HIS  HB2    27 VAL  H       5.40 
 10 HIS  HB2    34 LEU  QD1     6.72 
 10 HIS  HB2    34 LEU  QD2     6.72 
 10 HIS  HB3    11 LYS  H       5.40 
 10 HIS  HB3    12 ILE  H       5.40 
 10 HIS  HB3    12 ILE  QD1     6.72 
 10 HIS  HB3    27 VAL  H       5.40 
 10 HIS  HB3    34 LEU  QD1     6.72 
 10 HIS  HB3    34 LEU  QD2     6.72 
 10 HIS  HD2    11 LYS  H       5.40 
 10 HIS  HD2    29 SER  H       5.40 
 10 HIS  H      10 HIS  HD2     5.40 
 10 HIS  H      11 LYS  HA      5.40 
 10 HIS  H      11 LYS  H       5.70 
 10 HIS  H      26 THR  HA      5.40 
 10 HIS  H      26 THR  QG2     6.72 
 10 HIS  H      27 VAL  HA      5.40 
 10 HIS  H      27 VAL  H       4.30 
 10 HIS  H      28 GLU  HA      3.60 
 10 HIS  H      28 GLU  HB2     5.40 
 10 HIS  H      28 GLU  HB3     5.40 
 10 HIS  H      28 GLU  HG2     5.40 
 10 HIS  H      28 GLU  HG3     5.40 
 10 HIS  H      28 GLU  H       5.70 
 10 HIS  H      29 SER  H       4.30 
 11 LYS  HA     11 LYS  HD2     5.40 
 11 LYS  HA     11 LYS  HD3     5.40 
 11 LYS  HA     11 LYS  HG2     3.60 
 11 LYS  HA     11 LYS  HG3     3.60 
 11 LYS  HA     12 ILE  HA      5.40 
 11 LYS  HA     12 ILE  HB      5.40 
 11 LYS  HA     12 ILE  HG12    5.40 
 11 LYS  HA     12 ILE  HG13    5.40 
 11 LYS  HA     12 ILE  QD1     6.72 
 11 LYS  HA     13 LEU  H       5.40 
 11 LYS  HA     25 LEU  H       5.40 
 11 LYS  HA     26 THR  HA      5.40 
 11 LYS  HA     26 THR  H       5.40 
 11 LYS  HA     26 THR  QG2     6.72 
 11 LYS  HA     27 VAL  H       3.60 
 11 LYS  HB2    12 ILE  H       5.40 
 11 LYS  HB2    13 LEU  H       5.40 
 11 LYS  HB3    12 ILE  H       5.40 
 11 LYS  HB3    13 LEU  H       5.40 
 11 LYS  HD2    26 THR  HA      5.40 
 11 LYS  HD2    26 THR  QG2     6.72 
 11 LYS  HD3    26 THR  HA      5.40 
 11 LYS  HD3    26 THR  QG2     6.72 
 11 LYS  HE2    26 THR  QG2     6.72 
 11 LYS  HE3    26 THR  QG2     6.72 
 11 LYS  HG2    12 ILE  H       5.40 
 11 LYS  HG2    26 THR  QG2     6.72 
 11 LYS  HG3    12 ILE  H       5.40 
 11 LYS  HG3    26 THR  QG2     6.72 
 11 LYS  H      11 LYS  HD2     5.40 
 11 LYS  H      11 LYS  HD3     5.40 
 11 LYS  H      11 LYS  HE2     5.40 
 11 LYS  H      11 LYS  HE3     5.40 
 11 LYS  H      11 LYS  HG2     5.40 
 11 LYS  H      11 LYS  HG3     5.40 
 11 LYS  H      12 ILE  HA      5.40 
 11 LYS  H      12 ILE  H       4.30 
 11 LYS  H      12 ILE  QD1     6.72 
 11 LYS  H      26 THR  HA      5.40 
 12 ILE  HA     12 ILE  QD1     4.92 
 12 ILE  HA     13 LEU  HA      5.40 
 12 ILE  HB     13 LEU  H       5.40 
 12 ILE  HB     14 CYS  H       5.40 
 12 ILE  HB     25 LEU  HB2     5.40 
 12 ILE  HB     25 LEU  HB3     5.40 
 12 ILE  HB     25 LEU  HG      5.40 
 12 ILE  HB     25 LEU  H       5.40 
 12 ILE  HB     25 LEU  QD1     6.72 
 12 ILE  HB     25 LEU  QD2     6.72 
 12 ILE  HB     27 VAL  H       5.40 
 12 ILE  H      12 ILE  HB      3.60 
 12 ILE  H      12 ILE  QD1     6.72 
 12 ILE  H      12 ILE  QG2     6.72 
 12 ILE  H      13 LEU  HA      5.40 
 12 ILE  H      13 LEU  H       4.30 
 12 ILE  H      25 LEU  HB2     5.40 
 12 ILE  H      25 LEU  HB3     5.40 
 12 ILE  H      25 LEU  H       5.70 
 12 ILE  H      26 THR  HA      5.40 
 12 ILE  H      27 VAL  H       4.30 
 12 ILE  QD1    13 LEU  H       6.72 
 12 ILE  QD1    25 LEU  HB2     6.72 
 12 ILE  QD1    25 LEU  HB3     6.72 
 12 ILE  QD1    25 LEU  HG      6.72 
 12 ILE  QD1    25 LEU  QD1     8.74 
 12 ILE  QD1    25 LEU  QD2     8.74 
 12 ILE  QD1    27 VAL  HB      8.92 
 12 ILE  QD1    27 VAL  H       6.72 
 12 ILE  QD1    34 LEU  HG      6.72 
 12 ILE  QD1    34 LEU  QD1     8.74 
 12 ILE  QD1    34 LEU  QD2     8.74 
 12 ILE  QD1    37 LEU  HG      6.72 
 12 ILE  QD1    37 LEU  QD1     8.74 
 12 ILE  QD1    37 LEU  QD2     8.74 
 12 ILE  QD1    38 GLN  HA      6.72 
 12 ILE  QD1    41 PHE  QD      8.85 
 12 ILE  QD1    41 PHE  QE      8.85 
 12 ILE  QG2    13 LEU  H       6.72 
 12 ILE  QG2    13 LEU  QD1     8.74 
 12 ILE  QG2    13 LEU  QD2     8.74 
 12 ILE  QG2    14 CYS  HB2     6.72 
 12 ILE  QG2    14 CYS  HB3     6.72 
 12 ILE  QG2    14 CYS  H       6.72 
 12 ILE  QG2    25 LEU  HB2     6.72 
 12 ILE  QG2    25 LEU  HB3     6.72 
 12 ILE  QG2    25 LEU  H       6.72 
 12 ILE  QG2    27 VAL  QG1     8.74 
 12 ILE  QG2    27 VAL  QG2     8.74 
 12 ILE  QG2    34 LEU  QD1     8.74 
 12 ILE  QG2    34 LEU  QD2     8.74 
 12 ILE  QG2    41 PHE  QD      8.85 
 12 ILE  QG2    41 PHE  QE      8.85 
 12 ILE  QG2    41 PHE  HZ      8.92 
 13 LEU  HA     13 LEU  QD1     6.72 
 13 LEU  HA     13 LEU  QD2     6.72 
 13 LEU  HA     14 CYS  H       2.80 
 13 LEU  HA     23 ILE  H       5.40 
 13 LEU  HA     24 GLU  HG2     5.40 
 13 LEU  HA     24 GLU  HG3     5.40 
 13 LEU  HA     24 GLU  H       5.40 
 13 LEU  HA     25 LEU  H       3.60 
 13 LEU  HG     14 CYS  H       5.40 
 13 LEU  HG     22 ARG  HD2     5.40 
 13 LEU  HG     22 ARG  HD3     5.40 
 13 LEU  H      13 LEU  HA      2.80 
 13 LEU  H      13 LEU  HB2     3.60 
 13 LEU  H      13 LEU  HB3     3.60 
 13 LEU  H      13 LEU  HG      5.40 
 13 LEU  H      13 LEU  QD1     6.72 
 13 LEU  H      13 LEU  QD2     6.72 
 13 LEU  H      14 CYS  HA      5.40 
 13 LEU  H      14 CYS  H       4.30 
 13 LEU  H      24 GLU  HA      5.40 
 13 LEU  H      25 LEU  HG      5.40 
 13 LEU  H      25 LEU  H       4.30 
 13 LEU  QD1    14 CYS  H       6.72 
 13 LEU  QD1    22 ARG  HB2     6.72 
 13 LEU  QD1    22 ARG  HB3     6.72 
 13 LEU  QD1    22 ARG  HD2     6.72 
 13 LEU  QD1    22 ARG  HD3     6.72 
 13 LEU  QD1    23 ILE  QG2     8.74 
 13 LEU  QD1    24 GLU  HA      6.72 
 13 LEU  QD2    14 CYS  H       6.72 
 13 LEU  QD2    22 ARG  HB2     6.72 
 13 LEU  QD2    22 ARG  HB3     6.72 
 13 LEU  QD2    22 ARG  HD2     6.72 
 13 LEU  QD2    22 ARG  HD3     6.72 
 13 LEU  QD2    23 ILE  QG2     8.74 
 13 LEU  QD2    24 GLU  HA      6.72 
 14 CYS  HA     15 VAL  QG1     6.72 
 14 CYS  HA     15 VAL  QG2     6.72 
 14 CYS  HA     23 ILE  H       5.40 
 14 CYS  HB2    15 VAL  H       5.40 
 14 CYS  HB2    23 ILE  HB      5.40 
 14 CYS  HB2    23 ILE  QG2     6.72 
 14 CYS  HB3    15 VAL  H       5.40 
 14 CYS  HB3    23 ILE  HB      5.40 
 14 CYS  HB3    23 ILE  QG2     6.72 
 14 CYS  H      15 VAL  H       5.70 
 14 CYS  H      23 ILE  HB      5.40 
 14 CYS  H      23 ILE  H       4.30 
 14 CYS  H      23 ILE  QG2     6.72 
 14 CYS  H      24 GLU  HA      5.40 
 14 CYS  H      24 GLU  H       5.70 
 14 CYS  H      25 LEU  HA      5.40 
 14 CYS  H      25 LEU  HG      5.40 
 14 CYS  H      25 LEU  H       5.70 
 15 VAL  HA     16 CYSM H       2.80 
 15 VAL  HA     23 ILE  H       3.60 
 15 VAL  HB     16 CYSM H       3.60 
 15 VAL  HB     20 ASP  HA      5.40 
 15 VAL  HB     21 GLY  H       5.40 
 15 VAL  HB     22 ARG  HA      5.40 
 15 VAL  HB     22 ARG  H       5.40 
 15 VAL  H      16 CYSM H       5.70 
 15 VAL  H      23 ILE  HB      5.40 
 15 VAL  H      23 ILE  H       5.70 
 15 VAL  H      23 ILE  QD1     6.72 
 15 VAL  QG1    22 ARG  HA      6.72 
 15 VAL  QG2    22 ARG  HA      6.72 
 16 CYSM HA     17 CYS  H       2.80 
 16 CYSM HA     18 LYS  H       5.40 
 16 CYSM HA     19 CYSS H       5.40 
 16 CYSM HA     20 ASP  H       5.40 
 16 CYSM HA     21 GLY  H       5.40 
 16 CYSM HA     23 ILE  QD1     4.92 
 16 CYSM HA     47 PHE  HB2     5.40 
 16 CYSM HA     47 PHE  HB3     5.40 
 16 CYSM HA     47 PHE  QD      7.53 
 16 CYSM HA     47 PHE  H       5.40 
 16 CYSM HA     49 CYSS H       5.40 
 16 CYSM HB2    17 CYS  H       5.40 
 16 CYSM HB2    18 LYS  H       5.40 
 16 CYSM HB2    20 ASP  H       5.40 
 16 CYSM HB2    21 GLY  H       5.40 
 16 CYSM HB2    23 ILE  QD1     6.72 
 16 CYSM HB2    49 CYSS HB2     7.60 
 16 CYSM HB2    49 CYSS HB3     7.60 
 16 CYSM HB2    49 CYSS H       5.40 
 16 CYSM HB3    17 CYS  H       5.40 
 16 CYSM HB3    18 LYS  H       5.40 
 16 CYSM HB3    20 ASP  H       5.40 
 16 CYSM HB3    21 GLY  H       5.40 
 16 CYSM HB3    23 ILE  QD1     6.72 
 16 CYSM HB3    49 CYSS HB2     7.60 
 16 CYSM HB3    49 CYSS HB3     7.60 
 16 CYSM HB3    49 CYSS H       5.40 
 16 CYSM H      16 CYSM HB2     3.60 
 16 CYSM H      16 CYSM HB3     3.60 
 16 CYSM H      17 CYS  H       5.70 
 16 CYSM H      20 ASP  HA      5.40 
 16 CYSM H      20 ASP  H       5.70 
 16 CYSM H      21 GLY  HA2     5.40 
 16 CYSM H      21 GLY  HA3     5.40 
 16 CYSM H      21 GLY  H       4.30 
 16 CYSM H      22 ARG  HA      5.40 
 16 CYSM H      22 ARG  H       5.70 
 16 CYSM H      23 ILE  HB      5.40 
 16 CYSM H      23 ILE  H       4.30 
 16 CYSM H      23 ILE  QD1     6.72 
 17 CYS  HA     18 LYS  HA      5.40 
 17 CYS  HA     19 CYSS H       5.40 
 17 CYS  HA     20 ASP  H       5.40 
 17 CYS  HA     46 SER  HB2     5.40 
 17 CYS  HA     46 SER  HB3     5.40 
 17 CYS  HB2    18 LYS  H       5.40 
 17 CYS  HB2    46 SER  HB2     5.40 
 17 CYS  HB2    46 SER  HB3     5.40 
 17 CYS  HB2    47 PHE  H       5.40 
 17 CYS  HB3    18 LYS  H       5.40 
 17 CYS  HB3    46 SER  HB2     5.40 
 17 CYS  HB3    46 SER  HB3     5.40 
 17 CYS  HB3    47 PHE  H       5.40 
 17 CYS  H      17 CYS  HB2     3.60 
 17 CYS  H      17 CYS  HB3     3.60 
 17 CYS  H      18 LYS  HG2     5.40 
 17 CYS  H      18 LYS  HG3     5.40 
 17 CYS  H      18 LYS  H       4.30 
 17 CYS  H      19 CYSS H       5.70 
 17 CYS  H      21 GLY  H       5.70 
 17 CYS  H      23 ILE  QD1     6.72 
 17 CYS  H      46 SER  HB2     5.40 
 17 CYS  H      46 SER  HB3     5.40 
 17 CYS  H      47 PHE  H       5.70 
 17 CYS  H      48 VAL  HA      5.40 
 18 LYS  HA     20 ASP  H       5.40 
 18 LYS  HB2    18 LYS  HE2     5.40 
 18 LYS  HB2    18 LYS  HE3     5.40 
 18 LYS  HB2    19 CYSS H       5.40 
 18 LYS  HB3    18 LYS  HE2     5.40 
 18 LYS  HB3    18 LYS  HE3     5.40 
 18 LYS  HB3    19 CYSS H       5.40 
 18 LYS  HD2    19 CYSS H       5.40 
 18 LYS  HD2    56 GLN  HA      5.40 
 18 LYS  HD3    19 CYSS H       5.40 
 18 LYS  HD3    56 GLN  HA      5.40 
 18 LYS  HE2    48 VAL  QG1     6.72 
 18 LYS  HE2    48 VAL  QG2     6.72 
 18 LYS  HE3    48 VAL  QG1     6.72 
 18 LYS  HE3    48 VAL  QG2     6.72 
 18 LYS  HG2    48 VAL  QG1     6.72 
 18 LYS  HG2    48 VAL  QG2     6.72 
 18 LYS  HG2    52 CYSS HB2     5.40 
 18 LYS  HG2    52 CYSS HB3     5.40 
 18 LYS  HG2    53 ALA  QB      8.92 
 18 LYS  HG3    48 VAL  QG1     6.72 
 18 LYS  HG3    48 VAL  QG2     6.72 
 18 LYS  HG3    52 CYSS HB2     5.40 
 18 LYS  HG3    52 CYSS HB3     5.40 
 18 LYS  HG3    53 ALA  QB      8.92 
 18 LYS  H      18 LYS  HB2     3.60 
 18 LYS  H      18 LYS  HB3     3.60 
 18 LYS  H      19 CYSS HA      5.40 
 18 LYS  H      19 CYSS H       4.30 
 18 LYS  H      20 ASP  H       4.30 
 18 LYS  H      21 GLY  H       5.40 
 18 LYS  H      48 VAL  HA      5.40 
 18 LYS  H      48 VAL  QG1     6.72 
 18 LYS  H      48 VAL  QG2     6.72 
 19 CYSS HA     19 CYSS HB2     2.80 
 19 CYSS HA     19 CYSS HB3     2.80 
 19 CYSS HB2    20 ASP  H       5.40 
 19 CYSS HB2    21 GLY  H       5.40 
 19 CYSS HB3    20 ASP  H       5.40 
 19 CYSS HB3    21 GLY  H       5.40 
 19 CYSS H      19 CYSS HB2     3.60 
 19 CYSS H      19 CYSS HB3     3.60 
 19 CYSS H      20 ASP  HA      5.40 
 19 CYSS H      20 ASP  HB2     5.40 
 19 CYSS H      20 ASP  HB3     5.40 
 19 CYSS H      20 ASP  H       4.30 
 19 CYSS H      21 GLY  H       4.30 
 19 CYSS H      52 CYSS HB2     5.40 
 19 CYSS H      52 CYSS HB3     5.40 
 20 ASP  HB2    21 GLY  H       5.40 
 20 ASP  HB3    21 GLY  H       5.40 
 20 ASP  H      20 ASP  HA      2.80 
 20 ASP  H      20 ASP  HB2     3.60 
 20 ASP  H      20 ASP  HB3     3.60 
 20 ASP  H      21 GLY  H       4.30 
 21 GLY  HA2    22 ARG  HA      5.40 
 21 GLY  HA2    22 ARG  H       2.80 
 21 GLY  HA3    22 ARG  HA      5.40 
 21 GLY  HA3    22 ARG  H       2.80 
 21 GLY  H      22 ARG  H       5.70 
 21 GLY  H      23 ILE  QD1     6.72 
 22 ARG  HA     22 ARG  HD2     5.40 
 22 ARG  HA     22 ARG  HD3     5.40 
 22 ARG  HA     23 ILE  H       2.80 
 22 ARG  HB2    23 ILE  H       5.40 
 22 ARG  HB3    23 ILE  H       5.40 
 22 ARG  HD2    23 ILE  HA      5.40 
 22 ARG  HD2    24 GLU  HB2     5.40 
 22 ARG  HD2    24 GLU  HB3     5.40 
 22 ARG  HD2    24 GLU  H       5.40 
 22 ARG  HD3    23 ILE  HA      5.40 
 22 ARG  HD3    24 GLU  HB2     5.40 
 22 ARG  HD3    24 GLU  HB3     5.40 
 22 ARG  HD3    24 GLU  H       5.40 
 22 ARG  H      22 ARG  HB2     3.60 
 22 ARG  H      22 ARG  HB3     3.60 
 22 ARG  H      22 ARG  HD2     5.40 
 22 ARG  H      22 ARG  HD3     5.40 
 22 ARG  H      22 ARG  HG2     5.40 
 22 ARG  H      22 ARG  HG3     5.40 
 22 ARG  H      23 ILE  HA      5.40 
 22 ARG  H      23 ILE  H       5.70 
 23 ILE  HA     23 ILE  QD1     6.72 
 23 ILE  HA     23 ILE  QG2     4.12 
 23 ILE  HA     24 GLU  HA      5.40 
 23 ILE  HA     24 GLU  HB2     5.40 
 23 ILE  HA     24 GLU  HB3     5.40 
 23 ILE  HB     24 GLU  H       5.40 
 23 ILE  HB     47 PHE  HB2     5.40 
 23 ILE  HB     47 PHE  HB3     5.40 
 23 ILE  H      23 ILE  HB      3.60 
 23 ILE  H      23 ILE  QD1     6.72 
 23 ILE  H      23 ILE  QG2     6.72 
 23 ILE  H      24 GLU  HA      5.40 
 23 ILE  H      24 GLU  H       5.70 
 23 ILE  QD1    24 GLU  H       6.72 
 23 ILE  QD1    47 PHE  QD      8.85 
 23 ILE  QD1    47 PHE  H       6.72 
 23 ILE  QD1    48 VAL  HA      6.72 
 23 ILE  QD1    48 VAL  H       6.72 
 23 ILE  QD1    49 CYSS HA      6.72 
 23 ILE  QD1    49 CYSS HB2     6.72 
 23 ILE  QD1    49 CYSS HB3     6.72 
 23 ILE  QD1    49 CYSS H       4.92 
 23 ILE  QD1    50 PRO  QD      9.61 
 23 ILE  QG2    23 ILE  QD1     6.94 
 23 ILE  QG2    24 GLU  HB2     6.72 
 23 ILE  QG2    24 GLU  HB3     6.72 
 23 ILE  QG2    24 GLU  H       6.72 
 23 ILE  QG2    25 LEU  HA      6.72 
 23 ILE  QG2    25 LEU  HG      6.72 
 23 ILE  QG2    25 LEU  H       6.72 
 23 ILE  QG2    47 PHE  HB2     6.72 
 23 ILE  QG2    47 PHE  HB3     6.72 
 23 ILE  QG2    47 PHE  QD      8.85 
 23 ILE  QG2    47 PHE  QE      8.85 
 23 ILE  QG2    49 CYSS HA      6.72 
 23 ILE  QG2    50 PRO  QD      9.61 
 24 GLU  HB2    25 LEU  H       5.40 
 24 GLU  HB3    25 LEU  H       5.40 
 24 GLU  HG2    25 LEU  H       5.40 
 24 GLU  HG3    25 LEU  H       5.40 
 24 GLU  H      24 GLU  HB2     3.60 
 24 GLU  H      24 GLU  HB3     3.60 
 24 GLU  H      24 GLU  HG2     5.40 
 24 GLU  H      24 GLU  HG3     5.40 
 24 GLU  H      25 LEU  HG      5.40 
 24 GLU  H      25 LEU  H       4.30 
 25 LEU  HA     25 LEU  QD1     6.72 
 25 LEU  HA     25 LEU  QD2     6.72 
 25 LEU  HA     26 THR  HB      5.40 
 25 LEU  HA     26 THR  H       2.80 
 25 LEU  HB2    26 THR  H       5.40 
 25 LEU  HB3    26 THR  H       5.40 
 25 LEU  HG     26 THR  H       5.40 
 25 LEU  H      25 LEU  HG      5.40 
 25 LEU  H      25 LEU  QD1     6.72 
 25 LEU  H      25 LEU  QD2     6.72 
 25 LEU  H      26 THR  H       4.30 
 25 LEU  QD1    26 THR  H       6.72 
 25 LEU  QD1    47 PHE  QD      8.85 
 25 LEU  QD1    47 PHE  QE      8.85 
 25 LEU  QD2    26 THR  H       6.72 
 25 LEU  QD2    47 PHE  QD      8.85 
 25 LEU  QD2    47 PHE  QE      8.85 
 26 THR  HA     27 VAL  H       2.80 
 26 THR  HB     27 VAL  H       5.40 
 26 THR  H      26 THR  HB      3.60 
 26 THR  H      26 THR  QG2     6.72 
 26 THR  H      27 VAL  HA      5.40 
 26 THR  H      27 VAL  H       4.30 
 26 THR  QG2    27 VAL  HA      6.72 
 26 THR  QG2    27 VAL  H       6.72 
 26 THR  QG2    27 VAL  QG1     8.74 
 26 THR  QG2    27 VAL  QG2     8.74 
 26 THR  QG2    28 GLU  H       6.72 
 27 VAL  HA     27 VAL  HB      2.80 
 27 VAL  HA     28 GLU  HA      5.40 
 27 VAL  HA     28 GLU  H       2.80 
 27 VAL  HB     28 GLU  H       3.60 
 27 VAL  H      28 GLU  HA      5.40 
 27 VAL  H      28 GLU  H       5.70 
 27 VAL  QG1    37 LEU  QD1     8.74 
 27 VAL  QG1    37 LEU  QD2     8.74 
 27 VAL  QG2    37 LEU  QD1     8.74 
 27 VAL  QG2    37 LEU  QD2     8.74 
 28 GLU  HA     28 GLU  HG2     3.60 
 28 GLU  HA     28 GLU  HG3     3.60 
 28 GLU  HA     29 SER  H       2.80 
 28 GLU  HB2    29 SER  H       5.40 
 28 GLU  HB3    29 SER  H       5.40 
 28 GLU  H      28 GLU  HG2     5.40 
 28 GLU  H      28 GLU  HG3     5.40 
 28 GLU  H      29 SER  HA      5.40 
 28 GLU  H      29 SER  H       4.30 
 29 SER  HA     30 SER  H       2.80 
 29 SER  HB2    34 LEU  H       5.40 
 29 SER  HB3    34 LEU  H       5.40 
 29 SER  H      29 SER  HB2     3.60 
 29 SER  H      29 SER  HB3     3.60 
 29 SER  H      30 SER  H       5.70 
 30 SER  HA     31 ALA  QB      6.72 
 30 SER  HA     32 GLU  H       5.40 
 30 SER  HA     33 ASP  H       5.40 
 30 SER  HB2    33 ASP  H       5.40 
 30 SER  HB2    34 LEU  H       5.40 
 30 SER  HB3    33 ASP  H       5.40 
 30 SER  HB3    34 LEU  H       5.40 
 30 SER  H      30 SER  HB2     3.60 
 30 SER  H      30 SER  HB3     3.60 
 30 SER  H      33 ASP  HB2     5.40 
 30 SER  H      33 ASP  HB3     5.40 
 30 SER  H      33 ASP  H       5.40 
 30 SER  H      34 LEU  H       5.70 
 31 ALA  HA     33 ASP  H       5.40 
 31 ALA  HA     34 LEU  HA      5.40 
 31 ALA  HA     34 LEU  HB2     5.40 
 31 ALA  HA     34 LEU  HB3     5.40 
 31 ALA  HA     34 LEU  HG      5.40 
 31 ALA  HA     34 LEU  H       3.60 
 31 ALA  HA     34 LEU  QD1     6.72 
 31 ALA  HA     34 LEU  QD2     6.72 
 31 ALA  HA     35 ARG  H       5.40 
 31 ALA  QB     32 GLU  HA      6.72 
 31 ALA  QB     32 GLU  HG2     6.72 
 31 ALA  QB     32 GLU  HG3     6.72 
 31 ALA  QB     32 GLU  H       4.92 
 31 ALA  QB     33 ASP  H       6.72 
 31 ALA  QB     34 LEU  H       6.72 
 31 ALA  QB     35 ARG  H       6.72 
 32 GLU  HA     34 LEU  H       5.40 
 32 GLU  HA     35 ARG  HB2     5.40 
 32 GLU  HA     35 ARG  HB3     5.40 
 32 GLU  HA     35 ARG  HD2     5.40 
 32 GLU  HA     35 ARG  HD3     5.40 
 32 GLU  HA     35 ARG  H       3.60 
 32 GLU  HA     36 THR  H       5.40 
 32 GLU  HB2    33 ASP  H       5.40 
 32 GLU  HB3    33 ASP  H       5.40 
 32 GLU  HG2    33 ASP  H       5.40 
 32 GLU  HG3    33 ASP  H       5.40 
 32 GLU  H      32 GLU  HA      2.80 
 32 GLU  H      32 GLU  HB2     3.60 
 32 GLU  H      32 GLU  HB3     3.60 
 32 GLU  H      32 GLU  HG2     5.40 
 32 GLU  H      32 GLU  HG3     5.40 
 32 GLU  H      33 ASP  HA      5.40 
 32 GLU  H      33 ASP  HB2     5.40 
 32 GLU  H      33 ASP  HB3     5.40 
 32 GLU  H      33 ASP  H       4.30 
 32 GLU  H      34 LEU  H       4.30 
 33 ASP  HA     35 ARG  H       5.40 
 33 ASP  HA     36 THR  HB      5.40 
 33 ASP  HA     36 THR  H       3.60 
 33 ASP  HA     36 THR  QG2     6.72 
 33 ASP  HA     37 LEU  H       5.40 
 33 ASP  H      33 ASP  HA      2.80 
 33 ASP  H      34 LEU  HA      5.40 
 33 ASP  H      34 LEU  H       4.30 
 33 ASP  H      35 ARG  H       4.30 
 34 LEU  HA     34 LEU  HG      3.60 
 34 LEU  HA     34 LEU  QD1     6.72 
 34 LEU  HA     34 LEU  QD2     6.72 
 34 LEU  HA     35 ARG  HA      5.40 
 34 LEU  HA     36 THR  H       5.40 
 34 LEU  HA     37 LEU  HB2     5.40 
 34 LEU  HA     37 LEU  HB3     5.40 
 34 LEU  HA     37 LEU  HG      5.40 
 34 LEU  HA     37 LEU  H       5.40 
 34 LEU  HA     37 LEU  QD1     6.72 
 34 LEU  HA     37 LEU  QD2     6.72 
 34 LEU  HA     38 GLN  H       5.40 
 34 LEU  HB2    35 ARG  H       5.40 
 34 LEU  HB3    35 ARG  H       5.40 
 34 LEU  HG     35 ARG  HA      5.40 
 34 LEU  HG     35 ARG  H       5.40 
 34 LEU  HG     37 LEU  QD1     6.72 
 34 LEU  HG     37 LEU  QD2     6.72 
 34 LEU  HG     38 GLN  HA      5.40 
 34 LEU  HG     38 GLN  HE21    5.40 
 34 LEU  HG     38 GLN  HE22    5.40 
 34 LEU  HG     38 GLN  H       5.40 
 34 LEU  H      34 LEU  HB2     3.60 
 34 LEU  H      34 LEU  HB3     3.60 
 34 LEU  H      34 LEU  HG      5.40 
 34 LEU  H      34 LEU  QD1     6.72 
 34 LEU  H      34 LEU  QD2     6.72 
 34 LEU  H      35 ARG  HB2     5.40 
 34 LEU  H      35 ARG  HB3     5.40 
 34 LEU  H      35 ARG  H       4.30 
 34 LEU  H      36 THR  HB      5.40 
 34 LEU  H      36 THR  H       5.70 
 34 LEU  QD1    35 ARG  H       6.72 
 34 LEU  QD1    37 LEU  QD1     8.74 
 34 LEU  QD1    37 LEU  QD2     8.74 
 34 LEU  QD1    38 GLN  HE21    6.72 
 34 LEU  QD1    38 GLN  HE22    6.72 
 34 LEU  QD2    35 ARG  H       6.72 
 34 LEU  QD2    37 LEU  QD1     8.74 
 34 LEU  QD2    37 LEU  QD2     8.74 
 34 LEU  QD2    38 GLN  HE21    6.72 
 34 LEU  QD2    38 GLN  HE22    6.72 
 35 ARG  HA     35 ARG  HD2     5.40 
 35 ARG  HA     35 ARG  HD3     5.40 
 35 ARG  HA     37 LEU  H       5.40 
 35 ARG  HA     38 GLN  HB2     5.40 
 35 ARG  HA     38 GLN  HB3     5.40 
 35 ARG  HA     38 GLN  HG2     5.40 
 35 ARG  HA     38 GLN  HG3     5.40 
 35 ARG  HA     38 GLN  H       3.60 
 35 ARG  HA     39 GLN  H       5.40 
 35 ARG  HB2    36 THR  H       3.60 
 35 ARG  HB2    39 GLN  HE21    5.40 
 35 ARG  HB2    39 GLN  HE22    5.40 
 35 ARG  HB3    36 THR  H       3.60 
 35 ARG  HB3    39 GLN  HE21    5.40 
 35 ARG  HB3    39 GLN  HE22    5.40 
 35 ARG  HG2    36 THR  H       5.40 
 35 ARG  HG2    39 GLN  HE21    5.40 
 35 ARG  HG2    39 GLN  HE22    5.40 
 35 ARG  HG3    36 THR  H       5.40 
 35 ARG  HG3    39 GLN  HE21    5.40 
 35 ARG  HG3    39 GLN  HE22    5.40 
 35 ARG  H      35 ARG  HD2     5.40 
 35 ARG  H      35 ARG  HD3     5.40 
 35 ARG  H      35 ARG  HG2     5.40 
 35 ARG  H      35 ARG  HG3     5.40 
 35 ARG  H      36 THR  HB      5.40 
 35 ARG  H      36 THR  H       4.30 
 35 ARG  H      37 LEU  HG      5.40 
 35 ARG  H      37 LEU  H       4.30 
 36 THR  HA     38 GLN  H       5.40 
 36 THR  HA     39 GLN  HB2     5.40 
 36 THR  HA     39 GLN  HB3     5.40 
 36 THR  HA     39 GLN  HE21    5.40 
 36 THR  HA     39 GLN  HE22    5.40 
 36 THR  HA     39 GLN  HG2     5.40 
 36 THR  HA     39 GLN  HG3     5.40 
 36 THR  HA     39 GLN  H       3.60 
 36 THR  HB     37 LEU  HA      5.40 
 36 THR  HB     37 LEU  H       3.60 
 36 THR  HB     38 GLN  H       5.40 
 36 THR  HB     39 GLN  H       5.40 
 36 THR  H      36 THR  HB      3.60 
 36 THR  H      36 THR  QG2     6.72 
 36 THR  H      37 LEU  HA      5.40 
 36 THR  H      37 LEU  H       5.70 
 36 THR  H      38 GLN  H       4.30 
 36 THR  H      39 GLN  H       5.70 
 36 THR  QG2    37 LEU  HA      6.72 
 36 THR  QG2    37 LEU  H       6.72 
 36 THR  QG2    39 GLN  H       6.72 
 36 THR  QG2    40 LEU  HG      4.92 
 36 THR  QG2    40 LEU  H       6.72 
 36 THR  QG2    40 LEU  QD1     8.74 
 36 THR  QG2    40 LEU  QD2     8.74 
 37 LEU  HA     37 LEU  QD1     6.72 
 37 LEU  HA     37 LEU  QD2     6.72 
 37 LEU  HA     39 GLN  H       5.40 
 37 LEU  HA     40 LEU  HB2     5.40 
 37 LEU  HA     40 LEU  HB3     5.40 
 37 LEU  HA     40 LEU  HG      5.40 
 37 LEU  HA     40 LEU  H       3.60 
 37 LEU  HA     41 PHE  H       5.40 
 37 LEU  HB2    38 GLN  H       5.40 
 37 LEU  HB3    38 GLN  H       5.40 
 37 LEU  HG     38 GLN  HA      5.40 
 37 LEU  HG     38 GLN  H       5.40 
 37 LEU  HG     41 PHE  QE      7.53 
 37 LEU  H      37 LEU  HB2     3.60 
 37 LEU  H      37 LEU  HB3     3.60 
 37 LEU  H      37 LEU  HG      5.40 
 37 LEU  H      37 LEU  QD1     6.72 
 37 LEU  H      37 LEU  QD2     6.72 
 37 LEU  H      38 GLN  HA      5.40 
 37 LEU  H      38 GLN  H       4.30 
 37 LEU  H      39 GLN  H       5.70 
 37 LEU  H      40 LEU  HG      5.40 
 37 LEU  H      40 LEU  H       5.70 
 37 LEU  QD1    38 GLN  HA      6.72 
 37 LEU  QD1    38 GLN  H       6.72 
 37 LEU  QD2    38 GLN  HA      6.72 
 37 LEU  QD2    38 GLN  H       6.72 
 38 GLN  HA     41 PHE  HB2     5.40 
 38 GLN  HA     41 PHE  HB3     5.40 
 38 GLN  HA     41 PHE  QD      7.53 
 38 GLN  HA     41 PHE  H       3.60 
 38 GLN  HB2    38 GLN  HE21    5.40 
 38 GLN  HB2    38 GLN  HE22    5.40 
 38 GLN  HB2    39 GLN  H       5.40 
 38 GLN  HB3    38 GLN  HE21    5.40 
 38 GLN  HB3    38 GLN  HE22    5.40 
 38 GLN  HB3    39 GLN  H       5.40 
 38 GLN  HG2    39 GLN  HA      5.40 
 38 GLN  HG2    39 GLN  HE21    5.40 
 38 GLN  HG2    39 GLN  HE22    5.40 
 38 GLN  HG2    39 GLN  H       5.40 
 38 GLN  HG3    39 GLN  HA      5.40 
 38 GLN  HG3    39 GLN  HE21    5.40 
 38 GLN  HG3    39 GLN  HE22    5.40 
 38 GLN  HG3    39 GLN  H       5.40 
 38 GLN  H      38 GLN  HB2     3.60 
 38 GLN  H      38 GLN  HB3     3.60 
 38 GLN  H      38 GLN  HE21    5.70 
 38 GLN  H      38 GLN  HE22    5.70 
 38 GLN  H      38 GLN  HG2     5.40 
 38 GLN  H      38 GLN  HG3     5.40 
 38 GLN  H      39 GLN  H       4.30 
 38 GLN  H      40 LEU  H       4.30 
 38 GLN  H      41 PHE  QD      7.83 
 38 GLN  H      41 PHE  H       5.70 
 39 GLN  HA     39 GLN  HE21    5.40 
 39 GLN  HA     39 GLN  HE22    5.40 
 39 GLN  HA     40 LEU  HA      5.40 
 39 GLN  HA     41 PHE  H       5.40 
 39 GLN  HA     42 LEU  HB2     5.40 
 39 GLN  HA     42 LEU  HB3     5.40 
 39 GLN  HA     42 LEU  HG      5.40 
 39 GLN  HA     42 LEU  H       3.60 
 39 GLN  HA     42 LEU  QD1     6.72 
 39 GLN  HA     42 LEU  QD2     6.72 
 39 GLN  HA     43 SER  H       5.40 
 39 GLN  HB2    39 GLN  HE21    5.40 
 39 GLN  HB2    39 GLN  HE22    5.40 
 39 GLN  HB2    40 LEU  HA      5.40 
 39 GLN  HB2    40 LEU  H       5.40 
 39 GLN  HB2    42 LEU  H       5.40 
 39 GLN  HB3    39 GLN  HE21    5.40 
 39 GLN  HB3    39 GLN  HE22    5.40 
 39 GLN  HB3    40 LEU  HA      5.40 
 39 GLN  HB3    40 LEU  H       5.40 
 39 GLN  HB3    42 LEU  H       5.40 
 39 GLN  H      39 GLN  HA      2.80 
 39 GLN  H      39 GLN  HB2     3.60 
 39 GLN  H      39 GLN  HB3     3.60 
 39 GLN  H      40 LEU  HA      5.40 
 39 GLN  H      40 LEU  HG      5.20 
 39 GLN  H      40 LEU  H       4.30 
 39 GLN  H      40 LEU  QD1     6.72 
 39 GLN  H      40 LEU  QD2     6.72 
 39 GLN  H      41 PHE  QD      7.53 
 39 GLN  H      41 PHE  H       4.30 
 40 LEU  HA     40 LEU  HG      3.60 
 40 LEU  HA     41 PHE  HA      5.40 
 40 LEU  HA     42 LEU  H       5.40 
 40 LEU  HA     43 SER  HB2     5.40 
 40 LEU  HA     43 SER  HB3     5.40 
 40 LEU  HA     43 SER  H       3.60 
 40 LEU  HA     44 THR  H       5.40 
 40 LEU  HA     44 THR  QG2     8.92 
 40 LEU  HA     45 LEU  HB2     5.40 
 40 LEU  HA     45 LEU  HB3     5.40 
 40 LEU  HA     45 LEU  H       5.40 
 40 LEU  HB2    45 LEU  HB2     5.40 
 40 LEU  HB2    45 LEU  HB3     5.40 
 40 LEU  HB2    45 LEU  QD1     6.72 
 40 LEU  HB2    45 LEU  QD2     6.72 
 40 LEU  HB3    45 LEU  HB2     5.40 
 40 LEU  HB3    45 LEU  HB3     5.40 
 40 LEU  HB3    45 LEU  QD1     6.72 
 40 LEU  HB3    45 LEU  QD2     6.72 
 40 LEU  HG     41 PHE  H       5.40 
 40 LEU  H      40 LEU  HB2     3.60 
 40 LEU  H      40 LEU  HB3     3.60 
 40 LEU  H      40 LEU  HG      2.80 
 40 LEU  H      40 LEU  QD1     4.92 
 40 LEU  H      40 LEU  QD2     4.92 
 40 LEU  H      41 PHE  H       4.30 
 40 LEU  H      42 LEU  H       4.30 
 40 LEU  H      43 SER  H       5.70 
 40 LEU  QD1    41 PHE  H       6.72 
 40 LEU  QD2    41 PHE  H       6.72 
 41 PHE  HA     43 SER  H       5.40 
 41 PHE  HA     45 LEU  HG      5.40 
 41 PHE  HA     45 LEU  H       3.60 
 41 PHE  HA     45 LEU  QD1     6.72 
 41 PHE  HA     45 LEU  QD2     6.72 
 41 PHE  HA     46 SER  H       5.40 
 41 PHE  HB2    42 LEU  H       5.40 
 41 PHE  HB3    42 LEU  H       5.40 
 41 PHE  QE     45 LEU  QD1     8.85 
 41 PHE  QE     45 LEU  QD2     8.85 
 41 PHE  H      41 PHE  QD      7.53 
 41 PHE  H      42 LEU  HA      5.40 
 41 PHE  H      42 LEU  H       4.30 
 41 PHE  H      43 SER  H       5.40 
 42 LEU  HA     42 LEU  HG      3.60 
 42 LEU  HA     44 THR  H       5.40 
 42 LEU  HB2    43 SER  H       5.40 
 42 LEU  HB3    43 SER  H       5.40 
 42 LEU  HG     43 SER  H       5.40 
 42 LEU  H      42 LEU  HG      5.40 
 42 LEU  H      42 LEU  QD1     6.72 
 42 LEU  H      42 LEU  QD2     6.72 
 42 LEU  H      43 SER  HA      5.40 
 42 LEU  H      43 SER  HB2     5.40 
 42 LEU  H      43 SER  HB3     5.40 
 42 LEU  H      43 SER  H       4.30 
 42 LEU  H      44 THR  H       5.40 
 42 LEU  H      45 LEU  H       5.70 
 42 LEU  QD1    43 SER  H       6.72 
 42 LEU  QD2    43 SER  H       6.72 
 43 SER  HA     45 LEU  H       5.40 
 43 SER  HB2    44 THR  H       3.60 
 43 SER  HB2    45 LEU  H       5.40 
 43 SER  HB3    44 THR  H       3.60 
 43 SER  HB3    45 LEU  H       5.40 
 43 SER  H      43 SER  HA      2.80 
 43 SER  H      43 SER  HB2     3.60 
 43 SER  H      43 SER  HB3     3.60 
 43 SER  H      44 THR  HA      5.40 
 43 SER  H      44 THR  H       4.30 
 43 SER  H      45 LEU  H       4.30 
 44 THR  HB     45 LEU  H       5.40 
 44 THR  H      44 THR  HA      2.80 
 44 THR  H      44 THR  QG2     4.92 
 44 THR  H      45 LEU  HA      5.40 
 44 THR  H      45 LEU  HB2     5.40 
 44 THR  H      45 LEU  HB3     5.40 
 44 THR  H      45 LEU  H       4.30 
 44 THR  QG2    45 LEU  H       4.92 
 45 LEU  HA     46 SER  H       2.80 
 45 LEU  HB2    46 SER  H       5.40 
 45 LEU  HB3    46 SER  H       5.40 
 45 LEU  HG     46 SER  H       5.40 
 45 LEU  H      45 LEU  HB2     3.60 
 45 LEU  H      45 LEU  HB3     3.60 
 45 LEU  H      45 LEU  QD1     6.72 
 45 LEU  H      45 LEU  QD2     6.72 
 45 LEU  H      46 SER  H       5.70 
 46 SER  HA     47 PHE  HB2     5.40 
 46 SER  HA     47 PHE  HB3     5.40 
 46 SER  HA     47 PHE  QD      7.53 
 46 SER  HB2    47 PHE  H       3.60 
 46 SER  HB3    47 PHE  H       3.60 
 46 SER  H      47 PHE  HA      5.40 
 46 SER  H      47 PHE  H       4.30 
 47 PHE  HA     47 PHE  QD      7.53 
 47 PHE  HB2    48 VAL  H       5.40 
 47 PHE  HB3    48 VAL  H       5.40 
 47 PHE  QD     48 VAL  H       7.53 
 47 PHE  H      47 PHE  HB2     3.60 
 47 PHE  H      47 PHE  HB3     3.60 
 47 PHE  H      47 PHE  QD      6.43 
 47 PHE  H      48 VAL  HA      5.40 
 47 PHE  H      48 VAL  H       4.30 
 48 VAL  HA     49 CYSS H       2.80 
 48 VAL  HB     49 CYSS H       5.40 
 48 VAL  HB     53 ALA  QB      6.72 
 48 VAL  H      48 VAL  HA      2.80 
 48 VAL  H      48 VAL  HB      3.60 
 48 VAL  H      49 CYSS HA      5.40 
 48 VAL  H      49 CYSS H       4.30 
 48 VAL  QG1    52 CYSS HB2     6.72 
 48 VAL  QG1    52 CYSS HB3     6.72 
 48 VAL  QG1    53 ALA  HA      8.92 
 48 VAL  QG1    53 ALA  H       6.72 
 48 VAL  QG1    53 ALA  QB      8.74 
 48 VAL  QG2    52 CYSS HB2     6.72 
 48 VAL  QG2    52 CYSS HB3     6.72 
 48 VAL  QG2    53 ALA  HA      8.92 
 48 VAL  QG2    53 ALA  H       6.72 
 48 VAL  QG2    53 ALA  QB      8.74 
 49 CYSS HA     50 PRO  HG2     5.40 
 49 CYSS HA     50 PRO  HG3     5.40 
 49 CYSS HA     51 TRP  H       5.40 
 49 CYSS HB2    50 PRO  QD      7.89 
 49 CYSS HB2    51 TRP  H       5.40 
 49 CYSS HB3    50 PRO  QD      7.89 
 49 CYSS HB3    51 TRP  H       5.40 
 49 CYSS H      49 CYSS HB2     3.60 
 49 CYSS H      49 CYSS HB3     3.60 
 49 CYSS H      50 PRO  QD      7.89 
 49 CYSS H      51 TRP  H       5.40 
 49 CYSS H      52 CYSS HB2     5.40 
 49 CYSS H      52 CYSS HB3     5.40 
 49 CYSS H      52 CYSS H       5.70 
 49 CYSS H      53 ALA  H       5.70 
 50 PRO  HA     51 TRP  HA      5.40 
 50 PRO  HA     52 CYSS H       5.40 
 50 PRO  HA     53 ALA  H       5.40 
 50 PRO  HA     53 ALA  QB      4.92 
 50 PRO  HA     54 THR  H       5.40 
 50 PRO  HB2    53 ALA  QB      6.72 
 50 PRO  HB3    53 ALA  QB      6.72 
 50 PRO  HG2    51 TRP  H       5.40 
 50 PRO  HG3    51 TRP  H       5.40 
 50 PRO  QD     52 CYSS H       7.89 
 51 TRP  HA     51 TRP  HE1     5.40 
 51 TRP  HA     53 ALA  H       5.40 
 51 TRP  HA     54 THR  H       5.40 
 51 TRP  HA     54 THR  QG2     6.72 
 51 TRP  HA     55 ASN  HD21    5.40 
 51 TRP  HA     55 ASN  HD22    5.40 
 51 TRP  HB2    52 CYSS H       5.40 
 51 TRP  HB3    52 CYSS H       5.40 
 51 TRP  HD1    52 CYSS H       5.70 
 51 TRP  HD1    55 ASN  HD21    5.40 
 51 TRP  HD1    55 ASN  HD22    5.40 
 51 TRP  HE1    55 ASN  HB2     5.40 
 51 TRP  HE1    55 ASN  HB3     5.40 
 51 TRP  HE3    52 CYSS H       5.70 
 51 TRP  H      51 TRP  HA      2.80 
 51 TRP  H      51 TRP  HD1     5.40 
 51 TRP  H      52 CYSS HA      5.40 
 51 TRP  H      52 CYSS H       4.30 
 51 TRP  H      53 ALA  H       5.70 
 51 TRP  H      53 ALA  QB      6.72 
 51 TRP  H      54 THR  HB      5.40 
 51 TRP  H      54 THR  H       5.40 
 52 CYSS HB2    53 ALA  HA      5.40 
 52 CYSS HB2    53 ALA  H       5.40  
 52 CYSS HB3    53 ALA  HA      5.40 
 52 CYSS HB3    53 ALA  H       5.40  
 52 CYSS H      52 CYSS HB2     3.60 
 52 CYSS H      52 CYSS HB3     3.60 
 52 CYSS H      53 ALA  HA      5.40 
 52 CYSS H      53 ALA  H       4.30 
 52 CYSS H      53 ALA  QB      6.72 
 52 CYSS H      54 THR  H       5.70 
 53 ALA  HA     56 GLN  H       5.40 
 53 ALA  H      53 ALA  HA      2.80 
 53 ALA  H      54 THR  H       4.30 
 53 ALA  H      56 GLN  H       5.70 
 53 ALA  QB     54 THR  H       4.92 
 54 THR  HA     56 GLN  H       5.40 
 54 THR  HB     55 ASN  HD21    5.40 
 54 THR  HB     55 ASN  HD22    5.40 
 54 THR  H      54 THR  QG2     4.92 
 54 THR  H      55 ASN  HA      5.40 
 54 THR  H      55 ASN  H       4.30 
 54 THR  H      56 GLN  H       4.30 
 54 THR  QG2    55 ASN  HD21    6.72 
 54 THR  QG2    55 ASN  HD22    6.72 
 54 THR  QG2    55 ASN  H       6.72 
 54 THR  QG2    56 GLN  H       6.72 
 55 ASN  HD21   56 GLN  H       5.70 
 55 ASN  HD22   56 GLN  H       5.70 
 55 ASN  H      56 GLN  H       4.30 
 56 GLN  H      56 GLN  HG2     5.40 
 56 GLN  H      56 GLN  HG3     5.40 
  4 MET  QG      6 GLU  H       5.25 
  6 GLU  H       6 GLU  QB      3.41 
  6 GLU  QB      7 PRO  QD      3.46 
  6 GLU  QB      9 ARG  H       5.25 
  7 PRO  QG      8 GLN  HA      7.29 
  8 GLN  H       8 GLN  QB      3.41 
  8 GLN  QB      8 GLN  QE2     4.67 
  8 GLN  QB     29 SER  H       5.25 
  8 GLN  QG     29 SER  H       5.25 
  9 ARG  H       9 ARG  QD      5.25 
  9 ARG  QB     28 GLU  HA      5.25 
  9 ARG  QB     28 GLU  QG      5.10 
  9 ARG  QG     28 GLU  HA      5.25 
  9 ARG  QD     10 HIS  H       5.25 
  9 ARG  QD     26 THR  HB      7.29 
 10 HIS  H      27 VAL  QQG     6.61 
 10 HIS  HA     10 HIS  QB      2.58 
 10 HIS  QB     27 VAL  QQG     7.30 
 10 HIS  HD2    27 VAL  QQG     8.79 
 11 LYS  H      11 LYS  QB      3.41 
 11 LYS  H      12 ILE  QG1     5.25 
 11 LYS  HA     11 LYS  QB      2.58 
 11 LYS  HA     25 LEU  QB      7.29 
 11 LYS  HA     27 VAL  QQG     6.61 
 11 LYS  QB     11 LYS  QE      4.45 
 11 LYS  QG     26 THR  HB      5.25 
 12 ILE  H      12 ILE  QG1     3.55 
 12 ILE  H      25 LEU  QQD     6.61 
 12 ILE  H      27 VAL  QQG     6.61 
 12 ILE  QG2    25 LEU  QQD     8.52 
 12 ILE  QG2    37 LEU  QQD     8.52 
 12 ILE  QG1    13 LEU  H       5.25 
 12 ILE  QG1    25 LEU  QB      6.97 
 12 ILE  QG1    26 THR  HA      7.29 
 12 ILE  QG1    27 VAL  QQG     7.74 
 12 ILE  QG1    34 LEU  HG      7.29 
 12 ILE  QG1    34 LEU  QQD     5.89 
 12 ILE  QG1    37 LEU  QQD     6.36 
 12 ILE  QD1    27 VAL  QQG     6.69 
 12 ILE  QD1    37 LEU  QB      6.48 
 13 LEU  HA     24 GLU  QB      5.25 
 13 LEU  HG     22 ARG  QG      5.25 
 13 LEU  QQD    22 ARG  QG      5.77 
 13 LEU  QQD    23 ILE  H       6.61 
 13 LEU  QQD    24 GLU  H       6.61 
 13 LEU  QQD    24 GLU  QB      8.26 
 13 LEU  QQD    24 GLU  QG      7.74 
 13 LEU  QQD    25 LEU  H       6.61 
 14 CYS  H      25 LEU  QQD     6.61 
 14 CYS  QB     23 ILE  H       5.25 
 15 VAL  QQG    16 CYSM H       4.80 
 15 VAL  QQG    16 CYSM HA      6.61 
 15 VAL  QQG    16 CYSM QB      8.26 
 15 VAL  QQG    20 ASP  HA      6.61 
 15 VAL  QQG    21 GLY  H       6.61 
 15 VAL  QQG    22 ARG  QG      7.74 
 15 VAL  QQG    23 ILE  H       6.61 
 15 VAL  QQG    23 ILE  HB      6.61 
 15 VAL  QQG    23 ILE  QG2    10.58 
 16 CYSM H      23 ILE  QG1     5.25 
 16 CYSM QB     18 LYS  QB      6.97 
 16 CYSM QB     19 CYSS H       3.55 
 16 CYSM QB     20 ASP  HA      5.25 
 16 CYSM QB     20 ASP  QB      6.97 
 16 CYSM QB     21 GLY  QA      4.68 
 16 CYSM QB     22 ARG  HA      7.29 
 18 LYS  H      18 LYS  QG      3.55 
 18 LYS  H      18 LYS  QD      5.25 
 18 LYS  H      18 LYS  QE      5.25 
 18 LYS  H      19 CYSS QB      5.25 
 18 LYS  HA     18 LYS  QB      2.58 
 18 LYS  QB     48 VAL  QQG     7.74 
 18 LYS  QG     19 CYSS H       3.55 
 18 LYS  QG     49 CYSS H       5.25 
 18 LYS  QD     48 VAL  QQG     6.36 
 20 ASP  H      21 GLY  QA      5.25 
 21 GLY  H      21 GLY  QA      2.56 
 21 GLY  QA     22 ARG  QB      5.09 
 22 ARG  QB     23 ILE  HA      5.25 
 22 ARG  QG     23 ILE  H       5.25 
 22 ARG  QG     23 ILE  HB      7.29 
 22 ARG  QD     23 ILE  H       5.25 
 22 ARG  QD     24 GLU  QG      6.49 
 23 ILE  H      23 ILE  QG1     5.25 
 23 ILE  QG2    25 LEU  QQD     8.52 
 23 ILE  QG1    24 GLU  H       5.25 
 23 ILE  QG1    49 CYSS H       5.25 
 23 ILE  QD1    47 PHE  QB      4.80 
 23 ILE  QD1    48 VAL  QQG     8.52 
 24 GLU  QB     25 LEU  HG      7.29 
 24 GLU  QG     25 LEU  QB      6.49 
 25 LEU  QB     26 THR  HA      5.25 
 25 LEU  QB     27 VAL  H       5.25 
 25 LEU  QB     27 VAL  QQG     5.89 
 25 LEU  QB     47 PHE  QE      9.24 
 25 LEU  QQD    27 VAL  QQG     8.30 
 25 LEU  QQD    41 PHE  HZ      6.61 
 25 LEU  QQD    47 PHE  HZ      6.61 
 26 THR  H      27 VAL  QQG     6.61 
 26 THR  HA     27 VAL  QQG     6.61 
 27 VAL  QQG    28 GLU  H       4.80 
 27 VAL  QQG    28 GLU  HA      6.61 
 27 VAL  QQG    29 SER  H       6.61 
 27 VAL  QQG    34 LEU  QQD     9.42 
 27 VAL  QQG    47 PHE  QD     10.77 
 27 VAL  QQG    47 PHE  QE     10.77 
 28 GLU  H      28 GLU  QB      3.41 
 28 GLU  H      29 SER  QB      5.25 
 28 GLU  QB     29 SER  QB      6.49 
 29 SER  QB     30 SER  H       3.55 
 30 SER  QB     31 ALA  QB      6.48 
 30 SER  QB     32 GLU  H       3.55 
 31 ALA  QB     34 LEU  QQD     8.52 
 32 GLU  HA     32 GLU  QG      3.42 
 32 GLU  HA     35 ARG  QG      7.29 
 32 GLU  QB     34 LEU  H       5.25 
 33 ASP  QB     34 LEU  H       3.55 
 34 LEU  H      37 LEU  QQD     6.61 
 34 LEU  QB     37 LEU  QQD     6.36 
 34 LEU  HG     37 LEU  QB      7.29 
 34 LEU  HG     38 GLN  QB      5.25 
 34 LEU  QQD    35 ARG  HA      6.61 
 34 LEU  QQD    37 LEU  QB      8.26 
 34 LEU  QQD    37 LEU  HG      6.61 
 34 LEU  QQD    38 GLN  H       6.61 
 34 LEU  QQD    38 GLN  QB      7.57 
 34 LEU  QQD    38 GLN  QG      7.74 
 35 ARG  H      35 ARG  QB      3.41 
 35 ARG  H      37 LEU  QQD     6.61 
 35 ARG  HA     38 GLN  QE2     5.25 
 35 ARG  QG     36 THR  HA      7.29 
 36 THR  HA     40 LEU  QQD     6.61 
 36 THR  HB     37 LEU  QB      5.25 
 36 THR  HB     40 LEU  QQD     6.53 
 36 THR  QG2    39 GLN  QB      8.49 
 37 LEU  H      38 GLN  QB      5.25 
 37 LEU  H      40 LEU  QQD     6.61 
 37 LEU  HA     40 LEU  QQD     8.69 
 37 LEU  HA     45 LEU  QQD     8.69 
 37 LEU  QB     38 GLN  HA      7.29 
 37 LEU  QB     40 LEU  QB      7.31 
 37 LEU  QB     40 LEU  HG      7.29 
 37 LEU  QB     40 LEU  QQD     7.57 
 37 LEU  QQD    38 GLN  QB      6.36 
 37 LEU  QQD    41 PHE  H       6.61 
 37 LEU  QQD    41 PHE  QD      8.62 
 37 LEU  QQD    41 PHE  QE      8.51 
 37 LEU  QQD    41 PHE  HZ      8.79 
 37 LEU  QQD    47 PHE  QE     10.68 
 38 GLN  H      39 GLN  QG      5.25 
 38 GLN  HA     38 GLN  QE2     5.25 
 38 GLN  QB     39 GLN  QB      6.97 
 38 GLN  QB     39 GLN  QG      6.97 
 38 GLN  QG     39 GLN  QB      6.97 
 38 GLN  QG     39 GLN  QG      6.97 
 39 GLN  H      39 GLN  QG      5.25 
 39 GLN  H      39 GLN  QE2     5.53 
 39 GLN  H      42 LEU  QQD     6.61 
 39 GLN  HA     39 GLN  QG      3.42 
 40 LEU  QB     41 PHE  H       3.55 
 40 LEU  HG     45 LEU  QQD     8.69 
 40 LEU  QQD    43 SER  H       6.61 
 40 LEU  QQD    45 LEU  QQD     7.21 
 41 PHE  H      41 PHE  QB      3.41 
 41 PHE  H      42 LEU  QB      5.25 
 41 PHE  H      45 LEU  QB      5.25 
 41 PHE  H      45 LEU  QQD     6.61 
 41 PHE  HA     45 LEU  QB      3.55 
 41 PHE  QB     42 LEU  HA      5.25 
 41 PHE  QD     45 LEU  QQD     8.62 
 42 LEU  H      42 LEU  QB      3.40 
 45 LEU  QQD    46 SER  H       4.80 
 45 LEU  QQD    46 SER  HA      6.61 
 46 SER  H      46 SER  QB      3.41 
 46 SER  QB     47 PHE  HA      5.25 
 47 PHE  H      48 VAL  QQG     6.61 
 47 PHE  HA     48 VAL  QQG     6.61 
 47 PHE  QB     48 VAL  HA      5.25 
 47 PHE  QB     48 VAL  QQG     7.74 
 48 VAL  QQG    49 CYSS H       4.88 
 48 VAL  QQG    52 CYSS H       6.61 
 49 CYSS QB     52 CYSS H       5.25 
 49 CYSS QB     52 CYSS QB      6.97 
 50 PRO  QB     51 TRP  HA      7.29 
 50 PRO  QB     54 THR  H       5.25 
 50 PRO  QB     54 THR  QG2     8.50 
 51 TRP  H      51 TRP  QB      2.71 
 51 TRP  QB     53 ALA  H       5.25 
 52 CYSS HA     56 GLN  QB      7.29 
 52 CYSS HA     56 GLN  QG      7.29 
 52 CYSS QB     56 GLN  H       5.25 
 55 ASN  H      55 ASN  QB      3.41 
 55 ASN  H      55 ASN  QD2     5.53 
 55 ASN  QB     56 GLN  H       3.55 
 56 GLN  H      56 GLN  QB      3.41 
 56 GLN  HA     56 GLN  QG      3.42 
104 MET  HA    105 ALA  H       2.80 
104 MET  HA    105 ALA  QB      6.72 
104 MET  HB2   105 ALA  H       5.40 
104 MET  HB3   105 ALA  H       5.40 
105 ALA  HA    106 GLU  H       2.80 
105 ALA  H     105 ALA  HA      2.80 
105 ALA  H     106 GLU  HA      5.40 
105 ALA  H     106 GLU  H       4.30 
105 ALA  QB    106 GLU  HG2     6.72 
105 ALA  QB    106 GLU  HG3     6.72 
105 ALA  QB    106 GLU  H       4.92 
106 GLU  HA    107 PRO  HG2     5.40 
106 GLU  HA    107 PRO  HG3     5.40 
106 GLU  HG2   107 PRO  HD2     5.40 
106 GLU  HG2   107 PRO  HD3     5.40 
106 GLU  HG3   107 PRO  HD2     5.40 
106 GLU  HG3   107 PRO  HD3     5.40 
106 GLU  H     106 GLU  HG2     5.40 
106 GLU  H     106 GLU  HG3     5.40 
106 GLU  H     107 PRO  HD2     5.40 
106 GLU  H     107 PRO  HD3     5.40 
106 GLU  H     109 ARG  HB2     5.40 
106 GLU  H     109 ARG  HB3     5.40 
106 GLU  H     109 ARG  H       5.70 
107 PRO  HA    108 GLN  H       2.80 
107 PRO  HA    130 SER  HA      5.40 
108 GLN  HA    108 GLN  HG2     3.60 
108 GLN  HA    108 GLN  HG3     3.60 
108 GLN  HA    110 HIS  H       5.40 
108 GLN  HA    129 SER  H       5.40 
108 GLN  HB2   109 ARG  H       5.40 
108 GLN  HB3   109 ARG  H       5.40 
108 GLN  HE21  110 HIS  HE1     5.40 
108 GLN  HE22  110 HIS  HE1     5.40 
108 GLN  HG2   109 ARG  H       5.40 
108 GLN  HG3   109 ARG  H       5.40 
108 GLN  H     108 GLN  HG2     5.40 
108 GLN  H     108 GLN  HG3     5.40 
108 GLN  H     109 ARG  H       4.30 
108 GLN  H     110 HIS  HD2     5.40 
108 GLN  H     128 GLU  HA      5.40 
108 GLN  H     129 SER  H       5.70 
109 ARG  HA    109 ARG  HD2     5.40 
109 ARG  HA    109 ARG  HD3     5.40 
109 ARG  HA    109 ARG  HG2     3.60 
109 ARG  HA    109 ARG  HG3     3.60 
109 ARG  HA    110 HIS  H       2.80 
109 ARG  HA    126 THR  QG2     6.72 
109 ARG  HA    127 VAL  H       5.40 
109 ARG  HA    128 GLU  HA      3.60 
109 ARG  HA    128 GLU  HG2     5.40 
109 ARG  HA    128 GLU  HG3     5.40 
109 ARG  HA    128 GLU  H       5.40 
109 ARG  HA    129 SER  H       5.40 
109 ARG  HB2   109 ARG  HG2     2.80 
109 ARG  HB2   109 ARG  HG3     2.80 
109 ARG  HB2   110 HIS  H       5.40 
109 ARG  HB2   126 THR  QG2     6.72 
109 ARG  HB3   109 ARG  HG2     2.80 
109 ARG  HB3   109 ARG  HG3     2.80 
109 ARG  HB3   110 HIS  H       5.40 
109 ARG  HB3   126 THR  QG2     6.72 
109 ARG  HD2   126 THR  QG2     6.72 
109 ARG  HD3   126 THR  QG2     6.72 
109 ARG  HG2   110 HIS  H       5.40 
109 ARG  HG2   126 THR  QG2     6.72 
109 ARG  HG2   128 GLU  HG2     5.40 
109 ARG  HG2   128 GLU  HG3     5.40 
109 ARG  HG3   110 HIS  H       5.40 
109 ARG  HG3   126 THR  QG2     6.72 
109 ARG  HG3   128 GLU  HG2     5.40 
109 ARG  HG3   128 GLU  HG3     5.40 
109 ARG  H     109 ARG  HB2     3.60 
109 ARG  H     109 ARG  HB3     3.60 
109 ARG  H     109 ARG  HG2     5.40 
109 ARG  H     109 ARG  HG3     5.40 
109 ARG  H     110 HIS  H       4.30 
109 ARG  H     128 GLU  HA      5.40 
109 ARG  H     128 GLU  HB2     5.40 
109 ARG  H     128 GLU  HB3     5.40 
109 ARG  H     129 SER  H       5.70 
110 HIS  HA    111 LYS  H       2.80 
110 HIS  HA    127 VAL  H       5.40 
110 HIS  HB2   111 LYS  H       5.40 
110 HIS  HB2   112 ILE  H       5.40 
110 HIS  HB2   112 ILE  QD1     6.72 
110 HIS  HB2   127 VAL  H       5.40 
110 HIS  HB2   134 LEU  QD1     6.72 
110 HIS  HB2   134 LEU  QD2     6.72 
110 HIS  HB3   111 LYS  H       5.40 
110 HIS  HB3   112 ILE  H       5.40 
110 HIS  HB3   112 ILE  QD1     6.72 
110 HIS  HB3   127 VAL  H       5.40 
110 HIS  HB3   134 LEU  QD1     6.72 
110 HIS  HB3   134 LEU  QD2     6.72 
110 HIS  HD2   111 LYS  H       5.40 
110 HIS  HD2   129 SER  H       5.40 
110 HIS  H     110 HIS  HD2     5.40 
110 HIS  H     111 LYS  HA      5.40 
110 HIS  H     111 LYS  H       5.70 
110 HIS  H     126 THR  HA      5.40 
110 HIS  H     126 THR  QG2     6.72 
110 HIS  H     127 VAL  HA      5.40 
110 HIS  H     127 VAL  H       4.30 
110 HIS  H     128 GLU  HA      3.60 
110 HIS  H     128 GLU  HB2     5.40 
110 HIS  H     128 GLU  HB3     5.40 
110 HIS  H     128 GLU  HG2     5.40 
110 HIS  H     128 GLU  HG3     5.40 
110 HIS  H     128 GLU  H       5.70 
110 HIS  H     129 SER  H       4.30 
111 LYS  HA    111 LYS  HD2     5.40 
111 LYS  HA    111 LYS  HD3     5.40 
111 LYS  HA    111 LYS  HG2     3.60 
111 LYS  HA    111 LYS  HG3     3.60 
111 LYS  HA    112 ILE  HA      5.40 
111 LYS  HA    112 ILE  HB      5.40 
111 LYS  HA    112 ILE  HG12    5.40 
111 LYS  HA    112 ILE  HG13    5.40 
111 LYS  HA    112 ILE  QD1     6.72 
111 LYS  HA    113 LEU  H       5.40 
111 LYS  HA    125 LEU  H       5.40 
111 LYS  HA    126 THR  HA      5.40 
111 LYS  HA    126 THR  H       5.40 
111 LYS  HA    126 THR  QG2     6.72 
111 LYS  HA    127 VAL  H       3.60 
111 LYS  HB2   112 ILE  H       5.40 
111 LYS  HB2   113 LEU  H       5.40 
111 LYS  HB3   112 ILE  H       5.40 
111 LYS  HB3   113 LEU  H       5.40 
111 LYS  HD2   126 THR  HA      5.40 
111 LYS  HD2   126 THR  QG2     6.72 
111 LYS  HD3   126 THR  HA      5.40 
111 LYS  HD3   126 THR  QG2     6.72 
111 LYS  HE2   126 THR  QG2     6.72 
111 LYS  HE3   126 THR  QG2     6.72 
111 LYS  HG2   112 ILE  H       5.40 
111 LYS  HG2   126 THR  QG2     6.72 
111 LYS  HG3   112 ILE  H       5.40 
111 LYS  HG3   126 THR  QG2     6.72 
111 LYS  H     111 LYS  HD2     5.40 
111 LYS  H     111 LYS  HD3     5.40 
111 LYS  H     111 LYS  HE2     5.40 
111 LYS  H     111 LYS  HE3     5.40 
111 LYS  H     111 LYS  HG2     5.40 
111 LYS  H     111 LYS  HG3     5.40 
111 LYS  H     112 ILE  HA      5.40 
111 LYS  H     112 ILE  H       4.30 
111 LYS  H     112 ILE  QD1     6.72 
111 LYS  H     126 THR  HA      5.40 
112 ILE  HA    112 ILE  QD1     4.92 
112 ILE  HA    113 LEU  HA      5.40 
112 ILE  HB    113 LEU  H       5.40 
112 ILE  HB    114 CYS  H       5.40 
112 ILE  HB    125 LEU  HB2     5.40 
112 ILE  HB    125 LEU  HB3     5.40 
112 ILE  HB    125 LEU  HG      5.40 
112 ILE  HB    125 LEU  H       5.40 
112 ILE  HB    125 LEU  QD1     6.72 
112 ILE  HB    125 LEU  QD2     6.72 
112 ILE  HB    127 VAL  H       5.40 
112 ILE  H     112 ILE  HB      3.60 
112 ILE  H     112 ILE  QD1     6.72 
112 ILE  H     112 ILE  QG2     6.72 
112 ILE  H     113 LEU  HA      5.40 
112 ILE  H     113 LEU  H       4.30 
112 ILE  H     125 LEU  HB2     5.40 
112 ILE  H     125 LEU  HB3     5.40 
112 ILE  H     125 LEU  H       5.70 
112 ILE  H     126 THR  HA      5.40 
112 ILE  H     127 VAL  H       4.30 
112 ILE  QD1   113 LEU  H       6.72 
112 ILE  QD1   125 LEU  HB2     6.72 
112 ILE  QD1   125 LEU  HB3     6.72 
112 ILE  QD1   125 LEU  HG      6.72 
112 ILE  QD1   125 LEU  QD1     8.74 
112 ILE  QD1   125 LEU  QD2     8.74 
112 ILE  QD1   127 VAL  HB      8.92 
112 ILE  QD1   127 VAL  H       6.72 
112 ILE  QD1   134 LEU  HG      6.72 
112 ILE  QD1   134 LEU  QD1     8.74 
112 ILE  QD1   134 LEU  QD2     8.74 
112 ILE  QD1   137 LEU  HG      6.72 
112 ILE  QD1   137 LEU  QD1     8.74 
112 ILE  QD1   137 LEU  QD2     8.74 
112 ILE  QD1   138 GLN  HA      6.72 
112 ILE  QD1   141 PHE  QD      8.85 
112 ILE  QD1   141 PHE  QE      8.85 
112 ILE  QG2   113 LEU  H       6.72 
112 ILE  QG2   113 LEU  QD1     8.74 
112 ILE  QG2   113 LEU  QD2     8.74 
112 ILE  QG2   114 CYS  HB2     6.72 
112 ILE  QG2   114 CYS  HB3     6.72 
112 ILE  QG2   114 CYS  H       6.72 
112 ILE  QG2   125 LEU  HB2     6.72 
112 ILE  QG2   125 LEU  HB3     6.72 
112 ILE  QG2   125 LEU  H       6.72 
112 ILE  QG2   127 VAL  QG1     8.74 
112 ILE  QG2   127 VAL  QG2     8.74 
112 ILE  QG2   134 LEU  QD1     8.74 
112 ILE  QG2   134 LEU  QD2     8.74 
112 ILE  QG2   141 PHE  QD      8.85 
112 ILE  QG2   141 PHE  QE      8.85 
112 ILE  QG2   141 PHE  HZ      8.92 
113 LEU  HA    113 LEU  QD1     6.72 
113 LEU  HA    113 LEU  QD2     6.72 
113 LEU  HA    114 CYS  H       2.80 
113 LEU  HA    123 ILE  H       5.40 
113 LEU  HA    124 GLU  HG2     5.40 
113 LEU  HA    124 GLU  HG3     5.40 
113 LEU  HA    124 GLU  H       5.40 
113 LEU  HA    125 LEU  H       3.60 
113 LEU  HG    114 CYS  H       5.40 
113 LEU  HG    122 ARG  HD2     5.40 
113 LEU  HG    122 ARG  HD3     5.40 
113 LEU  H     113 LEU  HA      2.80 
113 LEU  H     113 LEU  HB2     3.60 
113 LEU  H     113 LEU  HB3     3.60 
113 LEU  H     113 LEU  HG      5.40 
113 LEU  H     113 LEU  QD1     6.72 
113 LEU  H     113 LEU  QD2     6.72 
113 LEU  H     114 CYS  HA      5.40 
113 LEU  H     114 CYS  H       4.30 
113 LEU  H     124 GLU  HA      5.40 
113 LEU  H     125 LEU  HG      5.40 
113 LEU  H     125 LEU  H       4.30 
113 LEU  QD1   114 CYS  H       6.72 
113 LEU  QD1   122 ARG  HB2     6.72 
113 LEU  QD1   122 ARG  HB3     6.72 
113 LEU  QD1   122 ARG  HD2     6.72 
113 LEU  QD1   122 ARG  HD3     6.72 
113 LEU  QD1   123 ILE  QG2     8.74 
113 LEU  QD1   124 GLU  HA      6.72 
113 LEU  QD2   114 CYS  H       6.72 
113 LEU  QD2   122 ARG  HB2     6.72 
113 LEU  QD2   122 ARG  HB3     6.72 
113 LEU  QD2   122 ARG  HD2     6.72 
113 LEU  QD2   122 ARG  HD3     6.72 
113 LEU  QD2   123 ILE  QG2     8.74 
113 LEU  QD2   124 GLU  HA      6.72 
114 CYS  HA    115 VAL  QG1     6.72 
114 CYS  HA    115 VAL  QG2     6.72 
114 CYS  HA    123 ILE  H       5.40 
114 CYS  HB2   115 VAL  H       5.40 
114 CYS  HB2   123 ILE  HB      5.40 
114 CYS  HB2   123 ILE  QG2     6.72 
114 CYS  HB3   115 VAL  H       5.40 
114 CYS  HB3   123 ILE  HB      5.40 
114 CYS  HB3   123 ILE  QG2     6.72 
114 CYS  H     115 VAL  H       5.70 
114 CYS  H     123 ILE  HB      5.40 
114 CYS  H     123 ILE  H       4.30 
114 CYS  H     123 ILE  QG2     6.72 
114 CYS  H     124 GLU  HA      5.40 
114 CYS  H     124 GLU  H       5.70 
114 CYS  H     125 LEU  HA      5.40 
114 CYS  H     125 LEU  HG      5.40 
114 CYS  H     125 LEU  H       5.70 
115 VAL  HA    116 CYSM H       2.80 
115 VAL  HA    123 ILE  H       3.60 
115 VAL  HB    116 CYSM H       3.60 
115 VAL  HB    120 ASP  HA      5.40 
115 VAL  HB    121 GLY  H       5.40 
115 VAL  HB    122 ARG  HA      5.40 
115 VAL  HB    122 ARG  H       5.40 
115 VAL  H     116 CYSM H       5.70 
115 VAL  H     123 ILE  HB      5.40 
115 VAL  H     123 ILE  H       5.70 
115 VAL  H     123 ILE  QD1     6.72 
115 VAL  QG1   122 ARG  HA      6.72 
115 VAL  QG2   122 ARG  HA      6.72 
116 CYSM HA    117 CYS  H       2.80 
116 CYSM HA    118 LYS  H       5.40 
116 CYSM HA    119 CYSS H       5.40 
116 CYSM HA    120 ASP  H       5.40 
116 CYSM HA    121 GLY  H       5.40 
116 CYSM HA    123 ILE  QD1     4.92 
116 CYSM HA    147 PHE  HB2     5.40 
116 CYSM HA    147 PHE  HB3     5.40 
116 CYSM HA    147 PHE  QD      7.53 
116 CYSM HA    147 PHE  H       5.40 
116 CYSM HA    149 CYSS H       5.40 
116 CYSM HB2   117 CYS  H       5.40 
116 CYSM HB2   118 LYS  H       5.40 
116 CYSM HB2   120 ASP  H       5.40 
116 CYSM HB2   121 GLY  H       5.40 
116 CYSM HB2   123 ILE  QD1     6.72 
116 CYSM HB2   149 CYSS HB2     7.60 
116 CYSM HB2   149 CYSS HB3     7.60 
116 CYSM HB2   149 CYSS H       5.40 
116 CYSM HB3   117 CYS  H       5.40 
116 CYSM HB3   118 LYS  H       5.40 
116 CYSM HB3   120 ASP  H       5.40 
116 CYSM HB3   121 GLY  H       5.40 
116 CYSM HB3   123 ILE  QD1     6.72 
116 CYSM HB3   149 CYSS HB2     7.60 
116 CYSM HB3   149 CYSS HB3     7.60 
116 CYSM HB3   149 CYSS H       5.40 
116 CYSM H     116 CYSM HB2     3.60 
116 CYSM H     116 CYSM HB3     3.60 
116 CYSM H     117 CYS  H       5.70 
116 CYSM H     120 ASP  HA      5.40 
116 CYSM H     120 ASP  H       5.70 
116 CYSM H     121 GLY  HA2     5.40 
116 CYSM H     121 GLY  HA3     5.40 
116 CYSM H     121 GLY  H       4.30 
116 CYSM H     122 ARG  HA      5.40 
116 CYSM H     122 ARG  H       5.70 
116 CYSM H     123 ILE  HB      5.40 
116 CYSM H     123 ILE  H       4.30 
116 CYSM H     123 ILE  QD1     6.72 
117 CYS  HA    118 LYS  HA      5.40 
117 CYS  HA    119 CYSS H       5.40 
117 CYS  HA    120 ASP  H       5.40 
117 CYS  HA    146 SER  HB2     5.40 
117 CYS  HA    146 SER  HB3     5.40 
117 CYS  HB2   118 LYS  H       5.40 
117 CYS  HB2   146 SER  HB2     5.40 
117 CYS  HB2   146 SER  HB3     5.40 
117 CYS  HB2   147 PHE  H       5.40 
117 CYS  HB3   118 LYS  H       5.40 
117 CYS  HB3   146 SER  HB2     5.40 
117 CYS  HB3   146 SER  HB3     5.40 
117 CYS  HB3   147 PHE  H       5.40 
117 CYS  H     117 CYS  HB2     3.60 
117 CYS  H     117 CYS  HB3     3.60 
117 CYS  H     118 LYS  HG2     5.40 
117 CYS  H     118 LYS  HG3     5.40 
117 CYS  H     118 LYS  H       4.30 
117 CYS  H     119 CYSS H       5.70 
117 CYS  H     121 GLY  H       5.70 
117 CYS  H     123 ILE  QD1     6.72 
117 CYS  H     146 SER  HB2     5.40 
117 CYS  H     146 SER  HB3     5.40 
117 CYS  H     147 PHE  H       5.70 
117 CYS  H     148 VAL  HA      5.40 
118 LYS  HA    120 ASP  H       5.40 
118 LYS  HB2   118 LYS  HE2     5.40 
118 LYS  HB2   118 LYS  HE3     5.40 
118 LYS  HB2   119 CYSS H       5.40 
118 LYS  HB3   118 LYS  HE2     5.40 
118 LYS  HB3   118 LYS  HE3     5.40 
118 LYS  HB3   119 CYSS H       5.40 
118 LYS  HD2   119 CYSS H       5.40 
118 LYS  HD2   156 GLN  HA      5.40 
118 LYS  HD3   119 CYSS H       5.40 
118 LYS  HD3   156 GLN  HA      5.40 
118 LYS  HE2   148 VAL  QG1     6.72 
118 LYS  HE2   148 VAL  QG2     6.72 
118 LYS  HE3   148 VAL  QG1     6.72 
118 LYS  HE3   148 VAL  QG2     6.72 
118 LYS  HG2   148 VAL  QG1     6.72 
118 LYS  HG2   148 VAL  QG2     6.72 
118 LYS  HG2   152 CYSS HB2     5.40 
118 LYS  HG2   152 CYSS HB3     5.40 
118 LYS  HG2   153 ALA  QB      8.92 
118 LYS  HG3   148 VAL  QG1     6.72 
118 LYS  HG3   148 VAL  QG2     6.72 
118 LYS  HG3   152 CYSS HB2     5.40 
118 LYS  HG3   152 CYSS HB3     5.40 
118 LYS  HG3   153 ALA  QB      8.92 
118 LYS  H     118 LYS  HB2     3.60 
118 LYS  H     118 LYS  HB3     3.60 
118 LYS  H     119 CYSS HA      5.40 
118 LYS  H     119 CYSS H       4.30 
118 LYS  H     120 ASP  H       4.30 
118 LYS  H     121 GLY  H       5.40 
118 LYS  H     148 VAL  HA      5.40 
118 LYS  H     148 VAL  QG1     6.72 
118 LYS  H     148 VAL  QG2     6.72 
119 CYSS HA    119 CYSS HB2     2.80 
119 CYSS HA    119 CYSS HB3     2.80 
119 CYSS HB2   120 ASP  H       5.40 
119 CYSS HB2   121 GLY  H       5.40 
119 CYSS HB3   120 ASP  H       5.40 
119 CYSS HB3   121 GLY  H       5.40 
119 CYSS H     119 CYSS HB2     3.60 
119 CYSS H     119 CYSS HB3     3.60 
119 CYSS H     120 ASP  HA      5.40 
119 CYSS H     120 ASP  HB2     5.40 
119 CYSS H     120 ASP  HB3     5.40 
119 CYSS H     120 ASP  H       4.30 
119 CYSS H     121 GLY  H       4.30 
119 CYSS H     152 CYSS HB2     5.40 
119 CYSS H     152 CYSS HB3     5.40 
120 ASP  HB2   121 GLY  H       5.40 
120 ASP  HB3   121 GLY  H       5.40 
120 ASP  H     120 ASP  HA      2.80 
120 ASP  H     120 ASP  HB2     3.60 
120 ASP  H     120 ASP  HB3     3.60 
120 ASP  H     121 GLY  H       4.30 
121 GLY  HA2   122 ARG  HA      5.40 
121 GLY  HA2   122 ARG  H       2.80 
121 GLY  HA3   122 ARG  HA      5.40 
121 GLY  HA3   122 ARG  H       2.80 
121 GLY  H     122 ARG  H       5.70 
121 GLY  H     123 ILE  QD1     6.72 
122 ARG  HA    122 ARG  HD2     5.40 
122 ARG  HA    122 ARG  HD3     5.40 
122 ARG  HA    123 ILE  H       2.80 
122 ARG  HB2   123 ILE  H       5.40 
122 ARG  HB3   123 ILE  H       5.40 
122 ARG  HD2   123 ILE  HA      5.40 
122 ARG  HD2   124 GLU  HB2     5.40 
122 ARG  HD2   124 GLU  HB3     5.40 
122 ARG  HD2   124 GLU  H       5.40 
122 ARG  HD3   123 ILE  HA      5.40 
122 ARG  HD3   124 GLU  HB2     5.40 
122 ARG  HD3   124 GLU  HB3     5.40 
122 ARG  HD3   124 GLU  H       5.40 
122 ARG  H     122 ARG  HB2     3.60 
122 ARG  H     122 ARG  HB3     3.60 
122 ARG  H     122 ARG  HD2     5.40 
122 ARG  H     122 ARG  HD3     5.40 
122 ARG  H     122 ARG  HG2     5.40 
122 ARG  H     122 ARG  HG3     5.40 
122 ARG  H     123 ILE  HA      5.40 
122 ARG  H     123 ILE  H       5.70 
123 ILE  HA    123 ILE  QD1     6.72 
123 ILE  HA    123 ILE  QG2     4.12 
123 ILE  HA    124 GLU  HA      5.40 
123 ILE  HA    124 GLU  HB2     5.40 
123 ILE  HA    124 GLU  HB3     5.40 
123 ILE  HB    124 GLU  H       5.40 
123 ILE  HB    147 PHE  HB2     5.40 
123 ILE  HB    147 PHE  HB3     5.40 
123 ILE  H     123 ILE  HB      3.60 
123 ILE  H     123 ILE  QD1     6.72 
123 ILE  H     123 ILE  QG2     6.72 
123 ILE  H     124 GLU  HA      5.40 
123 ILE  H     124 GLU  H       5.70 
123 ILE  QD1   124 GLU  H       6.72 
123 ILE  QD1   147 PHE  QD      8.85 
123 ILE  QD1   147 PHE  H       6.72 
123 ILE  QD1   148 VAL  HA      6.72 
123 ILE  QD1   148 VAL  H       6.72 
123 ILE  QD1   149 CYSS HA      6.72 
123 ILE  QD1   149 CYSS HB2     6.72 
123 ILE  QD1   149 CYSS HB3     6.72 
123 ILE  QD1   149 CYSS H       4.92 
123 ILE  QD1   150 PRO  QD      9.61 
123 ILE  QG2   123 ILE  QD1     6.94 
123 ILE  QG2   124 GLU  HB2     6.72 
123 ILE  QG2   124 GLU  HB3     6.72 
123 ILE  QG2   124 GLU  H       6.72 
123 ILE  QG2   125 LEU  HA      6.72 
123 ILE  QG2   125 LEU  HG      6.72 
123 ILE  QG2   125 LEU  H       6.72 
123 ILE  QG2   147 PHE  HB2     6.72 
123 ILE  QG2   147 PHE  HB3     6.72 
123 ILE  QG2   147 PHE  QD      8.85 
123 ILE  QG2   147 PHE  QE      8.85 
123 ILE  QG2   149 CYSS HA      6.72 
123 ILE  QG2   150 PRO  QD      9.61 
124 GLU  HB2   125 LEU  H       5.40 
124 GLU  HB3   125 LEU  H       5.40 
124 GLU  HG2   125 LEU  H       5.40 
124 GLU  HG3   125 LEU  H       5.40 
124 GLU  H     124 GLU  HB2     3.60 
124 GLU  H     124 GLU  HB3     3.60 
124 GLU  H     124 GLU  HG2     5.40 
124 GLU  H     124 GLU  HG3     5.40 
124 GLU  H     125 LEU  HG      5.40 
124 GLU  H     125 LEU  H       4.30 
125 LEU  HA    125 LEU  QD1     6.72 
125 LEU  HA    125 LEU  QD2     6.72 
125 LEU  HA    126 THR  HB      5.40 
125 LEU  HA    126 THR  H       2.80 
125 LEU  HB2   126 THR  H       5.40 
125 LEU  HB3   126 THR  H       5.40 
125 LEU  HG    126 THR  H       5.40 
125 LEU  H     125 LEU  HG      5.40 
125 LEU  H     125 LEU  QD1     6.72 
125 LEU  H     125 LEU  QD2     6.72 
125 LEU  H     126 THR  H       4.30 
125 LEU  QD1   126 THR  H       6.72 
125 LEU  QD1   147 PHE  QD      8.85 
125 LEU  QD1   147 PHE  QE      8.85 
125 LEU  QD2   126 THR  H       6.72 
125 LEU  QD2   147 PHE  QD      8.85 
125 LEU  QD2   147 PHE  QE      8.85 
126 THR  HA    127 VAL  H       2.80 
126 THR  HB    127 VAL  H       5.40 
126 THR  H     126 THR  HB      3.60 
126 THR  H     126 THR  QG2     6.72 
126 THR  H     127 VAL  HA      5.40 
126 THR  H     127 VAL  H       4.30 
126 THR  QG2   127 VAL  HA      6.72 
126 THR  QG2   127 VAL  H       6.72 
126 THR  QG2   127 VAL  QG1     8.74 
126 THR  QG2   127 VAL  QG2     8.74 
126 THR  QG2   128 GLU  H       6.72 
127 VAL  HA    127 VAL  HB      2.80 
127 VAL  HA    128 GLU  HA      5.40 
127 VAL  HA    128 GLU  H       2.80 
127 VAL  HB    128 GLU  H       3.60 
127 VAL  H     128 GLU  HA      5.40 
127 VAL  H     128 GLU  H       5.70 
127 VAL  QG1   137 LEU  QD1     8.74 
127 VAL  QG1   137 LEU  QD2     8.74 
127 VAL  QG2   137 LEU  QD1     8.74 
127 VAL  QG2   137 LEU  QD2     8.74 
128 GLU  HA    128 GLU  HG2     3.60 
128 GLU  HA    128 GLU  HG3     3.60 
128 GLU  HA    129 SER  H       2.80 
128 GLU  HB2   129 SER  H       5.40 
128 GLU  HB3   129 SER  H       5.40 
128 GLU  H     128 GLU  HG2     5.40 
128 GLU  H     128 GLU  HG3     5.40 
128 GLU  H     129 SER  HA      5.40 
128 GLU  H     129 SER  H       4.30 
129 SER  HA    130 SER  H       2.80 
129 SER  HB2   134 LEU  H       5.40 
129 SER  HB3   134 LEU  H       5.40 
129 SER  H     129 SER  HB2     3.60 
129 SER  H     129 SER  HB3     3.60 
129 SER  H     130 SER  H       5.70 
130 SER  HA    131 ALA  QB      6.72 
130 SER  HA    132 GLU  H       5.40 
130 SER  HA    133 ASP  H       5.40 
130 SER  HB2   133 ASP  H       5.40 
130 SER  HB2   134 LEU  H       5.40 
130 SER  HB3   133 ASP  H       5.40 
130 SER  HB3   134 LEU  H       5.40 
130 SER  H     130 SER  HB2     3.60 
130 SER  H     130 SER  HB3     3.60 
130 SER  H     133 ASP  HB2     5.40 
130 SER  H     133 ASP  HB3     5.40 
130 SER  H     133 ASP  H       5.40 
130 SER  H     134 LEU  H       5.70 
131 ALA  HA    133 ASP  H       5.40 
131 ALA  HA    134 LEU  HA      5.40 
131 ALA  HA    134 LEU  HB2     5.40 
131 ALA  HA    134 LEU  HB3     5.40 
131 ALA  HA    134 LEU  HG      5.40 
131 ALA  HA    134 LEU  H       3.60 
131 ALA  HA    134 LEU  QD1     6.72 
131 ALA  HA    134 LEU  QD2     6.72 
131 ALA  HA    135 ARG  H       5.40 
131 ALA  QB    132 GLU  HA      6.72 
131 ALA  QB    132 GLU  HG2     6.72 
131 ALA  QB    132 GLU  HG3     6.72 
131 ALA  QB    132 GLU  H       4.92 
131 ALA  QB    133 ASP  H       6.72 
131 ALA  QB    134 LEU  H       6.72 
131 ALA  QB    135 ARG  H       6.72 
132 GLU  HA    134 LEU  H       5.40 
132 GLU  HA    135 ARG  HB2     5.40 
132 GLU  HA    135 ARG  HB3     5.40 
132 GLU  HA    135 ARG  HD2     5.40 
132 GLU  HA    135 ARG  HD3     5.40 
132 GLU  HA    135 ARG  H       3.60 
132 GLU  HA    136 THR  H       5.40 
132 GLU  HB2   133 ASP  H       5.40 
132 GLU  HB3   133 ASP  H       5.40 
132 GLU  HG2   133 ASP  H       5.40 
132 GLU  HG3   133 ASP  H       5.40 
132 GLU  H     132 GLU  HA      2.80 
132 GLU  H     132 GLU  HB2     3.60 
132 GLU  H     132 GLU  HB3     3.60 
132 GLU  H     132 GLU  HG2     5.40 
132 GLU  H     132 GLU  HG3     5.40 
132 GLU  H     133 ASP  HA      5.40 
132 GLU  H     133 ASP  HB2     5.40 
132 GLU  H     133 ASP  HB3     5.40 
132 GLU  H     133 ASP  H       4.30 
132 GLU  H     134 LEU  H       4.30 
133 ASP  HA    135 ARG  H       5.40 
133 ASP  HA    136 THR  HB      5.40 
133 ASP  HA    136 THR  H       3.60 
133 ASP  HA    136 THR  QG2     6.72 
133 ASP  HA    137 LEU  H       5.40 
133 ASP  H     133 ASP  HA      2.80 
133 ASP  H     134 LEU  HA      5.40 
133 ASP  H     134 LEU  H       4.30 
133 ASP  H     135 ARG  H       4.30 
134 LEU  HA    134 LEU  HG      3.60 
134 LEU  HA    134 LEU  QD1     6.72 
134 LEU  HA    134 LEU  QD2     6.72 
134 LEU  HA    135 ARG  HA      5.40 
134 LEU  HA    136 THR  H       5.40 
134 LEU  HA    137 LEU  HB2     5.40 
134 LEU  HA    137 LEU  HB3     5.40 
134 LEU  HA    137 LEU  HG      5.40 
134 LEU  HA    137 LEU  H       5.40 
134 LEU  HA    137 LEU  QD1     6.72 
134 LEU  HA    137 LEU  QD2     6.72 
134 LEU  HA    138 GLN  H       5.40 
134 LEU  HB2   135 ARG  H       5.40 
134 LEU  HB3   135 ARG  H       5.40 
134 LEU  HG    135 ARG  HA      5.40 
134 LEU  HG    135 ARG  H       5.40 
134 LEU  HG    137 LEU  QD1     6.72 
134 LEU  HG    137 LEU  QD2     6.72 
134 LEU  HG    138 GLN  HA      5.40 
134 LEU  HG    138 GLN  HE21    5.40 
134 LEU  HG    138 GLN  HE22    5.40 
134 LEU  HG    138 GLN  H       5.40 
134 LEU  H     134 LEU  HB2     3.60 
134 LEU  H     134 LEU  HB3     3.60 
134 LEU  H     134 LEU  HG      5.40 
134 LEU  H     134 LEU  QD1     6.72 
134 LEU  H     134 LEU  QD2     6.72 
134 LEU  H     135 ARG  HB2     5.40 
134 LEU  H     135 ARG  HB3     5.40 
134 LEU  H     135 ARG  H       4.30 
134 LEU  H     136 THR  HB      5.40 
134 LEU  H     136 THR  H       5.70 
134 LEU  QD1   135 ARG  H       6.72 
134 LEU  QD1   137 LEU  QD1     8.74 
134 LEU  QD1   137 LEU  QD2     8.74 
134 LEU  QD1   138 GLN  HE21    6.72 
134 LEU  QD1   138 GLN  HE22    6.72 
134 LEU  QD2   135 ARG  H       6.72 
134 LEU  QD2   137 LEU  QD1     8.74 
134 LEU  QD2   137 LEU  QD2     8.74 
134 LEU  QD2   138 GLN  HE21    6.72 
134 LEU  QD2   138 GLN  HE22    6.72 
135 ARG  HA    135 ARG  HD2     5.40 
135 ARG  HA    135 ARG  HD3     5.40 
135 ARG  HA    137 LEU  H       5.40 
135 ARG  HA    138 GLN  HB2     5.40 
135 ARG  HA    138 GLN  HB3     5.40 
135 ARG  HA    138 GLN  HG2     5.40 
135 ARG  HA    138 GLN  HG3     5.40 
135 ARG  HA    138 GLN  H       3.60 
135 ARG  HA    139 GLN  H       5.40 
135 ARG  HB2   136 THR  H       3.60 
135 ARG  HB2   139 GLN  HE21    5.40 
135 ARG  HB2   139 GLN  HE22    5.40 
135 ARG  HB3   136 THR  H       3.60 
135 ARG  HB3   139 GLN  HE21    5.40 
135 ARG  HB3   139 GLN  HE22    5.40 
135 ARG  HG2   136 THR  H       5.40 
135 ARG  HG2   139 GLN  HE21    5.40 
135 ARG  HG2   139 GLN  HE22    5.40 
135 ARG  HG3   136 THR  H       5.40 
135 ARG  HG3   139 GLN  HE21    5.40 
135 ARG  HG3   139 GLN  HE22    5.40 
135 ARG  H     135 ARG  HD2     5.40 
135 ARG  H     135 ARG  HD3     5.40 
135 ARG  H     135 ARG  HG2     5.40 
135 ARG  H     135 ARG  HG3     5.40 
135 ARG  H     136 THR  HB      5.40 
135 ARG  H     136 THR  H       4.30 
135 ARG  H     137 LEU  HG      5.40 
135 ARG  H     137 LEU  H       4.30 
136 THR  HA    138 GLN  H       5.40 
136 THR  HA    139 GLN  HB2     5.40 
136 THR  HA    139 GLN  HB3     5.40 
136 THR  HA    139 GLN  HE21    5.40 
136 THR  HA    139 GLN  HE22    5.40 
136 THR  HA    139 GLN  HG2     5.40 
136 THR  HA    139 GLN  HG3     5.40 
136 THR  HA    139 GLN  H       3.60 
136 THR  HB    137 LEU  HA      5.40 
136 THR  HB    137 LEU  H       3.60 
136 THR  HB    138 GLN  H       5.40 
136 THR  HB    139 GLN  H       5.40 
136 THR  H     136 THR  HB      3.60 
136 THR  H     136 THR  QG2     6.72 
136 THR  H     137 LEU  HA      5.40 
136 THR  H     137 LEU  H       5.70 
136 THR  H     138 GLN  H       4.30 
136 THR  H     139 GLN  H       5.70 
136 THR  QG2   137 LEU  HA      6.72 
136 THR  QG2   137 LEU  H       6.72 
136 THR  QG2   139 GLN  H       6.72 
136 THR  QG2   140 LEU  HG      4.92 
136 THR  QG2   140 LEU  H       6.72 
136 THR  QG2   140 LEU  QD1     8.74 
136 THR  QG2   140 LEU  QD2     8.74 
137 LEU  HA    137 LEU  QD1     6.72 
137 LEU  HA    137 LEU  QD2     6.72 
137 LEU  HA    139 GLN  H       5.40 
137 LEU  HA    140 LEU  HB2     5.40 
137 LEU  HA    140 LEU  HB3     5.40 
137 LEU  HA    140 LEU  HG      5.40 
137 LEU  HA    140 LEU  H       3.60 
137 LEU  HA    141 PHE  H       5.40 
137 LEU  HB2   138 GLN  H       5.40 
137 LEU  HB3   138 GLN  H       5.40 
137 LEU  HG    138 GLN  HA      5.40 
137 LEU  HG    138 GLN  H       5.40 
137 LEU  HG    141 PHE  QE      7.53 
137 LEU  H     137 LEU  HB2     3.60 
137 LEU  H     137 LEU  HB3     3.60 
137 LEU  H     137 LEU  HG      5.40 
137 LEU  H     137 LEU  QD1     6.72 
137 LEU  H     137 LEU  QD2     6.72 
137 LEU  H     138 GLN  HA      5.40 
137 LEU  H     138 GLN  H       4.30 
137 LEU  H     139 GLN  H       5.70 
137 LEU  H     140 LEU  HG      5.40 
137 LEU  H     140 LEU  H       5.70 
137 LEU  QD1   138 GLN  HA      6.72 
137 LEU  QD1   138 GLN  H       6.72 
137 LEU  QD2   138 GLN  HA      6.72 
137 LEU  QD2   138 GLN  H       6.72 
138 GLN  HA    141 PHE  HB2     5.40 
138 GLN  HA    141 PHE  HB3     5.40 
138 GLN  HA    141 PHE  QD      7.53 
138 GLN  HA    141 PHE  H       3.60 
138 GLN  HB2   138 GLN  HE21    5.40 
138 GLN  HB2   138 GLN  HE22    5.40 
138 GLN  HB2   139 GLN  H       5.40 
138 GLN  HB3   138 GLN  HE21    5.40 
138 GLN  HB3   138 GLN  HE22    5.40 
138 GLN  HB3   139 GLN  H       5.40 
138 GLN  HG2   139 GLN  HA      5.40 
138 GLN  HG2   139 GLN  HE21    5.40 
138 GLN  HG2   139 GLN  HE22    5.40 
138 GLN  HG2   139 GLN  H       5.40 
138 GLN  HG3   139 GLN  HA      5.40 
138 GLN  HG3   139 GLN  HE21    5.40 
138 GLN  HG3   139 GLN  HE22    5.40 
138 GLN  HG3   139 GLN  H       5.40 
138 GLN  H     138 GLN  HB2     3.60 
138 GLN  H     138 GLN  HB3     3.60 
138 GLN  H     138 GLN  HE21    5.70 
138 GLN  H     138 GLN  HE22    5.70 
138 GLN  H     138 GLN  HG2     5.40 
138 GLN  H     138 GLN  HG3     5.40 
138 GLN  H     139 GLN  H       4.30 
138 GLN  H     140 LEU  H       4.30 
138 GLN  H     141 PHE  QD      7.83 
138 GLN  H     141 PHE  H       5.70 
139 GLN  HA    139 GLN  HE21    5.40 
139 GLN  HA    139 GLN  HE22    5.40 
139 GLN  HA    140 LEU  HA      5.40 
139 GLN  HA    141 PHE  H       5.40 
139 GLN  HA    142 LEU  HB2     5.40 
139 GLN  HA    142 LEU  HB3     5.40 
139 GLN  HA    142 LEU  HG      5.40 
139 GLN  HA    142 LEU  H       3.60 
139 GLN  HA    142 LEU  QD1     6.72 
139 GLN  HA    142 LEU  QD2     6.72 
139 GLN  HA    143 SER  H       5.40 
139 GLN  HB2   139 GLN  HE21    5.40 
139 GLN  HB2   139 GLN  HE22    5.40 
139 GLN  HB2   140 LEU  HA      5.40 
139 GLN  HB2   140 LEU  H       5.40 
139 GLN  HB2   142 LEU  H       5.40 
139 GLN  HB3   139 GLN  HE21    5.40 
139 GLN  HB3   139 GLN  HE22    5.40 
139 GLN  HB3   140 LEU  HA      5.40 
139 GLN  HB3   140 LEU  H       5.40 
139 GLN  HB3   142 LEU  H       5.40 
139 GLN  H     139 GLN  HA      2.80 
139 GLN  H     139 GLN  HB2     3.60 
139 GLN  H     139 GLN  HB3     3.60 
139 GLN  H     140 LEU  HA      5.40 
139 GLN  H     140 LEU  HG      5.20 
139 GLN  H     140 LEU  H       4.30 
139 GLN  H     140 LEU  QD1     6.72 
139 GLN  H     140 LEU  QD2     6.72 
139 GLN  H     141 PHE  QD      7.53 
139 GLN  H     141 PHE  H       4.30 
140 LEU  HA    140 LEU  HG      3.60 
140 LEU  HA    141 PHE  HA      5.40 
140 LEU  HA    142 LEU  H       5.40 
140 LEU  HA    143 SER  HB2     5.40 
140 LEU  HA    143 SER  HB3     5.40 
140 LEU  HA    143 SER  H       3.60 
140 LEU  HA    144 THR  H       5.40 
140 LEU  HA    144 THR  QG2     8.92 
140 LEU  HA    145 LEU  HB2     5.40 
140 LEU  HA    145 LEU  HB3     5.40 
140 LEU  HA    145 LEU  H       5.40 
140 LEU  HB2   145 LEU  HB2     5.40 
140 LEU  HB2   145 LEU  HB3     5.40 
140 LEU  HB2   145 LEU  QD1     6.72 
140 LEU  HB2   145 LEU  QD2     6.72 
140 LEU  HB3   145 LEU  HB2     5.40 
140 LEU  HB3   145 LEU  HB3     5.40 
140 LEU  HB3   145 LEU  QD1     6.72 
140 LEU  HB3   145 LEU  QD2     6.72 
140 LEU  HG    141 PHE  H       5.40 
140 LEU  H     140 LEU  HB2     3.60 
140 LEU  H     140 LEU  HB3     3.60 
140 LEU  H     140 LEU  HG      2.80 
140 LEU  H     140 LEU  QD1     4.92 
140 LEU  H     140 LEU  QD2     4.92 
140 LEU  H     141 PHE  H       4.30 
140 LEU  H     142 LEU  H       4.30 
140 LEU  H     143 SER  H       5.70 
140 LEU  QD1   141 PHE  H       6.72 
140 LEU  QD2   141 PHE  H       6.72 
141 PHE  HA    143 SER  H       5.40 
141 PHE  HA    145 LEU  HG      5.40 
141 PHE  HA    145 LEU  H       3.60 
141 PHE  HA    145 LEU  QD1     6.72 
141 PHE  HA    145 LEU  QD2     6.72 
141 PHE  HA    146 SER  H       5.40 
141 PHE  HB2   142 LEU  H       5.40 
141 PHE  HB3   142 LEU  H       5.40 
141 PHE  QE    145 LEU  QD1     8.85 
141 PHE  QE    145 LEU  QD2     8.85 
141 PHE  H     141 PHE  QD      7.53 
141 PHE  H     142 LEU  HA      5.40 
141 PHE  H     142 LEU  H       4.30 
141 PHE  H     143 SER  H       5.40 
142 LEU  HA    142 LEU  HG      3.60 
142 LEU  HA    144 THR  H       5.40 
142 LEU  HB2   143 SER  H       5.40 
142 LEU  HB3   143 SER  H       5.40 
142 LEU  HG    143 SER  H       5.40 
142 LEU  H     142 LEU  HG      5.40 
142 LEU  H     142 LEU  QD1     6.72 
142 LEU  H     142 LEU  QD2     6.72 
142 LEU  H     143 SER  HA      5.40 
142 LEU  H     143 SER  HB2     5.40 
142 LEU  H     143 SER  HB3     5.40 
142 LEU  H     143 SER  H       4.30 
142 LEU  H     144 THR  H       5.40 
142 LEU  H     145 LEU  H       5.70 
142 LEU  QD1   143 SER  H       6.72 
142 LEU  QD2   143 SER  H       6.72 
143 SER  HA    145 LEU  H       5.40 
143 SER  HB2   144 THR  H       3.60 
143 SER  HB2   145 LEU  H       5.40 
143 SER  HB3   144 THR  H       3.60 
143 SER  HB3   145 LEU  H       5.40 
143 SER  H     143 SER  HA      2.80 
143 SER  H     143 SER  HB2     3.60 
143 SER  H     143 SER  HB3     3.60 
143 SER  H     144 THR  HA      5.40 
143 SER  H     144 THR  H       4.30 
143 SER  H     145 LEU  H       4.30 
144 THR  HB    145 LEU  H       5.40 
144 THR  H     144 THR  HA      2.80 
144 THR  H     144 THR  QG2     4.92 
144 THR  H     145 LEU  HA      5.40 
144 THR  H     145 LEU  HB2     5.40 
144 THR  H     145 LEU  HB3     5.40 
144 THR  H     145 LEU  H       4.30 
144 THR  QG2   145 LEU  H       4.92 
145 LEU  HA    146 SER  H       2.80 
145 LEU  HB2   146 SER  H       5.40 
145 LEU  HB3   146 SER  H       5.40 
145 LEU  HG    146 SER  H       5.40 
145 LEU  H     145 LEU  HB2     3.60 
145 LEU  H     145 LEU  HB3     3.60 
145 LEU  H     145 LEU  QD1     6.72 
145 LEU  H     145 LEU  QD2     6.72 
145 LEU  H     146 SER  H       5.70 
146 SER  HA    147 PHE  HB2     5.40 
146 SER  HA    147 PHE  HB3     5.40 
146 SER  HA    147 PHE  QD      7.53 
146 SER  HB2   147 PHE  H       3.60 
146 SER  HB3   147 PHE  H       3.60 
146 SER  H     147 PHE  HA      5.40 
146 SER  H     147 PHE  H       4.30 
147 PHE  HA    147 PHE  QD      7.53 
147 PHE  HB2   148 VAL  H       5.40 
147 PHE  HB3   148 VAL  H       5.40 
147 PHE  QD    148 VAL  H       7.53 
147 PHE  H     147 PHE  HB2     3.60 
147 PHE  H     147 PHE  HB3     3.60 
147 PHE  H     147 PHE  QD      6.43 
147 PHE  H     148 VAL  HA      5.40 
147 PHE  H     148 VAL  H       4.30 
148 VAL  HA    149 CYSS H       2.80 
148 VAL  HB    149 CYSS H       5.40 
148 VAL  HB    153 ALA  QB      6.72 
148 VAL  H     148 VAL  HA      2.80 
148 VAL  H     148 VAL  HB      3.60 
148 VAL  H     149 CYSS HA      5.40 
148 VAL  H     149 CYSS H       4.30 
148 VAL  QG1   152 CYSS HB2     6.72 
148 VAL  QG1   152 CYSS HB3     6.72 
148 VAL  QG1   153 ALA  HA      8.92 
148 VAL  QG1   153 ALA  H       6.72 
148 VAL  QG1   153 ALA  QB      8.74 
148 VAL  QG2   152 CYSS HB2     6.72 
148 VAL  QG2   152 CYSS HB3     6.72 
148 VAL  QG2   153 ALA  HA      8.92 
148 VAL  QG2   153 ALA  H       6.72 
148 VAL  QG2   153 ALA  QB      8.74 
149 CYSS HA    150 PRO  HG2     5.40 
149 CYSS HA    150 PRO  HG3     5.40 
149 CYSS HA    151 TRP  H       5.40 
149 CYSS HB2   150 PRO  QD      7.89 
149 CYSS HB2   151 TRP  H       5.40 
149 CYSS HB3   150 PRO  QD      7.89 
149 CYSS HB3   151 TRP  H       5.40 
149 CYSS H     149 CYSS HB2     3.60 
149 CYSS H     149 CYSS HB3     3.60 
149 CYSS H     150 PRO  QD      7.89 
149 CYSS H     151 TRP  H       5.40 
149 CYSS H     152 CYSS HB2     5.40 
149 CYSS H     152 CYSS HB3     5.40 
149 CYSS H     152 CYSS H       5.70 
149 CYSS H     153 ALA  H       5.70 
150 PRO  HA    151 TRP  HA      5.40 
150 PRO  HA    152 CYSS H       5.40 
150 PRO  HA    153 ALA  H       5.40 
150 PRO  HA    153 ALA  QB      4.92 
150 PRO  HA    154 THR  H       5.40 
150 PRO  HB2   153 ALA  QB      6.72 
150 PRO  HB3   153 ALA  QB      6.72 
150 PRO  HG2   151 TRP  H       5.40 
150 PRO  HG3   151 TRP  H       5.40 
150 PRO  QD    152 CYSS H       7.89 
151 TRP  HA    151 TRP  HE1     5.40 
151 TRP  HA    153 ALA  H       5.40 
151 TRP  HA    154 THR  H       5.40 
151 TRP  HA    154 THR  QG2     6.72 
151 TRP  HA    155 ASN  HD21    5.40 
151 TRP  HA    155 ASN  HD22    5.40 
151 TRP  HB2   152 CYSS H       5.40 
151 TRP  HB3   152 CYSS H       5.40 
151 TRP  HD1   152 CYSS H       5.70 
151 TRP  HD1   155 ASN  HD21    5.40 
151 TRP  HD1   155 ASN  HD22    5.40 
151 TRP  HE1   155 ASN  HB2     5.40 
151 TRP  HE1   155 ASN  HB3     5.40 
151 TRP  HE3   152 CYSS H       5.70 
151 TRP  H     151 TRP  HA      2.80 
151 TRP  H     151 TRP  HD1     5.40 
151 TRP  H     152 CYSS HA      5.40 
151 TRP  H     152 CYSS H       4.30 
151 TRP  H     153 ALA  H       5.70 
151 TRP  H     153 ALA  QB      6.72 
151 TRP  H     154 THR  HB      5.40 
151 TRP  H     154 THR  H       5.40 
152 CYSS HB2   153 ALA  HA      5.40 
152 CYSS HB2   153 ALA  H       5.40  
152 CYSS HB3   153 ALA  HA      5.40 
152 CYSS HB3   153 ALA  H       5.40  
152 CYSS H     152 CYSS HB2     3.60 
152 CYSS H     152 CYSS HB3     3.60 
152 CYSS H     153 ALA  HA      5.40 
152 CYSS H     153 ALA  H       4.30 
152 CYSS H     153 ALA  QB      6.72 
152 CYSS H     154 THR  H       5.70 
153 ALA  HA    156 GLN  H       5.40 
153 ALA  H     153 ALA  HA      2.80 
153 ALA  H     154 THR  H       4.30 
153 ALA  H     156 GLN  H       5.70 
153 ALA  QB    154 THR  H       4.92 
154 THR  HA    156 GLN  H       5.40 
154 THR  HB    155 ASN  HD21    5.40 
154 THR  HB    155 ASN  HD22    5.40 
154 THR  H     154 THR  QG2     4.92 
154 THR  H     155 ASN  HA      5.40 
154 THR  H     155 ASN  H       4.30 
154 THR  H     156 GLN  H       4.30 
154 THR  QG2   155 ASN  HD21    6.72 
154 THR  QG2   155 ASN  HD22    6.72 
154 THR  QG2   155 ASN  H       6.72 
154 THR  QG2   156 GLN  H       6.72 
155 ASN  HD21  156 GLN  H       5.70 
155 ASN  HD22  156 GLN  H       5.70 
155 ASN  H     156 GLN  H       4.30 
156 GLN  H     156 GLN  HG2     5.40 
156 GLN  H     156 GLN  HG3     5.40 
104 MET  QG    106 GLU  H       5.25 
106 GLU  H     106 GLU  QB      3.41 
106 GLU  QB    107 PRO  QD      3.46 
106 GLU  QB    109 ARG  H       5.25 
107 PRO  QG    108 GLN  HA      7.29 
108 GLN  H     108 GLN  QB      3.41 
108 GLN  QB    108 GLN  QE2     4.67 
108 GLN  QB    129 SER  H       5.25 
108 GLN  QG    129 SER  H       5.25 
109 ARG  H     109 ARG  QD      5.25 
109 ARG  QB    128 GLU  HA      5.25 
109 ARG  QB    128 GLU  QG      5.10 
109 ARG  QG    128 GLU  HA      5.25 
109 ARG  QD    110 HIS  H       5.25 
109 ARG  QD    126 THR  HB      7.29 
110 HIS  H     127 VAL  QQG     6.61 
110 HIS  HA    110 HIS  QB      2.58 
110 HIS  QB    127 VAL  QQG     7.30 
110 HIS  HD2   127 VAL  QQG     8.79 
111 LYS  H     111 LYS  QB      3.41 
111 LYS  H     112 ILE  QG1     5.25 
111 LYS  HA    111 LYS  QB      2.58 
111 LYS  HA    125 LEU  QB      7.29 
111 LYS  HA    127 VAL  QQG     6.61 
111 LYS  QB    111 LYS  QE      4.45 
111 LYS  QG    126 THR  HB      5.25 
112 ILE  H     112 ILE  QG1     3.55 
112 ILE  H     125 LEU  QQD     6.61 
112 ILE  H     127 VAL  QQG     6.61 
112 ILE  QG2   125 LEU  QQD     8.52 
112 ILE  QG2   137 LEU  QQD     8.52 
112 ILE  QG1   113 LEU  H       5.25 
112 ILE  QG1   125 LEU  QB      6.97 
112 ILE  QG1   126 THR  HA      7.29 
112 ILE  QG1   127 VAL  QQG     7.74 
112 ILE  QG1   134 LEU  HG      7.29 
112 ILE  QG1   134 LEU  QQD     5.89 
112 ILE  QG1   137 LEU  QQD     6.36 
112 ILE  QD1   127 VAL  QQG     6.69 
112 ILE  QD1   137 LEU  QB      6.48 
113 LEU  HA    124 GLU  QB      5.25 
113 LEU  HG    122 ARG  QG      5.25 
113 LEU  QQD   122 ARG  QG      5.77 
113 LEU  QQD   123 ILE  H       6.61 
113 LEU  QQD   124 GLU  H       6.61 
113 LEU  QQD   124 GLU  QB      8.26 
113 LEU  QQD   124 GLU  QG      7.74 
113 LEU  QQD   125 LEU  H       6.61 
114 CYS  H     125 LEU  QQD     6.61 
114 CYS  QB    123 ILE  H       5.25 
115 VAL  QQG   116 CYSM H       4.80 
115 VAL  QQG   116 CYSM HA      6.61 
115 VAL  QQG   116 CYSM QB      8.26 
115 VAL  QQG   120 ASP  HA      6.61 
115 VAL  QQG   121 GLY  H       6.61 
115 VAL  QQG   122 ARG  QG      7.74 
115 VAL  QQG   123 ILE  H       6.61 
115 VAL  QQG   123 ILE  HB      6.61 
115 VAL  QQG   123 ILE  QG2    10.58 
116 CYSM H     123 ILE  QG1     5.25 
116 CYSM QB    118 LYS  QB      6.97 
116 CYSM QB    119 CYSS H       3.55 
116 CYSM QB    120 ASP  HA      5.25 
116 CYSM QB    120 ASP  QB      6.97 
116 CYSM QB    121 GLY  QA      4.68 
116 CYSM QB    122 ARG  HA      7.29 
118 LYS  H     118 LYS  QG      3.55 
118 LYS  H     118 LYS  QD      5.25 
118 LYS  H     118 LYS  QE      5.25 
118 LYS  H     119 CYSS QB      5.25 
118 LYS  HA    118 LYS  QB      2.58 
118 LYS  QB    148 VAL  QQG     7.74 
118 LYS  QG    119 CYSS H       3.55 
118 LYS  QG    149 CYSS H       5.25 
118 LYS  QD    148 VAL  QQG     6.36 
120 ASP  H     121 GLY  QA      5.25 
121 GLY  H     121 GLY  QA      2.56 
121 GLY  QA    122 ARG  QB      5.09 
122 ARG  QB    123 ILE  HA      5.25 
122 ARG  QG    123 ILE  H       5.25 
122 ARG  QG    123 ILE  HB      7.29 
122 ARG  QD    123 ILE  H       5.25 
122 ARG  QD    124 GLU  QG      6.49 
123 ILE  H     123 ILE  QG1     5.25 
123 ILE  QG2   125 LEU  QQD     8.52 
123 ILE  QG1   124 GLU  H       5.25 
123 ILE  QG1   149 CYSS H       5.25 
123 ILE  QD1   147 PHE  QB      4.80 
123 ILE  QD1   148 VAL  QQG     8.52 
124 GLU  QB    125 LEU  HG      7.29 
124 GLU  QG    125 LEU  QB      6.49 
125 LEU  QB    126 THR  HA      5.25 
125 LEU  QB    127 VAL  H       5.25 
125 LEU  QB    127 VAL  QQG     5.89 
125 LEU  QB    147 PHE  QE      9.24 
125 LEU  QQD   127 VAL  QQG     8.30 
125 LEU  QQD   141 PHE  HZ      6.61 
125 LEU  QQD   147 PHE  HZ      6.61 
126 THR  H     127 VAL  QQG     6.61 
126 THR  HA    127 VAL  QQG     6.61 
127 VAL  QQG   128 GLU  H       4.80 
127 VAL  QQG   128 GLU  HA      6.61 
127 VAL  QQG   129 SER  H       6.61 
127 VAL  QQG   134 LEU  QQD     9.42 
127 VAL  QQG   147 PHE  QD     10.77 
127 VAL  QQG   147 PHE  QE     10.77 
128 GLU  H     128 GLU  QB      3.41 
128 GLU  H     129 SER  QB      5.25 
128 GLU  QB    129 SER  QB      6.49 
129 SER  QB    130 SER  H       3.55 
130 SER  QB    131 ALA  QB      6.48 
130 SER  QB    132 GLU  H       3.55 
131 ALA  QB    134 LEU  QQD     8.52 
132 GLU  HA    132 GLU  QG      3.42 
132 GLU  HA    135 ARG  QG      7.29 
132 GLU  QB    134 LEU  H       5.25 
133 ASP  QB    134 LEU  H       3.55 
134 LEU  H     137 LEU  QQD     6.61 
134 LEU  QB    137 LEU  QQD     6.36 
134 LEU  HG    137 LEU  QB      7.29 
134 LEU  HG    138 GLN  QB      5.25 
134 LEU  QQD   135 ARG  HA      6.61 
134 LEU  QQD   137 LEU  QB      8.26 
134 LEU  QQD   137 LEU  HG      6.61 
134 LEU  QQD   138 GLN  H       6.61 
134 LEU  QQD   138 GLN  QB      7.57 
134 LEU  QQD   138 GLN  QG      7.74 
135 ARG  H     135 ARG  QB      3.41 
135 ARG  H     137 LEU  QQD     6.61 
135 ARG  HA    138 GLN  QE2     5.25 
135 ARG  QG    136 THR  HA      7.29 
136 THR  HA    140 LEU  QQD     6.61 
136 THR  HB    137 LEU  QB      5.25 
136 THR  HB    140 LEU  QQD     6.53 
136 THR  QG2   139 GLN  QB      8.49 
137 LEU  H     138 GLN  QB      5.25 
137 LEU  H     140 LEU  QQD     6.61 
137 LEU  HA    140 LEU  QQD     8.69 
137 LEU  HA    145 LEU  QQD     8.69 
137 LEU  QB    138 GLN  HA      7.29 
137 LEU  QB    140 LEU  QB      7.31 
137 LEU  QB    140 LEU  HG      7.29 
137 LEU  QB    140 LEU  QQD     7.57 
137 LEU  QQD   138 GLN  QB      6.36 
137 LEU  QQD   141 PHE  H       6.61 
137 LEU  QQD   141 PHE  QD      8.62 
137 LEU  QQD   141 PHE  QE      8.51 
137 LEU  QQD   141 PHE  HZ      8.79 
137 LEU  QQD   147 PHE  QE     10.68 
138 GLN  H     139 GLN  QG      5.25 
138 GLN  HA    138 GLN  QE2     5.25 
138 GLN  QB    139 GLN  QB      6.97 
138 GLN  QB    139 GLN  QG      6.97 
138 GLN  QG    139 GLN  QB      6.97 
138 GLN  QG    139 GLN  QG      6.97 
139 GLN  H     139 GLN  QG      5.25 
139 GLN  H     139 GLN  QE2     5.53 
139 GLN  H     142 LEU  QQD     6.61 
139 GLN  HA    139 GLN  QG      3.42 
140 LEU  QB    141 PHE  H       3.55 
140 LEU  HG    145 LEU  QQD     8.69 
140 LEU  QQD   143 SER  H       6.61 
140 LEU  QQD   145 LEU  QQD     7.21 
141 PHE  H     141 PHE  QB      3.41 
141 PHE  H     142 LEU  QB      5.25 
141 PHE  H     145 LEU  QB      5.25 
141 PHE  H     145 LEU  QQD     6.61 
141 PHE  HA    145 LEU  QB      3.55 
141 PHE  QB    142 LEU  HA      5.25 
141 PHE  QD    145 LEU  QQD     8.62 
142 LEU  H     142 LEU  QB      3.40 
145 LEU  QQD   146 SER  H       4.80 
145 LEU  QQD   146 SER  HA      6.61 
146 SER  H     146 SER  QB      3.41 
146 SER  QB    147 PHE  HA      5.25 
147 PHE  H     148 VAL  QQG     6.61 
147 PHE  HA    148 VAL  QQG     6.61 
147 PHE  QB    148 VAL  HA      5.25 
147 PHE  QB    148 VAL  QQG     7.74 
148 VAL  QQG   149 CYSS H       4.88 
148 VAL  QQG   152 CYSS H       6.61 
149 CYSS QB    152 CYSS H       5.25 
149 CYSS QB    152 CYSS QB      6.97 
150 PRO  QB    151 TRP  HA      7.29 
150 PRO  QB    154 THR  H       5.25 
150 PRO  QB    154 THR  QG2     8.50 
151 TRP  H     151 TRP  QB      2.71 
151 TRP  QB    153 ALA  H       5.25 
152 CYSS HA    156 GLN  QB      7.29 
152 CYSS HA    156 GLN  QG      7.29 
152 CYSS QB    156 GLN  H       5.25 
155 ASN  H     155 ASN  QB      3.41 
155 ASN  H     155 ASN  QD2     5.53 
155 ASN  QB    156 GLN  H       3.55 
156 GLN  H     156 GLN  QB      3.41 
156 GLN  HA    156 GLN  QG      3.42 
 25 LEU  HB3   147 PHE  HZ      5.80  
 26 THR  HA    148 VAL  HB      5.80  
 26 THR  HB    148 VAL  H       5.80  
 26 THR  HB    148 VAL  HB      5.80  
 26 THR  QG2   148 VAL  HB      6.10  
 27 VAL  HA    147 PHE  HA      5.80  
 27 VAL  HA    148 VAL  H       5.80  
 27 VAL  HA    148 VAL  HA      5.80  
 27 VAL  HA    148 VAL  QG1     6.10  
 27 VAL  HB    137 LEU  QD1     6.10  
 27 VAL  HB    146 SER  H       5.80  
 27 VAL  HB    147 PHE  HA      5.80  
 28 GLU  H     146 SER  HB2     5.80  
 28 GLU  H     148 VAL  HB      5.80  
 28 GLU  HB2   146 SER  HB2     5.80  
 28 GLU  HB2   148 VAL  QG1     6.10  
 28 GLU  HB3   146 SER  HB2     5.80  
 28 GLU  HB3   148 VAL  QG1     6.10  
 28 GLU  HG2   148 VAL  QG1     6.10  
 28 GLU  HG3   148 VAL  QG1     6.10  
 29 SER  HA    144 THR  HB      5.80  
 29 SER  HB2   145 LEU  HA      5.80  
 29 SER  HB2   145 LEU  HG      5.80  
 29 SER  HB3   145 LEU  HA      5.80  
 29 SER  HB3   145 LEU  HG      5.80  
 29 SER  HB3   146 SER  H       5.80  
 37 LEU  HA    137 LEU  HB3     5.80  
 37 LEU  HA    140 LEU  QD2     6.10  
 37 LEU  HB2   137 LEU  QD1     6.10  
 37 LEU  HB2   140 LEU  QD2     6.10  
 37 LEU  HB3   137 LEU  QD1     6.10  
 37 LEU  HB3   140 LEU  QD2     6.10  
 49 CYSS HA    150 PRO  QD      6.10  
125 LEU  HB3    47 PHE  HZ      5.80  
126 THR  HA     48 VAL  HB      5.80  
126 THR  HB     48 VAL  H       5.80  
126 THR  HB     48 VAL  HB      5.80  
126 THR  QG2    48 VAL  HB      6.10  
127 VAL  HA     47 PHE  HA      5.80  
127 VAL  HA     48 VAL  H       5.80  
127 VAL  HA     48 VAL  HA      5.80  
127 VAL  HA     48 VAL  QG1     6.10  
127 VAL  HB     37 LEU  QD1     6.10  
127 VAL  HB     46 SER  H       5.80  
127 VAL  HB     47 PHE  HA      5.80  
128 GLU  H      46 SER  HB2     5.80  
128 GLU  H      48 VAL  HB      5.80  
128 GLU  HB2    46 SER  HB2     5.80  
128 GLU  HB2    48 VAL  QG1     6.10  
128 GLU  HB3    46 SER  HB2     5.80  
128 GLU  HB3    48 VAL  QG1     6.10  
128 GLU  HG2    48 VAL  QG1     6.10  
128 GLU  HG3    48 VAL  QG1     6.10  
129 SER  HA     44 THR  HB      5.80  
129 SER  HB2    45 LEU  HA      5.80  
129 SER  HB2    45 LEU  HG      5.80  
129 SER  HB3    45 LEU  HA      5.80  
129 SER  HB3    45 LEU  HG      5.80  
129 SER  HB3    46 SER  H       5.80  
137 LEU  HA     37 LEU  HB3     5.80  
137 LEU  HA     40 LEU  QD2     6.10  
137 LEU  HB2    37 LEU  QD1     6.10  
137 LEU  HB2    40 LEU  QD2     6.10  
137 LEU  HB3    37 LEU  QD1     6.10  
137 LEU  HB3    40 LEU  QD2     6.10  
149 CYSS HA     50 PRO  QD      6.10  
 10 HIS  H      27 VAL  O       2.00
 12 ILE  H      25 LEU  O       2.00
 14 CYS  H      23 ILE  O       2.00
 16 CYSM H      21 GLY  O       2.00
  8 GLN  O      29 SER  H       2.00
 10 HIS  O      27 VAL  H       2.00
 12 ILE  O      25 LEU  H       2.00
 14 CYS  O      23 ILE  H       2.00
 10 HIS  N      27 VAL  O       3.00
 12 ILE  N      25 LEU  O       3.00
 14 CYS  N      23 ILE  O       3.00
 16 CYSM N      21 GLY  O       3.00
  8 GLN  O      29 SER  N       3.00
 10 HIS  O      27 VAL  N       3.00
 12 ILE  O      25 LEU  N       3.00
 14 CYS  O      23 ILE  N       3.00
 35 ARG  H      31 ALA  O       2.00
 35 ARG  N      31 ALA  O       3.00
 36 THR  H      32 GLU  O       2.00
 36 THR  N      32 GLU  O       3.00
 37 LEU  H      33 ASP  O       2.00
 37 LEU  N      33 ASP  O       3.00
 38 GLN  H      34 LEU  O       2.00
 38 GLN  N      34 LEU  O       3.00
 39 GLN  H      35 ARG  O       2.00
 39 GLN  N      35 ARG  O       3.00
 40 LEU  H      36 THR  O       2.00
 40 LEU  N      36 THR  O       3.00
 41 PHE  H      37 LEU  O       2.00
 41 PHE  N      37 LEU  O       3.00
 42 LEU  H      38 GLN  O       2.00 
 42 LEU  N      38 GLN  O       3.00 
 43 SER  H      39 GLN  O       2.00 
 43 SER  N      39 GLN  O       3.00 
 54 THR  H      50 PRO  O       2.00
 54 THR  N      50 PRO  O       3.00
 55 ASN  H      51 TRP  O       2.00
 55 ASN  N      51 TRP  O       3.00
 56 GLN  H      52 CYSS O       2.00
 56 GLN  N      52 CYSS O       3.00
110 HIS  H     127 VAL  O       2.00
112 ILE  H     125 LEU  O       2.00
114 CYS  H     123 ILE  O       2.00
116 CYSM H     121 GLY  O       2.00
108 GLN  O     129 SER  H       2.00
110 HIS  O     127 VAL  H       2.00
112 ILE  O     125 LEU  H       2.00
114 CYS  O     123 ILE  H       2.00
110 HIS  N     127 VAL  O       3.00
112 ILE  N     125 LEU  O       3.00
114 CYS  N     123 ILE  O       3.00
116 CYSM N     121 GLY  O       3.00
108 GLN  O     129 SER  N       3.00
110 HIS  O     127 VAL  N       3.00
112 ILE  O     125 LEU  N       3.00
114 CYS  O     123 ILE  N       3.00
135 ARG  H     131 ALA  O       2.00
135 ARG  N     131 ALA  O       3.00
136 THR  H     132 GLU  O       2.00
136 THR  N     132 GLU  O       3.00
137 LEU  H     133 ASP  O       2.00
137 LEU  N     133 ASP  O       3.00
138 GLN  H     134 LEU  O       2.00
138 GLN  N     134 LEU  O       3.00
139 GLN  H     135 ARG  O       2.00
139 GLN  N     135 ARG  O       3.00
140 LEU  H     136 THR  O       2.00
140 LEU  N     136 THR  O       3.00
141 PHE  H     137 LEU  O       2.00
141 PHE  N     137 LEU  O       3.00
142 LEU  H     138 GLN  O       2.00 
142 LEU  N     138 GLN  O       3.00 
143 SER  H     139 GLN  O       2.00 
143 SER  N     139 GLN  O       3.00 
154 THR  H     150 PRO  O       2.00
154 THR  N     150 PRO  O       3.00
155 ASN  H     151 TRP  O       2.00
155 ASN  N     151 TRP  O       3.00
156 GLN  H     152 CYSS O       2.00
156 GLN  N     152 CYSS O       3.00
 28 GLU  H     146 SER  O       2.00 
 28 GLU  N     146 SER  O       3.00 
128 GLU  H      46 SER  O       2.00 
128 GLU  N      46 SER  O       3.00 
 16 CYSM ME     19 CYSS SG      2.40  
 16 CYSM ME     49 CYSS SG      2.40  
 16 CYSM ME     52 CYSS SG      2.40  
 16 CYSM SG     19 CYSS SG      3.85  
 16 CYSM SG     49 CYSS SG      3.85  
 16 CYSM SG     52 CYSS SG      3.85  
 19 CYSS SG     49 CYSS SG      3.85  
 19 CYSS SG     52 CYSS SG      3.85  
 49 CYSS SG     52 CYSS SG      3.85  
116 CYSM ME    119 CYSS SG      2.40 
116 CYSM ME    149 CYSS SG      2.40 
116 CYSM ME    152 CYSS SG      2.40 
116 CYSM SG    119 CYSS SG      3.85  
116 CYSM SG    149 CYSS SG      3.85  
116 CYSM SG    152 CYSS SG      3.85  
119 CYSS SG    149 CYSS SG      3.85  
119 CYSS SG    152 CYSS SG      3.85  
149 CYSS SG    152 CYSS SG      3.85  

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLY   1          1H        GLY   1 -25.327  12.663   3.372
    2   1HA   GLY   1          1HA       GLY   1 -27.644  12.333   2.827
    3   2HA   GLY   1          2HA       GLY   1 -27.169  12.352   1.110
    4    H    SER   2           H        SER   2 -28.233  10.069   1.322
    5    HA   SER   2           HA       SER   2 -26.542   7.996   2.476
    6   1HB   SER   2          1HB       SER   2 -29.049   7.799   2.027
    7   2HB   SER   2          2HB       SER   2 -28.650   7.714   0.296
    8    HG   SER   2           HG       SER   2 -28.791   5.640   1.309
    9    H    HIS   3           H        HIS   3 -25.417   6.406   1.066
   10    HA   HIS   3           HA       HIS   3 -24.891   6.921  -1.665
   11   1HB   HIS   3          1HB       HIS   3 -23.257   8.527  -0.441
   12   2HB   HIS   3          2HB       HIS   3 -22.461   7.083   0.179
   13    HD1  HIS   3           1HD      HIS   3 -21.013   5.667  -1.664
   14    HD2  HIS   3           2HD      HIS   3 -23.039   9.104  -3.063
   15    HE1  HIS   3           1HE      HIS   3 -20.083   6.192  -3.994
   16    H    MET   4           H        MET   4 -23.358   5.047  -2.395
   17    HA   MET   4           HA       MET   4 -23.899   2.606  -0.820
   18   1HB   MET   4          1HB       MET   4 -24.113   2.651  -3.319
   19   2HB   MET   4          2HB       MET   4 -22.376   2.976  -3.439
   20   1HG   MET   4          1HG       MET   4 -21.877   0.805  -2.398
   21   2HG   MET   4          2HG       MET   4 -23.591   0.542  -2.067
   22   1HE   MET   4          1HE       MET   4 -20.713   0.593  -4.605
   23   2HE   MET   4          2HE       MET   4 -21.476   0.206  -6.159
   24   3HE   MET   4          3HE       MET   4 -21.718   1.808  -5.427
   25    H    ALA   5           H        ALA   5 -22.119   1.251  -0.057
   26    HA   ALA   5           HA       ALA   5 -19.424   2.146  -0.392
   27   1HB   ALA   5          1HB       ALA   5 -18.834   1.746   1.994
   28   2HB   ALA   5          2HB       ALA   5 -19.932   3.132   1.833
   29   3HB   ALA   5          3HB       ALA   5 -20.555   1.560   2.391
   30    H    GLU   6           H        GLU   6 -17.992   0.191   0.082
   31    HA   GLU   6           HA       GLU   6 -19.381  -2.394   0.016
   32   1HB   GLU   6          1HB       GLU   6 -17.446  -1.324  -2.093
   33   2HB   GLU   6          2HB       GLU   6 -17.869  -3.028  -1.923
   34   1HG   GLU   6          1HG       GLU   6 -20.239  -2.529  -2.381
   35   2HG   GLU   6          2HG       GLU   6 -19.872  -0.805  -2.525
   36    HA   PRO   7           HA       PRO   7 -15.864  -3.175   2.614
   37   1HB   PRO   7          1HB       PRO   7 -15.648  -5.881   2.639
   38   2HB   PRO   7          2HB       PRO   7 -17.102  -5.042   3.245
   39   1HG   PRO   7          1HG       PRO   7 -16.687  -6.236   0.477
   40   2HG   PRO   7          2HG       PRO   7 -18.049  -6.527   1.609
   41   1HD   PRO   7          1HD       PRO   7 -18.200  -4.670  -0.384
   42   2HD   PRO   7          2HD       PRO   7 -18.962  -4.389   1.210
   43    H    GLN   8           H        GLN   8 -14.775  -1.973   0.704
   44    HA   GLN   8           HA       GLN   8 -12.517  -3.606  -0.309
   45   1HB   GLN   8          1HB       GLN   8 -14.557  -2.751  -1.941
   46   2HB   GLN   8          2HB       GLN   8 -13.496  -1.360  -2.048
   47   1HG   GLN   8          1HG       GLN   8 -12.985  -2.886  -3.843
   48   2HG   GLN   8          2HG       GLN   8 -11.623  -2.917  -2.722
   49   1HE2  GLN   8          1HE2      GLN   8 -11.004  -4.921  -1.946
   50   2HE2  GLN   8          2HE2      GLN   8 -11.982  -6.392  -2.026
   51    H    ARG   9           H        ARG   9 -13.412  -0.124  -0.344
   52    HA   ARG   9           HA       ARG   9 -10.882   0.901   0.233
   53   1HB   ARG   9          1HB       ARG   9 -12.930   2.079  -0.662
   54   2HB   ARG   9          2HB       ARG   9 -13.527   2.182   0.981
   55   1HG   ARG   9          1HG       ARG   9 -10.929   3.270   0.279
   56   2HG   ARG   9          2HG       ARG   9 -12.391   4.185  -0.024
   57   1HD   ARG   9          1HD       ARG   9 -12.808   3.667   2.586
   58   2HD   ARG   9          2HD       ARG   9 -11.062   3.531   2.605
   59    HE   ARG   9           HE       ARG   9 -10.854   5.826   2.198
   60   1HH1  ARG   9          1HH1      ARG   9 -14.273   4.865   1.974
   61   2HH1  ARG   9          2HH1      ARG   9 -14.849   6.518   1.857
   62   1HH2  ARG   9          1HH2      ARG   9 -11.731   8.100   2.062
   63   2HH2  ARG   9          2HH2      ARG   9 -13.456   8.233   1.951
   64    H    HIS  10           H        HIS  10  -9.784  -0.225   1.885
   65    HA   HIS  10           HA       HIS  10 -10.848   0.137   4.645
   66   1HB   HIS  10          1HB       HIS  10  -9.259  -2.154   3.448
   67   2HB   HIS  10          2HB       HIS  10  -9.661  -1.952   5.163
   68    HD1  HIS  10           1HD      HIS  10 -10.682  -4.363   3.114
   69    HD2  HIS  10           2HD      HIS  10 -12.798  -0.995   4.302
   70    HE1  HIS  10           1HE      HIS  10 -13.108  -5.040   3.098
   71    H    LYS  11           H        LYS  11  -8.987   0.070   6.318
   72    HA   LYS  11           HA       LYS  11  -6.940   1.951   5.295
   73   1HB   LYS  11          1HB       LYS  11  -9.058   2.404   7.439
   74   2HB   LYS  11          2HB       LYS  11  -7.656   3.450   7.124
   75   1HG   LYS  11          1HG       LYS  11  -8.414   3.663   4.756
   76   2HG   LYS  11          2HG       LYS  11  -9.866   2.750   5.106
   77   1HD   LYS  11          1HD       LYS  11 -10.081   5.240   4.925
   78   2HD   LYS  11          2HD       LYS  11 -10.847   4.466   6.323
   79   1HE   LYS  11          1HE       LYS  11  -9.312   5.292   7.834
   80   2HE   LYS  11          2HE       LYS  11  -8.041   5.452   6.622
   81   1HZ   LYS  11          1HZ       LYS  11  -9.106   7.571   7.469
   82   2HZ   LYS  11          2HZ       LYS  11 -10.391   7.213   6.486
   83   3HZ   LYS  11          3HZ       LYS  11  -8.848   7.431   5.880
   84    H    ILE  12           H        ILE  12  -5.209   0.720   5.691
   85    HA   ILE  12           HA       ILE  12  -4.770  -0.362   8.423
   86    HB   ILE  12           HB       ILE  12  -2.894  -0.400   6.033
   87   1HG1  ILE  12          1HG1      ILE  12  -4.641  -2.691   7.008
   88   2HG1  ILE  12          2HG1      ILE  12  -4.997  -1.692   5.593
   89   1HG2  ILE  12          1HG2      ILE  12  -2.856  -1.863   8.706
   90   2HG2  ILE  12          2HG2      ILE  12  -1.655  -2.045   7.405
   91   3HG2  ILE  12          3HG2      ILE  12  -1.807  -0.510   8.251
   92   1HD1  ILE  12          1HD1      ILE  12  -2.780  -2.298   4.618
   93   2HD1  ILE  12          2HD1      ILE  12  -2.628  -3.526   5.911
   94   3HD1  ILE  12          3HD1      ILE  12  -3.954  -3.607   4.737
   95    H    LEU  13           H        LEU  13  -4.674   1.531   9.644
   96    HA   LEU  13           HA       LEU  13  -3.073   3.760   8.788
   97   1HB   LEU  13          1HB       LEU  13  -5.128   3.885  10.258
   98   2HB   LEU  13          2HB       LEU  13  -4.136   3.292  11.587
   99    HG   LEU  13           HG       LEU  13  -2.778   5.479  10.104
  100   1HD1  LEU  13          1HD1      LEU  13  -5.051   6.167   9.577
  101   2HD1  LEU  13          2HD1      LEU  13  -4.292   7.291  10.722
  102   3HD1  LEU  13          3HD1      LEU  13  -5.490   6.104  11.301
  103   1HD2  LEU  13          1HD2      LEU  13  -3.664   5.168  12.990
  104   2HD2  LEU  13          2HD2      LEU  13  -2.654   6.483  12.367
  105   3HD2  LEU  13          3HD2      LEU  13  -2.058   4.812  12.306
  106    H    CYS  14           H        CYS  14  -0.976   3.372   8.562
  107    HA   CYS  14           HA       CYS  14   0.463   1.642  10.524
  108   1HB   CYS  14          1HB       CYS  14   0.047   0.896   8.035
  109   2HB   CYS  14          2HB       CYS  14   1.289   2.094   7.640
  110    HG   CYS  14           HG       CYS  14   1.412  -0.551   9.640
  111    H    VAL  15           H        VAL  15   3.057   2.246   9.669
  112    HA   VAL  15           HA       VAL  15   3.337   5.160   9.843
  113    HB   VAL  15           HB       VAL  15   5.333   4.889  11.305
  114   1HG1  VAL  15          1HG1      VAL  15   4.093   4.749  13.402
  115   2HG1  VAL  15          2HG1      VAL  15   3.202   5.696  12.209
  116   3HG1  VAL  15          3HG1      VAL  15   2.698   4.027  12.570
  117   1HG2  VAL  15          1HG2      VAL  15   4.253   2.092  11.891
  118   2HG2  VAL  15          2HG2      VAL  15   5.737   2.450  10.975
  119   3HG2  VAL  15          3HG2      VAL  15   5.622   2.905  12.678
  120    H    CYS  16           H        CYS  16   5.255   5.917   8.950
  121    HA   CYS  16           HA       CYS  16   6.113   4.421   6.603
  122   1HB   CYS  16          1HB       CYS  16   5.632   6.978   6.770
  123   2HB   CYS  16          2HB       CYS  16   7.149   7.091   7.689
  124    H    CYS  17           H        CYS  17   8.046   3.375   6.393
  125    HA   CYS  17           HA       CYS  17   9.420   2.697   8.814
  126   1HB   CYS  17          1HB       CYS  17   9.025   1.367   6.623
  127   2HB   CYS  17          2HB       CYS  17  10.537   2.088   6.062
  128    HG   CYS  17           HG       CYS  17  10.630  -0.435   6.990
  129    H    LYS  18           H        LYS  18  10.238   5.172   6.309
  130    HA   LYS  18           HA       LYS  18  12.992   5.259   7.326
  131   1HB   LYS  18          1HB       LYS  18  13.480   6.518   5.357
  132   2HB   LYS  18          2HB       LYS  18  12.478   5.147   4.902
  133   1HG   LYS  18          1HG       LYS  18  11.386   6.759   3.698
  134   2HG   LYS  18          2HG       LYS  18  10.483   6.895   5.192
  135   1HD   LYS  18          1HD       LYS  18  10.947   9.098   5.009
  136   2HD   LYS  18          2HD       LYS  18  12.495   8.684   5.729
  137   1HE   LYS  18          1HE       LYS  18  13.435   8.368   3.438
  138   2HE   LYS  18          2HE       LYS  18  11.900   8.960   2.770
  139   1HZ   LYS  18          1HZ       LYS  18  13.557  10.756   2.984
  140   2HZ   LYS  18          2HZ       LYS  18  13.693  10.481   4.579
  141   3HZ   LYS  18          3HZ       LYS  18  12.276  11.048   3.949
  142    H    CYS  19           H        CYS  19   9.956   7.009   7.762
  143    HA   CYS  19           HA       CYS  19  11.438   9.152   9.160
  144   1HB   CYS  19          1HB       CYS  19   9.688  10.635   8.315
  145   2HB   CYS  19          2HB       CYS  19  10.774   9.998   7.091
  146    H    ASP  20           H        ASP  20   9.358   6.573   9.760
  147    HA   ASP  20           HA       ASP  20   7.877   6.029  11.260
  148   1HB   ASP  20          1HB       ASP  20   9.932   6.429  12.617
  149   2HB   ASP  20          2HB       ASP  20   9.262   7.995  13.084
  150    H    GLY  21           H        GLY  21   7.066   8.160   9.485
  151   1HA   GLY  21          1HA       GLY  21   5.287   9.890  11.124
  152   2HA   GLY  21          2HA       GLY  21   5.398   9.934   9.363
  153    H    ARG  22           H        ARG  22   3.054   9.713  11.028
  154    HA   ARG  22           HA       ARG  22   1.963   7.025  10.866
  155   1HB   ARG  22          1HB       ARG  22   1.171   8.609  12.528
  156   2HB   ARG  22          2HB       ARG  22   0.715   9.790  11.298
  157   1HG   ARG  22          1HG       ARG  22  -0.491   7.010  11.297
  158   2HG   ARG  22          2HG       ARG  22  -1.084   8.228  12.423
  159   1HD   ARG  22          1HD       ARG  22  -0.869   9.221   9.627
  160   2HD   ARG  22          2HD       ARG  22  -1.958   7.856   9.826
  161    HE   ARG  22           HE       ARG  22  -2.469   9.750  11.872
  162   1HH1  ARG  22          1HH1      ARG  22  -2.826   9.458   8.381
  163   2HH1  ARG  22          2HH1      ARG  22  -4.124  10.594   8.235
  164   1HH2  ARG  22          1HH2      ARG  22  -4.208  11.277  11.732
  165   2HH2  ARG  22          2HH2      ARG  22  -4.922  11.648  10.208
  166    H    ILE  23           H        ILE  23   0.921   6.085   9.122
  167    HA   ILE  23           HA       ILE  23   0.209   7.873   6.862
  168    HB   ILE  23           HB       ILE  23   1.088   5.026   6.385
  169   1HG1  ILE  23          1HG1      ILE  23   2.978   7.388   6.066
  170   2HG1  ILE  23          2HG1      ILE  23   3.096   6.160   7.330
  171   1HG2  ILE  23          1HG2      ILE  23   1.177   5.938   4.041
  172   2HG2  ILE  23          2HG2      ILE  23  -0.359   6.353   4.762
  173   3HG2  ILE  23          3HG2      ILE  23   0.913   7.576   4.665
  174   1HD1  ILE  23          1HD1      ILE  23   3.227   5.520   4.355
  175   2HD1  ILE  23          2HD1      ILE  23   4.596   5.635   5.418
  176   3HD1  ILE  23          3HD1      ILE  23   3.391   4.371   5.703
  177    H    GLU  24           H        GLU  24  -1.893   7.727   6.412
  178    HA   GLU  24           HA       GLU  24  -3.565   5.491   7.368
  179   1HB   GLU  24          1HB       GLU  24  -4.486   7.794   7.367
  180   2HB   GLU  24          2HB       GLU  24  -4.143   7.944   5.645
  181   1HG   GLU  24          1HG       GLU  24  -5.649   5.517   5.948
  182   2HG   GLU  24          2HG       GLU  24  -6.392   6.688   7.021
  183    H    LEU  25           H        LEU  25  -2.934   3.571   6.209
  184    HA   LEU  25           HA       LEU  25  -2.443   3.875   3.316
  185   1HB   LEU  25          1HB       LEU  25  -2.500   1.267   4.811
  186   2HB   LEU  25          2HB       LEU  25  -1.799   1.626   3.257
  187    HG   LEU  25           HG       LEU  25  -0.767   2.636   5.958
  188   1HD1  LEU  25          1HD1      LEU  25   0.195   0.460   4.059
  189   2HD1  LEU  25          2HD1      LEU  25  -0.491   0.215   5.680
  190   3HD1  LEU  25          3HD1      LEU  25   1.077   1.018   5.503
  191   1HD2  LEU  25          1HD2      LEU  25  -0.264   4.151   4.035
  192   2HD2  LEU  25          2HD2      LEU  25   0.394   2.795   3.123
  193   3HD2  LEU  25          3HD2      LEU  25   1.208   3.344   4.610
  194    H    THR  26           H        THR  26  -4.610   4.637   2.759
  195    HA   THR  26           HA       THR  26  -6.760   2.736   3.133
  196    HB   THR  26           HB       THR  26  -6.646   5.050   1.203
  197    HG1  THR  26           1HG      THR  26  -6.856   5.874   3.293
  198   1HG2  THR  26          1HG2      THR  26  -8.893   3.186   2.138
  199   2HG2  THR  26          2HG2      THR  26  -8.248   3.252   0.490
  200   3HG2  THR  26          3HG2      THR  26  -9.115   4.652   1.159
  201    H    VAL  27           H        VAL  27  -6.504   0.748   2.339
  202    HA   VAL  27           HA       VAL  27  -5.445   0.402  -0.410
  203    HB   VAL  27           HB       VAL  27  -4.387  -1.770   0.191
  204   1HG1  VAL  27          1HG1      VAL  27  -3.217   0.436   0.700
  205   2HG1  VAL  27          2HG1      VAL  27  -3.596   0.163   2.401
  206   3HG1  VAL  27          3HG1      VAL  27  -2.602  -1.017   1.519
  207   1HG2  VAL  27          1HG2      VAL  27  -5.465  -1.240   3.037
  208   2HG2  VAL  27          2HG2      VAL  27  -5.997  -2.538   1.956
  209   3HG2  VAL  27          3HG2      VAL  27  -4.341  -2.533   2.567
  210    H    GLU  28           H        GLU  28  -6.895  -0.597  -1.759
  211    HA   GLU  28           HA       GLU  28  -9.624  -0.678  -0.602
  212   1HB   GLU  28          1HB       GLU  28  -8.630   0.876  -2.555
  213   2HB   GLU  28          2HB       GLU  28  -8.963  -0.540  -3.502
  214   1HG   GLU  28          1HG       GLU  28 -11.349  -0.363  -2.324
  215   2HG   GLU  28          2HG       GLU  28 -10.823   1.268  -1.975
  216    H    SER  29           H        SER  29  -9.416  -2.752   0.354
  217    HA   SER  29           HA       SER  29  -8.697  -5.026  -1.382
  218   1HB   SER  29          1HB       SER  29  -7.494  -4.201   1.283
  219   2HB   SER  29          2HB       SER  29  -7.028  -5.565   0.295
  220    HG   SER  29           HG       SER  29  -6.706  -3.595  -1.303
  221    H    SER  30           H        SER  30  -9.869  -6.828  -0.814
  222    HA   SER  30           HA       SER  30 -12.124  -6.604   0.865
  223   1HB   SER  30          1HB       SER  30 -10.689  -9.165   0.047
  224   2HB   SER  30          2HB       SER  30 -12.399  -8.980   0.462
  225    HG   SER  30           HG       SER  30 -12.129  -8.971  -1.802
  226    H    ALA  31           H        ALA  31 -12.513  -7.435   3.031
  227    HA   ALA  31           HA       ALA  31 -10.618  -6.620   4.774
  228   1HB   ALA  31          1HB       ALA  31 -12.718  -8.774   5.329
  229   2HB   ALA  31          2HB       ALA  31 -11.907  -7.782   6.557
  230   3HB   ALA  31          3HB       ALA  31 -12.992  -7.012   5.379
  231    H    GLU  32           H        GLU  32 -10.853 -10.037   3.683
  232    HA   GLU  32           HA       GLU  32  -8.736 -10.634   5.554
  233   1HB   GLU  32          1HB       GLU  32 -10.975 -11.995   5.051
  234   2HB   GLU  32          2HB       GLU  32  -9.851 -12.842   3.953
  235   1HG   GLU  32          1HG       GLU  32  -8.255 -13.123   5.840
  236   2HG   GLU  32          2HG       GLU  32  -9.307 -12.182   6.887
  237    H    ASP  33           H        ASP  33  -9.012  -9.842   2.291
  238    HA   ASP  33           HA       ASP  33  -6.516 -11.005   1.432
  239   1HB   ASP  33          1HB       ASP  33  -8.463 -10.398  -0.077
  240   2HB   ASP  33          2HB       ASP  33  -8.089  -8.699   0.240
  241    H    LEU  34           H        LEU  34  -7.866  -8.045   2.815
  242    HA   LEU  34           HA       LEU  34  -5.457  -6.461   3.017
  243   1HB   LEU  34          1HB       LEU  34  -7.471  -5.339   3.245
  244   2HB   LEU  34          2HB       LEU  34  -8.115  -6.413   4.452
  245    HG   LEU  34           HG       LEU  34  -5.586  -4.921   5.162
  246   1HD1  LEU  34          1HD1      LEU  34  -7.002  -3.198   4.101
  247   2HD1  LEU  34          2HD1      LEU  34  -6.985  -2.956   5.857
  248   3HD1  LEU  34          3HD1      LEU  34  -8.380  -3.740   5.087
  249   1HD2  LEU  34          1HD2      LEU  34  -8.111  -5.604   6.749
  250   2HD2  LEU  34          2HD2      LEU  34  -6.683  -4.757   7.384
  251   3HD2  LEU  34          3HD2      LEU  34  -6.551  -6.433   6.879
  252    H    ARG  35           H        ARG  35  -7.048  -8.630   5.124
  253    HA   ARG  35           HA       ARG  35  -5.221  -8.721   7.320
  254   1HB   ARG  35          1HB       ARG  35  -7.476  -9.868   7.302
  255   2HB   ARG  35          2HB       ARG  35  -6.754 -11.153   6.333
  256   1HG   ARG  35          1HG       ARG  35  -5.138 -11.609   8.184
  257   2HG   ARG  35          2HG       ARG  35  -6.012 -10.420   9.175
  258   1HD   ARG  35          1HD       ARG  35  -8.098 -11.785   8.889
  259   2HD   ARG  35          2HD       ARG  35  -7.166 -12.975   7.945
  260    HE   ARG  35           HE       ARG  35  -5.903 -12.514  10.442
  261   1HH1  ARG  35          1HH1      ARG  35  -8.700 -14.398   9.059
  262   2HH1  ARG  35          2HH1      ARG  35  -8.828 -15.367  10.461
  263   1HH2  ARG  35          1HH2      ARG  35  -6.096 -13.960  12.214
  264   2HH2  ARG  35          2HH2      ARG  35  -7.315 -15.183  12.211
  265    H    THR  36           H        THR  36  -5.366 -10.838   4.455
  266    HA   THR  36           HA       THR  36  -3.013 -12.320   4.880
  267    HB   THR  36           HB       THR  36  -4.277 -11.477   2.240
  268    HG1  THR  36           1HG      THR  36  -5.770 -12.547   3.506
  269   1HG2  THR  36          1HG2      THR  36  -2.436 -13.815   2.898
  270   2HG2  THR  36          2HG2      THR  36  -2.033 -12.419   1.866
  271   3HG2  THR  36          3HG2      THR  36  -3.291 -13.558   1.360
  272    H    LEU  37           H        LEU  37  -3.362  -9.272   2.918
  273    HA   LEU  37           HA       LEU  37  -0.578  -9.087   2.501
  274   1HB   LEU  37          1HB       LEU  37  -1.029  -7.433   1.141
  275   2HB   LEU  37          2HB       LEU  37  -2.663  -7.961   1.356
  276    HG   LEU  37           HG       LEU  37  -2.550  -6.102   3.372
  277   1HD1  LEU  37          1HD1      LEU  37  -0.159  -5.457   2.811
  278   2HD1  LEU  37          2HD1      LEU  37  -1.268  -4.114   2.485
  279   3HD1  LEU  37          3HD1      LEU  37  -0.643  -5.093   1.169
  280   1HD2  LEU  37          1HD2      LEU  37  -3.794  -4.667   1.931
  281   2HD2  LEU  37          2HD2      LEU  37  -4.168  -6.322   1.410
  282   3HD2  LEU  37          3HD2      LEU  37  -3.040  -5.349   0.477
  283    H    GLN  38           H        GLN  38  -2.583  -8.023   5.249
  284    HA   GLN  38           HA       GLN  38  -0.530  -6.508   6.531
  285   1HB   GLN  38          1HB       GLN  38  -2.912  -6.208   6.893
  286   2HB   GLN  38          2HB       GLN  38  -3.020  -7.793   7.668
  287   1HG   GLN  38          1HG       GLN  38  -1.682  -7.051   9.532
  288   2HG   GLN  38          2HG       GLN  38  -1.201  -5.577   8.674
  289   1HE2  GLN  38          1HE2      GLN  38  -4.346  -7.267   9.464
  290   2HE2  GLN  38          2HE2      GLN  38  -5.145  -5.763   9.898
  291    H    GLN  39           H        GLN  39  -1.224 -10.027   6.312
  292    HA   GLN  39           HA       GLN  39   0.611 -10.716   8.409
  293   1HB   GLN  39          1HB       GLN  39  -0.044 -12.489   6.065
  294   2HB   GLN  39          2HB       GLN  39   0.618 -12.913   7.631
  295   1HG   GLN  39          1HG       GLN  39  -2.197 -12.146   6.943
  296   2HG   GLN  39          2HG       GLN  39  -1.610 -13.613   7.689
  297   1HE2  GLN  39          1HE2      GLN  39  -2.833 -10.457   8.231
  298   2HE2  GLN  39          2HE2      GLN  39  -2.773 -10.492  10.008
  299    H    LEU  40           H        LEU  40   0.824 -10.114   4.856
  300    HA   LEU  40           HA       LEU  40   3.637 -10.623   4.664
  301   1HB   LEU  40          1HB       LEU  40   2.226  -8.503   3.038
  302   2HB   LEU  40          2HB       LEU  40   3.667  -9.391   2.654
  303    HG   LEU  40           HG       LEU  40   0.872 -10.560   2.797
  304   1HD1  LEU  40          1HD1      LEU  40   1.239  -9.050   0.886
  305   2HD1  LEU  40          2HD1      LEU  40   1.030 -10.729   0.359
  306   3HD1  LEU  40          3HD1      LEU  40   2.658 -10.007   0.405
  307   1HD2  LEU  40          1HD2      LEU  40   1.722 -12.594   1.816
  308   2HD2  LEU  40          2HD2      LEU  40   2.521 -12.296   3.368
  309   3HD2  LEU  40          3HD2      LEU  40   3.379 -11.961   1.847
  310    H    PHE  41           H        PHE  41   1.877  -7.726   5.799
  311    HA   PHE  41           HA       PHE  41   4.209  -6.058   6.257
  312   1HB   PHE  41          1HB       PHE  41   1.425  -6.078   7.402
  313   2HB   PHE  41          2HB       PHE  41   2.676  -5.242   8.268
  314    HD1  PHE  41           1HD      PHE  41   3.669  -3.193   7.487
  315    HD2  PHE  41           2HD      PHE  41   0.621  -5.205   5.193
  316    HE1  PHE  41           1HE      PHE  41   3.326  -1.143   6.139
  317    HE2  PHE  41           2HE      PHE  41   0.275  -3.143   3.863
  318    HZ   PHE  41           HZ       PHE  41   1.672  -1.152   4.280
  319    H    LEU  42           H        LEU  42   2.420  -8.243   8.433
  320    HA   LEU  42           HA       LEU  42   4.208  -8.018  10.621
  321   1HB   LEU  42          1HB       LEU  42   2.209 -10.096   9.707
  322   2HB   LEU  42          2HB       LEU  42   3.091 -10.299  11.212
  323    HG   LEU  42           HG       LEU  42   1.431  -7.805  10.635
  324   1HD1  LEU  42          1HD1      LEU  42  -0.048  -9.759  10.507
  325   2HD1  LEU  42          2HD1      LEU  42  -0.365  -8.830  11.977
  326   3HD1  LEU  42          3HD1      LEU  42   0.558 -10.350  12.067
  327   1HD2  LEU  42          1HD2      LEU  42   1.429  -7.573  13.095
  328   2HD2  LEU  42          2HD2      LEU  42   3.075  -7.555  12.459
  329   3HD2  LEU  42          3HD2      LEU  42   2.449  -9.022  13.241
  330    H    SER  43           H        SER  43   4.403 -10.091   7.771
  331    HA   SER  43           HA       SER  43   6.627 -11.685   8.590
  332   1HB   SER  43          1HB       SER  43   5.110 -12.223   6.701
  333   2HB   SER  43          2HB       SER  43   5.695 -10.818   5.816
  334    HG   SER  43           HG       SER  43   7.066 -12.167   5.062
  335    H    THR  44           H        THR  44   6.586  -8.906   6.260
  336    HA   THR  44           HA       THR  44   9.165  -8.024   7.229
  337    HB   THR  44           HB       THR  44  10.020  -8.031   4.801
  338    HG1  THR  44           1HG      THR  44   8.368  -8.541   3.502
  339   1HG2  THR  44          1HG2      THR  44  10.817  -9.653   6.514
  340   2HG2  THR  44          2HG2      THR  44  10.826 -10.295   4.855
  341   3HG2  THR  44          3HG2      THR  44   9.550 -10.787   5.986
  342    H    LEU  45           H        LEU  45   6.322  -7.417   5.235
  343    HA   LEU  45           HA       LEU  45   7.471  -5.281   3.861
  344   1HB   LEU  45          1HB       LEU  45   5.612  -6.684   3.102
  345   2HB   LEU  45          2HB       LEU  45   4.514  -5.925   4.219
  346    HG   LEU  45           HG       LEU  45   5.986  -4.100   2.331
  347   1HD1  LEU  45          1HD1      LEU  45   5.299  -6.005   0.871
  348   2HD1  LEU  45          2HD1      LEU  45   4.372  -4.537   0.536
  349   3HD1  LEU  45          3HD1      LEU  45   3.651  -5.866   1.485
  350   1HD2  LEU  45          1HD2      LEU  45   3.069  -4.243   3.207
  351   2HD2  LEU  45          2HD2      LEU  45   3.850  -2.907   2.329
  352   3HD2  LEU  45          3HD2      LEU  45   4.302  -3.255   4.000
  353    H    SER  46           H        SER  46   7.599  -3.051   4.147
  354    HA   SER  46           HA       SER  46   5.740  -1.862   6.109
  355   1HB   SER  46          1HB       SER  46   7.380  -0.049   6.492
  356   2HB   SER  46          2HB       SER  46   7.849  -1.622   7.139
  357    HG   SER  46           HG       SER  46   9.020  -0.127   4.983
  358    H    PHE  47           H        PHE  47   5.566   0.597   5.455
  359    HA   PHE  47           HA       PHE  47   5.188   0.766   2.525
  360   1HB   PHE  47          1HB       PHE  47   3.024   0.683   4.056
  361   2HB   PHE  47          2HB       PHE  47   3.472   2.314   4.474
  362    HD1  PHE  47           1HD      PHE  47   2.168   0.111   1.832
  363    HD2  PHE  47           2HD      PHE  47   3.547   4.106   2.679
  364    HE1  PHE  47           1HE      PHE  47   1.208   0.914  -0.306
  365    HE2  PHE  47           2HE      PHE  47   2.610   4.890   0.532
  366    HZ   PHE  47           HZ       PHE  47   1.430   3.295  -0.970
  367    H    VAL  48           H        VAL  48   5.723   2.839   1.706
  368    HA   VAL  48           HA       VAL  48   6.877   4.649   3.625
  369    HB   VAL  48           HB       VAL  48   8.375   2.885   2.239
  370   1HG1  VAL  48          1HG1      VAL  48   8.043   3.893   0.153
  371   2HG1  VAL  48          2HG1      VAL  48   8.885   5.375   0.719
  372   3HG1  VAL  48          3HG1      VAL  48   9.742   3.800   0.657
  373   1HG2  VAL  48          1HG2      VAL  48   9.105   4.049   4.230
  374   2HG2  VAL  48          2HG2      VAL  48  10.340   4.177   2.973
  375   3HG2  VAL  48          3HG2      VAL  48   9.295   5.558   3.308
  376    H    CYS  49           H        CYS  49   5.823   6.497   3.509
  377    HA   CYS  49           HA       CYS  49   3.620   6.794   1.785
  378   1HB   CYS  49          1HB       CYS  49   3.610   9.154   2.774
  379   2HB   CYS  49          2HB       CYS  49   3.479   7.802   3.874
  380    HA   PRO  50           HA       PRO  50   5.371   8.280  -1.878
  381   1HB   PRO  50          1HB       PRO  50   3.429   9.929  -2.975
  382   2HB   PRO  50          2HB       PRO  50   3.385   8.140  -2.961
  383   1HG   PRO  50          1HG       PRO  50   2.064  10.052  -1.012
  384   2HG   PRO  50          2HG       PRO  50   1.344   8.627  -1.830
  385   1HD   PRO  50          1HD       PRO  50   2.239   8.441   0.700
  386   2HD   PRO  50          2HD       PRO  50   2.549   7.117  -0.460
  387    H    TRP  51           H        TRP  51   4.282  10.728   0.414
  388    HA   TRP  51           HA       TRP  51   5.690  12.996  -0.613
  389   1HB   TRP  51          1HB       TRP  51   4.202  13.529   1.110
  390   2HB   TRP  51          2HB       TRP  51   4.652  12.130   2.079
  391    HD1  TRP  51           HD       TRP  51   7.044  14.869   0.785
  392    HE1  TRP  51           1HE      TRP  51   8.517  15.619   2.688
  393    HE3  TRP  51           3HE      TRP  51   4.678  12.403   4.606
  394    HZ2  TRP  51           2HZ      TRP  51   8.547  15.374   5.605
  395    HZ3  TRP  51           3HZ      TRP  51   5.463  12.678   6.937
  396    HH2  TRP  51           HH       TRP  51   7.394  14.154   7.449
  397    H    CYS  52           H        CYS  52   6.675  10.610   1.952
  398    HA   CYS  52           HA       CYS  52   9.301  11.725   2.075
  399   1HB   CYS  52          1HB       CYS  52   9.754  10.194   3.679
  400   2HB   CYS  52          2HB       CYS  52   8.012  10.238   3.800
  401    H    ALA  53           H        ALA  53   7.837   9.076   0.205
  402    HA   ALA  53           HA       ALA  53  10.246   7.955  -0.659
  403   1HB   ALA  53          1HB       ALA  53   7.998   6.864  -0.885
  404   2HB   ALA  53          2HB       ALA  53   7.577   8.037  -2.151
  405   3HB   ALA  53          3HB       ALA  53   8.884   6.878  -2.426
  406    H    THR  54           H        THR  54   8.287  10.639  -1.959
  407    HA   THR  54           HA       THR  54   9.884  11.102  -4.317
  408    HB   THR  54           HB       THR  54   8.014  13.000  -2.826
  409    HG1  THR  54           1HG      THR  54   6.823  11.240  -3.337
  410   1HG2  THR  54          1HG2      THR  54   7.685  14.028  -5.054
  411   2HG2  THR  54          2HG2      THR  54   8.902  12.933  -5.745
  412   3HG2  THR  54          3HG2      THR  54   9.376  14.156  -4.543
  413    H    ASN  55           H        ASN  55   9.870  12.445  -0.981
  414    HA   ASN  55           HA       ASN  55  11.918  14.447  -1.474
  415   1HB   ASN  55          1HB       ASN  55  10.936  13.080   1.080
  416   2HB   ASN  55          2HB       ASN  55  12.198  14.303   1.066
  417   1HD2  ASN  55          1HD2      ASN  55   9.671  14.777  -1.293
  418   2HD2  ASN  55          2HD2      ASN  55   8.891  16.085  -0.422
  419    H    GLN  56           H        GLN  56  11.959  11.187  -0.286
  420    HA   GLN  56           HA       GLN  56  13.467   9.755   0.471
  421   1HB   GLN  56          2HB       GLN  56  13.835   9.627  -2.056
  422   2HB   GLN  56          3HB       GLN  56  15.285  10.607  -1.790
  423   1HG   GLN  56          2HG       GLN  56  15.884   8.756   0.020
  424   2HG   GLN  56          3HG       GLN  56  14.625   7.810  -0.763
  425   1HE2  GLN  56          1HE2      GLN  56  17.465   9.833  -1.626
  426   2HE2  GLN  56          2HE2      GLN  56  18.104   8.737  -2.856
  427   1H    GLY   1          1H        GLY   1  18.150  -2.002   9.234
  428   1HA   GLY   1          1HA       GLY   1  18.727  -4.226  10.126
  429   2HA   GLY   1          2HA       GLY   1  19.551  -4.490   8.567
  430    H    SER   2           H        SER   2  21.714  -4.077   8.686
  431    HA   SER   2           HA       SER   2  22.541  -1.494   9.732
  432   1HB   SER   2          1HB       SER   2  24.766  -2.469  10.314
  433   2HB   SER   2          2HB       SER   2  23.461  -3.012  11.379
  434    HG   SER   2           HG       SER   2  24.784  -4.746  10.716
  435    H    HIS   3           H        HIS   3  24.685  -1.001   8.425
  436    HA   HIS   3           HA       HIS   3  25.298  -0.253   6.406
  437   1HB   HIS   3          1HB       HIS   3  25.782  -2.735   5.951
  438   2HB   HIS   3          2HB       HIS   3  24.256  -2.775   5.074
  439    HD1  HIS   3           1HD      HIS   3  27.456  -0.528   4.948
  440    HD2  HIS   3           2HD      HIS   3  24.610  -2.477   2.520
  441    HE1  HIS   3           1HE      HIS   3  28.134  -0.099   2.523
  442    H    MET   4           H        MET   4  23.589  -0.677   3.867
  443    HA   MET   4           HA       MET   4  20.954   0.177   4.587
  444   1HB   MET   4          1HB       MET   4  22.460   2.265   4.844
  445   2HB   MET   4          2HB       MET   4  22.721   2.186   3.102
  446   1HG   MET   4          1HG       MET   4  20.361   2.630   2.699
  447   2HG   MET   4          2HG       MET   4  19.973   2.348   4.400
  448   1HE   MET   4          1HE       MET   4  23.005   4.555   2.922
  449   2HE   MET   4          2HE       MET   4  21.652   4.727   1.775
  450   3HE   MET   4          3HE       MET   4  22.158   6.108   2.774
  451    H    ALA   5           H        ALA   5  19.988   0.927   2.230
  452    HA   ALA   5           HA       ALA   5  19.381   0.384   0.141
  453   1HB   ALA   5          1HB       ALA   5  21.080  -0.029  -1.552
  454   2HB   ALA   5          2HB       ALA   5  21.597   1.277  -0.461
  455   3HB   ALA   5          3HB       ALA   5  22.295  -0.353  -0.306
  456    H    GLU   6           H        GLU   6  18.375  -1.322   1.720
  457    HA   GLU   6           HA       GLU   6  19.314  -4.038   1.182
  458   1HB   GLU   6          1HB       GLU   6  17.275  -2.868   3.105
  459   2HB   GLU   6          2HB       GLU   6  17.751  -4.574   3.061
  460   1HG   GLU   6          1HG       GLU   6  19.855  -4.193   3.954
  461   2HG   GLU   6          2HG       GLU   6  19.983  -2.562   3.346
  462    HA   PRO   7           HA       PRO   7  16.382  -4.600  -1.998
  463   1HB   PRO   7          1HB       PRO   7  16.265  -7.285  -2.276
  464   2HB   PRO   7          2HB       PRO   7  17.801  -6.389  -2.429
  465   1HG   PRO   7          1HG       PRO   7  16.739  -7.795   0.050
  466   2HG   PRO   7          2HG       PRO   7  18.343  -8.001  -0.730
  467   1HD   PRO   7          1HD       PRO   7  17.961  -6.296   1.368
  468   2HD   PRO   7          2HD       PRO   7  19.089  -5.905   0.034
  469    H    GLN   8           H        GLN   8  14.915  -3.601  -0.153
  470    HA   GLN   8           HA       GLN   8  12.412  -5.207  -0.114
  471   1HB   GLN   8          1HB       GLN   8  13.727  -3.673   2.149
  472   2HB   GLN   8          2HB       GLN   8  11.982  -3.876   2.083
  473   1HG   GLN   8          1HG       GLN   8  12.848  -5.592   3.489
  474   2HG   GLN   8          2HG       GLN   8  12.226  -6.335   2.027
  475   1HE2  GLN   8          1HE2      GLN   8  13.509  -8.229   1.684
  476   2HE2  GLN   8          2HE2      GLN   8  15.257  -8.108   1.692
  477    H    ARG   9           H        ARG   9  13.740  -1.797   0.136
  478    HA   ARG   9           HA       ARG   9  11.231  -0.596  -0.132
  479   1HB   ARG   9          1HB       ARG   9  13.295   0.416   0.812
  480   2HB   ARG   9          2HB       ARG   9  13.936   0.559  -0.826
  481   1HG   ARG   9          1HG       ARG   9  11.284   1.687  -0.652
  482   2HG   ARG   9          2HG       ARG   9  12.331   2.428   0.556
  483   1HD   ARG   9          1HD       ARG   9  12.913   2.217  -2.433
  484   2HD   ARG   9          2HD       ARG   9  12.217   3.631  -1.615
  485    HE   ARG   9           HE       ARG   9  14.774   2.656  -0.572
  486   1HH1  ARG   9          1HH1      ARG   9  13.237   5.090  -2.722
  487   2HH1  ARG   9          2HH1      ARG   9  14.706   6.057  -2.774
  488   1HH2  ARG   9          1HH2      ARG   9  16.671   4.053  -0.769
  489   2HH2  ARG   9          2HH2      ARG   9  16.501   5.503  -1.746
  490    H    HIS  10           H        HIS  10   9.926  -1.349  -1.842
  491    HA   HIS  10           HA       HIS  10  10.984  -1.093  -4.596
  492   1HB   HIS  10          1HB       HIS  10   9.240  -3.233  -3.312
  493   2HB   HIS  10          2HB       HIS  10   9.631  -3.114  -5.033
  494    HD1  HIS  10           1HD      HIS  10  10.578  -5.537  -2.819
  495    HD2  HIS  10           2HD      HIS  10  12.793  -2.365  -4.317
  496    HE1  HIS  10           1HE      HIS  10  12.948  -6.359  -2.936
  497    H    LYS  11           H        LYS  11   8.939  -1.439  -6.154
  498    HA   LYS  11           HA       LYS  11   7.023   0.703  -5.468
  499   1HB   LYS  11          1HB       LYS  11   9.169   0.658  -7.597
  500   2HB   LYS  11          2HB       LYS  11   7.757   1.728  -7.654
  501   1HG   LYS  11          1HG       LYS  11   8.394   2.895  -5.682
  502   2HG   LYS  11          2HG       LYS  11   9.609   1.696  -5.229
  503   1HD   LYS  11          1HD       LYS  11  10.566   3.779  -6.106
  504   2HD   LYS  11          2HD       LYS  11  11.085   2.316  -6.966
  505   1HE   LYS  11          1HE       LYS  11   9.814   2.804  -8.883
  506   2HE   LYS  11          2HE       LYS  11   8.642   3.716  -7.951
  507   1HZ   LYS  11          1HZ       LYS  11   9.665   5.244  -9.168
  508   2HZ   LYS  11          2HZ       LYS  11  11.226   4.680  -8.935
  509   3HZ   LYS  11          3HZ       LYS  11  10.394   5.457  -7.720
  510    H    ILE  12           H        ILE  12   5.188  -0.504  -5.733
  511    HA   ILE  12           HA       ILE  12   4.828  -2.007  -8.289
  512    HB   ILE  12           HB       ILE  12   2.857  -1.684  -5.997
  513   1HG1  ILE  12          1HG1      ILE  12   4.629  -4.063  -6.646
  514   2HG1  ILE  12          2HG1      ILE  12   4.863  -2.945  -5.299
  515   1HG2  ILE  12          1HG2      ILE  12   2.841  -3.436  -8.499
  516   2HG2  ILE  12          2HG2      ILE  12   1.616  -3.472  -7.205
  517   3HG2  ILE  12          3HG2      ILE  12   1.800  -2.041  -8.200
  518   1HD1  ILE  12          1HD1      ILE  12   2.569  -3.519  -4.458
  519   2HD1  ILE  12          2HD1      ILE  12   2.562  -4.865  -5.635
  520   3HD1  ILE  12          3HD1      ILE  12   3.780  -4.794  -4.351
  521    H    LEU  13           H        LEU  13   4.815  -0.336  -9.805
  522    HA   LEU  13           HA       LEU  13   3.180   2.000  -9.479
  523   1HB   LEU  13          1HB       LEU  13   5.109   1.850 -11.033
  524   2HB   LEU  13          2HB       LEU  13   4.157   0.810 -12.098
  525    HG   LEU  13           HG       LEU  13   2.942   3.437 -11.168
  526   1HD1  LEU  13          1HD1      LEU  13   5.167   4.096 -11.715
  527   2HD1  LEU  13          2HD1      LEU  13   4.080   4.608 -13.028
  528   3HD1  LEU  13          3HD1      LEU  13   5.124   3.186 -13.249
  529   1HD2  LEU  13          1HD2      LEU  13   2.853   1.970 -13.847
  530   2HD2  LEU  13          2HD2      LEU  13   2.001   3.481 -13.460
  531   3HD2  LEU  13          3HD2      LEU  13   1.562   1.995 -12.630
  532    H    CYS  14           H        CYS  14   1.104   1.807  -9.131
  533    HA   CYS  14           HA       CYS  14  -0.503   0.034 -10.902
  534   1HB   CYS  14          1HB       CYS  14  -0.238  -0.383  -8.214
  535   2HB   CYS  14          2HB       CYS  14  -1.606   0.739  -8.202
  536    HG   CYS  14           HG       CYS  14  -3.128  -0.686  -9.848
  537    H    VAL  15           H        VAL  15  -3.026   1.159 -10.168
  538    HA   VAL  15           HA       VAL  15  -2.711   4.033 -10.603
  539    HB   VAL  15           HB       VAL  15  -4.718   4.040 -12.058
  540   1HG1  VAL  15          1HG1      VAL  15  -3.556   3.444 -14.117
  541   2HG1  VAL  15          2HG1      VAL  15  -2.451   4.255 -12.998
  542   3HG1  VAL  15          3HG1      VAL  15  -2.360   2.493 -13.211
  543   1HG2  VAL  15          1HG2      VAL  15  -4.282   1.029 -12.334
  544   2HG2  VAL  15          2HG2      VAL  15  -5.650   1.803 -11.501
  545   3HG2  VAL  15          3HG2      VAL  15  -5.435   2.030 -13.239
  546    H    CYS  16           H        CYS  16  -4.377   5.251  -9.728
  547    HA   CYS  16           HA       CYS  16  -5.631   4.164  -7.344
  548   1HB   CYS  16          1HB       CYS  16  -4.927   6.626  -7.696
  549   2HB   CYS  16          2HB       CYS  16  -6.305   6.761  -8.800
  550    H    CYS  17           H        CYS  17  -7.607   3.249  -7.201
  551    HA   CYS  17           HA       CYS  17  -9.093   2.304  -9.370
  552   1HB   CYS  17          1HB       CYS  17  -9.155   1.507  -7.011
  553   2HB   CYS  17          2HB       CYS  17 -10.059   2.948  -6.541
  554    HG   CYS  17           HG       CYS  17 -11.482   0.792  -6.581
  555    H    LYS  18           H        LYS  18  -9.352   5.449  -7.805
  556    HA   LYS  18           HA       LYS  18 -11.771   6.117  -9.404
  557   1HB   LYS  18          1HB       LYS  18 -12.382   7.485  -7.394
  558   2HB   LYS  18          2HB       LYS  18 -12.439   5.745  -7.245
  559   1HG   LYS  18          1HG       LYS  18 -10.001   6.041  -6.127
  560   2HG   LYS  18          2HG       LYS  18 -10.484   7.723  -5.990
  561   1HD   LYS  18          1HD       LYS  18 -11.051   6.577  -3.937
  562   2HD   LYS  18          2HD       LYS  18 -12.574   6.909  -4.797
  563   1HE   LYS  18          1HE       LYS  18 -12.531   4.568  -5.724
  564   2HE   LYS  18          2HE       LYS  18 -10.997   4.285  -4.928
  565   1HZ   LYS  18          1HZ       LYS  18 -12.178   4.599  -2.812
  566   2HZ   LYS  18          2HZ       LYS  18 -12.608   3.293  -3.725
  567   3HZ   LYS  18          3HZ       LYS  18 -13.616   4.620  -3.658
  568    H    CYS  19           H        CYS  19  -8.570   7.308  -8.506
  569    HA   CYS  19           HA       CYS  19  -9.084   9.884  -9.819
  570   1HB   CYS  19          1HB       CYS  19  -6.448   8.808  -9.272
  571   2HB   CYS  19          2HB       CYS  19  -6.943  10.457  -9.459
  572    H    ASP  20           H        ASP  20  -8.370   6.574 -10.697
  573    HA   ASP  20           HA       ASP  20  -7.421   5.542 -12.410
  574   1HB   ASP  20          1HB       ASP  20  -9.572   6.236 -13.339
  575   2HB   ASP  20          2HB       ASP  20  -8.832   7.707 -13.965
  576    H    GLY  21           H        GLY  21  -5.626   6.931 -11.100
  577   1HA   GLY  21          1HA       GLY  21  -3.844   8.245 -13.099
  578   2HA   GLY  21          2HA       GLY  21  -4.124   8.906 -11.475
  579    H    ARG  22           H        ARG  22  -1.666   8.058 -12.669
  580    HA   ARG  22           HA       ARG  22  -0.698   5.494 -11.970
  581   1HB   ARG  22          1HB       ARG  22   0.257   6.922 -13.677
  582   2HB   ARG  22          2HB       ARG  22   0.591   8.208 -12.533
  583   1HG   ARG  22          1HG       ARG  22   1.930   5.608 -11.916
  584   2HG   ARG  22          2HG       ARG  22   2.366   6.343 -13.457
  585   1HD   ARG  22          1HD       ARG  22   2.784   8.536 -12.095
  586   2HD   ARG  22          2HD       ARG  22   2.764   7.477 -10.677
  587    HE   ARG  22           HE       ARG  22   4.471   6.692 -12.941
  588   1HH1  ARG  22          1HH1      ARG  22   4.566   8.497  -9.871
  589   2HH1  ARG  22          2HH1      ARG  22   6.140   7.854  -9.419
  590   1HH2  ARG  22          1HH2      ARG  22   6.596   6.024 -12.406
  591   2HH2  ARG  22          2HH2      ARG  22   7.239   6.373 -10.835
  592    H    ILE  23           H        ILE  23  -0.494   4.687  -9.912
  593    HA   ILE  23           HA       ILE  23   0.614   6.572  -7.918
  594    HB   ILE  23           HB       ILE  23  -0.790   4.051  -7.041
  595   1HG1  ILE  23          1HG1      ILE  23  -2.112   6.789  -6.883
  596   2HG1  ILE  23          2HG1      ILE  23  -2.523   5.590  -8.113
  597   1HG2  ILE  23          1HG2      ILE  23  -0.584   5.243  -4.845
  598   2HG2  ILE  23          2HG2      ILE  23   0.980   5.211  -5.637
  599   3HG2  ILE  23          3HG2      ILE  23   0.013   6.689  -5.681
  600   1HD1  ILE  23          1HD1      ILE  23  -2.686   5.028  -5.123
  601   2HD1  ILE  23          2HD1      ILE  23  -4.045   5.483  -6.115
  602   3HD1  ILE  23          3HD1      ILE  23  -3.199   3.959  -6.444
  603    H    GLU  24           H        GLU  24   2.661   6.150  -7.580
  604    HA   GLU  24           HA       GLU  24   3.912   3.588  -8.306
  605   1HB   GLU  24          1HB       GLU  24   4.813   5.593  -9.108
  606   2HB   GLU  24          2HB       GLU  24   4.836   6.363  -7.521
  607   1HG   GLU  24          1HG       GLU  24   6.652   4.878  -6.809
  608   2HG   GLU  24          2HG       GLU  24   6.480   3.918  -8.285
  609    H    LEU  25           H        LEU  25   3.008   2.190  -6.736
  610    HA   LEU  25           HA       LEU  25   2.680   3.018  -4.027
  611   1HB   LEU  25          1HB       LEU  25   2.706   0.209  -5.105
  612   2HB   LEU  25          2HB       LEU  25   2.030   0.745  -3.583
  613    HG   LEU  25           HG       LEU  25   0.972   1.494  -6.352
  614   1HD1  LEU  25          1HD1      LEU  25  -0.124  -0.436  -4.249
  615   2HD1  LEU  25          2HD1      LEU  25   0.568  -0.875  -5.824
  616   3HD1  LEU  25          3HD1      LEU  25  -0.944   0.037  -5.751
  617   1HD2  LEU  25          1HD2      LEU  25   0.569   3.228  -4.613
  618   2HD2  LEU  25          2HD2      LEU  25  -0.145   2.016  -3.556
  619   3HD2  LEU  25          3HD2      LEU  25  -0.936   2.442  -5.098
  620    H    THR  26           H        THR  26   4.591   3.582  -3.029
  621    HA   THR  26           HA       THR  26   6.967   1.922  -3.384
  622    HB   THR  26           HB       THR  26   6.767   4.392  -1.690
  623    HG1  THR  26           1HG      THR  26   6.067   4.542  -4.068
  624   1HG2  THR  26          1HG2      THR  26   9.044   3.191  -3.360
  625   2HG2  THR  26          2HG2      THR  26   8.842   2.835  -1.645
  626   3HG2  THR  26          3HG2      THR  26   9.160   4.503  -2.174
  627    H    VAL  27           H        VAL  27   6.642  -0.004  -2.442
  628    HA   VAL  27           HA       VAL  27   5.801  -0.158   0.409
  629    HB   VAL  27           HB       VAL  27   4.430  -2.185  -0.060
  630   1HG1  VAL  27          1HG1      VAL  27   3.526   0.123  -0.641
  631   2HG1  VAL  27          2HG1      VAL  27   3.754  -0.316  -2.338
  632   3HG1  VAL  27          3HG1      VAL  27   2.689  -1.294  -1.311
  633   1HG2  VAL  27          1HG2      VAL  27   5.542  -1.961  -2.925
  634   2HG2  VAL  27          2HG2      VAL  27   5.793  -3.301  -1.785
  635   3HG2  VAL  27          3HG2      VAL  27   4.183  -2.987  -2.447
  636    H    GLU  28           H        GLU  28   7.128  -1.522   1.648
  637    HA   GLU  28           HA       GLU  28   9.704  -1.987   0.257
  638   1HB   GLU  28          1HB       GLU  28   9.184  -1.257   3.103
  639   2HB   GLU  28          2HB       GLU  28  10.749  -1.259   2.274
  640   1HG   GLU  28          1HG       GLU  28  10.037   0.746   1.052
  641   2HG   GLU  28          2HG       GLU  28   8.418   0.628   1.768
  642    H    SER  29           H        SER  29   9.687  -4.200  -0.183
  643    HA   SER  29           HA       SER  29   9.972  -5.961   2.046
  644   1HB   SER  29          1HB       SER  29   7.380  -5.705   1.696
  645   2HB   SER  29          2HB       SER  29   7.635  -6.765   0.306
  646    HG   SER  29           HG       SER  29   7.162  -8.088   1.951
  647    H    SER  30           H        SER  30  10.524  -8.169   1.247
  648    HA   SER  30           HA       SER  30  12.348  -8.125  -0.872
  649   1HB   SER  30          1HB       SER  30  10.798 -10.489   0.293
  650   2HB   SER  30          2HB       SER  30  12.350 -10.580  -0.561
  651    HG   SER  30           HG       SER  30  12.431 -10.538   1.809
  652    H    ALA  31           H        ALA  31  12.262  -8.943  -3.009
  653    HA   ALA  31           HA       ALA  31  10.247  -7.915  -4.489
  654   1HB   ALA  31          1HB       ALA  31  12.011 -10.269  -5.308
  655   2HB   ALA  31          2HB       ALA  31  11.169  -9.161  -6.409
  656   3HB   ALA  31          3HB       ALA  31  12.475  -8.548  -5.371
  657    H    GLU  32           H        GLU  32  10.335 -11.345  -3.425
  658    HA   GLU  32           HA       GLU  32   8.054 -11.954  -5.058
  659   1HB   GLU  32          1HB       GLU  32  10.161 -13.382  -3.996
  660   2HB   GLU  32          2HB       GLU  32   8.790 -13.930  -3.012
  661   1HG   GLU  32          1HG       GLU  32   7.528 -14.489  -5.064
  662   2HG   GLU  32          2HG       GLU  32   8.771 -13.759  -6.072
  663    H    ASP  33           H        ASP  33   8.448 -10.800  -1.805
  664    HA   ASP  33           HA       ASP  33   5.862 -11.614  -0.825
  665   1HB   ASP  33          1HB       ASP  33   7.794 -11.269   0.660
  666   2HB   ASP  33          2HB       ASP  33   7.904  -9.586   0.151
  667    H    LEU  34           H        LEU  34   7.477  -8.858  -2.294
  668    HA   LEU  34           HA       LEU  34   5.247  -7.023  -2.535
  669   1HB   LEU  34          1HB       LEU  34   7.272  -6.062  -2.962
  670   2HB   LEU  34          2HB       LEU  34   7.874  -7.355  -3.957
  671    HG   LEU  34           HG       LEU  34   5.507  -5.835  -5.060
  672   1HD1  LEU  34          1HD1      LEU  34   6.969  -4.059  -4.127
  673   2HD1  LEU  34          2HD1      LEU  34   7.016  -4.051  -5.901
  674   3HD1  LEU  34          3HD1      LEU  34   8.343  -4.803  -4.989
  675   1HD2  LEU  34          1HD2      LEU  34   8.092  -6.859  -6.329
  676   2HD2  LEU  34          2HD2      LEU  34   6.777  -6.025  -7.186
  677   3HD2  LEU  34          3HD2      LEU  34   6.500  -7.608  -6.483
  678    H    ARG  35           H        ARG  35   6.489  -9.462  -4.539
  679    HA   ARG  35           HA       ARG  35   4.695  -9.325  -6.746
  680   1HB   ARG  35          1HB       ARG  35   6.859 -10.636  -6.749
  681   2HB   ARG  35          2HB       ARG  35   6.042 -11.901  -5.827
  682   1HG   ARG  35          1HG       ARG  35   4.394 -12.204  -7.610
  683   2HG   ARG  35          2HG       ARG  35   5.165 -10.920  -8.569
  684   1HD   ARG  35          1HD       ARG  35   7.210 -12.266  -8.727
  685   2HD   ARG  35          2HD       ARG  35   6.503 -13.510  -7.669
  686    HE   ARG  35           HE       ARG  35   4.677 -13.191  -9.713
  687   1HH1  ARG  35          1HH1      ARG  35   8.044 -14.237  -9.492
  688   2HH1  ARG  35          2HH1      ARG  35   8.022 -15.179 -10.939
  689   1HH2  ARG  35          1HH2      ARG  35   4.587 -14.471 -11.613
  690   2HH2  ARG  35          2HH2      ARG  35   5.981 -15.326 -12.168
  691    H    THR  36           H        THR  36   4.658 -11.459  -3.917
  692    HA   THR  36           HA       THR  36   2.236 -12.802  -4.425
  693    HB   THR  36           HB       THR  36   3.413 -11.960  -1.732
  694    HG1  THR  36           1HG      THR  36   4.891 -13.168  -2.912
  695   1HG2  THR  36          1HG2      THR  36   1.467 -14.208  -2.419
  696   2HG2  THR  36          2HG2      THR  36   1.097 -12.763  -1.445
  697   3HG2  THR  36          3HG2      THR  36   2.256 -13.961  -0.846
  698    H    LEU  37           H        LEU  37   2.705  -9.717  -2.555
  699    HA   LEU  37           HA       LEU  37  -0.083  -9.269  -2.343
  700   1HB   LEU  37          1HB       LEU  37   0.475  -7.588  -1.052
  701   2HB   LEU  37          2HB       LEU  37   2.100  -8.171  -1.232
  702    HG   LEU  37           HG       LEU  37   2.058  -6.478  -3.367
  703   1HD1  LEU  37          1HD1      LEU  37  -0.368  -5.784  -2.820
  704   2HD1  LEU  37          2HD1      LEU  37   0.761  -4.424  -2.771
  705   3HD1  LEU  37          3HD1      LEU  37   0.196  -5.171  -1.282
  706   1HD2  LEU  37          1HD2      LEU  37   3.275  -4.955  -2.014
  707   2HD2  LEU  37          2HD2      LEU  37   3.614  -6.568  -1.365
  708   3HD2  LEU  37          3HD2      LEU  37   2.466  -5.512  -0.541
  709    H    GLN  38           H        GLN  38   2.186  -8.511  -5.027
  710    HA   GLN  38           HA       GLN  38   0.343  -6.940  -6.506
  711   1HB   GLN  38          1HB       GLN  38   2.776  -7.050  -6.869
  712   2HB   GLN  38          2HB       GLN  38   2.608  -8.669  -7.546
  713   1HG   GLN  38          1HG       GLN  38   1.214  -7.856  -9.364
  714   2HG   GLN  38          2HG       GLN  38   1.245  -6.222  -8.696
  715   1HE2  GLN  38          1HE2      GLN  38   3.710  -5.491  -8.171
  716   2HE2  GLN  38          2HE2      GLN  38   4.856  -5.912  -9.436
  717    H    GLN  39           H        GLN  39   0.694 -10.496  -6.048
  718    HA   GLN  39           HA       GLN  39  -1.026 -11.175  -8.229
  719   1HB   GLN  39          1HB       GLN  39  -0.594 -12.884  -5.779
  720   2HB   GLN  39          2HB       GLN  39  -1.190 -13.356  -7.358
  721   1HG   GLN  39          1HG       GLN  39   1.612 -12.688  -6.541
  722   2HG   GLN  39          2HG       GLN  39   1.003 -14.145  -7.279
  723   1HE2  GLN  39          1HE2      GLN  39   2.256 -10.968  -7.826
  724   2HE2  GLN  39          2HE2      GLN  39   2.267 -11.020  -9.600
  725    H    LEU  40           H        LEU  40  -1.475 -10.464  -4.733
  726    HA   LEU  40           HA       LEU  40  -4.336 -10.766  -4.655
  727   1HB   LEU  40          1HB       LEU  40  -2.893  -8.534  -3.239
  728   2HB   LEU  40          2HB       LEU  40  -4.396  -9.317  -2.836
  729    HG   LEU  40           HG       LEU  40  -1.692 -10.687  -2.719
  730   1HD1  LEU  40          1HD1      LEU  40  -1.918  -8.805  -1.080
  731   2HD1  LEU  40          2HD1      LEU  40  -1.718 -10.405  -0.335
  732   3HD1  LEU  40          3HD1      LEU  40  -3.314  -9.640  -0.386
  733   1HD2  LEU  40          1HD2      LEU  40  -2.811 -12.392  -1.367
  734   2HD2  LEU  40          2HD2      LEU  40  -3.518 -12.299  -2.991
  735   3HD2  LEU  40          3HD2      LEU  40  -4.366 -11.572  -1.605
  736    H    PHE  41           H        PHE  41  -2.383  -7.982  -5.761
  737    HA   PHE  41           HA       PHE  41  -4.662  -6.332  -6.459
  738   1HB   PHE  41          1HB       PHE  41  -1.735  -6.282  -7.123
  739   2HB   PHE  41          2HB       PHE  41  -2.843  -5.368  -8.124
  740    HD1  PHE  41           1HD      PHE  41  -3.419  -3.203  -7.535
  741    HD2  PHE  41           2HD      PHE  41  -2.114  -5.902  -4.446
  742    HE1  PHE  41           1HE      PHE  41  -3.474  -1.361  -5.903
  743    HE2  PHE  41           2HE      PHE  41  -2.216  -4.064  -2.793
  744    HZ   PHE  41           HZ       PHE  41  -2.925  -1.799  -3.501
  745    H    LEU  42           H        LEU  42  -2.702  -8.590  -8.397
  746    HA   LEU  42           HA       LEU  42  -4.231  -8.303 -10.797
  747   1HB   LEU  42          1HB       LEU  42  -2.410 -10.419  -9.639
  748   2HB   LEU  42          2HB       LEU  42  -3.185 -10.675 -11.192
  749    HG   LEU  42           HG       LEU  42  -1.478  -8.210 -10.630
  750   1HD1  LEU  42          1HD1      LEU  42  -0.089 -10.199 -10.281
  751   2HD1  LEU  42          2HD1      LEU  42   0.372  -9.371 -11.775
  752   3HD1  LEU  42          3HD1      LEU  42  -0.599 -10.863 -11.848
  753   1HD2  LEU  42          1HD2      LEU  42  -1.289  -8.140 -13.104
  754   2HD2  LEU  42          2HD2      LEU  42  -2.973  -8.015 -12.589
  755   3HD2  LEU  42          3HD2      LEU  42  -2.360  -9.553 -13.229
  756    H    SER  43           H        SER  43  -4.851 -10.267  -7.864
  757    HA   SER  43           HA       SER  43  -6.942 -11.818  -9.057
  758   1HB   SER  43          1HB       SER  43  -5.636 -12.365  -6.962
  759   2HB   SER  43          2HB       SER  43  -6.536 -11.095  -6.121
  760    HG   SER  43           HG       SER  43  -7.550 -13.030  -5.792
  761    H    THR  44           H        THR  44  -7.077  -9.020  -6.762
  762    HA   THR  44           HA       THR  44  -9.607  -8.157  -7.874
  763    HB   THR  44           HB       THR  44 -10.552  -8.188  -5.495
  764    HG1  THR  44           1HG      THR  44  -9.431  -9.664  -4.080
  765   1HG2  THR  44          1HG2      THR  44 -11.212 -10.495  -5.447
  766   2HG2  THR  44          2HG2      THR  44  -9.848 -10.981  -6.470
  767   3HG2  THR  44          3HG2      THR  44 -11.153  -9.984  -7.145
  768    H    LEU  45           H        LEU  45  -6.796  -7.475  -5.916
  769    HA   LEU  45           HA       LEU  45  -7.965  -5.341  -4.459
  770   1HB   LEU  45          1HB       LEU  45  -5.604  -6.970  -4.421
  771   2HB   LEU  45          2HB       LEU  45  -5.046  -5.334  -4.414
  772    HG   LEU  45           HG       LEU  45  -6.673  -4.925  -2.517
  773   1HD1  LEU  45          1HD1      LEU  45  -8.272  -6.745  -2.869
  774   2HD1  LEU  45          2HD1      LEU  45  -7.438  -7.070  -1.339
  775   3HD1  LEU  45          3HD1      LEU  45  -6.979  -7.943  -2.808
  776   1HD2  LEU  45          1HD2      LEU  45  -4.483  -7.024  -2.207
  777   2HD2  LEU  45          2HD2      LEU  45  -5.216  -6.176  -0.853
  778   3HD2  LEU  45          3HD2      LEU  45  -4.308  -5.258  -2.065
  779    H    SER  46           H        SER  46  -7.617  -3.107  -4.350
  780    HA   SER  46           HA       SER  46  -6.059  -1.866  -6.514
  781   1HB   SER  46          1HB       SER  46  -7.966  -0.022  -6.150
  782   2HB   SER  46          2HB       SER  46  -8.082  -1.299  -7.363
  783    HG   SER  46           HG       SER  46  -9.871  -0.751  -5.478
  784    H    PHE  47           H        PHE  47  -5.694   0.508  -5.880
  785    HA   PHE  47           HA       PHE  47  -5.232   0.805  -2.979
  786   1HB   PHE  47          1HB       PHE  47  -3.076   0.349  -4.397
  787   2HB   PHE  47          2HB       PHE  47  -3.317   1.970  -5.005
  788    HD1  PHE  47           1HD      PHE  47  -2.207  -0.096  -2.196
  789    HD2  PHE  47           2HD      PHE  47  -3.257   3.931  -3.330
  790    HE1  PHE  47           1HE      PHE  47  -1.056   0.777  -0.200
  791    HE2  PHE  47           2HE      PHE  47  -2.128   4.788  -1.300
  792    HZ   PHE  47           HZ       PHE  47  -1.025   3.217   0.269
  793    H    VAL  48           H        VAL  48  -5.431   2.975  -2.292
  794    HA   VAL  48           HA       VAL  48  -6.796   4.789  -4.072
  795    HB   VAL  48           HB       VAL  48  -7.872   3.187  -1.783
  796   1HG1  VAL  48          1HG1      VAL  48  -8.227   5.445  -0.902
  797   2HG1  VAL  48          2HG1      VAL  48  -9.089   5.883  -2.405
  798   3HG1  VAL  48          3HG1      VAL  48  -9.720   4.607  -1.333
  799   1HG2  VAL  48          1HG2      VAL  48  -8.508   2.655  -4.100
  800   2HG2  VAL  48          2HG2      VAL  48  -9.908   3.286  -3.238
  801   3HG2  VAL  48          3HG2      VAL  48  -9.014   4.329  -4.372
  802    H    CYS  49           H        CYS  49  -5.336   6.334  -4.086
  803    HA   CYS  49           HA       CYS  49  -3.200   6.578  -2.205
  804   1HB   CYS  49          1HB       CYS  49  -2.804   8.743  -3.494
  805   2HB   CYS  49          2HB       CYS  49  -2.792   7.250  -4.411
  806    HA   PRO  50           HA       PRO  50  -4.888   8.703   1.092
  807   1HB   PRO  50          1HB       PRO  50  -3.012  10.631   1.849
  808   2HB   PRO  50          2HB       PRO  50  -2.978   8.884   2.235
  809   1HG   PRO  50          1HG       PRO  50  -1.585  10.329  -0.034
  810   2HG   PRO  50          2HG       PRO  50  -0.917   9.081   1.069
  811   1HD   PRO  50          1HD       PRO  50  -1.731   8.406  -1.392
  812   2HD   PRO  50          2HD       PRO  50  -2.133   7.353  -0.007
  813    H    TRP  51           H        TRP  51  -4.024  10.768  -1.595
  814    HA   TRP  51           HA       TRP  51  -5.407  13.159  -0.926
  815   1HB   TRP  51          1HB       TRP  51  -3.823  13.139  -2.726
  816   2HB   TRP  51          2HB       TRP  51  -4.646  11.812  -3.535
  817    HD1  TRP  51           HD       TRP  51  -6.162  15.167  -2.311
  818    HE1  TRP  51           1HE      TRP  51  -7.362  16.288  -4.261
  819    HE3  TRP  51           3HE      TRP  51  -4.870  11.895  -6.042
  820    HZ2  TRP  51           2HZ      TRP  51  -7.707  15.847  -7.104
  821    HZ3  TRP  51           3HZ      TRP  51  -5.621  12.299  -8.364
  822    HH2  TRP  51           HH       TRP  51  -7.049  14.256  -8.904
  823    H    CYS  52           H        CYS  52  -6.549  10.497  -3.180
  824    HA   CYS  52           HA       CYS  52  -9.259  11.438  -3.011
  825   1HB   CYS  52          1HB       CYS  52  -9.896   9.324  -4.035
  826   2HB   CYS  52          2HB       CYS  52  -8.599  10.111  -4.890
  827    H    ALA  53           H        ALA  53  -7.336   9.097  -1.088
  828    HA   ALA  53           HA       ALA  53  -9.548   7.850   0.020
  829   1HB   ALA  53          1HB       ALA  53  -7.144   7.123   0.326
  830   2HB   ALA  53          2HB       ALA  53  -6.944   8.452   1.498
  831   3HB   ALA  53          3HB       ALA  53  -8.089   7.166   1.838
  832    H    THR  54           H        THR  54  -7.899  10.827   0.971
  833    HA   THR  54           HA       THR  54  -9.479  11.457   3.292
  834    HB   THR  54           HB       THR  54  -7.782  13.247   1.486
  835    HG1  THR  54           1HG      THR  54  -6.452  11.708   2.209
  836   1HG2  THR  54          1HG2      THR  54  -7.502  14.636   3.510
  837   2HG2  THR  54          2HG2      THR  54  -8.627  13.585   4.398
  838   3HG2  THR  54          3HG2      THR  54  -9.203  14.561   3.026
  839    H    ASN  55           H        ASN  55  -9.513  12.605  -0.140
  840    HA   ASN  55           HA       ASN  55 -11.657  14.496   0.382
  841   1HB   ASN  55          1HB       ASN  55 -10.341  13.527  -2.195
  842   2HB   ASN  55          2HB       ASN  55 -11.652  14.703  -2.159
  843   1HD2  ASN  55          1HD2      ASN  55  -8.296  14.142  -0.972
  844   2HD2  ASN  55          2HD2      ASN  55  -8.029  15.857  -0.632
  845    H    GLN  56           H        GLN  56 -11.525  11.258  -0.777
  846    HA   GLN  56           HA       GLN  56 -12.902   9.713  -1.503
  847   1HB   GLN  56          2HB       GLN  56 -14.049  10.241   0.709
  848   2HB   GLN  56          3HB       GLN  56 -15.245  11.152  -0.221
  849   1HG   GLN  56          2HG       GLN  56 -15.868   9.109  -1.457
  850   2HG   GLN  56          3HG       GLN  56 -14.537   8.218  -0.706
  851   1HE2  GLN  56          1HE2      GLN  56 -17.715   9.694  -0.122
  852   2HE2  GLN  56          2HE2      GLN  56 -17.996   8.880   1.415
  Start of MODEL    2
    1   1H    GLY   1          1H        GLY   1 -26.018   2.087  -9.601
    2   1HA   GLY   1          1HA       GLY   1 -26.711   0.634  -7.786
    3   2HA   GLY   1          2HA       GLY   1 -25.364  -0.027  -8.744
    4    H    SER   2           H        SER   2 -25.350  -1.247  -6.408
    5    HA   SER   2           HA       SER   2 -23.855  -0.005  -4.337
    6   1HB   SER   2          1HB       SER   2 -23.959  -2.934  -5.165
    7   2HB   SER   2          2HB       SER   2 -23.512  -2.274  -3.580
    8    HG   SER   2           HG       SER   2 -25.655  -2.915  -3.527
    9    H    HIS   3           H        HIS   3 -22.278   1.217  -5.517
   10    HA   HIS   3           HA       HIS   3 -19.805  -0.327  -5.904
   11   1HB   HIS   3          1HB       HIS   3 -19.276   0.865  -8.037
   12   2HB   HIS   3          2HB       HIS   3 -20.606  -0.273  -8.157
   13    HD1  HIS   3           1HD      HIS   3 -20.484   3.495  -7.305
   14    HD2  HIS   3           2HD      HIS   3 -22.387   0.677  -9.765
   15    HE1  HIS   3           1HE      HIS   3 -22.317   4.778  -8.618
   16    H    MET   4           H        MET   4 -20.616   1.197  -3.761
   17    HA   MET   4           HA       MET   4 -18.247   2.350  -3.352
   18   1HB   MET   4          1HB       MET   4 -19.375   4.432  -4.639
   19   2HB   MET   4          2HB       MET   4 -20.061   4.757  -3.053
   20   1HG   MET   4          1HG       MET   4 -17.707   4.623  -2.104
   21   2HG   MET   4          2HG       MET   4 -17.114   4.320  -3.722
   22   1HE   MET   4          1HE       MET   4 -19.981   7.067  -2.894
   23   2HE   MET   4          2HE       MET   4 -19.016   6.853  -1.415
   24   3HE   MET   4          3HE       MET   4 -18.920   8.375  -2.334
   25    H    ALA   5           H        ALA   5 -20.170   0.628  -2.081
   26    HA   ALA   5           HA       ALA   5 -19.874   1.586   0.626
   27   1HB   ALA   5          1HB       ALA   5 -22.174   2.306  -0.028
   28   2HB   ALA   5          2HB       ALA   5 -22.555   0.625  -0.477
   29   3HB   ALA   5          3HB       ALA   5 -22.235   1.046   1.221
   30    H    GLU   6           H        GLU   6 -18.614  -0.375  -1.062
   31    HA   GLU   6           HA       GLU   6 -19.623  -2.974  -0.061
   32   1HB   GLU   6          1HB       GLU   6 -17.487  -2.416  -2.162
   33   2HB   GLU   6          2HB       GLU   6 -18.220  -3.968  -1.799
   34   1HG   GLU   6          1HG       GLU   6 -19.273  -3.183  -3.781
   35   2HG   GLU   6          2HG       GLU   6 -20.461  -3.080  -2.480
   36    HA   PRO   7           HA       PRO   7 -16.269  -3.490   2.841
   37   1HB   PRO   7          1HB       PRO   7 -16.135  -6.168   3.190
   38   2HB   PRO   7          2HB       PRO   7 -17.599  -5.235   3.603
   39   1HG   PRO   7          1HG       PRO   7 -17.054  -6.743   1.020
   40   2HG   PRO   7          2HG       PRO   7 -18.482  -6.887   2.099
   41   1HD   PRO   7          1HD       PRO   7 -18.497  -5.276  -0.087
   42   2HD   PRO   7          2HD       PRO   7 -19.323  -4.787   1.421
   43    H    GLN   8           H        GLN   8 -15.211  -2.600   0.718
   44    HA   GLN   8           HA       GLN   8 -12.678  -4.120   0.399
   45   1HB   GLN   8          1HB       GLN   8 -14.320  -2.793  -1.768
   46   2HB   GLN   8          2HB       GLN   8 -12.567  -2.819  -1.882
   47   1HG   GLN   8          1HG       GLN   8 -13.438  -4.666  -3.132
   48   2HG   GLN   8          2HG       GLN   8 -12.515  -5.261  -1.763
   49   1HE2  GLN   8          1HE2      GLN   8 -13.526  -7.361  -1.391
   50   2HE2  GLN   8          2HE2      GLN   8 -15.243  -7.404  -1.045
   51    H    ARG   9           H        ARG   9 -14.192  -0.802   0.199
   52    HA   ARG   9           HA       ARG   9 -11.695   0.530   0.114
   53   1HB   ARG   9          1HB       ARG   9 -13.947   1.411  -0.585
   54   2HB   ARG   9          2HB       ARG   9 -14.275   1.746   1.113
   55   1HG   ARG   9          1HG       ARG   9 -11.815   2.776  -0.024
   56   2HG   ARG   9          2HG       ARG   9 -13.312   3.571  -0.505
   57   1HD   ARG   9          1HD       ARG   9 -13.792   4.102   1.843
   58   2HD   ARG   9          2HD       ARG   9 -12.306   3.296   2.358
   59    HE   ARG   9           HE       ARG   9 -11.298   4.989   0.570
   60   1HH1  ARG   9          1HH1      ARG   9 -13.743   5.965   2.904
   61   2HH1  ARG   9          2HH1      ARG   9 -12.826   7.286   3.533
   62   1HH2  ARG   9          1HH2      ARG   9 -10.523   7.166   0.897
   63   2HH2  ARG   9          2HH2      ARG   9 -10.776   7.892   2.409
   64    H    HIS  10           H        HIS  10 -10.203  -0.217   1.762
   65    HA   HIS  10           HA       HIS  10 -11.073   0.230   4.571
   66   1HB   HIS  10          1HB       HIS  10  -9.410  -1.963   3.290
   67   2HB   HIS  10          2HB       HIS  10  -9.677  -1.756   5.025
   68    HD1  HIS  10           1HD      HIS  10 -10.715  -4.303   3.056
   69    HD2  HIS  10           2HD      HIS  10 -12.951  -1.094   4.449
   70    HE1  HIS  10           1HE      HIS  10 -13.029  -5.198   3.426
   71    H    LYS  11           H        LYS  11  -9.274   0.420   6.114
   72    HA   LYS  11           HA       LYS  11  -7.063   2.126   5.080
   73   1HB   LYS  11          1HB       LYS  11  -9.217   2.675   7.126
   74   2HB   LYS  11          2HB       LYS  11  -7.736   3.619   7.026
   75   1HG   LYS  11          1HG       LYS  11  -8.405   4.787   5.177
   76   2HG   LYS  11          2HG       LYS  11  -9.176   3.389   4.439
   77   1HD   LYS  11          1HD       LYS  11 -10.854   5.079   4.954
   78   2HD   LYS  11          2HD       LYS  11 -11.113   3.583   5.845
   79   1HE   LYS  11          1HE       LYS  11 -11.496   5.237   7.450
   80   2HE   LYS  11          2HE       LYS  11  -9.869   4.670   7.810
   81   1HZ   LYS  11          1HZ       LYS  11  -9.265   6.755   7.720
   82   2HZ   LYS  11          2HZ       LYS  11 -10.681   7.283   7.033
   83   3HZ   LYS  11          3HZ       LYS  11  -9.433   6.721   6.104
   84    H    ILE  12           H        ILE  12  -5.378   0.751   5.614
   85    HA   ILE  12           HA       ILE  12  -5.266  -0.415   8.347
   86    HB   ILE  12           HB       ILE  12  -3.316  -0.632   6.032
   87   1HG1  ILE  12          1HG1      ILE  12  -5.318  -2.752   6.797
   88   2HG1  ILE  12          2HG1      ILE  12  -5.476  -1.645   5.425
   89   1HG2  ILE  12          1HG2      ILE  12  -3.557  -2.186   8.657
   90   2HG2  ILE  12          2HG2      ILE  12  -2.347  -2.501   7.386
   91   3HG2  ILE  12          3HG2      ILE  12  -2.307  -0.990   8.278
   92   1HD1  ILE  12          1HD1      ILE  12  -3.160  -2.441   4.649
   93   2HD1  ILE  12          2HD1      ILE  12  -3.399  -3.806   5.771
   94   3HD1  ILE  12          3HD1      ILE  12  -4.528  -3.521   4.430
   95    H    LEU  13           H        LEU  13  -4.730   1.322   9.775
   96    HA   LEU  13           HA       LEU  13  -2.938   3.404   8.972
   97   1HB   LEU  13          1HB       LEU  13  -4.725   3.661  10.683
   98   2HB   LEU  13          2HB       LEU  13  -3.766   2.683  11.803
   99    HG   LEU  13           HG       LEU  13  -2.385   4.999  10.405
  100   1HD1  LEU  13          1HD1      LEU  13  -4.486   5.972  10.951
  101   2HD1  LEU  13          2HD1      LEU  13  -3.256   6.574  12.092
  102   3HD1  LEU  13          3HD1      LEU  13  -4.422   5.334  12.616
  103   1HD2  LEU  13          1HD2      LEU  13  -2.265   4.007  13.290
  104   2HD2  LEU  13          2HD2      LEU  13  -1.258   5.283  12.568
  105   3HD2  LEU  13          3HD2      LEU  13  -1.089   3.621  12.020
  106    H    CYS  14           H        CYS  14  -0.928   3.215   8.715
  107    HA   CYS  14           HA       CYS  14   0.687   1.539  10.526
  108   1HB   CYS  14          1HB       CYS  14   0.425   0.706   8.051
  109   2HB   CYS  14          2HB       CYS  14   1.451   2.086   7.630
  110    HG   CYS  14           HG       CYS  14   2.021  -0.456   9.687
  111    H    VAL  15           H        VAL  15   3.184   2.528   9.851
  112    HA   VAL  15           HA       VAL  15   2.971   5.449   9.811
  113    HB   VAL  15           HB       VAL  15   4.910   5.648  11.334
  114   1HG1  VAL  15          1HG1      VAL  15   3.646   5.452  13.398
  115   2HG1  VAL  15          2HG1      VAL  15   2.609   6.075  12.106
  116   3HG1  VAL  15          3HG1      VAL  15   2.459   4.378  12.621
  117   1HG2  VAL  15          1HG2      VAL  15   4.358   2.733  12.073
  118   2HG2  VAL  15          2HG2      VAL  15   5.797   3.331  11.211
  119   3HG2  VAL  15          3HG2      VAL  15   5.492   3.841  12.874
  120    H    CYS  16           H        CYS  16   4.768   6.472   8.863
  121    HA   CYS  16           HA       CYS  16   5.898   5.046   6.629
  122   1HB   CYS  16          1HB       CYS  16   5.518   7.622   6.885
  123   2HB   CYS  16          2HB       CYS  16   7.017   7.606   7.826
  124    H    CYS  17           H        CYS  17   7.607   3.743   6.632
  125    HA   CYS  17           HA       CYS  17   8.933   2.911   8.930
  126   1HB   CYS  17          1HB       CYS  17   8.725   1.800   6.621
  127   2HB   CYS  17          2HB       CYS  17  10.154   2.722   6.149
  128    HG   CYS  17           HG       CYS  17  10.880   0.384   6.625
  129    H    LYS  18           H        LYS  18   9.820   5.715   6.987
  130    HA   LYS  18           HA       LYS  18  12.383   5.927   8.488
  131   1HB   LYS  18          1HB       LYS  18  13.128   7.213   6.431
  132   2HB   LYS  18          2HB       LYS  18  13.090   5.459   6.408
  133   1HG   LYS  18          1HG       LYS  18  10.942   5.551   5.068
  134   2HG   LYS  18          2HG       LYS  18  11.024   7.297   5.105
  135   1HD   LYS  18          1HD       LYS  18  12.181   7.064   3.150
  136   2HD   LYS  18          2HD       LYS  18  13.539   6.779   4.205
  137   1HE   LYS  18          1HE       LYS  18  11.811   4.770   2.738
  138   2HE   LYS  18          2HE       LYS  18  13.532   5.048   2.516
  139   1HZ   LYS  18          1HZ       LYS  18  12.513   4.083   5.090
  140   2HZ   LYS  18          2HZ       LYS  18  14.009   3.862   4.423
  141   3HZ   LYS  18          3HZ       LYS  18  12.654   3.024   3.892
  142    H    CYS  19           H        CYS  19   9.445   7.800   7.688
  143    HA   CYS  19           HA       CYS  19  10.674   9.994   9.236
  144   1HB   CYS  19          1HB       CYS  19   9.256  11.451   8.158
  145   2HB   CYS  19          2HB       CYS  19  10.013  10.502   6.897
  146    H    ASP  20           H        ASP  20   8.694   7.324   9.761
  147    HA   ASP  20           HA       ASP  20   7.155   6.738  11.210
  148   1HB   ASP  20          1HB       ASP  20   9.071   7.397  12.639
  149   2HB   ASP  20          2HB       ASP  20   8.290   8.954  12.910
  150    H    GLY  21           H        GLY  21   6.304   8.737   9.239
  151   1HA   GLY  21          1HA       GLY  21   4.378  10.482  10.618
  152   2HA   GLY  21          2HA       GLY  21   4.514  10.286   8.865
  153    H    ARG  22           H        ARG  22   2.147  10.269  10.499
  154    HA   ARG  22           HA       ARG  22   1.014   7.621  10.757
  155   1HB   ARG  22          1HB       ARG  22   0.179   9.575  11.986
  156   2HB   ARG  22          2HB       ARG  22  -0.285  10.387  10.498
  157   1HG   ARG  22          1HG       ARG  22  -1.506   7.685  10.939
  158   2HG   ARG  22          2HG       ARG  22  -1.931   8.924  12.117
  159   1HD   ARG  22          1HD       ARG  22  -2.637  10.428  10.197
  160   2HD   ARG  22          2HD       ARG  22  -2.434   9.029   9.123
  161    HE   ARG  22           HE       ARG  22  -4.063   8.514  11.472
  162   1HH1  ARG  22          1HH1      ARG  22  -4.396   9.844   8.178
  163   2HH1  ARG  22          2HH1      ARG  22  -5.926   9.027   7.891
  164   1HH2  ARG  22          1HH2      ARG  22  -6.171   7.676  11.146
  165   2HH2  ARG  22          2HH2      ARG  22  -6.908   7.751   9.582
  166    H    ILE  23           H        ILE  23   0.774   6.252   8.959
  167    HA   ILE  23           HA       ILE  23  -0.356   7.561   6.544
  168    HB   ILE  23           HB       ILE  23   1.290   5.071   6.249
  169   1HG1  ILE  23          1HG1      ILE  23   2.345   7.916   5.899
  170   2HG1  ILE  23          2HG1      ILE  23   2.859   6.766   7.139
  171   1HG2  ILE  23          1HG2      ILE  23   1.082   5.688   3.912
  172   2HG2  ILE  23          2HG2      ILE  23  -0.513   5.968   4.595
  173   3HG2  ILE  23          3HG2      ILE  23   0.558   7.342   4.329
  174   1HD1  ILE  23          1HD1      ILE  23   3.702   5.211   5.464
  175   2HD1  ILE  23          2HD1      ILE  23   3.184   6.312   4.157
  176   3HD1  ILE  23          3HD1      ILE  23   4.443   6.810   5.257
  177    H    GLU  24           H        GLU  24  -2.362   7.155   6.628
  178    HA   GLU  24           HA       GLU  24  -3.582   4.676   7.562
  179   1HB   GLU  24          1HB       GLU  24  -4.466   6.853   7.987
  180   2HB   GLU  24          2HB       GLU  24  -4.581   7.228   6.257
  181   1HG   GLU  24          1HG       GLU  24  -6.311   5.513   6.003
  182   2HG   GLU  24          2HG       GLU  24  -6.049   4.976   7.678
  183    H    LEU  25           H        LEU  25  -2.765   3.038   6.254
  184    HA   LEU  25           HA       LEU  25  -2.267   3.425   3.435
  185   1HB   LEU  25          1HB       LEU  25  -2.423   0.775   4.861
  186   2HB   LEU  25          2HB       LEU  25  -1.637   1.142   3.349
  187    HG   LEU  25           HG       LEU  25  -0.737   1.974   6.146
  188   1HD1  LEU  25          1HD1      LEU  25   0.496   0.129   4.056
  189   2HD1  LEU  25          2HD1      LEU  25  -0.316  -0.385   5.550
  190   3HD1  LEU  25          3HD1      LEU  25   1.194   0.531   5.638
  191   1HD2  LEU  25          1HD2      LEU  25  -0.263   3.777   4.663
  192   2HD2  LEU  25          2HD2      LEU  25   0.412   2.695   3.439
  193   3HD2  LEU  25          3HD2      LEU  25   1.242   2.929   5.010
  194    H    THR  26           H        THR  26  -4.116   4.033   2.500
  195    HA   THR  26           HA       THR  26  -6.582   2.573   2.974
  196    HB   THR  26           HB       THR  26  -6.017   4.968   1.205
  197    HG1  THR  26           1HG      THR  26  -5.587   5.199   3.525
  198   1HG2  THR  26          1HG2      THR  26  -8.612   3.811   2.352
  199   2HG2  THR  26          2HG2      THR  26  -8.151   3.788   0.652
  200   3HG2  THR  26          3HG2      THR  26  -8.479   5.330   1.457
  201    H    VAL  27           H        VAL  27  -6.786   0.680   2.003
  202    HA   VAL  27           HA       VAL  27  -5.974   0.342  -0.840
  203    HB   VAL  27           HB       VAL  27  -5.066  -1.884  -0.405
  204   1HG1  VAL  27          1HG1      VAL  27  -3.895  -0.060   1.712
  205   2HG1  VAL  27          2HG1      VAL  27  -3.119  -1.386   0.828
  206   3HG1  VAL  27          3HG1      VAL  27  -3.598   0.088  -0.033
  207   1HG2  VAL  27          1HG2      VAL  27  -5.885  -1.434   2.521
  208   2HG2  VAL  27          2HG2      VAL  27  -6.560  -2.653   1.414
  209   3HG2  VAL  27          3HG2      VAL  27  -4.877  -2.762   1.929
  210    H    GLU  28           H        GLU  28  -7.746  -0.276  -2.054
  211    HA   GLU  28           HA       GLU  28 -10.232  -0.822  -0.557
  212   1HB   GLU  28          1HB       GLU  28 -10.255  -0.560  -3.551
  213   2HB   GLU  28          2HB       GLU  28 -11.519  -0.247  -2.338
  214   1HG   GLU  28          1HG       GLU  28 -10.104   1.694  -1.567
  215   2HG   GLU  28          2HG       GLU  28  -9.251   1.410  -3.122
  216    H    SER  29           H        SER  29 -10.013  -2.923   0.190
  217    HA   SER  29           HA       SER  29  -9.987  -4.996  -1.820
  218   1HB   SER  29          1HB       SER  29  -7.450  -4.477  -1.088
  219   2HB   SER  29          2HB       SER  29  -7.896  -5.491   0.293
  220    HG   SER  29           HG       SER  29  -7.276  -7.005  -1.235
  221    H    SER  30           H        SER  30 -10.570  -7.016  -0.979
  222    HA   SER  30           HA       SER  30 -12.542  -7.051   1.004
  223   1HB   SER  30          1HB       SER  30 -10.848  -9.436   0.132
  224   2HB   SER  30          2HB       SER  30 -12.551  -9.423   0.617
  225    HG   SER  30           HG       SER  30 -11.347  -8.629  -1.822
  226    H    ALA  31           H        ALA  31 -12.567  -7.853   3.179
  227    HA   ALA  31           HA       ALA  31 -10.488  -6.862   4.712
  228   1HB   ALA  31          1HB       ALA  31 -12.535  -8.978   5.529
  229   2HB   ALA  31          2HB       ALA  31 -11.590  -7.962   6.635
  230   3HB   ALA  31          3HB       ALA  31 -12.783  -7.213   5.558
  231    H    GLU  32           H        GLU  32 -10.940 -10.320   3.802
  232    HA   GLU  32           HA       GLU  32  -8.788 -11.261   5.444
  233   1HB   GLU  32          1HB       GLU  32 -10.303 -12.358   3.066
  234   2HB   GLU  32          2HB       GLU  32  -9.004 -13.261   3.869
  235   1HG   GLU  32          1HG       GLU  32 -10.212 -13.051   6.054
  236   2HG   GLU  32          2HG       GLU  32 -11.548 -12.239   5.228
  237    H    ASP  33           H        ASP  33  -8.982 -10.001   2.185
  238    HA   ASP  33           HA       ASP  33  -6.442 -10.922   1.209
  239   1HB   ASP  33          1HB       ASP  33  -8.349 -10.444  -0.224
  240   2HB   ASP  33          2HB       ASP  33  -8.442  -8.791   0.353
  241    H    LEU  34           H        LEU  34  -7.746  -7.912   2.522
  242    HA   LEU  34           HA       LEU  34  -5.420  -6.345   2.780
  243   1HB   LEU  34          1HB       LEU  34  -7.367  -5.191   2.992
  244   2HB   LEU  34          2HB       LEU  34  -8.173  -6.396   3.959
  245    HG   LEU  34           HG       LEU  34  -5.907  -4.928   5.307
  246   1HD1  LEU  34          1HD1      LEU  34  -7.140  -3.140   4.117
  247   2HD1  LEU  34          2HD1      LEU  34  -7.511  -3.074   5.851
  248   3HD1  LEU  34          3HD1      LEU  34  -8.672  -3.805   4.726
  249   1HD2  LEU  34          1HD2      LEU  34  -8.689  -5.784   6.241
  250   2HD2  LEU  34          2HD2      LEU  34  -7.441  -5.010   7.241
  251   3HD2  LEU  34          3HD2      LEU  34  -7.181  -6.629   6.607
  252    H    ARG  35           H        ARG  35  -6.836  -8.592   4.810
  253    HA   ARG  35           HA       ARG  35  -5.206  -8.355   7.175
  254   1HB   ARG  35          1HB       ARG  35  -7.467  -9.465   7.170
  255   2HB   ARG  35          2HB       ARG  35  -6.752 -10.858   6.364
  256   1HG   ARG  35          1HG       ARG  35  -5.195 -11.179   8.256
  257   2HG   ARG  35          2HG       ARG  35  -5.901  -9.773   9.080
  258   1HD   ARG  35          1HD       ARG  35  -8.073 -10.951   9.191
  259   2HD   ARG  35          2HD       ARG  35  -7.374 -12.325   8.302
  260    HE   ARG  35           HE       ARG  35  -5.800 -11.691  10.601
  261   1HH1  ARG  35          1HH1      ARG  35  -8.805 -13.317   9.713
  262   2HH1  ARG  35          2HH1      ARG  35  -8.841 -14.365  11.086
  263   1HH2  ARG  35          1HH2      ARG  35  -5.802 -13.071  12.436
  264   2HH2  ARG  35          2HH2      ARG  35  -7.077 -14.207  12.681
  265    H    THR  36           H        THR  36  -5.238 -10.686   4.507
  266    HA   THR  36           HA       THR  36  -2.891 -12.123   5.202
  267    HB   THR  36           HB       THR  36  -3.857 -11.447   2.379
  268    HG1  THR  36           1HG      THR  36  -5.528 -12.400   3.558
  269   1HG2  THR  36          1HG2      THR  36  -2.209 -13.789   3.438
  270   2HG2  THR  36          2HG2      THR  36  -1.600 -12.471   2.410
  271   3HG2  THR  36          3HG2      THR  36  -2.806 -13.604   1.778
  272    H    LEU  37           H        LEU  37  -3.240  -9.205   3.127
  273    HA   LEU  37           HA       LEU  37  -0.543  -8.480   2.850
  274   1HB   LEU  37          1HB       LEU  37  -1.739  -7.162   1.523
  275   2HB   LEU  37          2HB       LEU  37  -3.177  -7.304   2.494
  276    HG   LEU  37           HG       LEU  37  -2.298  -5.586   4.059
  277   1HD1  LEU  37          1HD1      LEU  37  -0.475  -4.046   3.126
  278   2HD1  LEU  37          2HD1      LEU  37  -0.365  -4.993   1.656
  279   3HD1  LEU  37          3HD1      LEU  37   0.226  -5.666   3.152
  280   1HD2  LEU  37          1HD2      LEU  37  -2.844  -3.712   2.578
  281   2HD2  LEU  37          2HD2      LEU  37  -3.967  -5.055   2.351
  282   3HD2  LEU  37          3HD2      LEU  37  -2.652  -4.769   1.182
  283    H    GLN  38           H        GLN  38  -2.752  -7.796   5.653
  284    HA   GLN  38           HA       GLN  38  -0.878  -6.224   7.043
  285   1HB   GLN  38          1HB       GLN  38  -3.284  -6.233   7.418
  286   2HB   GLN  38          2HB       GLN  38  -3.207  -7.864   8.079
  287   1HG   GLN  38          1HG       GLN  38  -1.827  -7.102   9.951
  288   2HG   GLN  38          2HG       GLN  38  -1.866  -5.449   9.315
  289   1HE2  GLN  38          1HE2      GLN  38  -4.187  -4.543   8.919
  290   2HE2  GLN  38          2HE2      GLN  38  -5.448  -5.120   9.999
  291    H    GLN  39           H        GLN  39  -1.316  -9.786   6.803
  292    HA   GLN  39           HA       GLN  39   0.436 -10.397   8.981
  293   1HB   GLN  39          1HB       GLN  39  -0.078 -12.238   6.648
  294   2HB   GLN  39          2HB       GLN  39   0.490 -12.620   8.263
  295   1HG   GLN  39          1HG       GLN  39  -2.269 -11.912   7.362
  296   2HG   GLN  39          2HG       GLN  39  -1.725 -13.319   8.237
  297   1HE2  GLN  39          1HE2      GLN  39  -2.993 -10.148   8.485
  298   2HE2  GLN  39          2HE2      GLN  39  -3.019 -10.022  10.251
  299    H    LEU  40           H        LEU  40   0.829  -9.836   5.452
  300    HA   LEU  40           HA       LEU  40   3.643 -10.327   5.309
  301   1HB   LEU  40          1HB       LEU  40   2.350  -8.066   3.814
  302   2HB   LEU  40          2HB       LEU  40   3.748  -9.022   3.396
  303    HG   LEU  40           HG       LEU  40   0.882  -9.959   3.348
  304   1HD1  LEU  40          1HD1      LEU  40   2.754  -9.419   1.027
  305   2HD1  LEU  40          2HD1      LEU  40   1.468  -8.330   1.576
  306   3HD1  LEU  40          3HD1      LEU  40   1.058  -9.932   0.936
  307   1HD2  LEU  40          1HD2      LEU  40   1.629 -11.990   2.251
  308   2HD2  LEU  40          2HD2      LEU  40   2.332 -11.859   3.874
  309   3HD2  LEU  40          3HD2      LEU  40   3.322 -11.501   2.441
  310    H    PHE  41           H        PHE  41   1.815  -7.414   6.363
  311    HA   PHE  41           HA       PHE  41   4.188  -5.830   6.859
  312   1HB   PHE  41          1HB       PHE  41   1.290  -5.587   7.578
  313   2HB   PHE  41          2HB       PHE  41   2.437  -4.724   8.582
  314    HD1  PHE  41           1HD      PHE  41   3.408  -2.681   7.894
  315    HD2  PHE  41           2HD      PHE  41   1.441  -5.196   5.005
  316    HE1  PHE  41           1HE      PHE  41   3.650  -0.911   6.192
  317    HE2  PHE  41           2HE      PHE  41   1.729  -3.421   3.279
  318    HZ   PHE  41           HZ       PHE  41   2.873  -1.321   3.848
  319    H    LEU  42           H        LEU  42   2.263  -7.945   8.979
  320    HA   LEU  42           HA       LEU  42   3.897  -7.601  11.312
  321   1HB   LEU  42          1HB       LEU  42   2.032  -9.754  10.291
  322   2HB   LEU  42          2HB       LEU  42   2.871  -9.952  11.820
  323    HG   LEU  42           HG       LEU  42   1.160  -7.494  11.255
  324   1HD1  LEU  42          1HD1      LEU  42  -0.294  -9.429  10.964
  325   2HD1  LEU  42          2HD1      LEU  42  -0.668  -8.626  12.492
  326   3HD1  LEU  42          3HD1      LEU  42   0.274 -10.136  12.491
  327   1HD2  LEU  42          1HD2      LEU  42   1.040  -7.377  13.723
  328   2HD2  LEU  42          2HD2      LEU  42   2.719  -7.322  13.176
  329   3HD2  LEU  42          3HD2      LEU  42   2.061  -8.825  13.853
  330    H    SER  43           H        SER  43   4.408  -9.542   8.396
  331    HA   SER  43           HA       SER  43   6.478 -11.177   9.546
  332   1HB   SER  43          1HB       SER  43   5.018 -12.150   7.929
  333   2HB   SER  43          2HB       SER  43   5.218 -10.812   6.809
  334    HG   SER  43           HG       SER  43   7.082 -11.513   6.141
  335    H    THR  44           H        THR  44   6.437  -8.982   6.753
  336    HA   THR  44           HA       THR  44   9.262  -8.411   7.021
  337    HB   THR  44           HB       THR  44   8.979  -9.061   4.355
  338    HG1  THR  44           1HG      THR  44   7.267 -10.212   3.983
  339   1HG2  THR  44          1HG2      THR  44   9.904 -11.220   4.941
  340   2HG2  THR  44          2HG2      THR  44   9.393 -11.005   6.640
  341   3HG2  THR  44          3HG2      THR  44  10.623  -9.921   5.937
  342    H    LEU  45           H        LEU  45   6.267  -7.342   6.009
  343    HA   LEU  45           HA       LEU  45   7.271  -5.320   4.113
  344   1HB   LEU  45          1HB       LEU  45   4.747  -6.676   4.556
  345   2HB   LEU  45          2HB       LEU  45   4.452  -4.961   4.601
  346    HG   LEU  45           HG       LEU  45   5.726  -4.791   2.438
  347   1HD1  LEU  45          1HD1      LEU  45   6.987  -6.944   2.597
  348   2HD1  LEU  45          2HD1      LEU  45   5.958  -6.971   1.144
  349   3HD1  LEU  45          3HD1      LEU  45   5.463  -7.820   2.608
  350   1HD2  LEU  45          1HD2      LEU  45   3.921  -5.693   1.002
  351   2HD2  LEU  45          2HD2      LEU  45   3.301  -4.767   2.370
  352   3HD2  LEU  45          3HD2      LEU  45   3.243  -6.544   2.402
  353    H    SER  46           H        SER  46   7.260  -3.062   4.217
  354    HA   SER  46           HA       SER  46   5.912  -1.767   6.451
  355   1HB   SER  46          1HB       SER  46   7.956  -0.162   6.398
  356   2HB   SER  46          2HB       SER  46   8.004  -1.655   7.346
  357    HG   SER  46           HG       SER  46   9.705  -0.830   5.381
  358    H    PHE  47           H        PHE  47   5.977   0.785   5.830
  359    HA   PHE  47           HA       PHE  47   5.412   1.027   2.945
  360   1HB   PHE  47          1HB       PHE  47   3.310   0.745   4.482
  361   2HB   PHE  47          2HB       PHE  47   3.662   2.372   5.004
  362    HD1  PHE  47           1HD      PHE  47   2.457   0.245   2.227
  363    HD2  PHE  47           2HD      PHE  47   3.480   4.267   3.365
  364    HE1  PHE  47           1HE      PHE  47   1.227   1.127   0.272
  365    HE2  PHE  47           2HE      PHE  47   2.290   5.141   1.381
  366    HZ   PHE  47           HZ       PHE  47   1.145   3.566  -0.169
  367    H    VAL  48           H        VAL  48   5.428   3.179   2.214
  368    HA   VAL  48           HA       VAL  48   7.045   5.077   3.652
  369    HB   VAL  48           HB       VAL  48   8.363   4.814   1.189
  370   1HG1  VAL  48          1HG1      VAL  48  10.178   3.829   2.585
  371   2HG1  VAL  48          2HG1      VAL  48   9.439   5.284   3.319
  372   3HG1  VAL  48          3HG1      VAL  48   9.041   3.649   3.918
  373   1HG2  VAL  48          1HG2      VAL  48   7.331   2.526   0.865
  374   2HG2  VAL  48          2HG2      VAL  48   9.094   2.573   0.924
  375   3HG2  VAL  48          3HG2      VAL  48   8.175   2.010   2.334
  376    H    CYS  49           H        CYS  49   5.970   6.937   3.396
  377    HA   CYS  49           HA       CYS  49   3.779   7.286   1.547
  378   1HB   CYS  49          1HB       CYS  49   3.924   9.672   2.374
  379   2HB   CYS  49          2HB       CYS  49   3.769   8.466   3.630
  380    HA   PRO  50           HA       PRO  50   5.750   8.801  -2.101
  381   1HB   PRO  50          1HB       PRO  50   4.241  11.017  -2.847
  382   2HB   PRO  50          2HB       PRO  50   3.797   9.307  -3.124
  383   1HG   PRO  50          1HG       PRO  50   2.944  11.113  -0.843
  384   2HG   PRO  50          2HG       PRO  50   1.919  10.034  -1.845
  385   1HD   PRO  50          1HD       PRO  50   2.743   9.235   0.578
  386   2HD   PRO  50          2HD       PRO  50   2.791   8.087  -0.788
  387    H    TRP  51           H        TRP  51   5.307  11.116   0.563
  388    HA   TRP  51           HA       TRP  51   7.203  13.048  -0.330
  389   1HB   TRP  51          1HB       TRP  51   5.637  13.345   1.614
  390   2HB   TRP  51          2HB       TRP  51   6.645  12.240   2.550
  391    HD1  TRP  51           HD       TRP  51   6.613  15.682   0.986
  392    HE1  TRP  51           1HE      TRP  51   8.554  17.128   1.878
  393    HE3  TRP  51           3HE      TRP  51   9.127  12.108   3.632
  394    HZ2  TRP  51           2HZ      TRP  51  10.933  16.741   3.472
  395    HZ3  TRP  51           3HZ      TRP  51  11.265  12.636   4.737
  396    HH2  TRP  51           HH       TRP  51  12.171  14.948   4.688
  397    H    CYS  52           H        CYS  52   7.584  10.027   1.609
  398    HA   CYS  52           HA       CYS  52  10.476  10.272   1.732
  399   1HB   CYS  52          1HB       CYS  52   8.528   8.035   2.379
  400   2HB   CYS  52          2HB       CYS  52  10.278   7.891   2.536
  401    H    ALA  53           H        ALA  53   8.162   8.678  -0.491
  402    HA   ALA  53           HA       ALA  53  10.093   7.254  -2.022
  403   1HB   ALA  53          1HB       ALA  53   7.541   7.230  -2.288
  404   2HB   ALA  53          2HB       ALA  53   7.722   8.735  -3.215
  405   3HB   ALA  53          3HB       ALA  53   8.494   7.252  -3.788
  406    H    THR  54           H        THR  54   9.188  10.671  -1.974
  407    HA   THR  54           HA       THR  54  10.874  11.410  -4.220
  408    HB   THR  54           HB       THR  54   9.381  13.145  -2.209
  409    HG1  THR  54           1HG      THR  54   7.889  11.806  -3.116
  410   1HG2  THR  54          1HG2      THR  54  10.285  13.705  -5.063
  411   2HG2  THR  54          2HG2      THR  54  10.954  14.445  -3.590
  412   3HG2  THR  54          3HG2      THR  54   9.280  14.777  -4.064
  413    H    ASN  55           H        ASN  55  11.053  11.864  -0.646
  414    HA   ASN  55           HA       ASN  55  13.604  13.361  -0.960
  415   1HB   ASN  55          1HB       ASN  55  11.653  13.195   1.379
  416   2HB   ASN  55          2HB       ASN  55  13.101  14.185   1.321
  417   1HD2  ASN  55          1HD2      ASN  55   9.890  13.741  -0.057
  418   2HD2  ASN  55          2HD2      ASN  55   9.779  15.365  -0.750
  419    H    GLN  56           H        GLN  56  12.495  10.339   0.116
  420    HA   GLN  56           HA       GLN  56  13.285   8.627   1.330
  421   1HB   GLN  56          2HB       GLN  56  15.554   9.196   0.368
  422   2HB   GLN  56          3HB       GLN  56  15.891  10.091   1.855
  423   1HG   GLN  56          2HG       GLN  56  15.821   8.109   3.184
  424   2HG   GLN  56          3HG       GLN  56  15.051   7.176   1.889
  425   1HE2  GLN  56          1HE2      GLN  56  18.098   8.233   3.216
  426   2HE2  GLN  56          2HE2      GLN  56  19.111   7.533   1.958
  427   1H    GLY   1          1H        GLY   1  24.866  -1.554  10.890
  428   1HA   GLY   1          1HA       GLY   1  24.952   0.730  11.403
  429   2HA   GLY   1          2HA       GLY   1  25.931   0.485   9.921
  430    H    SER   2           H        SER   2  25.520   2.764   9.334
  431    HA   SER   2           HA       SER   2  22.828   3.695   8.838
  432   1HB   SER   2          1HB       SER   2  24.858   5.141   9.299
  433   2HB   SER   2          2HB       SER   2  25.429   4.743   7.663
  434    HG   SER   2           HG       SER   2  24.189   6.671   7.709
  435    H    HIS   3           H        HIS   3  21.605   2.500   7.380
  436    HA   HIS   3           HA       HIS   3  22.667   2.067   4.672
  437   1HB   HIS   3          1HB       HIS   3  21.139  -0.095   6.166
  438   2HB   HIS   3          2HB       HIS   3  21.949  -0.213   4.610
  439    HD1  HIS   3           1HD      HIS   3  24.822   0.947   5.742
  440    HD2  HIS   3           2HD      HIS   3  22.400  -2.119   7.294
  441    HE1  HIS   3           1HE      HIS   3  26.395  -0.684   6.962
  442    H    MET   4           H        MET   4  20.911   1.899   3.119
  443    HA   MET   4           HA       MET   4  18.251   1.666   3.891
  444   1HB   MET   4          1HB       MET   4  18.686   4.184   4.399
  445   2HB   MET   4          2HB       MET   4  18.619   4.414   2.652
  446   1HG   MET   4          1HG       MET   4  16.374   3.472   2.576
  447   2HG   MET   4          2HG       MET   4  16.490   2.903   4.239
  448   1HE   MET   4          1HE       MET   4  16.020   4.229   6.349
  449   2HE   MET   4          2HE       MET   4  17.486   5.189   6.053
  450   3HE   MET   4          3HE       MET   4  15.954   6.005   6.429
  451    H    ALA   5           H        ALA   5  19.840   0.204   2.280
  452    HA   ALA   5           HA       ALA   5  19.308   0.870  -0.486
  453   1HB   ALA   5          1HB       ALA   5  21.607   0.044  -1.014
  454   2HB   ALA   5          2HB       ALA   5  21.682   1.376   0.164
  455   3HB   ALA   5          3HB       ALA   5  21.851  -0.313   0.709
  456    H    GLU   6           H        GLU   6  17.962  -0.860   1.389
  457    HA   GLU   6           HA       GLU   6  18.807  -3.592   0.801
  458   1HB   GLU   6          1HB       GLU   6  16.449  -2.605   2.474
  459   2HB   GLU   6          2HB       GLU   6  17.108  -4.229   2.473
  460   1HG   GLU   6          1HG       GLU   6  18.006  -3.177   4.412
  461   2HG   GLU   6          2HG       GLU   6  19.325  -3.302   3.253
  462    HA   PRO   7           HA       PRO   7  15.687  -4.464  -2.309
  463   1HB   PRO   7          1HB       PRO   7  15.396  -7.160  -2.168
  464   2HB   PRO   7          2HB       PRO   7  16.949  -6.403  -2.615
  465   1HG   PRO   7          1HG       PRO   7  16.100  -7.356   0.148
  466   2HG   PRO   7          2HG       PRO   7  17.591  -7.789  -0.755
  467   1HD   PRO   7          1HD       PRO   7  17.559  -5.792   1.080
  468   2HD   PRO   7          2HD       PRO   7  18.533  -5.651  -0.409
  469    H    GLN   8           H        GLN   8  14.575  -3.165  -0.408
  470    HA   GLN   8           HA       GLN   8  12.018  -4.492   0.375
  471   1HB   GLN   8          1HB       GLN   8  14.053  -3.096   2.029
  472   2HB   GLN   8          2HB       GLN   8  12.453  -2.401   2.206
  473   1HG   GLN   8          1HG       GLN   8  12.978  -4.146   3.880
  474   2HG   GLN   8          2HG       GLN   8  11.487  -4.397   2.977
  475   1HE2  GLN   8          1HE2      GLN   8  11.163  -6.388   2.193
  476   2HE2  GLN   8          2HE2      GLN   8  12.364  -7.595   1.840
  477    H    ARG   9           H        ARG   9  13.330  -1.172   0.413
  478    HA   ARG   9           HA       ARG   9  10.980   0.154  -0.229
  479   1HB   ARG   9          1HB       ARG   9  12.975   1.130   0.822
  480   2HB   ARG   9          2HB       ARG   9  13.862   0.944  -0.685
  481   1HG   ARG   9          1HG       ARG   9  11.472   2.461  -1.201
  482   2HG   ARG   9          2HG       ARG   9  12.296   3.164   0.191
  483   1HD   ARG   9          1HD       ARG   9  13.512   2.586  -2.537
  484   2HD   ARG   9          2HD       ARG   9  13.005   4.171  -1.955
  485    HE   ARG   9           HE       ARG   9  15.259   2.516  -0.874
  486   1HH1  ARG   9          1HH1      ARG   9  13.954   5.828  -1.329
  487   2HH1  ARG   9          2HH1      ARG   9  15.406   6.546  -0.676
  488   1HH2  ARG   9          1HH2      ARG   9  17.106   3.593   0.099
  489   2HH2  ARG   9          2HH2      ARG   9  17.082   5.341   0.063
  490    H    HIS  10           H        HIS  10   9.802  -0.661  -1.938
  491    HA   HIS  10           HA       HIS  10  10.965  -0.505  -4.665
  492   1HB   HIS  10          1HB       HIS  10   9.135  -2.587  -3.423
  493   2HB   HIS  10          2HB       HIS  10   9.491  -2.466  -5.146
  494    HD1  HIS  10           1HD      HIS  10  10.375  -4.952  -3.033
  495    HD2  HIS  10           2HD      HIS  10  12.754  -1.817  -4.370
  496    HE1  HIS  10           1HE      HIS  10  12.685  -5.828  -3.029
  497    H    LYS  11           H        LYS  11   9.228  -0.387  -6.343
  498    HA   LYS  11           HA       LYS  11   7.088   1.484  -5.493
  499   1HB   LYS  11          1HB       LYS  11   9.411   2.041  -7.350
  500   2HB   LYS  11          2HB       LYS  11   7.886   2.898  -7.426
  501   1HG   LYS  11          1HG       LYS  11   8.749   4.340  -5.918
  502   2HG   LYS  11          2HG       LYS  11   8.357   3.115  -4.754
  503   1HD   LYS  11          1HD       LYS  11  10.582   3.850  -4.313
  504   2HD   LYS  11          2HD       LYS  11  10.701   2.218  -4.959
  505   1HE   LYS  11          1HE       LYS  11  12.431   3.600  -5.944
  506   2HE   LYS  11          2HE       LYS  11  11.272   3.143  -7.199
  507   1HZ   LYS  11          1HZ       LYS  11  11.895   5.481  -7.319
  508   2HZ   LYS  11          2HZ       LYS  11  11.264   5.768  -5.823
  509   3HZ   LYS  11          3HZ       LYS  11  10.294   5.335  -7.079
  510    H    ILE  12           H        ILE  12   5.446   0.164  -6.006
  511    HA   ILE  12           HA       ILE  12   5.380  -1.210  -8.626
  512    HB   ILE  12           HB       ILE  12   3.236  -1.038  -6.484
  513   1HG1  ILE  12          1HG1      ILE  12   5.061  -3.396  -6.871
  514   2HG1  ILE  12          2HG1      ILE  12   5.317  -2.161  -5.629
  515   1HG2  ILE  12          1HG2      ILE  12   3.599  -2.983  -8.819
  516   2HG2  ILE  12          2HG2      ILE  12   2.196  -2.894  -7.724
  517   3HG2  ILE  12          3HG2      ILE  12   2.516  -1.588  -8.856
  518   1HD1  ILE  12          1HD1      ILE  12   2.982  -2.594  -4.771
  519   2HD1  ILE  12          2HD1      ILE  12   2.935  -4.026  -5.832
  520   3HD1  ILE  12          3HD1      ILE  12   4.143  -3.900  -4.540
  521    H    LEU  13           H        LEU  13   5.125   0.351 -10.233
  522    HA   LEU  13           HA       LEU  13   3.474   2.667  -9.890
  523   1HB   LEU  13          1HB       LEU  13   5.384   2.574 -11.452
  524   2HB   LEU  13          2HB       LEU  13   4.472   1.485 -12.506
  525    HG   LEU  13           HG       LEU  13   3.174   4.088 -11.613
  526   1HD1  LEU  13          1HD1      LEU  13   5.389   4.780 -12.215
  527   2HD1  LEU  13          2HD1      LEU  13   4.245   5.273 -13.489
  528   3HD1  LEU  13          3HD1      LEU  13   5.311   3.871 -13.745
  529   1HD2  LEU  13          1HD2      LEU  13   3.095   2.547 -14.250
  530   2HD2  LEU  13          2HD2      LEU  13   2.225   4.061 -13.913
  531   3HD2  LEU  13          3HD2      LEU  13   1.807   2.601 -13.032
  532    H    CYS  14           H        CYS  14   1.413   2.541  -9.647
  533    HA   CYS  14           HA       CYS  14  -0.208   0.756 -11.386
  534   1HB   CYS  14          1HB       CYS  14  -0.444   1.398  -8.426
  535   2HB   CYS  14          2HB       CYS  14  -1.860   0.884  -9.320
  536    HG   CYS  14           HG       CYS  14  -0.794  -1.330 -10.301
  537    H    VAL  15           H        VAL  15  -2.686   1.824 -10.907
  538    HA   VAL  15           HA       VAL  15  -2.411   4.745 -11.019
  539    HB   VAL  15           HB       VAL  15  -4.519   4.874 -12.281
  540   1HG1  VAL  15          1HG1      VAL  15  -3.579   4.415 -14.476
  541   2HG1  VAL  15          2HG1      VAL  15  -2.341   5.109 -13.417
  542   3HG1  VAL  15          3HG1      VAL  15  -2.332   3.365 -13.770
  543   1HG2  VAL  15          1HG2      VAL  15  -4.195   1.882 -12.798
  544   2HG2  VAL  15          2HG2      VAL  15  -5.456   2.628 -11.786
  545   3HG2  VAL  15          3HG2      VAL  15  -5.402   2.969 -13.516
  546    H    CYS  16           H        CYS  16  -4.147   5.824  -9.977
  547    HA   CYS  16           HA       CYS  16  -5.125   4.631  -7.547
  548   1HB   CYS  16          1HB       CYS  16  -4.829   7.125  -7.945
  549   2HB   CYS  16          2HB       CYS  16  -6.221   7.050  -9.045
  550    H    CYS  17           H        CYS  17  -6.903   3.510  -7.173
  551    HA   CYS  17           HA       CYS  17  -8.476   2.155  -9.039
  552   1HB   CYS  17          1HB       CYS  17  -8.181   1.674  -6.580
  553   2HB   CYS  17          2HB       CYS  17  -9.192   3.075  -6.216
  554    HG   CYS  17           HG       CYS  17 -10.918   1.585  -5.855
  555    H    LYS  18           H        LYS  18  -9.050   5.381  -7.580
  556    HA   LYS  18           HA       LYS  18 -11.535   5.633  -9.188
  557   1HB   LYS  18          1HB       LYS  18 -12.388   6.911  -7.309
  558   2HB   LYS  18          2HB       LYS  18 -12.115   5.214  -6.933
  559   1HG   LYS  18          1HG       LYS  18 -10.124   5.784  -5.583
  560   2HG   LYS  18          2HG       LYS  18 -10.197   7.459  -6.110
  561   1HD   LYS  18          1HD       LYS  18 -11.391   7.834  -4.258
  562   2HD   LYS  18          2HD       LYS  18 -12.752   7.217  -5.124
  563   1HE   LYS  18          1HE       LYS  18 -10.949   5.600  -3.262
  564   2HE   LYS  18          2HE       LYS  18 -12.522   6.306  -2.849
  565   1HZ   LYS  18          1HZ       LYS  18 -13.471   4.863  -4.634
  566   2HZ   LYS  18          2HZ       LYS  18 -12.786   3.995  -3.376
  567   3HZ   LYS  18          3HZ       LYS  18 -11.975   4.073  -4.692
  568    H    CYS  19           H        CYS  19  -8.544   7.303  -8.225
  569    HA   CYS  19           HA       CYS  19  -9.423   9.787  -9.508
  570   1HB   CYS  19          1HB       CYS  19  -6.731   9.143  -8.648
  571   2HB   CYS  19          2HB       CYS  19  -7.422  10.711  -8.939
  572    H    ASP  20           H        ASP  20  -8.209   6.728 -10.503
  573    HA   ASP  20           HA       ASP  20  -7.019   5.925 -12.202
  574   1HB   ASP  20          1HB       ASP  20  -9.310   6.228 -12.994
  575   2HB   ASP  20          2HB       ASP  20  -8.868   7.792 -13.670
  576    H    GLY  21           H        GLY  21  -5.380   7.517 -11.022
  577   1HA   GLY  21          1HA       GLY  21  -3.842   8.873 -13.185
  578   2HA   GLY  21          2HA       GLY  21  -4.023   9.597 -11.569
  579    H    ARG  22           H        ARG  22  -1.545   8.865 -12.776
  580    HA   ARG  22           HA       ARG  22  -0.554   6.276 -12.211
  581   1HB   ARG  22          1HB       ARG  22   0.349   7.787 -13.883
  582   2HB   ARG  22          2HB       ARG  22   0.758   9.001 -12.683
  583   1HG   ARG  22          1HG       ARG  22   2.025   6.249 -12.533
  584   2HG   ARG  22          2HG       ARG  22   2.550   7.412 -13.749
  585   1HD   ARG  22          1HD       ARG  22   2.903   9.085 -11.802
  586   2HD   ARG  22          2HD       ARG  22   2.781   7.669 -10.742
  587    HE   ARG  22           HE       ARG  22   4.591   7.230 -12.937
  588   1HH1  ARG  22          1HH1      ARG  22   4.609   8.953  -9.769
  589   2HH1  ARG  22          2HH1      ARG  22   6.231   8.302  -9.437
  590   1HH2  ARG  22          1HH2      ARG  22   6.835   6.706 -12.372
  591   2HH2  ARG  22          2HH2      ARG  22   7.331   7.188 -10.744
  592    H    ILE  23           H        ILE  23  -0.071   5.366 -10.256
  593    HA   ILE  23           HA       ILE  23   0.970   7.209  -8.199
  594    HB   ILE  23           HB       ILE  23  -0.490   4.650  -7.474
  595   1HG1  ILE  23          1HG1      ILE  23  -1.651   7.446  -7.115
  596   2HG1  ILE  23          2HG1      ILE  23  -2.161   6.316  -8.369
  597   1HG2  ILE  23          1HG2      ILE  23  -0.250   5.698  -5.176
  598   2HG2  ILE  23          2HG2      ILE  23   1.305   5.506  -5.954
  599   3HG2  ILE  23          3HG2      ILE  23   0.533   7.100  -5.927
  600   1HD1  ILE  23          1HD1      ILE  23  -2.851   4.654  -6.700
  601   2HD1  ILE  23          2HD1      ILE  23  -2.355   5.727  -5.376
  602   3HD1  ILE  23          3HD1      ILE  23  -3.669   6.203  -6.417
  603    H    GLU  24           H        GLU  24   3.004   6.687  -7.650
  604    HA   GLU  24           HA       GLU  24   4.211   4.122  -8.488
  605   1HB   GLU  24          1HB       GLU  24   5.237   6.143  -9.133
  606   2HB   GLU  24          2HB       GLU  24   5.294   6.777  -7.474
  607   1HG   GLU  24          1HG       GLU  24   6.835   4.912  -6.907
  608   2HG   GLU  24          2HG       GLU  24   6.745   4.354  -8.591
  609    H    LEU  25           H        LEU  25   3.221   2.674  -7.052
  610    HA   LEU  25           HA       LEU  25   2.576   3.429  -4.370
  611   1HB   LEU  25          1HB       LEU  25   2.724   0.640  -5.483
  612   2HB   LEU  25          2HB       LEU  25   1.911   1.131  -4.022
  613    HG   LEU  25           HG       LEU  25   1.109   1.934  -6.861
  614   1HD1  LEU  25          1HD1      LEU  25  -0.008  -0.110  -4.882
  615   2HD1  LEU  25          2HD1      LEU  25   0.743  -0.445  -6.452
  616   3HD1  LEU  25          3HD1      LEU  25  -0.820   0.394  -6.381
  617   1HD2  LEU  25          1HD2      LEU  25   0.490   3.589  -5.095
  618   2HD2  LEU  25          2HD2      LEU  25  -0.301   2.318  -4.181
  619   3HD2  LEU  25          3HD2      LEU  25  -0.934   2.797  -5.783
  620    H    THR  26           H        THR  26   4.295   3.948  -3.144
  621    HA   THR  26           HA       THR  26   6.747   2.397  -3.312
  622    HB   THR  26           HB       THR  26   6.085   4.876  -1.698
  623    HG1  THR  26           1HG      THR  26   5.905   4.954  -4.128
  624   1HG2  THR  26          1HG2      THR  26   8.774   3.743  -2.615
  625   2HG2  THR  26          2HG2      THR  26   8.132   3.616  -0.977
  626   3HG2  THR  26          3HG2      THR  26   8.501   5.207  -1.640
  627    H    VAL  27           H        VAL  27   6.558   0.437  -2.380
  628    HA   VAL  27           HA       VAL  27   5.696   0.328   0.478
  629    HB   VAL  27           HB       VAL  27   4.587  -1.917   0.073
  630   1HG1  VAL  27          1HG1      VAL  27   3.613   0.013  -2.068
  631   2HG1  VAL  27          2HG1      VAL  27   2.716  -1.243  -1.190
  632   3HG1  VAL  27          3HG1      VAL  27   3.315   0.190  -0.333
  633   1HG2  VAL  27          1HG2      VAL  27   5.339  -1.461  -2.893
  634   2HG2  VAL  27          2HG2      VAL  27   6.130  -2.644  -1.842
  635   3HG2  VAL  27          3HG2      VAL  27   4.419  -2.815  -2.214
  636    H    GLU  28           H        GLU  28   7.077  -0.886   1.809
  637    HA   GLU  28           HA       GLU  28   9.723  -1.505   0.630
  638   1HB   GLU  28          1HB       GLU  28   8.717  -0.753   3.320
  639   2HB   GLU  28          2HB       GLU  28  10.074  -1.892   3.246
  640   1HG   GLU  28          1HG       GLU  28  11.457  -0.338   2.104
  641   2HG   GLU  28          2HG       GLU  28  10.125   0.784   1.848
  642    H    SER  29           H        SER  29   9.618  -3.594  -0.240
  643    HA   SER  29           HA       SER  29   8.337  -5.745   1.327
  644   1HB   SER  29          1HB       SER  29   7.626  -4.639  -1.423
  645   2HB   SER  29          2HB       SER  29   6.962  -6.110  -0.689
  646    HG   SER  29           HG       SER  29   6.697  -4.062   1.006
  647    H    SER  30           H        SER  30   9.343  -7.696   0.842
  648    HA   SER  30           HA       SER  30  11.693  -7.758  -0.890
  649   1HB   SER  30          1HB       SER  30  10.049 -10.028   0.311
  650   2HB   SER  30          2HB       SER  30  11.586 -10.220  -0.539
  651    HG   SER  30           HG       SER  30  11.766 -10.109   1.784
  652    H    ALA  31           H        ALA  31  11.787  -8.792  -3.021
  653    HA   ALA  31           HA       ALA  31   9.791  -7.919  -4.680
  654   1HB   ALA  31          1HB       ALA  31  11.722 -10.212  -5.234
  655   2HB   ALA  31          2HB       ALA  31  10.866  -9.244  -6.453
  656   3HB   ALA  31          3HB       ALA  31  12.075  -8.476  -5.408
  657    H    GLU  32           H        GLU  32  10.049 -11.303  -3.453
  658    HA   GLU  32           HA       GLU  32   7.746 -12.194  -4.937
  659   1HB   GLU  32          1HB       GLU  32   9.471 -13.350  -2.769
  660   2HB   GLU  32          2HB       GLU  32   8.077 -14.233  -3.417
  661   1HG   GLU  32          1HG       GLU  32  10.117 -13.177  -5.392
  662   2HG   GLU  32          2HG       GLU  32  10.591 -14.532  -4.396
  663    H    ASP  33           H        ASP  33   8.218 -10.608  -1.871
  664    HA   ASP  33           HA       ASP  33   5.767 -11.461  -0.614
  665   1HB   ASP  33          1HB       ASP  33   8.011 -10.731   0.454
  666   2HB   ASP  33          2HB       ASP  33   7.500  -9.071   0.119
  667    H    LEU  34           H        LEU  34   7.105  -8.771  -2.401
  668    HA   LEU  34           HA       LEU  34   4.823  -7.063  -2.611
  669   1HB   LEU  34          1HB       LEU  34   6.829  -6.044  -3.064
  670   2HB   LEU  34          2HB       LEU  34   7.468  -7.350  -4.018
  671    HG   LEU  34           HG       LEU  34   5.164  -5.760  -5.181
  672   1HD1  LEU  34          1HD1      LEU  34   6.732  -4.046  -4.348
  673   2HD1  LEU  34          2HD1      LEU  34   6.980  -4.195  -6.099
  674   3HD1  LEU  34          3HD1      LEU  34   8.123  -4.952  -4.987
  675   1HD2  LEU  34          1HD2      LEU  34   7.655  -7.039  -6.413
  676   2HD2  LEU  34          2HD2      LEU  34   6.393  -6.149  -7.294
  677   3HD2  LEU  34          3HD2      LEU  34   6.005  -7.676  -6.514
  678    H    ARG  35           H        ARG  35   6.025  -9.581  -4.423
  679    HA   ARG  35           HA       ARG  35   4.156  -9.742  -6.617
  680   1HB   ARG  35          1HB       ARG  35   6.383 -11.003  -6.497
  681   2HB   ARG  35          2HB       ARG  35   5.542 -12.191  -5.501
  682   1HG   ARG  35          1HG       ARG  35   3.846 -12.433  -7.393
  683   2HG   ARG  35          2HG       ARG  35   4.946 -11.444  -8.390
  684   1HD   ARG  35          1HD       ARG  35   6.772 -13.082  -7.773
  685   2HD   ARG  35          2HD       ARG  35   5.530 -14.071  -6.968
  686    HE   ARG  35           HE       ARG  35   4.777 -13.610  -9.660
  687   1HH1  ARG  35          1HH1      ARG  35   7.232 -15.310  -7.709
  688   2HH1  ARG  35          2HH1      ARG  35   7.347 -16.689  -8.748
  689   1HH2  ARG  35          1HH2      ARG  35   5.027 -15.334 -11.154
  690   2HH2  ARG  35          2HH2      ARG  35   6.098 -16.661 -10.849
  691    H    THR  36           H        THR  36   4.337 -11.476  -3.485
  692    HA   THR  36           HA       THR  36   1.846 -12.817  -3.685
  693    HB   THR  36           HB       THR  36   3.240 -11.761  -1.173
  694    HG1  THR  36           1HG      THR  36   4.622 -13.107  -2.377
  695   1HG2  THR  36          1HG2      THR  36   1.234 -14.023  -1.536
  696   2HG2  THR  36          2HG2      THR  36   0.936 -12.482  -0.695
  697   3HG2  THR  36          3HG2      THR  36   2.112 -13.633  -0.040
  698    H    LEU  37           H        LEU  37   2.589  -9.597  -2.236
  699    HA   LEU  37           HA       LEU  37  -0.061  -8.722  -1.868
  700   1HB   LEU  37          1HB       LEU  37   1.189  -7.190  -0.863
  701   2HB   LEU  37          2HB       LEU  37   2.612  -7.660  -1.732
  702    HG   LEU  37           HG       LEU  37   1.794  -6.166  -3.670
  703   1HD1  LEU  37          1HD1      LEU  37  -0.620  -5.814  -2.699
  704   2HD1  LEU  37          2HD1      LEU  37   0.231  -4.302  -2.962
  705   3HD1  LEU  37          3HD1      LEU  37   0.105  -4.982  -1.342
  706   1HD2  LEU  37          1HD2      LEU  37   2.590  -4.098  -2.515
  707   2HD2  LEU  37          2HD2      LEU  37   3.677  -5.462  -2.368
  708   3HD2  LEU  37          3HD2      LEU  37   2.647  -5.011  -0.996
  709    H    GLN  38           H        GLN  38   1.888  -8.713  -4.891
  710    HA   GLN  38           HA       GLN  38   0.027  -7.213  -6.417
  711   1HB   GLN  38          1HB       GLN  38   2.266  -7.366  -7.109
  712   2HB   GLN  38          2HB       GLN  38   2.236  -9.110  -7.078
  713   1HG   GLN  38          1HG       GLN  38   0.577  -9.020  -9.035
  714   2HG   GLN  38          2HG       GLN  38   1.087  -7.327  -9.195
  715   1HE2  GLN  38          1HE2      GLN  38   3.552  -6.993  -9.305
  716   2HE2  GLN  38          2HE2      GLN  38   4.533  -8.278  -9.981
  717    H    GLN  39           H        GLN  39   0.203 -10.711  -5.519
  718    HA   GLN  39           HA       GLN  39  -1.896 -11.482  -7.319
  719   1HB   GLN  39          1HB       GLN  39  -1.163 -12.965  -4.803
  720   2HB   GLN  39          2HB       GLN  39  -1.998 -13.547  -6.235
  721   1HG   GLN  39          1HG       GLN  39   0.910 -12.989  -5.838
  722   2HG   GLN  39          2HG       GLN  39   0.140 -14.429  -6.442
  723   1HE2  GLN  39          1HE2      GLN  39   1.707 -11.546  -7.261
  724   2HE2  GLN  39          2HE2      GLN  39   1.583 -11.605  -9.012
  725    H    LEU  40           H        LEU  40  -1.727 -10.311  -3.938
  726    HA   LEU  40           HA       LEU  40  -4.544 -10.425  -3.399
  727   1HB   LEU  40          1HB       LEU  40  -2.529  -8.443  -2.301
  728   2HB   LEU  40          2HB       LEU  40  -4.130  -8.730  -1.690
  729    HG   LEU  40           HG       LEU  40  -1.921 -10.828  -1.740
  730   1HD1  LEU  40          1HD1      LEU  40  -1.394  -8.990  -0.189
  731   2HD1  LEU  40          2HD1      LEU  40  -1.793 -10.471   0.691
  732   3HD1  LEU  40          3HD1      LEU  40  -2.989  -9.160   0.556
  733   1HD2  LEU  40          1HD2      LEU  40  -3.368 -12.103  -0.203
  734   2HD2  LEU  40          2HD2      LEU  40  -4.162 -11.869  -1.763
  735   3HD2  LEU  40          3HD2      LEU  40  -4.638 -10.874  -0.374
  736    H    PHE  41           H        PHE  41  -2.566  -8.123  -5.215
  737    HA   PHE  41           HA       PHE  41  -4.576  -6.138  -5.711
  738   1HB   PHE  41          1HB       PHE  41  -1.926  -6.269  -6.145
  739   2HB   PHE  41          2HB       PHE  41  -2.460  -6.704  -7.763
  740    HD1  PHE  41           1HD      PHE  41  -4.366  -5.045  -8.768
  741    HD2  PHE  41           2HD      PHE  41  -1.513  -4.057  -5.681
  742    HE1  PHE  41           1HE      PHE  41  -4.630  -2.640  -9.282
  743    HE2  PHE  41           2HE      PHE  41  -1.767  -1.671  -6.212
  744    HZ   PHE  41           HZ       PHE  41  -3.343  -0.935  -8.001
  745    H    LEU  42           H        LEU  42  -3.510  -8.957  -7.589
  746    HA   LEU  42           HA       LEU  42  -5.503  -8.764  -9.636
  747   1HB   LEU  42          1HB       LEU  42  -3.798 -11.024  -8.539
  748   2HB   LEU  42          2HB       LEU  42  -4.902 -11.278  -9.882
  749    HG   LEU  42           HG       LEU  42  -2.732  -9.133  -9.950
  750   1HD1  LEU  42          1HD1      LEU  42  -1.639 -11.293  -9.629
  751   2HD1  LEU  42          2HD1      LEU  42  -1.390 -10.732 -11.283
  752   3HD1  LEU  42          3HD1      LEU  42  -2.584 -12.009 -10.949
  753   1HD2  LEU  42          1HD2      LEU  42  -3.037  -9.319 -12.404
  754   2HD2  LEU  42          2HD2      LEU  42  -4.537  -8.831 -11.611
  755   3HD2  LEU  42          3HD2      LEU  42  -4.334 -10.509 -12.157
  756    H    SER  43           H        SER  43  -5.602 -10.242  -6.434
  757    HA   SER  43           HA       SER  43  -8.164 -11.493  -6.588
  758   1HB   SER  43          1HB       SER  43  -6.894 -12.159  -4.796
  759   2HB   SER  43          2HB       SER  43  -6.236 -10.584  -4.510
  760    HG   SER  43           HG       SER  43  -7.451 -10.492  -2.895
  761    H    THR  44           H        THR  44  -7.526  -8.533  -4.735
  762    HA   THR  44           HA       THR  44  -9.627  -7.150  -6.165
  763    HB   THR  44           HB       THR  44 -10.728  -6.324  -4.018
  764    HG1  THR  44           1HG      THR  44  -9.103  -7.216  -2.501
  765   1HG2  THR  44          1HG2      THR  44 -12.224  -8.174  -3.894
  766   2HG2  THR  44          2HG2      THR  44 -10.984  -9.296  -4.510
  767   3HG2  THR  44          3HG2      THR  44 -11.662  -8.040  -5.573
  768    H    LEU  45           H        LEU  45  -6.872  -6.977  -4.231
  769    HA   LEU  45           HA       LEU  45  -7.195  -4.522  -3.100
  770   1HB   LEU  45          1HB       LEU  45  -5.508  -6.307  -2.508
  771   2HB   LEU  45          2HB       LEU  45  -4.432  -5.644  -3.713
  772    HG   LEU  45           HG       LEU  45  -5.574  -3.570  -1.929
  773   1HD1  LEU  45          1HD1      LEU  45  -5.408  -5.502  -0.342
  774   2HD1  LEU  45          2HD1      LEU  45  -4.357  -4.136   0.024
  775   3HD1  LEU  45          3HD1      LEU  45  -3.687  -5.621  -0.727
  776   1HD2  LEU  45          1HD2      LEU  45  -2.707  -4.318  -2.633
  777   2HD2  LEU  45          2HD2      LEU  45  -3.246  -2.847  -1.787
  778   3HD2  LEU  45          3HD2      LEU  45  -3.707  -3.118  -3.477
  779    H    SER  46           H        SER  46  -7.749  -2.696  -4.057
  780    HA   SER  46           HA       SER  46  -6.146  -1.745  -6.342
  781   1HB   SER  46          1HB       SER  46  -8.937  -0.974  -5.425
  782   2HB   SER  46          2HB       SER  46  -8.139  -0.535  -6.946
  783    HG   SER  46           HG       SER  46  -8.739  -3.243  -6.187
  784    H    PHE  47           H        PHE  47  -5.686   0.548  -6.175
  785    HA   PHE  47           HA       PHE  47  -5.043   1.229  -3.374
  786   1HB   PHE  47          1HB       PHE  47  -3.269   0.694  -5.561
  787   2HB   PHE  47          2HB       PHE  47  -3.090   2.371  -5.080
  788    HD1  PHE  47           1HD      PHE  47  -2.539  -1.108  -4.113
  789    HD2  PHE  47           2HD      PHE  47  -2.580   2.948  -2.633
  790    HE1  PHE  47           1HE      PHE  47  -1.159  -1.794  -2.171
  791    HE2  PHE  47           2HE      PHE  47  -1.259   2.239  -0.670
  792    HZ   PHE  47           HZ       PHE  47  -0.536  -0.138  -0.440
  793    H    VAL  48           H        VAL  48  -4.745   3.207  -2.812
  794    HA   VAL  48           HA       VAL  48  -6.437   5.218  -4.023
  795    HB   VAL  48           HB       VAL  48  -6.659   4.659  -1.066
  796   1HG1  VAL  48          1HG1      VAL  48  -8.317   6.172  -1.959
  797   2HG1  VAL  48          2HG1      VAL  48  -8.764   5.007  -3.259
  798   3HG1  VAL  48          3HG1      VAL  48  -9.153   4.684  -1.573
  799   1HG2  VAL  48          1HG2      VAL  48  -6.614   2.327  -1.954
  800   2HG2  VAL  48          2HG2      VAL  48  -8.203   2.770  -1.396
  801   3HG2  VAL  48          3HG2      VAL  48  -7.822   2.827  -3.151
  802    H    CYS  49           H        CYS  49  -5.065   6.907  -4.319
  803    HA   CYS  49           HA       CYS  49  -2.609   7.316  -2.808
  804   1HB   CYS  49          1HB       CYS  49  -2.727   9.582  -4.044
  805   2HB   CYS  49          2HB       CYS  49  -2.527   8.120  -4.984
  806    HA   PRO  50           HA       PRO  50  -3.952   9.415   0.720
  807   1HB   PRO  50          1HB       PRO  50  -2.546  11.886   0.740
  808   2HB   PRO  50          2HB       PRO  50  -2.051  10.315   1.433
  809   1HG   PRO  50          1HG       PRO  50  -1.372  11.488  -1.266
  810   2HG   PRO  50          2HG       PRO  50  -0.311  10.575  -0.145
  811   1HD   PRO  50          1HD       PRO  50  -1.344   9.343  -2.276
  812   2HD   PRO  50          2HD       PRO  50  -1.354   8.512  -0.701
  813    H    TRP  51           H        TRP  51  -4.401  11.259  -2.244
  814    HA   TRP  51           HA       TRP  51  -6.187  13.251  -1.256
  815   1HB   TRP  51          1HB       TRP  51  -5.114  13.463  -3.419
  816   2HB   TRP  51          2HB       TRP  51  -5.848  11.968  -3.989
  817    HD1  TRP  51           HD       TRP  51  -8.119  14.365  -2.106
  818    HE1  TRP  51           1HE      TRP  51  -9.864  15.258  -3.610
  819    HE3  TRP  51           3HE      TRP  51  -6.119  12.785  -6.559
  820    HZ2  TRP  51           2HZ      TRP  51 -10.329  15.447  -6.534
  821    HZ3  TRP  51           3HZ      TRP  51  -7.242  13.360  -8.694
  822    HH2  TRP  51           HH       TRP  51  -9.342  14.681  -8.693
  823    H    CYS  52           H        CYS  52  -7.010  10.200  -3.084
  824    HA   CYS  52           HA       CYS  52  -9.765  10.246  -2.279
  825   1HB   CYS  52          1HB       CYS  52  -9.495   7.686  -2.855
  826   2HB   CYS  52          2HB       CYS  52  -9.540   8.871  -4.055
  827    H    ALA  53           H        ALA  53  -6.824   9.052  -0.661
  828    HA   ALA  53           HA       ALA  53  -8.294   7.435   1.100
  829   1HB   ALA  53          1HB       ALA  53  -5.801   7.420   1.004
  830   2HB   ALA  53          2HB       ALA  53  -5.781   9.045   1.744
  831   3HB   ALA  53          3HB       ALA  53  -6.377   7.676   2.672
  832    H    THR  54           H        THR  54  -7.468  10.886   1.158
  833    HA   THR  54           HA       THR  54  -8.821  11.526   3.620
  834    HB   THR  54           HB       THR  54  -7.826  13.359   1.394
  835    HG1  THR  54           1HG      THR  54  -6.088  12.151   1.933
  836   1HG2  THR  54          1HG2      THR  54  -7.364  14.938   3.259
  837   2HG2  THR  54          2HG2      THR  54  -8.150  13.816   4.392
  838   3HG2  THR  54          3HG2      THR  54  -9.090  14.602   3.102
  839    H    ASN  55           H        ASN  55  -9.905  11.365   0.247
  840    HA   ASN  55           HA       ASN  55 -12.423  12.849   0.980
  841   1HB   ASN  55          1HB       ASN  55 -11.049  12.437  -1.701
  842   2HB   ASN  55          2HB       ASN  55 -12.599  13.237  -1.478
  843   1HD2  ASN  55          1HD2      ASN  55 -10.895  14.128   1.278
  844   2HD2  ASN  55          2HD2      ASN  55 -10.040  15.489   0.598
  845    H    GLN  56           H        GLN  56 -11.375   9.869   0.146
  846    HA   GLN  56           HA       GLN  56 -12.260   7.854  -0.473
  847   1HB   GLN  56          2HB       GLN  56 -14.108   8.302   1.172
  848   2HB   GLN  56          3HB       GLN  56 -15.074   8.941  -0.160
  849   1HG   GLN  56          2HG       GLN  56 -15.215   6.810  -1.220
  850   2HG   GLN  56          3HG       GLN  56 -13.860   6.162  -0.306
  851   1HE2  GLN  56          1HE2      GLN  56 -17.207   6.087  -0.542
  852   2HE2  GLN  56          2HE2      GLN  56 -17.543   5.505   1.079
  Start of MODEL    3
    1   1H    GLY   1          1H        GLY   1 -16.813   5.177 -14.993
    2   1HA   GLY   1          1HA       GLY   1 -18.369   3.692 -13.922
    3   2HA   GLY   1          2HA       GLY   1 -17.115   2.433 -13.998
    4    H    SER   2           H        SER   2 -17.429   2.499 -11.504
    5    HA   SER   2           HA       SER   2 -15.180   3.737 -10.363
    6   1HB   SER   2          1HB       SER   2 -17.939   4.810  -9.580
    7   2HB   SER   2          2HB       SER   2 -16.497   4.975  -8.562
    8    HG   SER   2           HG       SER   2 -16.258   5.773 -11.233
    9    H    HIS   3           H        HIS   3 -15.288   3.094  -7.870
   10    HA   HIS   3           HA       HIS   3 -17.182   0.944  -7.274
   11   1HB   HIS   3          1HB       HIS   3 -15.172  -0.255  -8.028
   12   2HB   HIS   3          2HB       HIS   3 -14.149   0.760  -7.005
   13    HD1  HIS   3           1HD      HIS   3 -16.826  -2.022  -6.626
   14    HD2  HIS   3           2HD      HIS   3 -13.907   0.117  -4.460
   15    HE1  HIS   3           1HE      HIS   3 -16.655  -3.133  -4.336
   16    H    MET   4           H        MET   4 -17.882   1.188  -5.108
   17    HA   MET   4           HA       MET   4 -16.453   2.370  -3.056
   18   1HB   MET   4          1HB       MET   4 -17.619   4.362  -4.823
   19   2HB   MET   4          2HB       MET   4 -18.585   4.349  -3.354
   20   1HG   MET   4          1HG       MET   4 -16.576   4.602  -1.980
   21   2HG   MET   4          2HG       MET   4 -15.547   4.484  -3.412
   22   1HE   MET   4          1HE       MET   4 -15.023   8.105  -2.178
   23   2HE   MET   4          2HE       MET   4 -15.455   6.736  -1.126
   24   3HE   MET   4          3HE       MET   4 -14.303   6.502  -2.461
   25    H    ALA   5           H        ALA   5 -18.190   2.995  -1.249
   26    HA   ALA   5           HA       ALA   5 -19.731   2.291   0.193
   27   1HB   ALA   5          1HB       ALA   5 -21.470   1.951  -2.273
   28   2HB   ALA   5          2HB       ALA   5 -22.024   2.180  -0.604
   29   3HB   ALA   5          3HB       ALA   5 -21.158   3.489  -1.430
   30    H    GLU   6           H        GLU   6 -17.888   0.269  -0.634
   31    HA   GLU   6           HA       GLU   6 -19.408  -2.202  -0.095
   32   1HB   GLU   6          1HB       GLU   6 -17.495  -1.508  -2.335
   33   2HB   GLU   6          2HB       GLU   6 -17.487  -3.152  -1.725
   34   1HG   GLU   6          1HG       GLU   6 -20.076  -1.836  -2.628
   35   2HG   GLU   6          2HG       GLU   6 -18.970  -2.605  -3.762
   36    HA   PRO   7           HA       PRO   7 -16.022  -2.746   2.800
   37   1HB   PRO   7          1HB       PRO   7 -15.846  -5.437   3.101
   38   2HB   PRO   7          2HB       PRO   7 -17.288  -4.515   3.616
   39   1HG   PRO   7          1HG       PRO   7 -16.907  -6.064   1.036
   40   2HG   PRO   7          2HG       PRO   7 -18.302  -6.105   2.158
   41   1HD   PRO   7          1HD       PRO   7 -18.228  -4.559  -0.110
   42   2HD   PRO   7          2HD       PRO   7 -19.128  -4.061   1.350
   43    H    GLN   8           H        GLN   8 -14.694  -1.723   1.127
   44    HA   GLN   8           HA       GLN   8 -12.488  -3.511   0.291
   45   1HB   GLN   8          1HB       GLN   8 -14.350  -2.989  -1.541
   46   2HB   GLN   8          2HB       GLN   8 -13.506  -1.459  -1.675
   47   1HG   GLN   8          1HG       GLN   8 -12.716  -3.034  -3.337
   48   2HG   GLN   8          2HG       GLN   8 -11.415  -2.670  -2.229
   49   1HE2  GLN   8          1HE2      GLN   8 -13.835  -5.016  -0.936
   50   2HE2  GLN   8          2HE2      GLN   8 -12.847  -6.407  -1.360
   51    H    ARG   9           H        ARG   9 -13.342  -0.018  -0.093
   52    HA   ARG   9           HA       ARG   9 -10.822   1.032   0.444
   53   1HB   ARG   9          1HB       ARG   9 -12.802   2.194  -0.528
   54   2HB   ARG   9          2HB       ARG   9 -13.491   2.326   1.076
   55   1HG   ARG   9          1HG       ARG   9 -10.870   3.434   0.519
   56   2HG   ARG   9          2HG       ARG   9 -12.319   4.331   0.077
   57   1HD   ARG   9          1HD       ARG   9 -12.903   3.859   2.664
   58   2HD   ARG   9          2HD       ARG   9 -11.157   3.751   2.794
   59    HE   ARG   9           HE       ARG   9 -10.935   6.031   2.150
   60   1HH1  ARG   9          1HH1      ARG   9 -14.379   5.104   2.433
   61   2HH1  ARG   9          2HH1      ARG   9 -14.894   6.785   2.531
   62   1HH2  ARG   9          1HH2      ARG   9 -11.800   8.316   2.289
   63   2HH2  ARG   9          2HH2      ARG   9 -13.531   8.420   2.486
   64    H    HIS  10           H        HIS  10  -9.708   0.025   2.165
   65    HA   HIS  10           HA       HIS  10 -10.822   0.421   4.900
   66   1HB   HIS  10          1HB       HIS  10  -9.265  -1.902   3.721
   67   2HB   HIS  10          2HB       HIS  10  -9.633  -1.695   5.435
   68    HD1  HIS  10           1HD      HIS  10 -10.812  -4.101   3.394
   69    HD2  HIS  10           2HD      HIS  10 -12.777  -0.650   4.620
   70    HE1  HIS  10           1HE      HIS  10 -13.242  -4.700   3.499
   71    H    LYS  11           H        LYS  11  -9.107   0.449   6.612
   72    HA   LYS  11           HA       LYS  11  -6.934   2.231   5.626
   73   1HB   LYS  11          1HB       LYS  11  -9.173   2.751   7.595
   74   2HB   LYS  11          2HB       LYS  11  -7.717   3.753   7.455
   75   1HG   LYS  11          1HG       LYS  11  -8.234   4.403   5.220
   76   2HG   LYS  11          2HG       LYS  11  -9.515   3.204   5.040
   77   1HD   LYS  11          1HD       LYS  11 -10.288   5.575   5.344
   78   2HD   LYS  11          2HD       LYS  11 -11.005   4.373   6.444
   79   1HE   LYS  11          1HE       LYS  11  -9.630   5.048   8.275
   80   2HE   LYS  11          2HE       LYS  11  -8.496   5.848   7.204
   81   1HZ   LYS  11          1HZ       LYS  11  -9.577   7.424   8.319
   82   2HZ   LYS  11          2HZ       LYS  11 -11.124   6.861   8.025
   83   3HZ   LYS  11          3HZ       LYS  11 -10.211   7.542   6.804
   84    H    ILE  12           H        ILE  12  -5.255   0.878   6.177
   85    HA   ILE  12           HA       ILE  12  -5.086  -0.113   8.970
   86    HB   ILE  12           HB       ILE  12  -3.002  -0.383   6.779
   87   1HG1  ILE  12          1HG1      ILE  12  -5.049  -2.460   7.654
   88   2HG1  ILE  12          2HG1      ILE  12  -5.167  -1.508   6.172
   89   1HG2  ILE  12          1HG2      ILE  12  -3.359  -1.763   9.477
   90   2HG2  ILE  12          2HG2      ILE  12  -2.048  -2.071   8.311
   91   3HG2  ILE  12          3HG2      ILE  12  -2.159  -0.513   9.115
   92   1HD1  ILE  12          1HD1      ILE  12  -2.970  -2.402   5.413
   93   2HD1  ILE  12          2HD1      ILE  12  -2.999  -3.522   6.804
   94   3HD1  ILE  12          3HD1      ILE  12  -4.258  -3.605   5.561
   95    H    LEU  13           H        LEU  13  -4.889   1.701  10.261
   96    HA   LEU  13           HA       LEU  13  -3.148   3.889   9.648
   97   1HB   LEU  13          1HB       LEU  13  -5.103   4.018  11.165
   98   2HB   LEU  13          2HB       LEU  13  -4.222   3.080  12.374
   99    HG   LEU  13           HG       LEU  13  -2.872   5.526  11.179
  100   1HD1  LEU  13          1HD1      LEU  13  -5.094   6.318  11.563
  101   2HD1  LEU  13          2HD1      LEU  13  -4.005   6.973  12.811
  102   3HD1  LEU  13          3HD1      LEU  13  -5.108   5.631  13.207
  103   1HD2  LEU  13          1HD2      LEU  13  -1.600   4.217  12.841
  104   2HD2  LEU  13          2HD2      LEU  13  -2.928   4.378  14.007
  105   3HD2  LEU  13          3HD2      LEU  13  -2.004   5.804  13.484
  106    H    CYS  14           H        CYS  14  -1.068   3.665   9.458
  107    HA   CYS  14           HA       CYS  14   0.422   2.016  11.452
  108   1HB   CYS  14          1HB       CYS  14   0.075   0.966   9.065
  109   2HB   CYS  14          2HB       CYS  14   1.310   2.135   8.560
  110    HG   CYS  14           HG       CYS  14   1.394  -0.224  10.886
  111    H    VAL  15           H        VAL  15   3.009   2.605  10.471
  112    HA   VAL  15           HA       VAL  15   3.153   5.535  10.326
  113    HB   VAL  15           HB       VAL  15   5.296   5.497  11.571
  114   1HG1  VAL  15          1HG1      VAL  15   4.324   5.467  13.808
  115   2HG1  VAL  15          2HG1      VAL  15   3.227   6.246  12.663
  116   3HG1  VAL  15          3HG1      VAL  15   2.897   4.588  13.213
  117   1HG2  VAL  15          1HG2      VAL  15   4.490   2.701  12.495
  118   2HG2  VAL  15          2HG2      VAL  15   5.840   3.075  11.398
  119   3HG2  VAL  15          3HG2      VAL  15   5.870   3.664  13.063
  120    H    CYS  16           H        CYS  16   4.888   6.273   9.093
  121    HA   CYS  16           HA       CYS  16   5.748   4.572   6.899
  122   1HB   CYS  16          1HB       CYS  16   5.405   7.100   6.715
  123   2HB   CYS  16          2HB       CYS  16   6.837   7.292   7.746
  124    H    CYS  17           H        CYS  17   7.377   3.156   7.064
  125    HA   CYS  17           HA       CYS  17   8.838   2.584   9.349
  126   1HB   CYS  17          1HB       CYS  17   8.501   1.212   7.256
  127   2HB   CYS  17          2HB       CYS  17   9.795   2.147   6.485
  128    HG   CYS  17           HG       CYS  17  10.912   0.026   7.044
  129    H    LYS  18           H        LYS  18   9.743   4.895   6.790
  130    HA   LYS  18           HA       LYS  18  12.397   5.255   8.052
  131   1HB   LYS  18          1HB       LYS  18  13.144   5.980   5.922
  132   2HB   LYS  18          2HB       LYS  18  12.309   4.447   5.750
  133   1HG   LYS  18          1HG       LYS  18  11.037   5.306   4.150
  134   2HG   LYS  18          2HG       LYS  18  10.314   6.440   5.278
  135   1HD   LYS  18          1HD       LYS  18  12.963   7.022   3.853
  136   2HD   LYS  18          2HD       LYS  18  11.401   7.361   3.140
  137   1HE   LYS  18          1HE       LYS  18  11.456   9.338   4.139
  138   2HE   LYS  18          2HE       LYS  18  11.067   8.501   5.640
  139   1HZ   LYS  18          1HZ       LYS  18  12.966  10.014   5.731
  140   2HZ   LYS  18          2HZ       LYS  18  13.769   9.140   4.626
  141   3HZ   LYS  18          3HZ       LYS  18  13.391   8.480   6.161
  142    H    CYS  19           H        CYS  19   9.393   6.907   7.936
  143    HA   CYS  19           HA       CYS  19  10.675   9.513   8.504
  144   1HB   CYS  19          1HB       CYS  19   7.824   9.036   8.299
  145   2HB   CYS  19          2HB       CYS  19   8.690  10.516   8.163
  146    H    ASP  20           H        ASP  20   9.074   6.750   9.966
  147    HA   ASP  20           HA       ASP  20   7.823   6.370  11.686
  148   1HB   ASP  20          1HB       ASP  20  10.015   6.495  12.806
  149   2HB   ASP  20          2HB       ASP  20   9.681   8.176  13.240
  150    H    GLY  21           H        GLY  21   6.612   7.972  10.056
  151   1HA   GLY  21          1HA       GLY  21   5.154   9.954  11.759
  152   2HA   GLY  21          2HA       GLY  21   5.394  10.181  10.022
  153    H    ARG  22           H        ARG  22   2.937   9.975  11.502
  154    HA   ARG  22           HA       ARG  22   1.703   7.387  11.393
  155   1HB   ARG  22          1HB       ARG  22   1.060   9.110  12.959
  156   2HB   ARG  22          2HB       ARG  22   0.653  10.242  11.681
  157   1HG   ARG  22          1HG       ARG  22  -0.852   7.612  11.958
  158   2HG   ARG  22          2HG       ARG  22  -1.192   8.990  13.008
  159   1HD   ARG  22          1HD       ARG  22  -1.469  10.382  10.828
  160   2HD   ARG  22          2HD       ARG  22  -1.585   8.810  10.014
  161    HE   ARG  22           HE       ARG  22  -3.299   8.947  12.314
  162   1HH1  ARG  22          1HH1      ARG  22  -3.195  10.166   8.932
  163   2HH1  ARG  22          2HH1      ARG  22  -4.924   9.797   8.740
  164   1HH2  ARG  22          1HH2      ARG  22  -5.653   8.789  11.906
  165   2HH2  ARG  22          2HH2      ARG  22  -6.158   9.159  10.257
  166    H    ILE  23           H        ILE  23   0.786   6.331   9.684
  167    HA   ILE  23           HA       ILE  23  -0.136   7.997   7.425
  168    HB   ILE  23           HB       ILE  23   0.800   5.130   7.046
  169   1HG1  ILE  23          1HG1      ILE  23   2.440   7.507   6.094
  170   2HG1  ILE  23          2HG1      ILE  23   2.810   6.632   7.580
  171   1HG2  ILE  23          1HG2      ILE  23   0.706   5.975   4.585
  172   2HG2  ILE  23          2HG2      ILE  23  -0.828   5.889   5.408
  173   3HG2  ILE  23          3HG2      ILE  23  -0.009   7.455   5.219
  174   1HD1  ILE  23          1HD1      ILE  23   3.138   4.537   6.405
  175   2HD1  ILE  23          2HD1      ILE  23   2.662   5.251   4.855
  176   3HD1  ILE  23          3HD1      ILE  23   4.128   5.787   5.630
  177    H    GLU  24           H        GLU  24  -2.168   7.286   6.579
  178    HA   GLU  24           HA       GLU  24  -3.649   5.266   8.186
  179   1HB   GLU  24          1HB       GLU  24  -4.311   7.433   8.711
  180   2HB   GLU  24          2HB       GLU  24  -4.492   7.921   7.012
  181   1HG   GLU  24          1HG       GLU  24  -6.409   6.431   6.785
  182   2HG   GLU  24          2HG       GLU  24  -6.102   5.736   8.376
  183    H    LEU  25           H        LEU  25  -2.946   3.598   6.877
  184    HA   LEU  25           HA       LEU  25  -2.446   3.977   4.157
  185   1HB   LEU  25          1HB       LEU  25  -2.766   1.406   5.677
  186   2HB   LEU  25          2HB       LEU  25  -2.028   1.560   4.104
  187    HG   LEU  25           HG       LEU  25  -0.935   2.866   6.642
  188   1HD1  LEU  25          1HD1      LEU  25  -0.188   0.256   5.252
  189   2HD1  LEU  25          2HD1      LEU  25  -0.794   0.463   6.904
  190   3HD1  LEU  25          3HD1      LEU  25   0.820   1.055   6.477
  191   1HD2  LEU  25          1HD2      LEU  25  -0.267   3.904   4.417
  192   2HD2  LEU  25          2HD2      LEU  25   0.326   2.337   3.896
  193   3HD2  LEU  25          3HD2      LEU  25   1.106   3.169   5.263
  194    H    THR  26           H        THR  26  -4.313   4.532   2.957
  195    HA   THR  26           HA       THR  26  -6.714   2.953   3.368
  196    HB   THR  26           HB       THR  26  -6.373   5.214   1.419
  197    HG1  THR  26           1HG      THR  26  -5.931   5.593   3.806
  198   1HG2  THR  26          1HG2      THR  26  -8.758   3.898   2.836
  199   2HG2  THR  26          2HG2      THR  26  -8.360   3.703   1.125
  200   3HG2  THR  26          3HG2      THR  26  -8.863   5.284   1.742
  201    H    VAL  27           H        VAL  27  -6.231   0.895   2.676
  202    HA   VAL  27           HA       VAL  27  -5.393   0.555  -0.169
  203    HB   VAL  27           HB       VAL  27  -4.430  -1.661   0.400
  204   1HG1  VAL  27          1HG1      VAL  27  -3.570   0.178   2.676
  205   2HG1  VAL  27          2HG1      VAL  27  -2.623  -1.061   1.829
  206   3HG1  VAL  27          3HG1      VAL  27  -3.096   0.430   0.994
  207   1HG2  VAL  27          1HG2      VAL  27  -5.568  -1.178   3.223
  208   2HG2  VAL  27          2HG2      VAL  27  -6.069  -2.442   2.087
  209   3HG2  VAL  27          3HG2      VAL  27  -4.447  -2.479   2.783
  210    H    GLU  28           H        GLU  28  -6.804  -0.772  -1.492
  211    HA   GLU  28           HA       GLU  28  -9.532  -0.653  -0.309
  212   1HB   GLU  28          1HB       GLU  28  -8.639   0.948  -2.185
  213   2HB   GLU  28          2HB       GLU  28  -8.866  -0.419  -3.217
  214   1HG   GLU  28          1HG       GLU  28 -11.283  -0.338  -1.880
  215   2HG   GLU  28          2HG       GLU  28 -10.821   1.345  -1.833
  216    H    SER  29           H        SER  29  -9.767  -2.728   0.530
  217    HA   SER  29           HA       SER  29  -8.987  -5.051  -1.112
  218   1HB   SER  29          1HB       SER  29  -7.941  -4.171   1.604
  219   2HB   SER  29          2HB       SER  29  -7.523  -5.649   0.745
  220    HG   SER  29           HG       SER  29  -7.064  -3.619  -0.890
  221    H    SER  30           H        SER  30 -10.313  -6.723  -0.629
  222    HA   SER  30           HA       SER  30 -12.515  -6.594   1.176
  223   1HB   SER  30          1HB       SER  30 -11.077  -9.097   0.186
  224   2HB   SER  30          2HB       SER  30 -12.731  -9.017   0.800
  225    HG   SER  30           HG       SER  30 -12.397  -8.945  -1.589
  226    H    ALA  31           H        ALA  31 -12.786  -7.427   3.339
  227    HA   ALA  31           HA       ALA  31 -10.727  -6.783   4.994
  228   1HB   ALA  31          1HB       ALA  31 -12.999  -8.703   5.650
  229   2HB   ALA  31          2HB       ALA  31 -12.025  -7.787   6.821
  230   3HB   ALA  31          3HB       ALA  31 -13.080  -6.922   5.687
  231    H    GLU  32           H        GLU  32 -11.342 -10.174   3.898
  232    HA   GLU  32           HA       GLU  32  -9.300 -11.218   5.648
  233   1HB   GLU  32          1HB       GLU  32 -11.051 -12.339   3.477
  234   2HB   GLU  32          2HB       GLU  32  -9.790 -13.323   4.226
  235   1HG   GLU  32          1HG       GLU  32 -11.907 -11.925   5.918
  236   2HG   GLU  32          2HG       GLU  32 -12.214 -13.482   5.163
  237    H    ASP  33           H        ASP  33  -9.393  -9.872   2.450
  238    HA   ASP  33           HA       ASP  33  -7.006 -11.139   1.442
  239   1HB   ASP  33          1HB       ASP  33  -9.183 -10.398   0.217
  240   2HB   ASP  33          2HB       ASP  33  -8.500  -8.777   0.267
  241    H    LEU  34           H        LEU  34  -8.150  -8.128   2.782
  242    HA   LEU  34           HA       LEU  34  -5.733  -6.580   3.028
  243   1HB   LEU  34          1HB       LEU  34  -7.794  -5.498   3.334
  244   2HB   LEU  34          2HB       LEU  34  -8.362  -6.639   4.518
  245    HG   LEU  34           HG       LEU  34  -5.856  -5.170   5.277
  246   1HD1  LEU  34          1HD1      LEU  34  -7.161  -3.384   4.180
  247   2HD1  LEU  34          2HD1      LEU  34  -7.121  -3.148   5.934
  248   3HD1  LEU  34          3HD1      LEU  34  -8.578  -3.821   5.165
  249   1HD2  LEU  34          1HD2      LEU  34  -8.443  -5.782   6.773
  250   2HD2  LEU  34          2HD2      LEU  34  -6.993  -5.023   7.464
  251   3HD2  LEU  34          3HD2      LEU  34  -6.930  -6.692   6.902
  252    H    ARG  35           H        ARG  35  -7.321  -8.877   5.067
  253    HA   ARG  35           HA       ARG  35  -5.460  -8.956   7.229
  254   1HB   ARG  35          1HB       ARG  35  -7.759  -9.986   7.215
  255   2HB   ARG  35          2HB       ARG  35  -7.094 -11.327   6.293
  256   1HG   ARG  35          1HG       ARG  35  -5.483 -11.796   8.148
  257   2HG   ARG  35          2HG       ARG  35  -6.256 -10.500   9.108
  258   1HD   ARG  35          1HD       ARG  35  -8.423 -11.642   8.903
  259   2HD   ARG  35          2HD       ARG  35  -7.688 -12.863   7.840
  260    HE   ARG  35           HE       ARG  35  -6.358 -12.816  10.358
  261   1HH1  ARG  35          1HH1      ARG  35  -9.408 -13.795   8.757
  262   2HH1  ARG  35          2HH1      ARG  35  -9.648 -15.205   9.716
  263   1HH2  ARG  35          1HH2      ARG  35  -6.719 -14.653  11.739
  264   2HH2  ARG  35          2HH2      ARG  35  -8.114 -15.655  11.526
  265    H    THR  36           H        THR  36  -5.719 -10.974   4.315
  266    HA   THR  36           HA       THR  36  -3.412 -12.568   4.729
  267    HB   THR  36           HB       THR  36  -4.568 -11.609   2.070
  268    HG1  THR  36           1HG      THR  36  -6.142 -12.664   3.360
  269   1HG2  THR  36          1HG2      THR  36  -2.879 -14.053   2.755
  270   2HG2  THR  36          2HG2      THR  36  -2.351 -12.660   1.780
  271   3HG2  THR  36          3HG2      THR  36  -3.642 -13.718   1.185
  272    H    LEU  37           H        LEU  37  -3.653  -9.402   2.963
  273    HA   LEU  37           HA       LEU  37  -0.819  -9.183   2.717
  274   1HB   LEU  37          1HB       LEU  37  -1.302  -7.497   1.378
  275   2HB   LEU  37          2HB       LEU  37  -2.949  -7.954   1.611
  276    HG   LEU  37           HG       LEU  37  -2.805  -6.235   3.694
  277   1HD1  LEU  37          1HD1      LEU  37  -0.381  -5.660   3.328
  278   2HD1  LEU  37          2HD1      LEU  37  -1.429  -4.258   3.078
  279   3HD1  LEU  37          3HD1      LEU  37  -0.765  -5.135   1.692
  280   1HD2  LEU  37          1HD2      LEU  37  -3.889  -4.631   2.318
  281   2HD2  LEU  37          2HD2      LEU  37  -4.305  -6.212   1.637
  282   3HD2  LEU  37          3HD2      LEU  37  -3.079  -5.225   0.852
  283    H    GLN  38           H        GLN  38  -2.924  -8.403   5.437
  284    HA   GLN  38           HA       GLN  38  -0.987  -6.940   6.960
  285   1HB   GLN  38          1HB       GLN  38  -3.239  -6.719   7.546
  286   2HB   GLN  38          2HB       GLN  38  -3.479  -8.439   7.610
  287   1HG   GLN  38          1HG       GLN  38  -1.867  -8.432   9.660
  288   2HG   GLN  38          2HG       GLN  38  -2.234  -6.700   9.703
  289   1HE2  GLN  38          1HE2      GLN  38  -4.716  -6.205   9.538
  290   2HE2  GLN  38          2HE2      GLN  38  -5.804  -7.353  10.291
  291    H    GLN  39           H        GLN  39  -1.569 -10.467   6.388
  292    HA   GLN  39           HA       GLN  39   0.390 -11.262   8.331
  293   1HB   GLN  39          1HB       GLN  39  -0.418 -12.910   5.945
  294   2HB   GLN  39          2HB       GLN  39   0.312 -13.420   7.460
  295   1HG   GLN  39          1HG       GLN  39  -2.516 -12.621   6.899
  296   2HG   GLN  39          2HG       GLN  39  -1.909 -14.066   7.668
  297   1HE2  GLN  39          1HE2      GLN  39  -3.199 -10.965   8.156
  298   2HE2  GLN  39          2HE2      GLN  39  -3.109 -10.859   9.907
  299    H    LEU  40           H        LEU  40   0.457 -10.385   4.839
  300    HA   LEU  40           HA       LEU  40   3.271 -10.814   4.524
  301   1HB   LEU  40          1HB       LEU  40   1.587  -8.771   3.070
  302   2HB   LEU  40          2HB       LEU  40   3.180  -9.327   2.623
  303    HG   LEU  40           HG       LEU  40   0.706 -11.103   2.753
  304   1HD1  LEU  40          1HD1      LEU  40   0.640  -9.416   0.931
  305   2HD1  LEU  40          2HD1      LEU  40   0.748 -11.076   0.329
  306   3HD1  LEU  40          3HD1      LEU  40   2.194 -10.041   0.338
  307   1HD2  LEU  40          1HD2      LEU  40   2.086 -12.762   1.531
  308   2HD2  LEU  40          2HD2      LEU  40   2.740 -12.439   3.135
  309   3HD2  LEU  40          3HD2      LEU  40   3.508 -11.709   1.712
  310    H    PHE  41           H        PHE  41   1.509  -8.173   6.040
  311    HA   PHE  41           HA       PHE  41   3.682  -6.333   6.516
  312   1HB   PHE  41          1HB       PHE  41   0.957  -6.502   7.093
  313   2HB   PHE  41          2HB       PHE  41   1.708  -6.487   8.669
  314    HD1  PHE  41           1HD      PHE  41   3.532  -4.514   8.971
  315    HD2  PHE  41           2HD      PHE  41   0.314  -4.546   6.096
  316    HE1  PHE  41           1HE      PHE  41   3.586  -2.038   8.872
  317    HE2  PHE  41           2HE      PHE  41   0.342  -2.076   6.034
  318    HZ   PHE  41           HZ       PHE  41   1.999  -0.813   7.404
  319    H    LEU  42           H        LEU  42   2.322  -8.986   8.433
  320    HA   LEU  42           HA       LEU  42   4.347  -8.905  10.477
  321   1HB   LEU  42          1HB       LEU  42   2.312 -10.980   9.588
  322   2HB   LEU  42          2HB       LEU  42   3.356 -11.228  10.983
  323    HG   LEU  42           HG       LEU  42   1.435  -8.868  10.714
  324   1HD1  LEU  42          1HD1      LEU  42   0.188 -10.982  10.767
  325   2HD1  LEU  42          2HD1      LEU  42  -0.023 -10.090  12.278
  326   3HD1  LEU  42          3HD1      LEU  42   1.073 -11.491  12.220
  327   1HD2  LEU  42          1HD2      LEU  42   1.752  -8.682  13.178
  328   2HD2  LEU  42          2HD2      LEU  42   3.253  -8.399  12.296
  329   3HD2  LEU  42          3HD2      LEU  42   2.988  -9.958  13.106
  330    H    SER  43           H        SER  43   4.258 -10.498   7.365
  331    HA   SER  43           HA       SER  43   6.549 -12.183   7.668
  332   1HB   SER  43          1HB       SER  43   5.038 -12.626   5.896
  333   2HB   SER  43          2HB       SER  43   5.033 -10.957   5.389
  334    HG   SER  43           HG       SER  43   6.268 -11.497   3.925
  335    H    THR  44           H        THR  44   6.556  -9.311   5.506
  336    HA   THR  44           HA       THR  44   8.863  -8.287   6.921
  337    HB   THR  44           HB       THR  44  10.315  -8.082   5.005
  338    HG1  THR  44           1HG      THR  44   8.444  -8.217   3.342
  339   1HG2  THR  44          1HG2      THR  44  10.342 -10.161   6.359
  340   2HG2  THR  44          2HG2      THR  44  10.913 -10.393   4.693
  341   3HG2  THR  44          3HG2      THR  44   9.279 -10.924   5.147
  342    H    LEU  45           H        LEU  45   6.082  -7.605   5.328
  343    HA   LEU  45           HA       LEU  45   6.912  -5.216   4.004
  344   1HB   LEU  45          1HB       LEU  45   5.072  -6.651   3.267
  345   2HB   LEU  45          2HB       LEU  45   4.067  -6.133   4.576
  346    HG   LEU  45           HG       LEU  45   5.210  -3.997   2.791
  347   1HD1  LEU  45          1HD1      LEU  45   4.456  -5.708   1.219
  348   2HD1  LEU  45          2HD1      LEU  45   3.327  -4.341   1.226
  349   3HD1  LEU  45          3HD1      LEU  45   2.907  -5.849   2.074
  350   1HD2  LEU  45          1HD2      LEU  45   2.463  -4.387   4.093
  351   2HD2  LEU  45          2HD2      LEU  45   2.992  -2.981   3.137
  352   3HD2  LEU  45          3HD2      LEU  45   3.740  -3.314   4.696
  353    H    SER  46           H        SER  46   7.678  -3.443   4.995
  354    HA   SER  46           HA       SER  46   5.997  -2.122   7.020
  355   1HB   SER  46          1HB       SER  46   8.127  -0.478   6.157
  356   2HB   SER  46          2HB       SER  46   7.967  -1.289   7.717
  357    HG   SER  46           HG       SER  46   9.873  -1.561   5.951
  358    H    PHE  47           H        PHE  47   5.934   0.366   6.276
  359    HA   PHE  47           HA       PHE  47   5.106   0.519   3.444
  360   1HB   PHE  47          1HB       PHE  47   3.302   0.619   5.700
  361   2HB   PHE  47          2HB       PHE  47   3.381   2.209   4.978
  362    HD1  PHE  47           1HD      PHE  47   2.140  -1.164   4.630
  363    HD2  PHE  47           2HD      PHE  47   2.973   2.441   2.416
  364    HE1  PHE  47           1HE      PHE  47   0.597  -1.910   2.837
  365    HE2  PHE  47           2HE      PHE  47   1.452   1.685   0.621
  366    HZ   PHE  47           HZ       PHE  47   0.253  -0.497   0.832
  367    H    VAL  48           H        VAL  48   5.327   2.481   2.500
  368    HA   VAL  48           HA       VAL  48   6.885   4.516   3.819
  369    HB   VAL  48           HB       VAL  48   7.733   2.542   1.732
  370   1HG1  VAL  48          1HG1      VAL  48   8.196   4.889   0.719
  371   2HG1  VAL  48          2HG1      VAL  48   9.446   4.996   1.994
  372   3HG1  VAL  48          3HG1      VAL  48   9.484   3.677   0.830
  373   1HG2  VAL  48          1HG2      VAL  48   8.516   2.235   4.036
  374   2HG2  VAL  48          2HG2      VAL  48   9.886   2.752   3.053
  375   3HG2  VAL  48          3HG2      VAL  48   9.077   3.911   4.112
  376    H    CYS  49           H        CYS  49   5.490   6.148   3.606
  377    HA   CYS  49           HA       CYS  49   3.318   6.388   1.801
  378   1HB   CYS  49          1HB       CYS  49   3.388   8.797   2.626
  379   2HB   CYS  49          2HB       CYS  49   3.278   7.549   3.850
  380    HA   PRO  50           HA       PRO  50   5.146   7.639  -1.957
  381   1HB   PRO  50          1HB       PRO  50   3.341   9.422  -3.088
  382   2HB   PRO  50          2HB       PRO  50   3.172   7.642  -3.046
  383   1HG   PRO  50          1HG       PRO  50   1.989   9.673  -1.131
  384   2HG   PRO  50          2HG       PRO  50   1.170   8.289  -1.924
  385   1HD   PRO  50          1HD       PRO  50   2.040   8.084   0.609
  386   2HD   PRO  50          2HD       PRO  50   2.270   6.722  -0.525
  387    H    TRP  51           H        TRP  51   4.296  10.242   0.242
  388    HA   TRP  51           HA       TRP  51   5.846  12.370  -0.822
  389   1HB   TRP  51          1HB       TRP  51   4.287  12.762   0.971
  390   2HB   TRP  51          2HB       TRP  51   5.066  11.566   2.002
  391    HD1  TRP  51           HD       TRP  51   6.152  14.867   0.269
  392    HE1  TRP  51           1HE      TRP  51   7.694  16.163   1.844
  393    HE3  TRP  51           3HE      TRP  51   6.217  11.599   4.223
  394    HZ2  TRP  51           2HZ      TRP  51   8.795  15.850   4.501
  395    HZ3  TRP  51           3HZ      TRP  51   7.502  12.145   6.266
  396    HH2  TRP  51           HH       TRP  51   8.797  14.255   6.414
  397    H    CYS  52           H        CYS  52   6.785   9.725   1.507
  398    HA   CYS  52           HA       CYS  52   9.586  10.623   1.413
  399   1HB   CYS  52          1HB       CYS  52   9.983   9.080   3.035
  400   2HB   CYS  52          2HB       CYS  52   8.342   9.619   3.344
  401    H    ALA  53           H        ALA  53   7.499   8.240  -0.206
  402    HA   ALA  53           HA       ALA  53   9.566   6.782  -1.208
  403   1HB   ALA  53          1HB       ALA  53   7.099   6.355  -1.657
  404   2HB   ALA  53          2HB       ALA  53   7.152   7.625  -2.902
  405   3HB   ALA  53          3HB       ALA  53   8.121   6.170  -3.109
  406    H    THR  54           H        THR  54   8.267   9.872  -2.216
  407    HA   THR  54           HA       THR  54   9.997  10.432  -4.440
  408    HB   THR  54           HB       THR  54   8.375  12.352  -2.707
  409    HG1  THR  54           1HG      THR  54   6.959  10.786  -3.420
  410   1HG2  THR  54          1HG2      THR  54   8.214  13.680  -4.772
  411   2HG2  THR  54          2HG2      THR  54   9.253  12.512  -5.618
  412   3HG2  THR  54          3HG2      THR  54   9.905  13.485  -4.278
  413    H    ASN  55           H        ASN  55   9.987  11.623  -1.010
  414    HA   ASN  55           HA       ASN  55  12.405  13.187  -1.515
  415   1HB   ASN  55          1HB       ASN  55  10.699  12.783   0.983
  416   2HB   ASN  55          2HB       ASN  55  12.129  13.809   0.923
  417   1HD2  ASN  55          1HD2      ASN  55   8.856  13.384  -0.489
  418   2HD2  ASN  55          2HD2      ASN  55   8.817  15.013  -1.154
  419    H    GLN  56           H        GLN  56  11.779  10.145  -0.152
  420    HA   GLN  56           HA       GLN  56  12.902   8.550   0.968
  421   1HB   GLN  56          2HB       GLN  56  14.716   9.011  -0.781
  422   2HB   GLN  56          3HB       GLN  56  15.570   9.896   0.482
  423   1HG   GLN  56          2HG       GLN  56  15.891   7.937   1.797
  424   2HG   GLN  56          3HG       GLN  56  14.609   7.051   0.972
  425   1HE2  GLN  56          1HE2      GLN  56  17.708   6.659   1.372
  426   2HE2  GLN  56          2HE2      GLN  56  18.199   6.161  -0.240
  427   1H    GLY   1          1H        GLY   1  24.660   9.402  -1.633
  428   1HA   GLY   1          1HA       GLY   1  25.246   9.648   0.708
  429   2HA   GLY   1          2HA       GLY   1  23.626  10.290   0.329
  430    H    SER   2           H        SER   2  24.948   8.867   2.814
  431    HA   SER   2           HA       SER   2  24.709   7.173   4.228
  432   1HB   SER   2          1HB       SER   2  22.599   6.252   4.792
  433   2HB   SER   2          2HB       SER   2  22.291   7.936   4.347
  434    HG   SER   2           HG       SER   2  21.887   7.017   2.153
  435    H    HIS   3           H        HIS   3  23.454   4.595   3.812
  436    HA   HIS   3           HA       HIS   3  24.534   3.623   1.227
  437   1HB   HIS   3          1HB       HIS   3  24.770   2.245   3.928
  438   2HB   HIS   3          2HB       HIS   3  25.074   1.470   2.378
  439    HD1  HIS   3           1HD      HIS   3  26.574   4.722   1.882
  440    HD2  HIS   3           2HD      HIS   3  27.501   1.220   4.039
  441    HE1  HIS   3           1HE      HIS   3  29.119   4.736   2.282
  442    H    MET   4           H        MET   4  21.767   4.528   2.508
  443    HA   MET   4           HA       MET   4  20.172   2.215   2.734
  444   1HB   MET   4          1HB       MET   4  19.453   4.310   3.650
  445   2HB   MET   4          2HB       MET   4  19.459   5.087   2.057
  446   1HG   MET   4          1HG       MET   4  17.623   3.725   1.292
  447   2HG   MET   4          2HG       MET   4  17.694   2.700   2.724
  448   1HE   MET   4          1HE       MET   4  17.537   4.036   5.257
  449   2HE   MET   4          2HE       MET   4  15.821   4.474   5.427
  450   3HE   MET   4          3HE       MET   4  16.276   2.928   4.675
  451    H    ALA   5           H        ALA   5  19.886   0.765   1.257
  452    HA   ALA   5           HA       ALA   5  18.688   1.011  -1.250
  453   1HB   ALA   5          1HB       ALA   5  20.566   0.264  -2.714
  454   2HB   ALA   5          2HB       ALA   5  20.760   1.940  -2.137
  455   3HB   ALA   5          3HB       ALA   5  21.699   0.618  -1.380
  456    H    GLU   6           H        GLU   6  17.544  -0.860  -0.916
  457    HA   GLU   6           HA       GLU   6  18.828  -3.313  -0.044
  458   1HB   GLU   6          1HB       GLU   6  17.308  -3.092   2.053
  459   2HB   GLU   6          2HB       GLU   6  18.821  -2.209   1.987
  460   1HG   GLU   6          1HG       GLU   6  16.985  -0.301   0.975
  461   2HG   GLU   6          2HG       GLU   6  16.043  -1.174   2.082
  462    HA   PRO   7           HA       PRO   7  15.382  -4.706  -2.311
  463   1HB   PRO   7          1HB       PRO   7  15.388  -7.367  -1.823
  464   2HB   PRO   7          2HB       PRO   7  16.828  -6.535  -2.466
  465   1HG   PRO   7          1HG       PRO   7  16.246  -7.214   0.441
  466   2HG   PRO   7          2HG       PRO   7  17.719  -7.600  -0.506
  467   1HD   PRO   7          1HD       PRO   7  17.516  -5.370   1.090
  468   2HD   PRO   7          2HD       PRO   7  18.468  -5.371  -0.422
  469    H    GLN   8           H        GLN   8  14.353  -3.298  -0.193
  470    HA   GLN   8           HA       GLN   8  11.887  -4.824   0.442
  471   1HB   GLN   8          1HB       GLN   8  13.616  -3.384   2.450
  472   2HB   GLN   8          2HB       GLN   8  11.864  -3.365   2.629
  473   1HG   GLN   8          1HG       GLN   8  12.722  -5.146   3.963
  474   2HG   GLN   8          2HG       GLN   8  11.761  -5.810   2.650
  475   1HE2  GLN   8          1HE2      GLN   8  12.735  -7.955   2.402
  476   2HE2  GLN   8          2HE2      GLN   8  14.442  -8.042   2.027
  477    H    ARG   9           H        ARG   9  13.142  -1.445   0.821
  478    HA   ARG   9           HA       ARG   9  10.726  -0.166   0.311
  479   1HB   ARG   9          1HB       ARG   9  12.853   0.791   1.275
  480   2HB   ARG   9          2HB       ARG   9  13.464   0.919  -0.368
  481   1HG   ARG   9          1HG       ARG   9  10.844   2.116  -0.221
  482   2HG   ARG   9          2HG       ARG   9  11.873   2.776   1.066
  483   1HD   ARG   9          1HD       ARG   9  13.631   3.110  -0.770
  484   2HD   ARG   9          2HD       ARG   9  12.332   2.804  -1.940
  485    HE   ARG   9           HE       ARG   9  11.268   4.782  -0.387
  486   1HH1  ARG   9          1HH1      ARG   9  14.367   4.468  -2.036
  487   2HH1  ARG   9          2HH1      ARG   9  14.798   6.141  -1.913
  488   1HH2  ARG   9          1HH2      ARG   9  11.679   7.195  -0.547
  489   2HH2  ARG   9          2HH2      ARG   9  13.075   7.657  -1.412
  490    H    HIS  10           H        HIS  10   9.518  -1.044  -1.395
  491    HA   HIS  10           HA       HIS  10  10.634  -0.832  -4.139
  492   1HB   HIS  10          1HB       HIS  10   8.845  -2.899  -2.805
  493   2HB   HIS  10          2HB       HIS  10   9.217  -2.828  -4.533
  494    HD1  HIS  10           1HD      HIS  10  10.083  -5.291  -2.430
  495    HD2  HIS  10           2HD      HIS  10  12.468  -2.152  -3.739
  496    HE1  HIS  10           1HE      HIS  10  12.380  -6.251  -2.698
  497    H    LYS  11           H        LYS  11   8.742  -1.029  -5.790
  498    HA   LYS  11           HA       LYS  11   6.592   0.871  -5.047
  499   1HB   LYS  11          1HB       LYS  11   8.750   1.317  -7.149
  500   2HB   LYS  11          2HB       LYS  11   7.230   2.193  -7.059
  501   1HG   LYS  11          1HG       LYS  11   8.306   3.683  -5.745
  502   2HG   LYS  11          2HG       LYS  11   8.075   2.511  -4.491
  503   1HD   LYS  11          1HD       LYS  11  10.347   3.188  -4.368
  504   2HD   LYS  11          2HD       LYS  11  10.363   1.559  -5.029
  505   1HE   LYS  11          1HE       LYS  11  11.955   2.917  -6.237
  506   2HE   LYS  11          2HE       LYS  11  10.627   2.491  -7.325
  507   1HZ   LYS  11          1HZ       LYS  11  11.288   4.828  -7.486
  508   2HZ   LYS  11          2HZ       LYS  11  10.817   5.091  -5.925
  509   3HZ   LYS  11          3HZ       LYS  11   9.720   4.675  -7.083
  510    H    ILE  12           H        ILE  12   4.875  -0.367  -5.510
  511    HA   ILE  12           HA       ILE  12   4.754  -1.855  -8.087
  512    HB   ILE  12           HB       ILE  12   2.731  -1.691  -5.821
  513   1HG1  ILE  12          1HG1      ILE  12   4.582  -4.024  -6.368
  514   2HG1  ILE  12          2HG1      ILE  12   4.814  -2.828  -5.086
  515   1HG2  ILE  12          1HG2      ILE  12   2.896  -3.502  -8.280
  516   2HG2  ILE  12          2HG2      ILE  12   1.627  -3.566  -7.032
  517   3HG2  ILE  12          3HG2      ILE  12   1.762  -2.159  -8.070
  518   1HD1  ILE  12          1HD1      ILE  12   2.517  -3.380  -4.201
  519   2HD1  ILE  12          2HD1      ILE  12   2.512  -4.780  -5.307
  520   3HD1  ILE  12          3HD1      ILE  12   3.732  -4.643  -4.032
  521    H    LEU  13           H        LEU  13   4.410  -0.251  -9.707
  522    HA   LEU  13           HA       LEU  13   2.797   2.055  -9.192
  523   1HB   LEU  13          1HB       LEU  13   4.652   1.972 -10.851
  524   2HB   LEU  13          2HB       LEU  13   3.644   0.963 -11.899
  525    HG   LEU  13           HG       LEU  13   2.430   3.524 -10.811
  526   1HD1  LEU  13          1HD1      LEU  13   4.642   4.245 -11.386
  527   2HD1  LEU  13          2HD1      LEU  13   3.475   4.847 -12.590
  528   3HD1  LEU  13          3HD1      LEU  13   4.532   3.466 -12.986
  529   1HD2  LEU  13          1HD2      LEU  13   2.318   2.235 -13.576
  530   2HD2  LEU  13          2HD2      LEU  13   1.403   3.664 -13.039
  531   3HD2  LEU  13          3HD2      LEU  13   1.071   2.092 -12.322
  532    H    CYS  14           H        CYS  14   0.767   2.094  -9.071
  533    HA   CYS  14           HA       CYS  14  -0.952   0.281 -10.648
  534   1HB   CYS  14          1HB       CYS  14  -0.658  -0.267  -8.083
  535   2HB   CYS  14          2HB       CYS  14  -1.670   1.163  -7.830
  536    HG   CYS  14           HG       CYS  14  -2.262  -1.597  -9.567
  537    H    VAL  15           H        VAL  15  -3.400   1.392 -10.042
  538    HA   VAL  15           HA       VAL  15  -3.162   4.299 -10.255
  539    HB   VAL  15           HB       VAL  15  -5.079   4.372 -11.841
  540   1HG1  VAL  15          1HG1      VAL  15  -3.746   4.045 -13.852
  541   2HG1  VAL  15          2HG1      VAL  15  -2.773   4.796 -12.581
  542   3HG1  VAL  15          3HG1      VAL  15  -2.560   3.070 -12.954
  543   1HG2  VAL  15          1HG2      VAL  15  -4.453   1.433 -12.389
  544   2HG2  VAL  15          2HG2      VAL  15  -5.910   2.039 -11.564
  545   3HG2  VAL  15          3HG2      VAL  15  -5.612   2.467 -13.251
  546    H    CYS  16           H        CYS  16  -5.020   5.386  -9.489
  547    HA   CYS  16           HA       CYS  16  -6.050   4.147  -7.111
  548   1HB   CYS  16          1HB       CYS  16  -5.549   6.654  -7.498
  549   2HB   CYS  16          2HB       CYS  16  -7.092   6.703  -8.386
  550    H    CYS  17           H        CYS  17  -7.903   3.122  -6.755
  551    HA   CYS  17           HA       CYS  17  -9.405   2.077  -8.910
  552   1HB   CYS  17          1HB       CYS  17  -9.141   1.231  -6.465
  553   2HB   CYS  17          2HB       CYS  17 -10.512   2.284  -6.090
  554    HG   CYS  17           HG       CYS  17 -11.366  -0.078  -6.296
  555    H    LYS  18           H        LYS  18 -10.109   4.960  -6.881
  556    HA   LYS  18           HA       LYS  18 -12.781   5.124  -8.111
  557   1HB   LYS  18          1HB       LYS  18 -13.460   6.204  -6.183
  558   2HB   LYS  18          2HB       LYS  18 -12.432   4.899  -5.651
  559   1HG   LYS  18          1HG       LYS  18 -11.467   6.458  -4.316
  560   2HG   LYS  18          2HG       LYS  18 -10.535   6.850  -5.743
  561   1HD   LYS  18          1HD       LYS  18 -11.402   8.880  -4.675
  562   2HD   LYS  18          2HD       LYS  18 -12.113   8.712  -6.272
  563   1HE   LYS  18          1HE       LYS  18 -14.126   7.608  -5.074
  564   2HE   LYS  18          2HE       LYS  18 -13.364   8.177  -3.583
  565   1HZ   LYS  18          1HZ       LYS  18 -14.355   9.878  -5.803
  566   2HZ   LYS  18          2HZ       LYS  18 -13.492  10.442  -4.477
  567   3HZ   LYS  18          3HZ       LYS  18 -14.883   9.826  -4.206
  568    H    CYS  19           H        CYS  19  -9.708   6.749  -8.399
  569    HA   CYS  19           HA       CYS  19 -11.029   8.848  -9.980
  570   1HB   CYS  19          1HB       CYS  19  -9.432  10.375  -9.025
  571   2HB   CYS  19          2HB       CYS  19 -10.521   9.728  -7.805
  572    H    ASP  20           H        ASP  20  -8.967   6.209 -10.297
  573    HA   ASP  20           HA       ASP  20  -7.440   5.561 -11.695
  574   1HB   ASP  20          1HB       ASP  20  -9.368   6.200 -13.176
  575   2HB   ASP  20          2HB       ASP  20  -8.477   7.667 -13.595
  576    H    GLY  21           H        GLY  21  -6.602   7.797  -9.891
  577   1HA   GLY  21          1HA       GLY  21  -4.612   9.323 -11.391
  578   2HA   GLY  21          2HA       GLY  21  -4.711   9.236  -9.629
  579    H    ARG  22           H        ARG  22  -2.414   9.026 -11.350
  580    HA   ARG  22           HA       ARG  22  -1.385   6.312 -11.447
  581   1HB   ARG  22          1HB       ARG  22  -0.614   8.088 -12.933
  582   2HB   ARG  22          2HB       ARG  22  -0.034   9.058 -11.587
  583   1HG   ARG  22          1HG       ARG  22   1.113   6.287 -12.084
  584   2HG   ARG  22          2HG       ARG  22   1.591   7.658 -13.085
  585   1HD   ARG  22          1HD       ARG  22   2.234   8.903 -10.955
  586   2HD   ARG  22          2HD       ARG  22   2.024   7.365 -10.095
  587    HE   ARG  22           HE       ARG  22   3.681   7.016 -12.396
  588   1HH1  ARG  22          1HH1      ARG  22   3.975   8.519  -9.133
  589   2HH1  ARG  22          2HH1      ARG  22   5.567   7.751  -8.926
  590   1HH2  ARG  22          1HH2      ARG  22   5.924   6.303 -11.975
  591   2HH2  ARG  22          2HH2      ARG  22   6.533   6.666 -10.353
  592    H    ILE  23           H        ILE  23  -0.783   5.087  -9.622
  593    HA   ILE  23           HA       ILE  23   0.346   6.653  -7.370
  594    HB   ILE  23           HB       ILE  23  -1.129   4.125  -6.756
  595   1HG1  ILE  23          1HG1      ILE  23  -2.568   6.800  -6.763
  596   2HG1  ILE  23          2HG1      ILE  23  -2.856   5.467  -7.893
  597   1HG2  ILE  23          1HG2      ILE  23  -1.085   5.172  -4.516
  598   2HG2  ILE  23          2HG2      ILE  23   0.511   5.362  -5.220
  599   3HG2  ILE  23          3HG2      ILE  23  -0.610   6.734  -5.223
  600   1HD1  ILE  23          1HD1      ILE  23  -3.192   5.195  -4.888
  601   2HD1  ILE  23          2HD1      ILE  23  -4.486   5.449  -6.025
  602   3HD1  ILE  23          3HD1      ILE  23  -3.528   3.960  -6.121
  603    H    GLU  24           H        GLU  24   2.384   6.185  -7.196
  604    HA   GLU  24           HA       GLU  24   3.511   3.589  -7.984
  605   1HB   GLU  24          1HB       GLU  24   4.530   5.641  -8.606
  606   2HB   GLU  24          2HB       GLU  24   4.686   6.186  -6.921
  607   1HG   GLU  24          1HG       GLU  24   6.222   4.311  -6.503
  608   2HG   GLU  24          2HG       GLU  24   5.974   3.727  -8.158
  609    H    LEU  25           H        LEU  25   2.545   2.115  -6.528
  610    HA   LEU  25           HA       LEU  25   1.987   2.858  -3.806
  611   1HB   LEU  25          1HB       LEU  25   2.052   0.053  -4.927
  612   2HB   LEU  25          2HB       LEU  25   1.288   0.593  -3.459
  613    HG   LEU  25           HG       LEU  25   0.407   1.251  -6.307
  614   1HD1  LEU  25          1HD1      LEU  25  -0.843  -0.450  -4.099
  615   2HD1  LEU  25          2HD1      LEU  25  -0.090  -1.056  -5.587
  616   3HD1  LEU  25          3HD1      LEU  25  -1.577  -0.100  -5.676
  617   1HD2  LEU  25          1HD2      LEU  25  -0.000   3.143  -4.883
  618   2HD2  LEU  25          2HD2      LEU  25  -0.699   2.134  -3.620
  619   3HD2  LEU  25          3HD2      LEU  25  -1.539   2.330  -5.186
  620    H    THR  26           H        THR  26   3.756   3.367  -2.655
  621    HA   THR  26           HA       THR  26   6.132   1.726  -2.971
  622    HB   THR  26           HB       THR  26   5.755   4.310  -1.478
  623    HG1  THR  26           1HG      THR  26   5.435   4.287  -3.835
  624   1HG2  THR  26          1HG2      THR  26   8.254   2.745  -2.325
  625   2HG2  THR  26          2HG2      THR  26   7.667   2.924  -0.673
  626   3HG2  THR  26          3HG2      THR  26   8.254   4.337  -1.565
  627    H    VAL  27           H        VAL  27   6.220  -0.074  -1.927
  628    HA   VAL  27           HA       VAL  27   5.194  -0.267   0.861
  629    HB   VAL  27           HB       VAL  27   4.297  -2.491   0.390
  630   1HG1  VAL  27          1HG1      VAL  27   3.375  -0.783  -1.950
  631   2HG1  VAL  27          2HG1      VAL  27   2.478  -2.036  -1.073
  632   3HG1  VAL  27          3HG1      VAL  27   2.884  -0.510  -0.269
  633   1HG2  VAL  27          1HG2      VAL  27   5.534  -2.135  -2.397
  634   2HG2  VAL  27          2HG2      VAL  27   5.919  -3.387  -1.195
  635   3HG2  VAL  27          3HG2      VAL  27   4.356  -3.380  -2.014
  636    H    GLU  28           H        GLU  28   6.625  -1.499   2.256
  637    HA   GLU  28           HA       GLU  28   9.346  -1.533   1.061
  638   1HB   GLU  28          1HB       GLU  28   8.457   0.261   2.752
  639   2HB   GLU  28          2HB       GLU  28   8.659  -0.995   3.932
  640   1HG   GLU  28          1HG       GLU  28  11.118  -1.080   2.769
  641   2HG   GLU  28          2HG       GLU  28  10.669   0.569   2.395
  642    H    SER  29           H        SER  29   9.202  -3.756   0.369
  643    HA   SER  29           HA       SER  29   9.349  -5.691   2.527
  644   1HB   SER  29          1HB       SER  29   6.787  -5.346   1.925
  645   2HB   SER  29          2HB       SER  29   7.185  -6.354   0.526
  646    HG   SER  29           HG       SER  29   6.637  -7.806   2.182
  647    H    SER  30           H        SER  30   9.923  -7.734   1.845
  648    HA   SER  30           HA       SER  30  11.928  -7.991  -0.044
  649   1HB   SER  30          1HB       SER  30  10.133 -10.238   0.933
  650   2HB   SER  30          2HB       SER  30  11.854 -10.310   0.514
  651    HG   SER  30           HG       SER  30  10.560  -9.338   2.818
  652    H    ALA  31           H        ALA  31  12.016  -8.766  -2.178
  653    HA   ALA  31           HA       ALA  31  10.050  -7.862  -3.837
  654   1HB   ALA  31          1HB       ALA  31  12.041 -10.083  -4.470
  655   2HB   ALA  31          2HB       ALA  31  11.191  -9.070  -5.656
  656   3HB   ALA  31          3HB       ALA  31  12.362  -8.332  -4.547
  657    H    GLU  32           H        GLU  32  10.244 -11.273  -2.669
  658    HA   GLU  32           HA       GLU  32   8.067 -12.076  -4.370
  659   1HB   GLU  32          1HB       GLU  32   9.515 -13.442  -2.099
  660   2HB   GLU  32          2HB       GLU  32   8.234 -14.191  -3.080
  661   1HG   GLU  32          1HG       GLU  32   9.653 -13.517  -5.148
  662   2HG   GLU  32          2HG       GLU  32  10.975 -13.234  -4.012
  663    H    ASP  33           H        ASP  33   8.301 -10.764  -1.139
  664    HA   ASP  33           HA       ASP  33   5.709 -11.604  -0.204
  665   1HB   ASP  33          1HB       ASP  33   7.625 -11.168   1.275
  666   2HB   ASP  33          2HB       ASP  33   7.702  -9.501   0.725
  667    H    LEU  34           H        LEU  34   7.257  -8.816  -1.678
  668    HA   LEU  34           HA       LEU  34   5.010  -7.059  -2.076
  669   1HB   LEU  34          1HB       LEU  34   7.059  -6.089  -2.389
  670   2HB   LEU  34          2HB       LEU  34   7.708  -7.392  -3.349
  671    HG   LEU  34           HG       LEU  34   5.400  -5.896  -4.588
  672   1HD1  LEU  34          1HD1      LEU  34   6.751  -4.091  -3.583
  673   2HD1  LEU  34          2HD1      LEU  34   6.933  -4.095  -5.346
  674   3HD1  LEU  34          3HD1      LEU  34   8.208  -4.796  -4.325
  675   1HD2  LEU  34          1HD2      LEU  34   8.080  -6.881  -5.683
  676   2HD2  LEU  34          2HD2      LEU  34   6.800  -6.092  -6.630
  677   3HD2  LEU  34          3HD2      LEU  34   6.519  -7.673  -5.918
  678    H    ARG  35           H        ARG  35   6.392  -9.530  -3.936
  679    HA   ARG  35           HA       ARG  35   4.729  -9.455  -6.262
  680   1HB   ARG  35          1HB       ARG  35   6.892 -10.754  -6.148
  681   2HB   ARG  35          2HB       ARG  35   6.047 -12.009  -5.239
  682   1HG   ARG  35          1HG       ARG  35   4.454 -12.319  -7.079
  683   2HG   ARG  35          2HG       ARG  35   5.264 -11.050  -8.023
  684   1HD   ARG  35          1HD       ARG  35   7.293 -12.432  -8.135
  685   2HD   ARG  35          2HD       ARG  35   6.538 -13.650  -7.078
  686    HE   ARG  35           HE       ARG  35   4.908 -13.057  -9.366
  687   1HH1  ARG  35          1HH1      ARG  35   7.714 -14.988  -8.395
  688   2HH1  ARG  35          2HH1      ARG  35   7.510 -16.190  -9.617
  689   1HH2  ARG  35          1HH2      ARG  35   4.585 -14.652 -10.968
  690   2HH2  ARG  35          2HH2      ARG  35   5.674 -15.981 -11.131
  691    H    THR  36           H        THR  36   4.583 -11.515  -3.384
  692    HA   THR  36           HA       THR  36   2.191 -12.871  -4.013
  693    HB   THR  36           HB       THR  36   3.147 -12.047  -1.227
  694    HG1  THR  36           1HG      THR  36   4.786 -13.162  -2.346
  695   1HG2  THR  36          1HG2      THR  36   1.406 -14.376  -2.166
  696   2HG2  THR  36          2HG2      THR  36   0.851 -12.987  -1.206
  697   3HG2  THR  36          3HG2      THR  36   2.010 -14.137  -0.515
  698    H    LEU  37           H        LEU  37   2.574  -9.728  -2.223
  699    HA   LEU  37           HA       LEU  37  -0.239  -9.290  -2.132
  700   1HB   LEU  37          1HB       LEU  37   0.244  -7.599  -0.848
  701   2HB   LEU  37          2HB       LEU  37   1.884  -8.164  -0.940
  702    HG   LEU  37           HG       LEU  37   1.941  -6.484  -3.088
  703   1HD1  LEU  37          1HD1      LEU  37  -0.489  -5.789  -2.754
  704   2HD1  LEU  37          2HD1      LEU  37   0.622  -4.430  -2.523
  705   3HD1  LEU  37          3HD1      LEU  37  -0.091  -5.246  -1.132
  706   1HD2  LEU  37          1HD2      LEU  37   2.949  -4.888  -1.593
  707   2HD2  LEU  37          2HD2      LEU  37   3.379  -6.518  -1.020
  708   3HD2  LEU  37          3HD2      LEU  37   2.105  -5.604  -0.214
  709    H    GLN  38           H        GLN  38   2.112  -8.628  -4.744
  710    HA   GLN  38           HA       GLN  38   0.337  -7.034  -6.329
  711   1HB   GLN  38          1HB       GLN  38   2.663  -6.962  -6.776
  712   2HB   GLN  38          2HB       GLN  38   2.782  -8.694  -6.879
  713   1HG   GLN  38          1HG       GLN  38   1.237  -8.471  -9.002
  714   2HG   GLN  38          2HG       GLN  38   1.794  -6.793  -8.971
  715   1HE2  GLN  38          1HE2      GLN  38   4.301  -6.547  -8.805
  716   2HE2  GLN  38          2HE2      GLN  38   5.265  -7.834  -9.512
  717    H    GLN  39           H        GLN  39   0.770 -10.600  -5.841
  718    HA   GLN  39           HA       GLN  39  -1.027 -11.333  -7.928
  719   1HB   GLN  39          1HB       GLN  39  -0.473 -13.017  -5.495
  720   2HB   GLN  39          2HB       GLN  39  -1.099 -13.501  -7.059
  721   1HG   GLN  39          1HG       GLN  39   1.697 -12.837  -6.267
  722   2HG   GLN  39          2HG       GLN  39   1.088 -14.229  -7.122
  723   1HE2  GLN  39          1HE2      GLN  39   2.407 -11.099  -7.376
  724   2HE2  GLN  39          2HE2      GLN  39   2.536 -10.937  -9.120
  725    H    LEU  40           H        LEU  40  -1.458 -10.485  -4.443
  726    HA   LEU  40           HA       LEU  40  -4.284 -10.952  -4.361
  727   1HB   LEU  40          1HB       LEU  40  -2.896  -8.672  -2.945
  728   2HB   LEU  40          2HB       LEU  40  -4.433  -9.414  -2.580
  729    HG   LEU  40           HG       LEU  40  -1.724 -10.739  -2.269
  730   1HD1  LEU  40          1HD1      LEU  40  -2.195  -8.940  -0.637
  731   2HD1  LEU  40          2HD1      LEU  40  -2.130 -10.537   0.131
  732   3HD1  LEU  40          3HD1      LEU  40  -3.701  -9.765  -0.180
  733   1HD2  LEU  40          1HD2      LEU  40  -2.877 -12.540  -1.085
  734   2HD2  LEU  40          2HD2      LEU  40  -3.341 -12.463  -2.792
  735   3HD2  LEU  40          3HD2      LEU  40  -4.443 -11.841  -1.541
  736    H    PHE  41           H        PHE  41  -2.461  -8.028  -5.445
  737    HA   PHE  41           HA       PHE  41  -4.792  -6.565  -6.276
  738   1HB   PHE  41          1HB       PHE  41  -1.867  -6.419  -6.962
  739   2HB   PHE  41          2HB       PHE  41  -3.019  -5.592  -7.988
  740    HD1  PHE  41           1HD      PHE  41  -3.662  -3.406  -7.480
  741    HD2  PHE  41           2HD      PHE  41  -2.218  -5.947  -4.313
  742    HE1  PHE  41           1HE      PHE  41  -3.777  -1.514  -5.902
  743    HE2  PHE  41           2HE      PHE  41  -2.360  -4.054  -2.727
  744    HZ   PHE  41           HZ       PHE  41  -3.171  -1.852  -3.500
  745    H    LEU  42           H        LEU  42  -2.750  -8.851  -8.095
  746    HA   LEU  42           HA       LEU  42  -4.126  -8.739 -10.562
  747   1HB   LEU  42          1HB       LEU  42  -1.898  -9.694 -10.067
  748   2HB   LEU  42          2HB       LEU  42  -2.649 -11.054  -9.244
  749    HG   LEU  42           HG       LEU  42  -3.365 -10.533 -12.128
  750   1HD1  LEU  42          1HD1      LEU  42  -0.904 -10.379 -12.052
  751   2HD1  LEU  42          2HD1      LEU  42  -1.403 -11.894 -12.816
  752   3HD1  LEU  42          3HD1      LEU  42  -0.816 -11.901 -11.138
  753   1HD2  LEU  42          1HD2      LEU  42  -3.472 -13.022 -12.177
  754   2HD2  LEU  42          2HD2      LEU  42  -4.532 -12.386 -10.923
  755   3HD2  LEU  42          3HD2      LEU  42  -2.964 -13.087 -10.476
  756    H    SER  43           H        SER  43  -4.783 -10.690  -7.641
  757    HA   SER  43           HA       SER  43  -6.960 -12.222  -8.677
  758   1HB   SER  43          1HB       SER  43  -5.763 -13.024  -6.792
  759   2HB   SER  43          2HB       SER  43  -5.856 -11.498  -5.941
  760    HG   SER  43           HG       SER  43  -7.848 -11.847  -5.309
  761    H    THR  44           H        THR  44  -6.973  -9.591  -6.292
  762    HA   THR  44           HA       THR  44  -9.718  -8.925  -6.928
  763    HB   THR  44           HB       THR  44  -9.575  -8.967  -4.149
  764    HG1  THR  44           1HG      THR  44  -8.203 -10.432  -3.412
  765   1HG2  THR  44          1HG2      THR  44 -10.752 -11.111  -4.278
  766   2HG2  THR  44          2HG2      THR  44 -10.239 -11.306  -5.974
  767   3HG2  THR  44          3HG2      THR  44 -11.339  -9.979  -5.520
  768    H    LEU  45           H        LEU  45  -6.734  -7.870  -5.475
  769    HA   LEU  45           HA       LEU  45  -7.983  -5.729  -4.041
  770   1HB   LEU  45          1HB       LEU  45  -5.528  -7.217  -3.953
  771   2HB   LEU  45          2HB       LEU  45  -5.072  -5.543  -4.088
  772    HG   LEU  45           HG       LEU  45  -6.600  -5.046  -2.171
  773   1HD1  LEU  45          1HD1      LEU  45  -8.202  -6.866  -2.241
  774   2HD1  LEU  45          2HD1      LEU  45  -7.226  -7.166  -0.791
  775   3HD1  LEU  45          3HD1      LEU  45  -6.899  -8.055  -2.286
  776   1HD2  LEU  45          1HD2      LEU  45  -5.138  -6.038  -0.450
  777   2HD2  LEU  45          2HD2      LEU  45  -4.173  -5.451  -1.810
  778   3HD2  LEU  45          3HD2      LEU  45  -4.493  -7.195  -1.624
  779    H    SER  46           H        SER  46  -7.468  -3.489  -3.886
  780    HA   SER  46           HA       SER  46  -6.288  -2.201  -6.239
  781   1HB   SER  46          1HB       SER  46  -8.349  -0.603  -5.945
  782   2HB   SER  46          2HB       SER  46  -8.505  -2.089  -6.883
  783    HG   SER  46           HG       SER  46 -10.088  -1.351  -4.905
  784    H    PHE  47           H        PHE  47  -6.364   0.363  -5.609
  785    HA   PHE  47           HA       PHE  47  -5.697   0.716  -2.771
  786   1HB   PHE  47          1HB       PHE  47  -3.589   0.232  -4.245
  787   2HB   PHE  47          2HB       PHE  47  -3.859   1.829  -4.898
  788    HD1  PHE  47           1HD      PHE  47  -2.540  -0.132  -2.128
  789    HD2  PHE  47           2HD      PHE  47  -3.755   3.843  -3.272
  790    HE1  PHE  47           1HE      PHE  47  -1.171   0.826  -0.314
  791    HE2  PHE  47           2HE      PHE  47  -2.460   4.779  -1.385
  792    HZ   PHE  47           HZ       PHE  47  -1.142   3.274   0.088
  793    H    VAL  48           H        VAL  48  -5.802   2.921  -2.130
  794    HA   VAL  48           HA       VAL  48  -7.170   4.719  -3.914
  795    HB   VAL  48           HB       VAL  48  -8.262   3.205  -1.619
  796   1HG1  VAL  48          1HG1      VAL  48  -8.270   5.359  -0.550
  797   2HG1  VAL  48          2HG1      VAL  48  -9.155   6.056  -1.938
  798   3HG1  VAL  48          3HG1      VAL  48  -9.892   4.779  -0.947
  799   1HG2  VAL  48          1HG2      VAL  48  -9.092   2.925  -3.931
  800   2HG2  VAL  48          2HG2      VAL  48 -10.370   3.566  -2.903
  801   3HG2  VAL  48          3HG2      VAL  48  -9.506   4.649  -4.009
  802    H    CYS  49           H        CYS  49  -5.785   6.364  -4.037
  803    HA   CYS  49           HA       CYS  49  -3.472   6.599  -2.378
  804   1HB   CYS  49          1HB       CYS  49  -3.283   8.850  -3.591
  805   2HB   CYS  49          2HB       CYS  49  -3.281   7.404  -4.570
  806    HA   PRO  50           HA       PRO  50  -4.954   8.614   1.152
  807   1HB   PRO  50          1HB       PRO  50  -2.949  10.430   1.859
  808   2HB   PRO  50          2HB       PRO  50  -2.964   8.672   2.187
  809   1HG   PRO  50          1HG       PRO  50  -1.654  10.133  -0.121
  810   2HG   PRO  50          2HG       PRO  50  -0.963   8.838   0.908
  811   1HD   PRO  50          1HD       PRO  50  -1.941   8.245  -1.509
  812   2HD   PRO  50          2HD       PRO  50  -2.308   7.178  -0.124
  813    H    TRP  51           H        TRP  51  -3.948  10.794  -1.431
  814    HA   TRP  51           HA       TRP  51  -5.287  13.182  -0.650
  815   1HB   TRP  51          1HB       TRP  51  -3.763  13.342  -2.455
  816   2HB   TRP  51          2HB       TRP  51  -4.463  11.963  -3.296
  817    HD1  TRP  51           HD       TRP  51  -5.715  15.486  -2.244
  818    HE1  TRP  51           1HE      TRP  51  -7.266  16.391  -4.062
  819    HE3  TRP  51           3HE      TRP  51  -5.481  11.567  -5.541
  820    HZ2  TRP  51           2HZ      TRP  51  -8.302  15.521  -6.623
  821    HZ3  TRP  51           3HZ      TRP  51  -6.751  11.643  -7.662
  822    HH2  TRP  51           HH       TRP  51  -8.173  13.602  -8.207
  823    H    CYS  52           H        CYS  52  -6.441  10.535  -2.878
  824    HA   CYS  52           HA       CYS  52  -9.085  11.701  -2.955
  825   1HB   CYS  52          1HB       CYS  52  -9.610  10.086  -4.464
  826   2HB   CYS  52          2HB       CYS  52  -7.870  10.162  -4.662
  827    H    ALA  53           H        ALA  53  -7.436   9.244  -0.984
  828    HA   ALA  53           HA       ALA  53  -9.707   8.068   0.066
  829   1HB   ALA  53          1HB       ALA  53  -7.371   7.225   0.430
  830   2HB   ALA  53          2HB       ALA  53  -7.064   8.603   1.509
  831   3HB   ALA  53          3HB       ALA  53  -8.249   7.397   1.976
  832    H    THR  54           H        THR  54  -7.951  10.977   1.024
  833    HA   THR  54           HA       THR  54  -9.520  11.668   3.341
  834    HB   THR  54           HB       THR  54  -7.682  13.378   1.597
  835    HG1  THR  54           1HG      THR  54  -6.469  11.705   2.282
  836   1HG2  THR  54          1HG2      THR  54  -7.324  14.672   3.677
  837   2HG2  THR  54          2HG2      THR  54  -8.524  13.666   4.517
  838   3HG2  THR  54          3HG2      THR  54  -9.024  14.729   3.182
  839    H    ASN  55           H        ASN  55  -9.451  12.840  -0.078
  840    HA   ASN  55           HA       ASN  55 -11.551  14.799   0.352
  841   1HB   ASN  55          1HB       ASN  55 -10.304  13.634  -2.177
  842   2HB   ASN  55          2HB       ASN  55 -11.600  14.827  -2.201
  843   1HD2  ASN  55          1HD2      ASN  55  -8.228  14.312  -0.995
  844   2HD2  ASN  55          2HD2      ASN  55  -7.941  16.042  -0.815
  845    H    GLN  56           H        GLN  56 -11.501  11.493  -0.602
  846    HA   GLN  56           HA       GLN  56 -12.969   9.889  -0.993
  847   1HB   GLN  56          2HB       GLN  56 -13.962  10.843   1.189
  848   2HB   GLN  56          3HB       GLN  56 -15.199  11.604   0.183
  849   1HG   GLN  56          2HG       GLN  56 -16.046   9.449  -0.514
  850   2HG   GLN  56          3HG       GLN  56 -14.598   8.626   0.099
  851   1HE2  GLN  56          1HE2      GLN  56 -17.488  10.487   1.178
  852   2HE2  GLN  56          2HE2      GLN  56 -17.535   9.739   2.769
  Start of MODEL    4
    1   1H    GLY   1          1H        GLY   1 -21.209  -0.040  -6.814
    2   1HA   GLY   1          1HA       GLY   1 -19.981   1.996  -7.161
    3   2HA   GLY   1          2HA       GLY   1 -21.450   1.907  -8.165
    4    H    SER   2           H        SER   2 -23.306   3.328  -7.616
    5    HA   SER   2           HA       SER   2 -22.915   5.641  -6.091
    6   1HB   SER   2          1HB       SER   2 -25.534   4.132  -6.487
    7   2HB   SER   2          2HB       SER   2 -25.295   5.880  -6.300
    8    HG   SER   2           HG       SER   2 -25.589   5.344  -8.488
    9    H    HIS   3           H        HIS   3 -23.130   6.007  -3.872
   10    HA   HIS   3           HA       HIS   3 -22.877   5.515  -1.688
   11   1HB   HIS   3          1HB       HIS   3 -25.349   5.512  -1.960
   12   2HB   HIS   3          2HB       HIS   3 -25.309   3.756  -2.116
   13    HD1  HIS   3           1HD      HIS   3 -24.665   6.510   0.521
   14    HD2  HIS   3           2HD      HIS   3 -25.087   2.337   0.135
   15    HE1  HIS   3           1HE      HIS   3 -24.765   5.557   2.891
   16    H    MET   4           H        MET   4 -20.913   4.328  -2.835
   17    HA   MET   4           HA       MET   4 -20.705   1.519  -2.462
   18   1HB   MET   4          1HB       MET   4 -18.252   1.909  -2.756
   19   2HB   MET   4          2HB       MET   4 -19.277   2.503  -4.050
   20   1HG   MET   4          1HG       MET   4 -19.004   4.775  -3.403
   21   2HG   MET   4          2HG       MET   4 -18.311   4.338  -1.840
   22   1HE   MET   4          1HE       MET   4 -17.173   2.575  -5.266
   23   2HE   MET   4          2HE       MET   4 -17.744   4.194  -5.744
   24   3HE   MET   4          3HE       MET   4 -16.015   3.789  -5.847
   25    H    ALA   5           H        ALA   5 -21.805   1.752  -0.226
   26    HA   ALA   5           HA       ALA   5 -19.995   1.778   2.018
   27   1HB   ALA   5          1HB       ALA   5 -22.767   0.555   1.686
   28   2HB   ALA   5          2HB       ALA   5 -21.913   0.816   3.219
   29   3HB   ALA   5          3HB       ALA   5 -22.432   2.208   2.252
   30    H    GLU   6           H        GLU   6 -18.863   0.334  -0.126
   31    HA   GLU   6           HA       GLU   6 -19.697  -2.472  -0.014
   32   1HB   GLU   6          1HB       GLU   6 -17.939  -0.824  -1.853
   33   2HB   GLU   6          2HB       GLU   6 -17.990  -2.590  -1.971
   34   1HG   GLU   6          1HG       GLU   6 -20.287  -2.638  -2.533
   35   2HG   GLU   6          2HG       GLU   6 -20.570  -0.989  -1.987
   36    HA   PRO   7           HA       PRO   7 -16.524  -3.626   2.750
   37   1HB   PRO   7          1HB       PRO   7 -16.476  -6.318   2.497
   38   2HB   PRO   7          2HB       PRO   7 -17.981  -5.455   2.913
   39   1HG   PRO   7          1HG       PRO   7 -17.088  -6.344   0.144
   40   2HG   PRO   7          2HG       PRO   7 -18.641  -6.708   0.964
   41   1HD   PRO   7          1HD       PRO   7 -18.366  -4.599  -0.761
   42   2HD   PRO   7          2HD       PRO   7 -19.416  -4.499   0.685
   43    H    GLN   8           H        GLN   8 -15.304  -2.389   0.668
   44    HA   GLN   8           HA       GLN   8 -12.791  -3.946   0.304
   45   1HB   GLN   8          1HB       GLN   8 -14.378  -2.521  -1.838
   46   2HB   GLN   8          2HB       GLN   8 -12.623  -2.584  -1.931
   47   1HG   GLN   8          1HG       GLN   8 -13.471  -4.377  -3.243
   48   2HG   GLN   8          2HG       GLN   8 -12.642  -5.041  -1.842
   49   1HE2  GLN   8          1HE2      GLN   8 -13.742  -7.094  -1.530
   50   2HE2  GLN   8          2HE2      GLN   8 -15.482  -7.095  -1.322
   51    H    ARG   9           H        ARG   9 -14.186  -0.572   0.236
   52    HA   ARG   9           HA       ARG   9 -11.658   0.686   0.203
   53   1HB   ARG   9          1HB       ARG   9 -13.918   1.659  -0.398
   54   2HB   ARG   9          2HB       ARG   9 -14.184   1.924   1.307
   55   1HG   ARG   9          1HG       ARG   9 -11.840   3.010  -0.017
   56   2HG   ARG   9          2HG       ARG   9 -13.370   3.856  -0.053
   57   1HD   ARG   9          1HD       ARG   9 -13.213   3.626   2.590
   58   2HD   ARG   9          2HD       ARG   9 -11.499   3.362   2.278
   59    HE   ARG   9           HE       ARG   9 -11.238   5.603   1.828
   60   1HH1  ARG   9          1HH1      ARG   9 -14.672   4.856   1.622
   61   2HH1  ARG   9          2HH1      ARG   9 -15.222   6.485   1.432
   62   1HH2  ARG   9          1HH2      ARG   9 -11.912   7.883   1.765
   63   2HH2  ARG   9          2HH2      ARG   9 -13.582   8.211   1.500
   64    H    HIS  10           H        HIS  10 -10.226  -0.224   1.762
   65    HA   HIS  10           HA       HIS  10 -11.010   0.087   4.619
   66   1HB   HIS  10          1HB       HIS  10  -9.394  -2.060   3.200
   67   2HB   HIS  10          2HB       HIS  10  -9.655  -1.941   4.945
   68    HD1  HIS  10           1HD      HIS  10 -10.759  -4.355   2.866
   69    HD2  HIS  10           2HD      HIS  10 -12.918  -1.156   4.390
   70    HE1  HIS  10           1HE      HIS  10 -13.097  -5.207   3.206
   71    H    LYS  11           H        LYS  11  -9.046  -0.020   6.104
   72    HA   LYS  11           HA       LYS  11  -6.966   1.857   5.129
   73   1HB   LYS  11          1HB       LYS  11  -8.913   2.341   7.422
   74   2HB   LYS  11          2HB       LYS  11  -7.427   3.229   7.142
   75   1HG   LYS  11          1HG       LYS  11  -8.669   4.678   5.947
   76   2HG   LYS  11          2HG       LYS  11  -8.537   3.492   4.684
   77   1HD   LYS  11          1HD       LYS  11 -10.838   4.154   4.827
   78   2HD   LYS  11          2HD       LYS  11 -10.732   2.503   5.424
   79   1HE   LYS  11          1HE       LYS  11 -12.218   3.774   6.851
   80   2HE   LYS  11          2HE       LYS  11 -10.771   3.342   7.769
   81   1HZ   LYS  11          1HZ       LYS  11 -11.446   5.647   8.109
   82   2HZ   LYS  11          2HZ       LYS  11 -11.195   5.988   6.515
   83   3HZ   LYS  11          3HZ       LYS  11  -9.942   5.577   7.497
   84    H    ILE  12           H        ILE  12  -5.231   0.609   5.478
   85    HA   ILE  12           HA       ILE  12  -4.894  -0.797   8.072
   86    HB   ILE  12           HB       ILE  12  -3.062  -0.640   5.648
   87   1HG1  ILE  12          1HG1      ILE  12  -4.818  -2.954   6.526
   88   2HG1  ILE  12          2HG1      ILE  12  -5.162  -1.859   5.179
   89   1HG2  ILE  12          1HG2      ILE  12  -2.943  -2.307   8.217
   90   2HG2  ILE  12          2HG2      ILE  12  -1.801  -2.441   6.859
   91   3HG2  ILE  12          3HG2      ILE  12  -1.858  -0.968   7.811
   92   1HD1  ILE  12          1HD1      ILE  12  -2.936  -2.499   4.163
   93   2HD1  ILE  12          2HD1      ILE  12  -2.886  -3.830   5.355
   94   3HD1  ILE  12          3HD1      ILE  12  -4.200  -3.734   4.168
   95    H    LEU  13           H        LEU  13  -4.715   0.916   9.534
   96    HA   LEU  13           HA       LEU  13  -3.035   3.188   9.083
   97   1HB   LEU  13          1HB       LEU  13  -4.860   3.135  10.754
   98   2HB   LEU  13          2HB       LEU  13  -3.902   2.042  11.762
   99    HG   LEU  13           HG       LEU  13  -2.602   4.604  10.767
  100   1HD1  LEU  13          1HD1      LEU  13  -4.772   5.345  11.451
  101   2HD1  LEU  13          2HD1      LEU  13  -3.556   5.846  12.655
  102   3HD1  LEU  13          3HD1      LEU  13  -4.637   4.469  12.998
  103   1HD2  LEU  13          1HD2      LEU  13  -2.440   3.141  13.443
  104   2HD2  LEU  13          2HD2      LEU  13  -1.527   4.599  12.991
  105   3HD2  LEU  13          3HD2      LEU  13  -1.220   3.085  12.158
  106    H    CYS  14           H        CYS  14  -0.990   3.073   8.794
  107    HA   CYS  14           HA       CYS  14   0.649   1.247  10.479
  108   1HB   CYS  14          1HB       CYS  14   0.403   0.724   7.888
  109   2HB   CYS  14          2HB       CYS  14   1.527   2.083   7.709
  110    HG   CYS  14           HG       CYS  14   1.843  -0.724   9.457
  111    H    VAL  15           H        VAL  15   3.101   2.249   9.823
  112    HA   VAL  15           HA       VAL  15   2.974   5.162  10.046
  113    HB   VAL  15           HB       VAL  15   5.102   5.110  11.350
  114   1HG1  VAL  15          1HG1      VAL  15   4.037   4.794  13.517
  115   2HG1  VAL  15          2HG1      VAL  15   2.949   5.634  12.406
  116   3HG1  VAL  15          3HG1      VAL  15   2.688   3.910  12.767
  117   1HG2  VAL  15          1HG2      VAL  15   4.414   2.183  11.895
  118   2HG2  VAL  15          2HG2      VAL  15   5.780   2.759  10.909
  119   3HG2  VAL  15          3HG2      VAL  15   5.716   3.128  12.634
  120    H    CYS  16           H        CYS  16   4.851   6.160   9.025
  121    HA   CYS  16           HA       CYS  16   5.592   4.814   6.609
  122   1HB   CYS  16          1HB       CYS  16   5.602   7.361   6.888
  123   2HB   CYS  16          2HB       CYS  16   7.139   7.160   7.777
  124    H    CYS  17           H        CYS  17   7.121   3.460   6.234
  125    HA   CYS  17           HA       CYS  17   8.546   1.938   8.061
  126   1HB   CYS  17          1HB       CYS  17   8.083   1.428   5.638
  127   2HB   CYS  17          2HB       CYS  17   9.365   2.561   5.185
  128    HG   CYS  17           HG       CYS  17  11.182   1.189   5.401
  129    H    LYS  18           H        LYS  18   9.651   4.958   6.499
  130    HA   LYS  18           HA       LYS  18  12.199   4.779   8.016
  131   1HB   LYS  18          1HB       LYS  18  13.146   6.052   6.160
  132   2HB   LYS  18          2HB       LYS  18  12.579   4.444   5.724
  133   1HG   LYS  18          1HG       LYS  18  10.643   5.367   4.539
  134   2HG   LYS  18          2HG       LYS  18  10.933   6.961   5.234
  135   1HD   LYS  18          1HD       LYS  18  11.780   7.243   3.111
  136   2HD   LYS  18          2HD       LYS  18  13.224   6.902   4.036
  137   1HE   LYS  18          1HE       LYS  18  11.661   4.995   2.224
  138   2HE   LYS  18          2HE       LYS  18  13.206   5.754   1.848
  139   1HZ   LYS  18          1HZ       LYS  18  13.399   3.418   2.539
  140   2HZ   LYS  18          2HZ       LYS  18  12.699   3.664   3.889
  141   3HZ   LYS  18          3HZ       LYS  18  14.192   4.398   3.649
  142    H    CYS  19           H        CYS  19   9.332   6.658   7.878
  143    HA   CYS  19           HA       CYS  19  10.706   8.947   9.151
  144   1HB   CYS  19          1HB       CYS  19   7.950   9.209   8.329
  145   2HB   CYS  19          2HB       CYS  19   9.276  10.321   8.273
  146    H    ASP  20           H        ASP  20   8.677   6.216   9.897
  147    HA   ASP  20           HA       ASP  20   7.330   5.644  11.516
  148   1HB   ASP  20          1HB       ASP  20   9.436   6.038  12.772
  149   2HB   ASP  20          2HB       ASP  20   8.825   7.628  13.233
  150    H    GLY  21           H        GLY  21   6.508   7.957   9.810
  151   1HA   GLY  21          1HA       GLY  21   4.804   9.594  11.627
  152   2HA   GLY  21          2HA       GLY  21   4.964   9.842   9.890
  153    H    ARG  22           H        ARG  22   2.554   9.616  11.452
  154    HA   ARG  22           HA       ARG  22   1.324   7.016  11.274
  155   1HB   ARG  22          1HB       ARG  22   0.678   8.758  12.880
  156   2HB   ARG  22          2HB       ARG  22   0.135   9.822  11.592
  157   1HG   ARG  22          1HG       ARG  22  -1.126   7.081  12.001
  158   2HG   ARG  22          2HG       ARG  22  -1.550   8.455  13.020
  159   1HD   ARG  22          1HD       ARG  22  -2.129   9.743  10.870
  160   2HD   ARG  22          2HD       ARG  22  -2.029   8.179  10.040
  161    HE   ARG  22           HE       ARG  22  -3.653   7.967  12.378
  162   1HH1  ARG  22          1HH1      ARG  22  -3.962   9.446   9.105
  163   2HH1  ARG  22          2HH1      ARG  22  -5.604   8.779   8.966
  164   1HH2  ARG  22          1HH2      ARG  22  -5.941   7.396  12.045
  165   2HH2  ARG  22          2HH2      ARG  22  -6.582   7.763  10.439
  166    H    ILE  23           H        ILE  23   0.557   5.979   9.425
  167    HA   ILE  23           HA       ILE  23  -0.523   7.761   7.326
  168    HB   ILE  23           HB       ILE  23   0.851   5.176   6.589
  169   1HG1  ILE  23          1HG1      ILE  23   2.229   7.884   6.381
  170   2HG1  ILE  23          2HG1      ILE  23   2.651   6.596   7.517
  171   1HG2  ILE  23          1HG2      ILE  23   0.673   6.248   4.319
  172   2HG2  ILE  23          2HG2      ILE  23  -0.892   6.300   5.102
  173   3HG2  ILE  23          3HG2      ILE  23   0.115   7.754   5.072
  174   1HD1  ILE  23          1HD1      ILE  23   2.798   6.296   4.491
  175   2HD1  ILE  23          2HD1      ILE  23   4.142   6.539   5.576
  176   3HD1  ILE  23          3HD1      ILE  23   3.189   5.051   5.699
  177    H    GLU  24           H        GLU  24  -2.559   7.186   6.718
  178    HA   GLU  24           HA       GLU  24  -3.713   4.678   7.800
  179   1HB   GLU  24          1HB       GLU  24  -4.662   6.682   8.532
  180   2HB   GLU  24          2HB       GLU  24  -4.942   7.291   6.887
  181   1HG   GLU  24          1HG       GLU  24  -6.531   5.425   6.528
  182   2HG   GLU  24          2HG       GLU  24  -6.153   4.795   8.140
  183    H    LEU  25           H        LEU  25  -2.854   3.217   6.332
  184    HA   LEU  25           HA       LEU  25  -2.521   3.906   3.599
  185   1HB   LEU  25          1HB       LEU  25  -2.377   1.144   4.799
  186   2HB   LEU  25          2HB       LEU  25  -1.687   1.678   3.286
  187    HG   LEU  25           HG       LEU  25  -0.848   2.671   6.064
  188   1HD1  LEU  25          1HD1      LEU  25   0.435   0.713   4.115
  189   2HD1  LEU  25          2HD1      LEU  25  -0.267   0.340   5.713
  190   3HD1  LEU  25          3HD1      LEU  25   1.203   1.329   5.594
  191   1HD2  LEU  25          1HD2      LEU  25  -0.497   4.307   4.196
  192   2HD2  LEU  25          2HD2      LEU  25   0.341   3.079   3.266
  193   3HD2  LEU  25          3HD2      LEU  25   1.046   3.685   4.791
  194    H    THR  26           H        THR  26  -4.322   4.228   2.416
  195    HA   THR  26           HA       THR  26  -6.621   2.533   2.961
  196    HB   THR  26           HB       THR  26  -6.407   5.016   1.274
  197    HG1  THR  26           1HG      THR  26  -5.928   5.178   3.631
  198   1HG2  THR  26          1HG2      THR  26  -8.853   3.687   2.560
  199   2HG2  THR  26          2HG2      THR  26  -8.426   3.468   0.876
  200   3HG2  THR  26          3HG2      THR  26  -8.835   5.094   1.485
  201    H    VAL  27           H        VAL  27  -6.847   0.716   1.938
  202    HA   VAL  27           HA       VAL  27  -5.988   0.420  -0.896
  203    HB   VAL  27           HB       VAL  27  -5.066  -1.791  -0.521
  204   1HG1  VAL  27          1HG1      VAL  27  -4.099  -0.210   1.877
  205   2HG1  VAL  27          2HG1      VAL  27  -3.243  -1.429   0.913
  206   3HG1  VAL  27          3HG1      VAL  27  -3.649   0.142   0.199
  207   1HG2  VAL  27          1HG2      VAL  27  -6.146  -1.615   2.339
  208   2HG2  VAL  27          2HG2      VAL  27  -6.714  -2.716   1.065
  209   3HG2  VAL  27          3HG2      VAL  27  -5.082  -2.891   1.712
  210    H    GLU  28           H        GLU  28  -7.803  -0.098  -2.157
  211    HA   GLU  28           HA       GLU  28 -10.275  -0.749  -0.651
  212   1HB   GLU  28          1HB       GLU  28 -10.333  -0.420  -3.631
  213   2HB   GLU  28          2HB       GLU  28 -11.630  -0.335  -2.419
  214   1HG   GLU  28          1HG       GLU  28 -10.480   1.738  -1.575
  215   2HG   GLU  28          2HG       GLU  28  -9.675   1.678  -3.186
  216    H    SER  29           H        SER  29 -10.106  -2.871   0.002
  217    HA   SER  29           HA       SER  29 -10.066  -4.862  -2.067
  218   1HB   SER  29          1HB       SER  29  -7.517  -4.405  -1.418
  219   2HB   SER  29          2HB       SER  29  -7.919  -5.411  -0.013
  220    HG   SER  29           HG       SER  29  -7.334  -6.918  -1.564
  221    H    SER  30           H        SER  30 -10.652  -6.958  -1.194
  222    HA   SER  30           HA       SER  30 -12.587  -6.889   0.843
  223   1HB   SER  30          1HB       SER  30 -10.971  -9.264  -0.181
  224   2HB   SER  30          2HB       SER  30 -12.587  -9.321   0.555
  225    HG   SER  30           HG       SER  30 -11.994  -9.019  -1.978
  226    H    ALA  31           H        ALA  31 -12.559  -7.592   3.036
  227    HA   ALA  31           HA       ALA  31 -10.476  -6.590   4.507
  228   1HB   ALA  31          1HB       ALA  31 -12.411  -8.779   5.393
  229   2HB   ALA  31          2HB       ALA  31 -11.479  -7.717   6.463
  230   3HB   ALA  31          3HB       ALA  31 -12.737  -7.028   5.419
  231    H    GLU  32           H        GLU  32 -10.814 -10.066   3.578
  232    HA   GLU  32           HA       GLU  32  -8.481 -10.579   5.180
  233   1HB   GLU  32          1HB       GLU  32 -10.723 -11.976   4.821
  234   2HB   GLU  32          2HB       GLU  32  -9.648 -12.813   3.659
  235   1HG   GLU  32          1HG       GLU  32  -7.964 -13.129   5.437
  236   2HG   GLU  32          2HG       GLU  32  -8.882 -12.094   6.529
  237    H    ASP  33           H        ASP  33  -9.010  -9.859   1.944
  238    HA   ASP  33           HA       ASP  33  -6.543 -10.865   0.858
  239   1HB   ASP  33          1HB       ASP  33  -8.485 -10.241  -0.513
  240   2HB   ASP  33          2HB       ASP  33  -8.414  -8.592   0.084
  241    H    LEU  34           H        LEU  34  -7.776  -7.963   2.481
  242    HA   LEU  34           HA       LEU  34  -5.334  -6.493   2.676
  243   1HB   LEU  34          1HB       LEU  34  -7.103  -5.153   2.916
  244   2HB   LEU  34          2HB       LEU  34  -8.075  -6.277   3.810
  245    HG   LEU  34           HG       LEU  34  -5.713  -4.975   5.218
  246   1HD1  LEU  34          1HD1      LEU  34  -6.996  -3.167   4.098
  247   2HD1  LEU  34          2HD1      LEU  34  -7.258  -3.129   5.850
  248   3HD1  LEU  34          3HD1      LEU  34  -8.494  -3.835   4.783
  249   1HD2  LEU  34          1HD2      LEU  34  -8.451  -5.852   6.224
  250   2HD2  LEU  34          2HD2      LEU  34  -7.162  -5.107   7.191
  251   3HD2  LEU  34          3HD2      LEU  34  -6.930  -6.710   6.507
  252    H    ARG  35           H        ARG  35  -6.788  -8.724   4.635
  253    HA   ARG  35           HA       ARG  35  -5.053  -8.729   6.952
  254   1HB   ARG  35          1HB       ARG  35  -7.362  -9.788   6.895
  255   2HB   ARG  35          2HB       ARG  35  -6.620 -11.171   6.073
  256   1HG   ARG  35          1HG       ARG  35  -5.076 -11.446   8.030
  257   2HG   ARG  35          2HG       ARG  35  -5.959 -10.148   8.861
  258   1HD   ARG  35          1HD       ARG  35  -8.051 -11.536   8.656
  259   2HD   ARG  35          2HD       ARG  35  -7.082 -12.818   7.895
  260    HE   ARG  35           HE       ARG  35  -5.990 -11.973  10.412
  261   1HH1  ARG  35          1HH1      ARG  35  -8.529 -14.165   9.001
  262   2HH1  ARG  35          2HH1      ARG  35  -8.579 -15.139  10.408
  263   1HH2  ARG  35          1HH2      ARG  35  -6.081 -13.373  12.219
  264   2HH2  ARG  35          2HH2      ARG  35  -7.171 -14.713  12.242
  265    H    THR  36           H        THR  36  -5.227 -10.862   4.098
  266    HA   THR  36           HA       THR  36  -2.891 -12.404   4.654
  267    HB   THR  36           HB       THR  36  -3.884 -11.523   1.905
  268    HG1  THR  36           1HG      THR  36  -5.591 -12.485   3.054
  269   1HG2  THR  36          1HG2      THR  36  -2.325 -13.982   2.838
  270   2HG2  THR  36          2HG2      THR  36  -1.676 -12.655   1.850
  271   3HG2  THR  36          3HG2      THR  36  -2.940 -13.716   1.198
  272    H    LEU  37           H        LEU  37  -3.276  -9.304   2.909
  273    HA   LEU  37           HA       LEU  37  -0.549  -8.619   2.634
  274   1HB   LEU  37          1HB       LEU  37  -1.835  -7.361   1.301
  275   2HB   LEU  37          2HB       LEU  37  -3.216  -7.431   2.362
  276    HG   LEU  37           HG       LEU  37  -2.304  -5.668   3.767
  277   1HD1  LEU  37          1HD1      LEU  37  -0.472  -4.179   2.492
  278   2HD1  LEU  37          2HD1      LEU  37  -0.207  -5.544   1.442
  279   3HD1  LEU  37          3HD1      LEU  37   0.193  -5.667   3.147
  280   1HD2  LEU  37          1HD2      LEU  37  -2.798  -3.876   2.090
  281   2HD2  LEU  37          2HD2      LEU  37  -3.951  -5.204   2.003
  282   3HD2  LEU  37          3HD2      LEU  37  -2.645  -5.081   0.810
  283    H    GLN  38           H        GLN  38  -2.723  -8.126   5.478
  284    HA   GLN  38           HA       GLN  38  -0.854  -6.662   7.036
  285   1HB   GLN  38          1HB       GLN  38  -3.200  -6.760   7.540
  286   2HB   GLN  38          2HB       GLN  38  -3.106  -8.488   7.804
  287   1HG   GLN  38          1HG       GLN  38  -1.603  -8.103   9.769
  288   2HG   GLN  38          2HG       GLN  38  -1.972  -6.370   9.609
  289   1HE2  GLN  38          1HE2      GLN  38  -4.296  -5.741   9.709
  290   2HE2  GLN  38          2HE2      GLN  38  -5.496  -6.837  10.356
  291    H    GLN  39           H        GLN  39  -1.196 -10.193   6.414
  292    HA   GLN  39           HA       GLN  39   0.800 -10.888   8.350
  293   1HB   GLN  39          1HB       GLN  39   0.130 -12.578   5.965
  294   2HB   GLN  39          2HB       GLN  39   0.813 -13.045   7.515
  295   1HG   GLN  39          1HG       GLN  39  -2.012 -12.342   6.824
  296   2HG   GLN  39          2HG       GLN  39  -1.400 -13.765   7.626
  297   1HE2  GLN  39          1HE2      GLN  39  -2.870 -10.751   8.058
  298   2HE2  GLN  39          2HE2      GLN  39  -2.822 -10.634   9.815
  299    H    LEU  40           H        LEU  40   0.826  -9.954   4.893
  300    HA   LEU  40           HA       LEU  40   3.645 -10.265   4.523
  301   1HB   LEU  40          1HB       LEU  40   1.829  -8.327   3.081
  302   2HB   LEU  40          2HB       LEU  40   3.440  -8.785   2.616
  303    HG   LEU  40           HG       LEU  40   1.118 -10.745   2.821
  304   1HD1  LEU  40          1HD1      LEU  40   0.762  -9.101   1.026
  305   2HD1  LEU  40          2HD1      LEU  40   1.101 -10.707   0.371
  306   3HD1  LEU  40          3HD1      LEU  40   2.369  -9.458   0.389
  307   1HD2  LEU  40          1HD2      LEU  40   2.548 -12.288   1.560
  308   2HD2  LEU  40          2HD2      LEU  40   3.309 -11.871   3.093
  309   3HD2  LEU  40          3HD2      LEU  40   3.876 -11.110   1.596
  310    H    PHE  41           H        PHE  41   1.823  -7.615   6.082
  311    HA   PHE  41           HA       PHE  41   4.188  -5.917   6.487
  312   1HB   PHE  41          1HB       PHE  41   1.583  -6.070   8.035
  313   2HB   PHE  41          2HB       PHE  41   2.929  -5.080   8.526
  314    HD1  PHE  41           1HD      PHE  41   3.407  -2.947   7.512
  315    HD2  PHE  41           2HD      PHE  41   0.352  -5.508   5.905
  316    HE1  PHE  41           1HE      PHE  41   2.534  -1.074   6.131
  317    HE2  PHE  41           2HE      PHE  41  -0.572  -3.626   4.624
  318    HZ   PHE  41           HZ       PHE  41   0.565  -1.453   4.635
  319    H    LEU  42           H        LEU  42   2.596  -8.420   8.479
  320    HA   LEU  42           HA       LEU  42   4.525  -8.351  10.581
  321   1HB   LEU  42          1HB       LEU  42   2.599 -10.472   9.590
  322   2HB   LEU  42          2HB       LEU  42   3.580 -10.708  11.029
  323    HG   LEU  42           HG       LEU  42   1.685  -8.336  10.709
  324   1HD1  LEU  42          1HD1      LEU  42   0.367 -10.393  10.572
  325   2HD1  LEU  42          2HD1      LEU  42   0.092  -9.592  12.120
  326   3HD1  LEU  42          3HD1      LEU  42   1.145 -11.024  12.037
  327   1HD2  LEU  42          1HD2      LEU  42   1.828  -8.242  13.178
  328   2HD2  LEU  42          2HD2      LEU  42   3.419  -8.029  12.444
  329   3HD2  LEU  42          3HD2      LEU  42   2.985  -9.591  13.169
  330    H    SER  43           H        SER  43   4.587 -10.007   7.500
  331    HA   SER  43           HA       SER  43   6.985 -11.527   7.815
  332   1HB   SER  43          1HB       SER  43   5.524 -12.105   6.056
  333   2HB   SER  43          2HB       SER  43   5.308 -10.440   5.586
  334    HG   SER  43           HG       SER  43   6.541 -10.796   4.061
  335    H    THR  44           H        THR  44   6.763  -8.669   5.649
  336    HA   THR  44           HA       THR  44   9.024  -7.489   7.015
  337    HB   THR  44           HB       THR  44  10.355  -7.101   4.972
  338    HG1  THR  44           1HG      THR  44   8.574  -7.635   3.378
  339   1HG2  THR  44          1HG2      THR  44  10.754  -8.982   6.538
  340   2HG2  THR  44          2HG2      THR  44  11.327  -9.284   4.883
  341   3HG2  THR  44          3HG2      THR  44   9.812 -10.035   5.449
  342    H    LEU  45           H        LEU  45   6.272  -6.993   5.211
  343    HA   LEU  45           HA       LEU  45   7.046  -4.634   3.920
  344   1HB   LEU  45          1HB       LEU  45   5.114  -6.187   3.363
  345   2HB   LEU  45          2HB       LEU  45   4.136  -5.321   4.520
  346    HG   LEU  45           HG       LEU  45   5.519  -3.581   2.524
  347   1HD1  LEU  45          1HD1      LEU  45   4.932  -5.519   1.108
  348   2HD1  LEU  45          2HD1      LEU  45   3.903  -4.124   0.750
  349   3HD1  LEU  45          3HD1      LEU  45   3.276  -5.475   1.729
  350   1HD2  LEU  45          1HD2      LEU  45   2.610  -3.760   3.415
  351   2HD2  LEU  45          2HD2      LEU  45   3.347  -2.458   2.454
  352   3HD2  LEU  45          3HD2      LEU  45   3.828  -2.701   4.135
  353    H    SER  46           H        SER  46   6.843  -2.456   4.162
  354    HA   SER  46           HA       SER  46   4.841  -1.403   5.924
  355   1HB   SER  46          1HB       SER  46   7.765  -0.829   6.486
  356   2HB   SER  46          2HB       SER  46   6.447   0.232   7.027
  357    HG   SER  46           HG       SER  46   6.222  -2.531   7.509
  358    H    PHE  47           H        PHE  47   4.841   1.158   5.525
  359    HA   PHE  47           HA       PHE  47   5.003   1.318   2.584
  360   1HB   PHE  47          1HB       PHE  47   2.758   1.102   3.798
  361   2HB   PHE  47          2HB       PHE  47   3.036   2.751   4.357
  362    HD1  PHE  47           1HD      PHE  47   2.264   0.559   1.497
  363    HD2  PHE  47           2HD      PHE  47   2.985   4.642   2.685
  364    HE1  PHE  47           1HE      PHE  47   1.429   1.352  -0.700
  365    HE2  PHE  47           2HE      PHE  47   2.173   5.424   0.481
  366    HZ   PHE  47           HZ       PHE  47   1.391   3.781  -1.216
  367    H    VAL  48           H        VAL  48   5.144   3.394   1.765
  368    HA   VAL  48           HA       VAL  48   7.038   5.093   3.139
  369    HB   VAL  48           HB       VAL  48   7.314   3.919   0.349
  370   1HG1  VAL  48          1HG1      VAL  48   9.125   5.630   0.648
  371   2HG1  VAL  48          2HG1      VAL  48   9.638   4.741   2.138
  372   3HG1  VAL  48          3HG1      VAL  48   9.775   4.011   0.572
  373   1HG2  VAL  48          1HG2      VAL  48   7.265   2.116   2.013
  374   2HG2  VAL  48          2HG2      VAL  48   8.825   2.350   1.350
  375   3HG2  VAL  48          3HG2      VAL  48   8.461   3.037   2.986
  376    H    CYS  49           H        CYS  49   5.741   6.829   3.340
  377    HA   CYS  49           HA       CYS  49   3.503   7.533   1.701
  378   1HB   CYS  49          1HB       CYS  49   3.836   9.793   2.877
  379   2HB   CYS  49          2HB       CYS  49   3.562   8.392   3.895
  380    HA   PRO  50           HA       PRO  50   5.336   9.084  -1.904
  381   1HB   PRO  50          1HB       PRO  50   3.920  11.448  -2.492
  382   2HB   PRO  50          2HB       PRO  50   3.455   9.771  -2.906
  383   1HG   PRO  50          1HG       PRO  50   2.593  11.430  -0.525
  384   2HG   PRO  50          2HG       PRO  50   1.588  10.368  -1.564
  385   1HD   PRO  50          1HD       PRO  50   2.424   9.504   0.833
  386   2HD   PRO  50          2HD       PRO  50   2.489   8.403  -0.573
  387    H    TRP  51           H        TRP  51   5.102  11.482   0.696
  388    HA   TRP  51           HA       TRP  51   7.181  13.250  -0.089
  389   1HB   TRP  51          1HB       TRP  51   5.735  13.808   1.749
  390   2HB   TRP  51          2HB       TRP  51   6.134  12.320   2.603
  391    HD1  TRP  51           HD       TRP  51   8.962  14.430   1.150
  392    HE1  TRP  51           1HE      TRP  51  10.466  15.208   2.998
  393    HE3  TRP  51           3HE      TRP  51   5.989  13.138   5.122
  394    HZ2  TRP  51           2HZ      TRP  51  10.326  15.451   5.927
  395    HZ3  TRP  51           3HZ      TRP  51   6.704  13.674   7.434
  396    HH2  TRP  51           HH       TRP  51   8.864  14.824   7.847
  397    H    CYS  52           H        CYS  52   7.387  10.279   2.022
  398    HA   CYS  52           HA       CYS  52  10.257  10.487   2.153
  399   1HB   CYS  52          1HB       CYS  52  10.164   8.812   3.673
  400   2HB   CYS  52          2HB       CYS  52   8.416   9.146   3.665
  401    H    ALA  53           H        ALA  53   7.967   8.777   0.034
  402    HA   ALA  53           HA       ALA  53   9.892   7.112  -1.203
  403   1HB   ALA  53          1HB       ALA  53   7.422   6.845  -1.470
  404   2HB   ALA  53          2HB       ALA  53   7.381   8.340  -2.438
  405   3HB   ALA  53          3HB       ALA  53   8.252   6.924  -3.041
  406    H    THR  54           H        THR  54   8.917  10.486  -1.800
  407    HA   THR  54           HA       THR  54  10.604  10.852  -4.122
  408    HB   THR  54           HB       THR  54   9.339  12.941  -2.294
  409    HG1  THR  54           1HG      THR  54   7.696  11.658  -3.008
  410   1HG2  THR  54          1HG2      THR  54   9.314  14.340  -4.333
  411   2HG2  THR  54          2HG2      THR  54  10.160  13.062  -5.228
  412   3HG2  THR  54          3HG2      THR  54  10.973  13.903  -3.890
  413    H    ASN  55           H        ASN  55  10.929  11.679  -0.627
  414    HA   ASN  55           HA       ASN  55  13.459  13.105  -1.036
  415   1HB   ASN  55          1HB       ASN  55  11.913  12.236   1.456
  416   2HB   ASN  55          2HB       ASN  55  13.484  13.021   1.532
  417   1HD2  ASN  55          1HD2      ASN  55  11.291  14.007  -1.033
  418   2HD2  ASN  55          2HD2      ASN  55  10.900  15.557  -0.305
  419    H    GLN  56           H        GLN  56  12.503  10.041   0.347
  420    HA   GLN  56           HA       GLN  56  13.520   8.321   1.296
  421   1HB   GLN  56          2HB       GLN  56  13.892   7.988  -1.177
  422   2HB   GLN  56          3HB       GLN  56  15.537   8.577  -0.953
  423   1HG   GLN  56          2HG       GLN  56  15.081   6.532   1.040
  424   2HG   GLN  56          3HG       GLN  56  14.407   5.936  -0.474
  425   1HE2  GLN  56          1HE2      GLN  56  17.279   7.722   0.675
  426   2HE2  GLN  56          2HE2      GLN  56  18.487   6.774  -0.252
  427   1H    GLY   1          1H        GLY   1  19.745   9.584   5.122
  428   1HA   GLY   1          1HA       GLY   1  21.803   9.416   6.331
  429   2HA   GLY   1          2HA       GLY   1  20.453   8.825   7.338
  430    H    SER   2           H        SER   2  23.516   8.046   6.152
  431    HA   SER   2           HA       SER   2  24.537   6.389   5.111
  432   1HB   SER   2          1HB       SER   2  23.939   4.904   7.057
  433   2HB   SER   2          2HB       SER   2  22.498   4.388   6.155
  434    HG   SER   2           HG       SER   2  24.355   3.027   5.856
  435    H    HIS   3           H        HIS   3  23.623   4.406   3.472
  436    HA   HIS   3           HA       HIS   3  21.277   5.384   2.001
  437   1HB   HIS   3          1HB       HIS   3  23.307   6.490   0.952
  438   2HB   HIS   3          2HB       HIS   3  23.827   4.887   0.432
  439    HD1  HIS   3           1HD      HIS   3  21.760   7.713  -0.712
  440    HD2  HIS   3           2HD      HIS   3  21.685   3.514  -1.061
  441    HE1  HIS   3           1HE      HIS   3  20.193   7.160  -2.661
  442    H    MET   4           H        MET   4  20.262   3.614   2.820
  443    HA   MET   4           HA       MET   4  21.020   0.901   2.726
  444   1HB   MET   4          1HB       MET   4  18.385   2.435   2.736
  445   2HB   MET   4          2HB       MET   4  18.404   0.684   2.628
  446   1HG   MET   4          1HG       MET   4  18.164   1.240   4.937
  447   2HG   MET   4          2HG       MET   4  19.771   0.565   4.705
  448   1HE   MET   4          1HE       MET   4  20.892   1.344   6.860
  449   2HE   MET   4          2HE       MET   4  20.646   2.943   7.597
  450   3HE   MET   4          3HE       MET   4  19.271   1.830   7.411
  451    H    ALA   5           H        ALA   5  20.882  -0.695   1.118
  452    HA   ALA   5           HA       ALA   5  19.947   0.089  -1.502
  453   1HB   ALA   5          1HB       ALA   5  22.056  -0.764  -2.509
  454   2HB   ALA   5          2HB       ALA   5  22.408   0.538  -1.348
  455   3HB   ALA   5          3HB       ALA   5  22.655  -1.162  -0.882
  456    H    GLU   6           H        GLU   6  19.019  -1.634   0.619
  457    HA   GLU   6           HA       GLU   6  19.527  -4.364  -0.261
  458   1HB   GLU   6          1HB       GLU   6  17.817  -3.294   2.028
  459   2HB   GLU   6          2HB       GLU   6  18.216  -4.984   1.766
  460   1HG   GLU   6          1HG       GLU   6  19.710  -4.161   3.449
  461   2HG   GLU   6          2HG       GLU   6  20.649  -4.462   1.987
  462    HA   PRO   7           HA       PRO   7  15.848  -4.916  -2.678
  463   1HB   PRO   7          1HB       PRO   7  15.556  -7.605  -2.752
  464   2HB   PRO   7          2HB       PRO   7  17.018  -6.800  -3.388
  465   1HG   PRO   7          1HG       PRO   7  16.650  -8.025  -0.627
  466   2HG   PRO   7          2HG       PRO   7  17.958  -8.357  -1.813
  467   1HD   PRO   7          1HD       PRO   7  18.267  -6.544   0.188
  468   2HD   PRO   7          2HD       PRO   7  18.964  -6.258  -1.434
  469    H    GLN   8           H        GLN   8  15.032  -3.776  -0.559
  470    HA   GLN   8           HA       GLN   8  12.458  -5.117   0.074
  471   1HB   GLN   8          1HB       GLN   8  14.330  -3.739   2.016
  472   2HB   GLN   8          2HB       GLN   8  12.587  -3.643   2.245
  473   1HG   GLN   8          1HG       GLN   8  13.406  -5.445   3.581
  474   2HG   GLN   8          2HG       GLN   8  12.389  -6.086   2.299
  475   1HE2  GLN   8          1HE2      GLN   8  13.256  -8.249   2.129
  476   2HE2  GLN   8          2HE2      GLN   8  14.952  -8.451   1.696
  477    H    ARG   9           H        ARG   9  14.194  -1.931  -0.018
  478    HA   ARG   9           HA       ARG   9  11.890  -0.294  -0.122
  479   1HB   ARG   9          1HB       ARG   9  14.151   0.476   0.438
  480   2HB   ARG   9          2HB       ARG   9  14.666   0.127  -1.199
  481   1HG   ARG   9          1HG       ARG   9  12.386   1.885  -1.250
  482   2HG   ARG   9          2HG       ARG   9  13.629   2.577  -0.221
  483   1HD   ARG   9          1HD       ARG   9  14.205   1.632  -3.065
  484   2HD   ARG   9          2HD       ARG   9  13.580   3.229  -2.693
  485    HE   ARG   9           HE       ARG   9  15.595   3.929  -1.857
  486   1HH1  ARG   9          1HH1      ARG   9  15.987   0.441  -2.467
  487   2HH1  ARG   9          2HH1      ARG   9  17.687   0.488  -2.112
  488   1HH2  ARG   9          1HH2      ARG   9  17.665   3.981  -1.480
  489   2HH2  ARG   9          2HH2      ARG   9  18.649   2.553  -1.267
  490    H    HIS  10           H        HIS  10  10.270  -1.145  -1.643
  491    HA   HIS  10           HA       HIS  10  11.106  -1.172  -4.497
  492   1HB   HIS  10          1HB       HIS  10   9.236  -2.991  -2.932
  493   2HB   HIS  10          2HB       HIS  10   9.478  -3.018  -4.681
  494    HD1  HIS  10           1HD      HIS  10  10.312  -5.416  -2.443
  495    HD2  HIS  10           2HD      HIS  10  12.807  -2.647  -4.260
  496    HE1  HIS  10           1HE      HIS  10  12.504  -6.597  -2.805
  497    H    LYS  11           H        LYS  11   9.130  -1.179  -5.979
  498    HA   LYS  11           HA       LYS  11   7.174   0.880  -5.159
  499   1HB   LYS  11          1HB       LYS  11   9.153   1.128  -7.461
  500   2HB   LYS  11          2HB       LYS  11   7.668   2.058  -7.302
  501   1HG   LYS  11          1HG       LYS  11   8.921   3.588  -6.226
  502   2HG   LYS  11          2HG       LYS  11   8.685   2.535  -4.862
  503   1HD   LYS  11          1HD       LYS  11  10.995   3.081  -4.887
  504   2HD   LYS  11          2HD       LYS  11  10.894   1.412  -5.433
  505   1HE   LYS  11          1HE       LYS  11  12.490   2.600  -6.805
  506   2HE   LYS  11          2HE       LYS  11  11.089   2.182  -7.801
  507   1HZ   LYS  11          1HZ       LYS  11  11.886   4.472  -8.124
  508   2HZ   LYS  11          2HZ       LYS  11  11.466   4.846  -6.572
  509   3HZ   LYS  11          3HZ       LYS  11  10.325   4.431  -7.683
  510    H    ILE  12           H        ILE  12   5.332  -0.183  -5.478
  511    HA   ILE  12           HA       ILE  12   4.928  -1.798  -7.944
  512    HB   ILE  12           HB       ILE  12   3.108  -1.352  -5.545
  513   1HG1  ILE  12          1HG1      ILE  12   4.690  -3.839  -6.282
  514   2HG1  ILE  12          2HG1      ILE  12   5.122  -2.694  -5.006
  515   1HG2  ILE  12          1HG2      ILE  12   2.840  -3.186  -7.984
  516   2HG2  ILE  12          2HG2      ILE  12   1.706  -3.124  -6.615
  517   3HG2  ILE  12          3HG2      ILE  12   1.867  -1.738  -7.675
  518   1HD1  ILE  12          1HD1      ILE  12   2.885  -3.116  -3.928
  519   2HD1  ILE  12          2HD1      ILE  12   2.690  -4.486  -5.055
  520   3HD1  ILE  12          3HD1      ILE  12   4.032  -4.459  -3.900
  521    H    LEU  13           H        LEU  13   4.826  -0.211  -9.545
  522    HA   LEU  13           HA       LEU  13   3.286   2.188  -9.276
  523   1HB   LEU  13          1HB       LEU  13   5.104   1.911 -10.924
  524   2HB   LEU  13          2HB       LEU  13   4.099   0.786 -11.845
  525    HG   LEU  13           HG       LEU  13   2.936   3.492 -11.088
  526   1HD1  LEU  13          1HD1      LEU  13   5.146   4.055 -11.836
  527   2HD1  LEU  13          2HD1      LEU  13   3.956   4.505 -13.084
  528   3HD1  LEU  13          3HD1      LEU  13   4.960   3.048 -13.296
  529   1HD2  LEU  13          1HD2      LEU  13   2.695   1.793 -13.617
  530   2HD2  LEU  13          2HD2      LEU  13   1.871   3.341 -13.321
  531   3HD2  LEU  13          3HD2      LEU  13   1.469   1.938 -12.343
  532    H    CYS  14           H        CYS  14   1.232   2.192  -8.951
  533    HA   CYS  14           HA       CYS  14  -0.510   0.351 -10.514
  534   1HB   CYS  14          1HB       CYS  14  -0.306   0.015  -7.883
  535   2HB   CYS  14          2HB       CYS  14  -1.352   1.444  -7.824
  536    HG   CYS  14           HG       CYS  14  -1.808  -1.471  -9.346
  537    H    VAL  15           H        VAL  15  -2.901   1.550  -9.946
  538    HA   VAL  15           HA       VAL  15  -2.585   4.424 -10.417
  539    HB   VAL  15           HB       VAL  15  -4.731   4.408 -11.685
  540   1HG1  VAL  15          1HG1      VAL  15  -3.740   3.813 -13.830
  541   2HG1  VAL  15          2HG1      VAL  15  -2.572   4.673 -12.819
  542   3HG1  VAL  15          3HG1      VAL  15  -2.442   2.907 -13.017
  543   1HG2  VAL  15          1HG2      VAL  15  -4.269   1.404 -11.983
  544   2HG2  VAL  15          2HG2      VAL  15  -5.567   2.158 -11.024
  545   3HG2  VAL  15          3HG2      VAL  15  -5.519   2.378 -12.775
  546    H    CYS  16           H        CYS  16  -4.400   5.629  -9.491
  547    HA   CYS  16           HA       CYS  16  -5.269   4.563  -6.972
  548   1HB   CYS  16          1HB       CYS  16  -5.135   7.057  -7.434
  549   2HB   CYS  16          2HB       CYS  16  -6.605   6.872  -8.432
  550    H    CYS  17           H        CYS  17  -6.868   3.315  -6.534
  551    HA   CYS  17           HA       CYS  17  -8.362   1.725  -8.247
  552   1HB   CYS  17          1HB       CYS  17  -7.981   1.415  -5.774
  553   2HB   CYS  17          2HB       CYS  17  -9.187   2.673  -5.461
  554    HG   CYS  17           HG       CYS  17 -11.114   1.442  -5.662
  555    H    LYS  18           H        LYS  18  -9.296   4.941  -6.969
  556    HA   LYS  18           HA       LYS  18 -11.816   4.787  -8.532
  557   1HB   LYS  18          1HB       LYS  18 -12.725   6.261  -6.815
  558   2HB   LYS  18          2HB       LYS  18 -12.271   4.664  -6.233
  559   1HG   LYS  18          1HG       LYS  18 -10.321   5.563  -5.055
  560   2HG   LYS  18          2HG       LYS  18 -10.481   7.107  -5.886
  561   1HD   LYS  18          1HD       LYS  18 -11.377   7.608  -3.826
  562   2HD   LYS  18          2HD       LYS  18 -12.809   7.307  -4.779
  563   1HE   LYS  18          1HE       LYS  18 -11.468   5.423  -2.785
  564   2HE   LYS  18          2HE       LYS  18 -12.944   6.359  -2.510
  565   1HZ   LYS  18          1HZ       LYS  18 -13.324   3.988  -3.037
  566   2HZ   LYS  18          2HZ       LYS  18 -12.612   4.103  -4.403
  567   3HZ   LYS  18          3HZ       LYS  18 -14.045   4.974  -4.183
  568    H    CYS  19           H        CYS  19  -8.834   6.518  -8.444
  569    HA   CYS  19           HA       CYS  19 -10.054   8.783  -9.899
  570   1HB   CYS  19          1HB       CYS  19  -7.310   8.871  -8.991
  571   2HB   CYS  19          2HB       CYS  19  -8.499  10.117  -9.159
  572    H    ASP  20           H        ASP  20  -8.243   5.871 -10.430
  573    HA   ASP  20           HA       ASP  20  -6.929   5.078 -11.980
  574   1HB   ASP  20          1HB       ASP  20  -9.012   5.524 -13.264
  575   2HB   ASP  20          2HB       ASP  20  -8.282   7.013 -13.860
  576    H    GLY  21           H        GLY  21  -5.924   7.437 -10.471
  577   1HA   GLY  21          1HA       GLY  21  -4.111   8.785 -12.422
  578   2HA   GLY  21          2HA       GLY  21  -4.262   9.213 -10.720
  579    H    ARG  22           H        ARG  22  -1.871   8.669 -12.231
  580    HA   ARG  22           HA       ARG  22  -0.824   6.019 -11.801
  581   1HB   ARG  22          1HB       ARG  22  -0.070   7.529 -13.571
  582   2HB   ARG  22          2HB       ARG  22   0.529   8.700 -12.408
  583   1HG   ARG  22          1HG       ARG  22   1.650   5.873 -12.484
  584   2HG   ARG  22          2HG       ARG  22   2.133   7.083 -13.670
  585   1HD   ARG  22          1HD       ARG  22   2.774   8.604 -11.688
  586   2HD   ARG  22          2HD       ARG  22   2.627   7.151 -10.682
  587    HE   ARG  22           HE       ARG  22   4.225   6.649 -13.007
  588   1HH1  ARG  22          1HH1      ARG  22   4.606   8.365  -9.859
  589   2HH1  ARG  22          2HH1      ARG  22   6.209   7.623  -9.655
  590   1HH2  ARG  22          1HH2      ARG  22   6.480   5.988 -12.617
  591   2HH2  ARG  22          2HH2      ARG  22   7.135   6.443 -11.039
  592    H    ILE  23           H        ILE  23  -0.135   5.115  -9.859
  593    HA   ILE  23           HA       ILE  23   1.064   7.004  -7.924
  594    HB   ILE  23           HB       ILE  23  -0.465   4.583  -6.966
  595   1HG1  ILE  23          1HG1      ILE  23  -1.666   7.382  -7.019
  596   2HG1  ILE  23          2HG1      ILE  23  -2.167   6.024  -8.036
  597   1HG2  ILE  23          1HG2      ILE  23  -0.218   5.829  -4.804
  598   2HG2  ILE  23          2HG2      ILE  23   1.349   5.714  -5.584
  599   3HG2  ILE  23          3HG2      ILE  23   0.435   7.227  -5.678
  600   1HD1  ILE  23          1HD1      ILE  23  -2.346   6.034  -4.998
  601   2HD1  ILE  23          2HD1      ILE  23  -3.670   6.226  -6.123
  602   3HD1  ILE  23          3HD1      ILE  23  -2.790   4.689  -6.076
  603    H    GLU  24           H        GLU  24   3.096   6.406  -7.388
  604    HA   GLU  24           HA       GLU  24   4.089   3.728  -8.165
  605   1HB   GLU  24          1HB       GLU  24   5.154   5.593  -9.091
  606   2HB   GLU  24          2HB       GLU  24   5.459   6.345  -7.510
  607   1HG   GLU  24          1HG       GLU  24   6.933   4.433  -6.955
  608   2HG   GLU  24          2HG       GLU  24   6.560   3.692  -8.520
  609    H    LEU  25           H        LEU  25   3.150   2.477  -6.549
  610    HA   LEU  25           HA       LEU  25   2.913   3.429  -3.886
  611   1HB   LEU  25          1HB       LEU  25   2.594   0.578  -4.825
  612   2HB   LEU  25          2HB       LEU  25   1.958   1.285  -3.359
  613    HG   LEU  25           HG       LEU  25   1.132   2.086  -6.201
  614   1HD1  LEU  25          1HD1      LEU  25  -0.232   0.354  -4.099
  615   2HD1  LEU  25          2HD1      LEU  25   0.455  -0.192  -5.656
  616   3HD1  LEU  25          3HD1      LEU  25  -0.965   0.876  -5.632
  617   1HD2  LEU  25          1HD2      LEU  25   0.875   3.866  -4.420
  618   2HD2  LEU  25          2HD2      LEU  25  -0.037   2.735  -3.433
  619   3HD2  LEU  25          3HD2      LEU  25  -0.694   3.287  -4.999
  620    H    THR  26           H        THR  26   4.795   3.773  -2.805
  621    HA   THR  26           HA       THR  26   6.965   1.863  -3.161
  622    HB   THR  26           HB       THR  26   6.936   4.469  -1.634
  623    HG1  THR  26           1HG      THR  26   6.462   4.514  -3.993
  624   1HG2  THR  26          1HG2      THR  26   9.273   2.873  -2.806
  625   2HG2  THR  26          2HG2      THR  26   8.818   2.819  -1.114
  626   3HG2  THR  26          3HG2      THR  26   9.355   4.353  -1.839
  627    H    VAL  27           H        VAL  27   7.011   0.106  -2.002
  628    HA   VAL  27           HA       VAL  27   6.068   0.079   0.813
  629    HB   VAL  27           HB       VAL  27   4.912  -2.037   0.596
  630   1HG1  VAL  27          1HG1      VAL  27   4.134  -0.563  -1.937
  631   2HG1  VAL  27          2HG1      VAL  27   3.145  -1.592  -0.881
  632   3HG1  VAL  27          3HG1      VAL  27   3.724  -0.019  -0.301
  633   1HG2  VAL  27          1HG2      VAL  27   6.030  -2.217  -2.249
  634   2HG2  VAL  27          2HG2      VAL  27   6.455  -3.263  -0.873
  635   3HG2  VAL  27          3HG2      VAL  27   4.821  -3.308  -1.539
  636    H    GLU  28           H        GLU  28   7.808  -0.499   2.115
  637    HA   GLU  28           HA       GLU  28  10.230  -1.492   0.697
  638   1HB   GLU  28          1HB       GLU  28  10.294  -0.807   3.621
  639   2HB   GLU  28          2HB       GLU  28  11.600  -0.897   2.409
  640   1HG   GLU  28          1HG       GLU  28  10.478   1.068   1.315
  641   2HG   GLU  28          2HG       GLU  28   9.700   1.218   2.939
  642    H    SER  29           H        SER  29   9.869  -3.647   0.268
  643    HA   SER  29           HA       SER  29   9.666  -5.408   2.524
  644   1HB   SER  29          1HB       SER  29   7.164  -4.802   1.839
  645   2HB   SER  29          2HB       SER  29   7.465  -5.940   0.514
  646    HG   SER  29           HG       SER  29   6.780  -7.284   2.165
  647    H    SER  30           H        SER  30  10.036  -7.609   1.854
  648    HA   SER  30           HA       SER  30  12.022  -7.868  -0.121
  649   1HB   SER  30          1HB       SER  30  10.285 -10.138   0.931
  650   2HB   SER  30          2HB       SER  30  11.987 -10.190   0.441
  651    HG   SER  30           HG       SER  30  10.812  -9.059   2.774
  652    H    ALA  31           H        ALA  31  12.006  -8.834  -2.228
  653    HA   ALA  31           HA       ALA  31  10.062  -7.817  -3.867
  654   1HB   ALA  31          1HB       ALA  31  11.792 -10.264  -4.466
  655   2HB   ALA  31          2HB       ALA  31  10.988  -9.237  -5.666
  656   3HB   ALA  31          3HB       ALA  31  12.288  -8.563  -4.664
  657    H    GLU  32           H        GLU  32  10.051 -11.207  -2.608
  658    HA   GLU  32           HA       GLU  32   7.697 -11.627  -4.211
  659   1HB   GLU  32          1HB       GLU  32   9.782 -13.204  -3.659
  660   2HB   GLU  32          2HB       GLU  32   8.580 -13.828  -2.486
  661   1HG   GLU  32          1HG       GLU  32   6.959 -14.174  -4.294
  662   2HG   GLU  32          2HG       GLU  32   7.966 -13.266  -5.418
  663    H    ASP  33           H        ASP  33   8.262 -10.669  -1.050
  664    HA   ASP  33           HA       ASP  33   5.699 -11.331   0.078
  665   1HB   ASP  33          1HB       ASP  33   7.670 -10.778   1.427
  666   2HB   ASP  33          2HB       ASP  33   7.774  -9.192   0.686
  667    H    LEU  34           H        LEU  34   7.218  -8.720  -1.772
  668    HA   LEU  34           HA       LEU  34   4.938  -7.041  -2.136
  669   1HB   LEU  34          1HB       LEU  34   6.793  -5.887  -2.533
  670   2HB   LEU  34          2HB       LEU  34   7.680  -7.192  -3.254
  671    HG   LEU  34           HG       LEU  34   5.439  -5.905  -4.862
  672   1HD1  LEU  34          1HD1      LEU  34   6.839  -4.059  -3.969
  673   2HD1  LEU  34          2HD1      LEU  34   7.089  -4.269  -5.712
  674   3HD1  LEU  34          3HD1      LEU  34   8.289  -4.902  -4.564
  675   1HD2  LEU  34          1HD2      LEU  34   8.133  -7.071  -5.695
  676   2HD2  LEU  34          2HD2      LEU  34   6.904  -6.385  -6.778
  677   3HD2  LEU  34          3HD2      LEU  34   6.568  -7.870  -5.898
  678    H    ARG  35           H        ARG  35   6.182  -9.568  -3.872
  679    HA   ARG  35           HA       ARG  35   4.473  -9.637  -6.194
  680   1HB   ARG  35          1HB       ARG  35   6.684 -10.882  -5.983
  681   2HB   ARG  35          2HB       ARG  35   5.796 -12.129  -5.098
  682   1HG   ARG  35          1HG       ARG  35   4.292 -12.404  -7.089
  683   2HG   ARG  35          2HG       ARG  35   5.311 -11.245  -7.966
  684   1HD   ARG  35          1HD       ARG  35   7.271 -12.782  -7.562
  685   2HD   ARG  35          2HD       ARG  35   6.155 -13.936  -6.802
  686    HE   ARG  35           HE       ARG  35   5.218 -13.179  -9.382
  687   1HH1  ARG  35          1HH1      ARG  35   7.710 -15.332  -7.835
  688   2HH1  ARG  35          2HH1      ARG  35   7.832 -16.323  -9.229
  689   1HH2  ARG  35          1HH2      ARG  35   5.400 -14.599 -11.170
  690   2HH2  ARG  35          2HH2      ARG  35   6.493 -15.935 -11.132
  691    H    THR  36           H        THR  36   4.419 -11.519  -3.158
  692    HA   THR  36           HA       THR  36   1.973 -12.905  -3.641
  693    HB   THR  36           HB       THR  36   3.009 -11.892  -0.953
  694    HG1  THR  36           1HG      THR  36   4.634 -13.080  -1.990
  695   1HG2  THR  36          1HG2      THR  36   1.234 -14.261  -1.720
  696   2HG2  THR  36          2HG2      THR  36   0.715 -12.814  -0.829
  697   3HG2  THR  36          3HG2      THR  36   1.869 -13.943  -0.096
  698    H    LEU  37           H        LEU  37   2.597  -9.715  -2.145
  699    HA   LEU  37           HA       LEU  37  -0.072  -8.811  -1.934
  700   1HB   LEU  37          1HB       LEU  37   1.294  -7.538  -0.699
  701   2HB   LEU  37          2HB       LEU  37   2.677  -7.824  -1.722
  702    HG   LEU  37           HG       LEU  37   1.943  -6.118  -3.297
  703   1HD1  LEU  37          1HD1      LEU  37  -0.545  -5.841  -2.703
  704   2HD1  LEU  37          2HD1      LEU  37   0.255  -4.366  -2.176
  705   3HD1  LEU  37          3HD1      LEU  37  -0.137  -5.601  -1.012
  706   1HD2  LEU  37          1HD2      LEU  37   2.588  -4.241  -1.765
  707   2HD2  LEU  37          2HD2      LEU  37   3.620  -5.655  -1.564
  708   3HD2  LEU  37          3HD2      LEU  37   2.327  -5.327  -0.395
  709    H    GLN  38           H        GLN  38   2.131  -8.723  -4.779
  710    HA   GLN  38           HA       GLN  38   0.398  -7.228  -6.484
  711   1HB   GLN  38          1HB       GLN  38   2.696  -7.467  -7.005
  712   2HB   GLN  38          2HB       GLN  38   2.582  -9.208  -6.988
  713   1HG   GLN  38          1HG       GLN  38   1.037  -9.041  -9.025
  714   2HG   GLN  38          2HG       GLN  38   1.622  -7.368  -9.151
  715   1HE2  GLN  38          1HE2      GLN  38   4.055  -7.103  -9.160
  716   2HE2  GLN  38          2HE2      GLN  38   5.076  -8.413  -9.705
  717    H    GLN  39           H        GLN  39   0.488 -10.722  -5.588
  718    HA   GLN  39           HA       GLN  39  -1.563 -11.409  -7.471
  719   1HB   GLN  39          1HB       GLN  39  -0.993 -12.976  -4.977
  720   2HB   GLN  39          2HB       GLN  39  -1.723 -13.496  -6.489
  721   1HG   GLN  39          1HG       GLN  39   1.148 -12.968  -5.850
  722   2HG   GLN  39          2HG       GLN  39   0.422 -14.380  -6.578
  723   1HE2  GLN  39          1HE2      GLN  39   2.133 -11.540  -7.152
  724   2HE2  GLN  39          2HE2      GLN  39   2.117 -11.490  -8.909
  725    H    LEU  40           H        LEU  40  -1.523 -10.196  -4.103
  726    HA   LEU  40           HA       LEU  40  -4.357 -10.328  -3.723
  727   1HB   LEU  40          1HB       LEU  40  -2.431  -8.398  -2.421
  728   2HB   LEU  40          2HB       LEU  40  -4.073  -8.713  -1.936
  729    HG   LEU  40           HG       LEU  40  -1.882 -10.827  -1.963
  730   1HD1  LEU  40          1HD1      LEU  40  -1.433  -9.070  -0.297
  731   2HD1  LEU  40          2HD1      LEU  40  -1.858 -10.605   0.470
  732   3HD1  LEU  40          3HD1      LEU  40  -3.055  -9.293   0.363
  733   1HD2  LEU  40          1HD2      LEU  40  -3.405 -12.178  -0.604
  734   2HD2  LEU  40          2HD2      LEU  40  -4.141 -11.828  -2.166
  735   3HD2  LEU  40          3HD2      LEU  40  -4.660 -10.927  -0.729
  736    H    PHE  41           H        PHE  41  -2.365  -7.933  -5.469
  737    HA   PHE  41           HA       PHE  41  -4.612  -6.117  -6.008
  738   1HB   PHE  41          1HB       PHE  41  -2.034  -6.567  -7.539
  739   2HB   PHE  41          2HB       PHE  41  -3.316  -5.537  -8.114
  740    HD1  PHE  41           1HD      PHE  41  -3.652  -3.299  -7.273
  741    HD2  PHE  41           2HD      PHE  41  -0.755  -5.914  -5.474
  742    HE1  PHE  41           1HE      PHE  41  -2.667  -1.385  -6.025
  743    HE2  PHE  41           2HE      PHE  41   0.286  -3.998  -4.333
  744    HZ   PHE  41           HZ       PHE  41  -0.736  -1.771  -4.494
  745    H    LEU  42           H        LEU  42  -3.214  -8.878  -7.786
  746    HA   LEU  42           HA       LEU  42  -5.167  -8.845  -9.870
  747   1HB   LEU  42          1HB       LEU  42  -3.351 -10.996  -8.748
  748   2HB   LEU  42          2HB       LEU  42  -4.365 -11.277 -10.156
  749    HG   LEU  42           HG       LEU  42  -2.322  -9.011 -10.022
  750   1HD1  LEU  42          1HD1      LEU  42  -1.151 -11.146  -9.771
  751   2HD1  LEU  42          2HD1      LEU  42  -0.840 -10.458 -11.366
  752   3HD1  LEU  42          3HD1      LEU  42  -1.990 -11.805 -11.189
  753   1HD2  LEU  42          1HD2      LEU  42  -2.499  -9.063 -12.491
  754   2HD2  LEU  42          2HD2      LEU  42  -4.056  -8.688 -11.752
  755   3HD2  LEU  42          3HD2      LEU  42  -3.749 -10.321 -12.382
  756    H    SER  43           H        SER  43  -5.283 -10.295  -6.680
  757    HA   SER  43           HA       SER  43  -7.775 -11.675  -6.845
  758   1HB   SER  43          1HB       SER  43  -6.317 -12.129  -5.031
  759   2HB   SER  43          2HB       SER  43  -6.064 -10.437  -4.717
  760    HG   SER  43           HG       SER  43  -7.323 -10.643  -3.168
  761    H    THR  44           H        THR  44  -7.322  -8.597  -5.041
  762    HA   THR  44           HA       THR  44  -9.564  -7.440  -6.457
  763    HB   THR  44           HB       THR  44 -10.739  -6.794  -4.321
  764    HG1  THR  44           1HG      THR  44  -9.012  -7.302  -2.793
  765   1HG2  THR  44          1HG2      THR  44 -11.426  -8.711  -5.770
  766   2HG2  THR  44          2HG2      THR  44 -11.897  -8.856  -4.061
  767   3HG2  THR  44          3HG2      THR  44 -10.512  -9.788  -4.682
  768    H    LEU  45           H        LEU  45  -6.763  -6.957  -4.634
  769    HA   LEU  45           HA       LEU  45  -7.393  -4.463  -3.555
  770   1HB   LEU  45          1HB       LEU  45  -5.594  -6.108  -2.865
  771   2HB   LEU  45          2HB       LEU  45  -4.548  -5.427  -4.081
  772    HG   LEU  45           HG       LEU  45  -5.766  -3.420  -2.239
  773   1HD1  LEU  45          1HD1      LEU  45  -5.365  -5.290  -0.671
  774   2HD1  LEU  45          2HD1      LEU  45  -4.219  -3.967  -0.409
  775   3HD1  LEU  45          3HD1      LEU  45  -3.707  -5.443  -1.269
  776   1HD2  LEU  45          1HD2      LEU  45  -2.892  -3.947  -3.111
  777   2HD2  LEU  45          2HD2      LEU  45  -3.480  -2.517  -2.234
  778   3HD2  LEU  45          3HD2      LEU  45  -4.009  -2.818  -3.891
  779    H    SER  46           H        SER  46  -7.019  -2.326  -3.987
  780    HA   SER  46           HA       SER  46  -4.934  -1.608  -5.824
  781   1HB   SER  46          1HB       SER  46  -7.791  -0.813  -6.441
  782   2HB   SER  46          2HB       SER  46  -6.379   0.048  -7.088
  783    HG   SER  46           HG       SER  46  -6.418  -2.752  -7.302
  784    H    PHE  47           H        PHE  47  -4.679   0.952  -5.637
  785    HA   PHE  47           HA       PHE  47  -4.843   1.378  -2.724
  786   1HB   PHE  47          1HB       PHE  47  -2.605   0.965  -3.902
  787   2HB   PHE  47          2HB       PHE  47  -2.812   2.570  -4.602
  788    HD1  PHE  47           1HD      PHE  47  -2.168   0.604  -1.551
  789    HD2  PHE  47           2HD      PHE  47  -2.664   4.595  -3.103
  790    HE1  PHE  47           1HE      PHE  47  -1.321   1.544   0.582
  791    HE2  PHE  47           2HE      PHE  47  -1.841   5.527  -0.963
  792    HZ   PHE  47           HZ       PHE  47  -1.165   4.004   0.885
  793    H    VAL  48           H        VAL  48  -4.872   3.518  -2.084
  794    HA   VAL  48           HA       VAL  48  -6.687   5.203  -3.578
  795    HB   VAL  48           HB       VAL  48  -6.989   4.266  -0.698
  796   1HG1  VAL  48          1HG1      VAL  48  -8.652   6.103  -1.141
  797   2HG1  VAL  48          2HG1      VAL  48  -9.314   5.100  -2.485
  798   3HG1  VAL  48          3HG1      VAL  48  -9.417   4.554  -0.843
  799   1HG2  VAL  48          1HG2      VAL  48  -7.103   2.353  -2.232
  800   2HG2  VAL  48          2HG2      VAL  48  -8.652   2.744  -1.589
  801   3HG2  VAL  48          3HG2      VAL  48  -8.233   3.294  -3.263
  802    H    CYS  49           H        CYS  49  -5.329   6.838  -3.921
  803    HA   CYS  49           HA       CYS  49  -3.004   7.551  -2.394
  804   1HB   CYS  49          1HB       CYS  49  -3.278   9.725  -3.748
  805   2HB   CYS  49          2HB       CYS  49  -3.088   8.233  -4.650
  806    HA   PRO  50           HA       PRO  50  -4.684   9.355   1.144
  807   1HB   PRO  50          1HB       PRO  50  -3.164  11.682   1.607
  808   2HB   PRO  50          2HB       PRO  50  -2.754  10.004   2.068
  809   1HG   PRO  50          1HG       PRO  50  -1.899  11.535  -0.398
  810   2HG   PRO  50          2HG       PRO  50  -0.905  10.481   0.660
  811   1HD   PRO  50          1HD       PRO  50  -1.835   9.547  -1.675
  812   2HD   PRO  50          2HD       PRO  50  -1.910   8.509  -0.221
  813    H    TRP  51           H        TRP  51  -4.481  11.559  -1.573
  814    HA   TRP  51           HA       TRP  51  -6.435  13.502  -0.889
  815   1HB   TRP  51          1HB       TRP  51  -5.009  13.836  -2.779
  816   2HB   TRP  51          2HB       TRP  51  -5.446  12.286  -3.483
  817    HD1  TRP  51           HD       TRP  51  -7.656  15.299  -2.395
  818    HE1  TRP  51           1HE      TRP  51  -9.241  15.879  -4.303
  819    HE3  TRP  51           3HE      TRP  51  -6.016  11.907  -5.877
  820    HZ2  TRP  51           2HZ      TRP  51  -9.733  15.012  -7.024
  821    HZ3  TRP  51           3HZ      TRP  51  -7.041  11.839  -8.125
  822    HH2  TRP  51           HH       TRP  51  -8.904  13.374  -8.707
  823    H    CYS  52           H        CYS  52  -6.871  10.464  -2.859
  824    HA   CYS  52           HA       CYS  52  -9.740  10.712  -2.766
  825   1HB   CYS  52          1HB       CYS  52  -9.740   9.065  -4.307
  826   2HB   CYS  52          2HB       CYS  52  -7.981   9.325  -4.361
  827    H    ALA  53           H        ALA  53  -7.334   9.074  -0.743
  828    HA   ALA  53           HA       ALA  53  -9.099   7.366   0.631
  829   1HB   ALA  53          1HB       ALA  53  -6.625   7.322   0.938
  830   2HB   ALA  53          2HB       ALA  53  -6.714   8.885   1.785
  831   3HB   ALA  53          3HB       ALA  53  -7.477   7.467   2.495
  832    H    THR  54           H        THR  54  -8.161  10.729   1.276
  833    HA   THR  54           HA       THR  54  -9.923  11.188   3.479
  834    HB   THR  54           HB       THR  54  -8.590  13.198   1.608
  835    HG1  THR  54           1HG      THR  54  -6.949  11.974   2.296
  836   1HG2  THR  54          1HG2      THR  54  -8.525  14.638   3.615
  837   2HG2  THR  54          2HG2      THR  54  -9.396  13.402   4.542
  838   3HG2  THR  54          3HG2      THR  54 -10.195  14.231   3.187
  839    H    ASN  55           H        ASN  55 -10.118  12.106  -0.010
  840    HA   ASN  55           HA       ASN  55 -12.633  13.547   0.463
  841   1HB   ASN  55          1HB       ASN  55 -10.935  13.177  -2.047
  842   2HB   ASN  55          2HB       ASN  55 -12.403  14.146  -1.958
  843   1HD2  ASN  55          1HD2      ASN  55  -9.111  13.852  -0.606
  844   2HD2  ASN  55          2HD2      ASN  55  -9.064  15.515  -0.003
  845    H    GLN  56           H        GLN  56 -11.781  10.442  -0.552
  846    HA   GLN  56           HA       GLN  56 -12.863   8.611  -1.247
  847   1HB   GLN  56          2HB       GLN  56 -14.844   9.488   0.119
  848   2HB   GLN  56          3HB       GLN  56 -15.509  10.079  -1.406
  849   1HG   GLN  56          2HG       GLN  56 -15.670   7.823  -2.289
  850   2HG   GLN  56          3HG       GLN  56 -14.686   7.179  -0.969
  851   1HE2  GLN  56          1HE2      GLN  56 -17.903   8.373  -1.853
  852   2HE2  GLN  56          2HE2      GLN  56 -18.671   7.878  -0.344
  Start of MODEL    5
    1   1H    GLY   1          1H        GLY   1 -29.397  11.642  -0.537
    2   1HA   GLY   1          1HA       GLY   1 -31.480  10.054  -1.860
    3   2HA   GLY   1          2HA       GLY   1 -29.945  10.560  -2.606
    4    H    SER   2           H        SER   2 -30.462   7.822  -2.479
    5    HA   SER   2           HA       SER   2 -29.379   6.531  -0.219
    6   1HB   SER   2          1HB       SER   2 -29.287   5.632  -3.129
    7   2HB   SER   2          2HB       SER   2 -29.351   4.613  -1.677
    8    HG   SER   2           HG       SER   2 -31.401   4.770  -2.610
    9    H    HIS   3           H        HIS   3 -27.317   5.136  -0.438
   10    HA   HIS   3           HA       HIS   3 -25.299   6.052  -2.252
   11   1HB   HIS   3          1HB       HIS   3 -23.546   6.388  -0.681
   12   2HB   HIS   3          2HB       HIS   3 -24.861   7.428  -0.165
   13    HD1  HIS   3           1HD      HIS   3 -22.802   4.415   0.989
   14    HD2  HIS   3           2HD      HIS   3 -26.182   6.682   2.145
   15    HE1  HIS   3           1HE      HIS   3 -23.321   3.803   3.413
   16    H    MET   4           H        MET   4 -23.296   4.359  -1.556
   17    HA   MET   4           HA       MET   4 -24.444   1.735  -0.866
   18   1HB   MET   4          1HB       MET   4 -24.257   1.932  -3.344
   19   2HB   MET   4          2HB       MET   4 -22.532   2.276  -3.189
   20   1HG   MET   4          1HG       MET   4 -22.077   0.046  -2.416
   21   2HG   MET   4          2HG       MET   4 -23.795  -0.281  -2.137
   22   1HE   MET   4          1HE       MET   4 -21.930  -2.312  -3.705
   23   2HE   MET   4          2HE       MET   4 -23.668  -2.578  -3.440
   24   3HE   MET   4          3HE       MET   4 -22.971  -2.747  -5.070
   25    H    ALA   5           H        ALA   5 -22.547   0.243  -0.202
   26    HA   ALA   5           HA       ALA   5 -19.981   1.392   0.201
   27   1HB   ALA   5          1HB       ALA   5 -21.005   2.047   2.374
   28   2HB   ALA   5          2HB       ALA   5 -21.575   0.377   2.614
   29   3HB   ALA   5          3HB       ALA   5 -19.834   0.732   2.602
   30    H    GLU   6           H        GLU   6 -18.474  -0.480   0.587
   31    HA   GLU   6           HA       GLU   6 -19.631  -3.152   0.254
   32   1HB   GLU   6          1HB       GLU   6 -17.518  -1.953  -1.597
   33   2HB   GLU   6          2HB       GLU   6 -18.027  -3.647  -1.562
   34   1HG   GLU   6          1HG       GLU   6 -20.344  -2.960  -2.145
   35   2HG   GLU   6          2HG       GLU   6 -19.792  -1.287  -2.325
   36    HA   PRO   7           HA       PRO   7 -16.311  -3.806   3.189
   37   1HB   PRO   7          1HB       PRO   7 -16.151  -6.502   3.289
   38   2HB   PRO   7          2HB       PRO   7 -17.656  -5.648   3.725
   39   1HG   PRO   7          1HG       PRO   7 -16.965  -6.886   1.034
   40   2HG   PRO   7          2HG       PRO   7 -18.429  -7.170   2.032
   41   1HD   PRO   7          1HD       PRO   7 -18.383  -5.334   0.009
   42   2HD   PRO   7          2HD       PRO   7 -19.312  -5.050   1.511
   43    H    GLN   8           H        GLN   8 -15.214  -2.716   1.063
   44    HA   GLN   8           HA       GLN   8 -12.755  -4.290   0.545
   45   1HB   GLN   8          1HB       GLN   8 -14.525  -2.932  -1.495
   46   2HB   GLN   8          2HB       GLN   8 -12.782  -2.985  -1.731
   47   1HG   GLN   8          1HG       GLN   8 -13.746  -4.816  -2.924
   48   2HG   GLN   8          2HG       GLN   8 -12.773  -5.436  -1.600
   49   1HE2  GLN   8          1HE2      GLN   8 -13.814  -7.506  -1.182
   50   2HE2  GLN   8          2HE2      GLN   8 -15.525  -7.523  -0.790
   51    H    ARG   9           H        ARG   9 -14.190  -0.932   0.403
   52    HA   ARG   9           HA       ARG   9 -11.683   0.375   0.299
   53   1HB   ARG   9          1HB       ARG   9 -13.902   1.367  -0.262
   54   2HB   ARG   9          2HB       ARG   9 -14.246   1.494   1.453
   55   1HG   ARG   9          1HG       ARG   9 -11.824   2.719   0.433
   56   2HG   ARG   9          2HG       ARG   9 -13.360   3.527   0.160
   57   1HD   ARG   9          1HD       ARG   9 -13.663   3.360   2.744
   58   2HD   ARG   9          2HD       ARG   9 -11.944   2.973   2.791
   59    HE   ARG   9           HE       ARG   9 -11.406   5.145   2.339
   60   1HH1  ARG   9          1HH1      ARG   9 -14.861   4.722   1.588
   61   2HH1  ARG   9          2HH1      ARG   9 -15.123   6.436   1.316
   62   1HH2  ARG   9          1HH2      ARG   9 -11.883   7.490   2.080
   63   2HH2  ARG   9          2HH2      ARG   9 -13.517   7.913   1.682
   64    H    HIS  10           H        HIS  10 -10.128  -0.460   1.852
   65    HA   HIS  10           HA       HIS  10 -10.888  -0.077   4.699
   66   1HB   HIS  10          1HB       HIS  10  -9.273  -2.266   3.345
   67   2HB   HIS  10          2HB       HIS  10  -9.524  -2.070   5.088
   68    HD1  HIS  10           1HD      HIS  10 -10.619  -4.574   3.040
   69    HD2  HIS  10           2HD      HIS  10 -12.775  -1.415   4.652
   70    HE1  HIS  10           1HE      HIS  10 -12.897  -5.488   3.526
   71    H    LYS  11           H        LYS  11  -8.904  -0.062   6.140
   72    HA   LYS  11           HA       LYS  11  -6.899   1.803   5.036
   73   1HB   LYS  11          1HB       LYS  11  -8.957   2.210   7.224
   74   2HB   LYS  11          2HB       LYS  11  -7.499   3.203   7.038
   75   1HG   LYS  11          1HG       LYS  11  -8.192   3.987   4.873
   76   2HG   LYS  11          2HG       LYS  11  -9.543   2.851   4.786
   77   1HD   LYS  11          1HD       LYS  11 -10.201   5.183   5.304
   78   2HD   LYS  11          2HD       LYS  11 -10.763   3.970   6.471
   79   1HE   LYS  11          1HE       LYS  11  -9.198   4.613   8.122
   80   2HE   LYS  11          2HE       LYS  11  -8.117   5.298   6.921
   81   1HZ   LYS  11          1HZ       LYS  11  -8.959   7.020   8.105
   82   2HZ   LYS  11          2HZ       LYS  11 -10.557   6.546   7.988
   83   3HZ   LYS  11          3HZ       LYS  11  -9.735   7.125   6.663
   84    H    ILE  12           H        ILE  12  -5.162   0.505   5.398
   85    HA   ILE  12           HA       ILE  12  -4.769  -0.704   8.084
   86    HB   ILE  12           HB       ILE  12  -2.941  -0.738   5.659
   87   1HG1  ILE  12          1HG1      ILE  12  -4.754  -2.970   6.606
   88   2HG1  ILE  12          2HG1      ILE  12  -5.041  -1.938   5.200
   89   1HG2  ILE  12          1HG2      ILE  12  -2.893  -2.248   8.327
   90   2HG2  ILE  12          2HG2      ILE  12  -1.728  -2.485   6.998
   91   3HG2  ILE  12          3HG2      ILE  12  -1.780  -0.958   7.859
   92   1HD1  ILE  12          1HD1      ILE  12  -2.784  -2.641   4.287
   93   2HD1  ILE  12          2HD1      ILE  12  -2.790  -3.924   5.530
   94   3HD1  ILE  12          3HD1      ILE  12  -4.057  -3.857   4.290
   95    H    LEU  13           H        LEU  13  -4.602   1.181   9.369
   96    HA   LEU  13           HA       LEU  13  -2.739   3.273   8.756
   97   1HB   LEU  13          1HB       LEU  13  -4.614   3.521  10.342
   98   2HB   LEU  13          2HB       LEU  13  -3.782   2.470  11.493
   99    HG   LEU  13           HG       LEU  13  -2.247   4.818  10.325
  100   1HD1  LEU  13          1HD1      LEU  13  -4.382   5.801  10.798
  101   2HD1  LEU  13          2HD1      LEU  13  -3.209   6.310  12.037
  102   3HD1  LEU  13          3HD1      LEU  13  -4.421   5.062  12.420
  103   1HD2  LEU  13          1HD2      LEU  13  -2.347   3.598  13.125
  104   2HD2  LEU  13          2HD2      LEU  13  -1.315   4.956  12.627
  105   3HD2  LEU  13          3HD2      LEU  13  -1.059   3.363  11.927
  106    H    CYS  14           H        CYS  14  -0.698   2.822   8.395
  107    HA   CYS  14           HA       CYS  14   0.747   1.099  10.361
  108   1HB   CYS  14          1HB       CYS  14   0.518   0.272   7.869
  109   2HB   CYS  14          2HB       CYS  14   1.731   1.525   7.533
  110    HG   CYS  14           HG       CYS  14   1.809  -1.069   9.603
  111    H    VAL  15           H        VAL  15   3.313   1.819   9.744
  112    HA   VAL  15           HA       VAL  15   3.413   4.758   9.927
  113    HB   VAL  15           HB       VAL  15   5.377   4.550  11.422
  114   1HG1  VAL  15          1HG1      VAL  15   4.089   4.300  13.470
  115   2HG1  VAL  15          2HG1      VAL  15   3.163   5.201  12.264
  116   3HG1  VAL  15          3HG1      VAL  15   2.769   3.495  12.590
  117   1HG2  VAL  15          1HG2      VAL  15   4.433   1.675  11.892
  118   2HG2  VAL  15          2HG2      VAL  15   5.921   2.139  11.032
  119   3HG2  VAL  15          3HG2      VAL  15   5.735   2.530  12.744
  120    H    CYS  16           H        CYS  16   5.265   5.665   9.046
  121    HA   CYS  16           HA       CYS  16   6.081   4.395   6.629
  122   1HB   CYS  16          1HB       CYS  16   5.820   6.907   7.038
  123   2HB   CYS  16          2HB       CYS  16   7.344   6.831   7.962
  124    H    CYS  17           H        CYS  17   7.817   3.281   6.126
  125    HA   CYS  17           HA       CYS  17   9.279   1.928   8.134
  126   1HB   CYS  17          1HB       CYS  17   8.760   1.217   5.720
  127   2HB   CYS  17          2HB       CYS  17  10.112   2.243   5.232
  128    HG   CYS  17           HG       CYS  17  11.283   0.243   5.138
  129    H    LYS  18           H        LYS  18  10.214   4.869   6.241
  130    HA   LYS  18           HA       LYS  18  12.897   4.732   7.455
  131   1HB   LYS  18          1HB       LYS  18  13.644   5.998   5.661
  132   2HB   LYS  18          2HB       LYS  18  12.547   4.817   4.978
  133   1HG   LYS  18          1HG       LYS  18  11.599   6.540   3.881
  134   2HG   LYS  18          2HG       LYS  18  10.806   6.925   5.391
  135   1HD   LYS  18          1HD       LYS  18  11.786   8.955   4.561
  136   2HD   LYS  18          2HD       LYS  18  12.749   8.466   5.953
  137   1HE   LYS  18          1HE       LYS  18  14.357   7.365   4.328
  138   2HE   LYS  18          2HE       LYS  18  13.426   8.106   3.020
  139   1HZ   LYS  18          1HZ       LYS  18  13.973  10.290   3.891
  140   2HZ   LYS  18          2HZ       LYS  18  15.281   9.531   3.565
  141   3HZ   LYS  18          3HZ       LYS  18  14.823   9.623   5.171
  142    H    CYS  19           H        CYS  19   9.932   6.645   7.831
  143    HA   CYS  19           HA       CYS  19  11.448   8.528   9.506
  144   1HB   CYS  19          1HB       CYS  19  10.056  10.242   8.637
  145   2HB   CYS  19          2HB       CYS  19  10.992   9.505   7.352
  146    H    ASP  20           H        ASP  20   9.226   6.058   9.787
  147    HA   ASP  20           HA       ASP  20   7.683   5.463  11.200
  148   1HB   ASP  20          1HB       ASP  20   9.624   5.994  12.690
  149   2HB   ASP  20          2HB       ASP  20   8.830   7.517  13.096
  150    H    GLY  21           H        GLY  21   7.072   7.931   9.474
  151   1HA   GLY  21          1HA       GLY  21   5.162   9.479  11.022
  152   2HA   GLY  21          2HA       GLY  21   5.318   9.528   9.262
  153    H    ARG  22           H        ARG  22   2.959   9.414  10.907
  154    HA   ARG  22           HA       ARG  22   1.640   6.857  10.854
  155   1HB   ARG  22          1HB       ARG  22   0.964   8.672  12.307
  156   2HB   ARG  22          2HB       ARG  22   0.624   9.737  10.950
  157   1HG   ARG  22          1HG       ARG  22  -0.940   7.166  11.096
  158   2HG   ARG  22          2HG       ARG  22  -1.239   8.379  12.341
  159   1HD   ARG  22          1HD       ARG  22  -1.590  10.089  10.468
  160   2HD   ARG  22          2HD       ARG  22  -1.611   8.712   9.349
  161    HE   ARG  22           HE       ARG  22  -3.383   8.431  11.637
  162   1HH1  ARG  22          1HH1      ARG  22  -3.310   9.909   8.382
  163   2HH1  ARG  22          2HH1      ARG  22  -4.977   9.426   8.046
  164   1HH2  ARG  22          1HH2      ARG  22  -5.628   8.064  11.196
  165   2HH2  ARG  22          2HH2      ARG  22  -6.253   8.377   9.613
  166    H    ILE  23           H        ILE  23   1.108   5.698   8.999
  167    HA   ILE  23           HA       ILE  23   0.205   7.323   6.690
  168    HB   ILE  23           HB       ILE  23   1.421   4.584   6.301
  169   1HG1  ILE  23          1HG1      ILE  23   2.945   7.211   6.063
  170   2HG1  ILE  23          2HG1      ILE  23   3.242   5.928   7.241
  171   1HG2  ILE  23          1HG2      ILE  23   1.409   5.388   3.947
  172   2HG2  ILE  23          2HG2      ILE  23  -0.171   5.722   4.631
  173   3HG2  ILE  23          3HG2      ILE  23   1.008   7.031   4.478
  174   1HD1  ILE  23          1HD1      ILE  23   3.526   5.546   4.241
  175   2HD1  ILE  23          2HD1      ILE  23   4.832   5.814   5.361
  176   3HD1  ILE  23          3HD1      ILE  23   3.856   4.342   5.510
  177    H    GLU  24           H        GLU  24  -1.891   7.142   6.522
  178    HA   GLU  24           HA       GLU  24  -3.400   4.818   7.500
  179   1HB   GLU  24          1HB       GLU  24  -4.052   7.009   8.053
  180   2HB   GLU  24          2HB       GLU  24  -4.075   7.540   6.361
  181   1HG   GLU  24          1HG       GLU  24  -6.041   6.167   5.930
  182   2HG   GLU  24          2HG       GLU  24  -5.896   5.395   7.515
  183    H    LEU  25           H        LEU  25  -2.615   3.204   6.064
  184    HA   LEU  25           HA       LEU  25  -2.426   3.690   3.267
  185   1HB   LEU  25          1HB       LEU  25  -2.548   1.029   4.639
  186   2HB   LEU  25          2HB       LEU  25  -1.897   1.373   3.054
  187    HG   LEU  25           HG       LEU  25  -0.737   2.436   5.682
  188   1HD1  LEU  25          1HD1      LEU  25   0.054   0.050   3.982
  189   2HD1  LEU  25          2HD1      LEU  25  -0.569   0.018   5.645
  190   3HD1  LEU  25          3HD1      LEU  25   1.022   0.728   5.324
  191   1HD2  LEU  25          1HD2      LEU  25  -0.212   3.729   3.547
  192   2HD2  LEU  25          2HD2      LEU  25   0.432   2.246   2.850
  193   3HD2  LEU  25          3HD2      LEU  25   1.220   2.973   4.270
  194    H    THR  26           H        THR  26  -4.404   4.264   2.394
  195    HA   THR  26           HA       THR  26  -6.771   2.645   2.967
  196    HB   THR  26           HB       THR  26  -6.436   4.969   1.066
  197    HG1  THR  26           1HG      THR  26  -5.933   5.355   3.337
  198   1HG2  THR  26          1HG2      THR  26  -8.896   3.820   2.494
  199   2HG2  THR  26          2HG2      THR  26  -8.511   3.477   0.806
  200   3HG2  THR  26          3HG2      THR  26  -8.871   5.148   1.312
  201    H    VAL  27           H        VAL  27  -6.820   0.663   2.059
  202    HA   VAL  27           HA       VAL  27  -5.973   0.269  -0.759
  203    HB   VAL  27           HB       VAL  27  -4.767  -1.781  -0.301
  204   1HG1  VAL  27          1HG1      VAL  27  -4.013  -0.062   2.068
  205   2HG1  VAL  27          2HG1      VAL  27  -3.018  -1.159   1.092
  206   3HG1  VAL  27          3HG1      VAL  27  -3.628   0.351   0.388
  207   1HG2  VAL  27          1HG2      VAL  27  -5.936  -1.634   2.538
  208   2HG2  VAL  27          2HG2      VAL  27  -6.318  -2.848   1.300
  209   3HG2  VAL  27          3HG2      VAL  27  -4.698  -2.783   1.996
  210    H    GLU  28           H        GLU  28  -7.733  -0.414  -1.929
  211    HA   GLU  28           HA       GLU  28 -10.203  -1.054  -0.385
  212   1HB   GLU  28          1HB       GLU  28 -10.326  -0.567  -3.357
  213   2HB   GLU  28          2HB       GLU  28 -11.571  -0.391  -2.083
  214   1HG   GLU  28          1HG       GLU  28 -10.184   1.484  -1.213
  215   2HG   GLU  28          2HG       GLU  28  -9.432   1.353  -2.854
  216    H    SER  29           H        SER  29 -10.156  -3.195   0.168
  217    HA   SER  29           HA       SER  29 -10.260  -5.151  -1.915
  218   1HB   SER  29          1HB       SER  29  -7.691  -4.752  -1.404
  219   2HB   SER  29          2HB       SER  29  -8.012  -5.735   0.020
  220    HG   SER  29           HG       SER  29  -7.444  -7.204  -1.495
  221    H    SER  30           H        SER  30 -10.821  -7.261  -1.009
  222    HA   SER  30           HA       SER  30 -12.608  -7.257   1.126
  223   1HB   SER  30          1HB       SER  30 -10.958  -9.580   0.036
  224   2HB   SER  30          2HB       SER  30 -12.542  -9.689   0.835
  225    HG   SER  30           HG       SER  30 -12.475  -9.684  -1.565
  226    H    ALA  31           H        ALA  31 -12.472  -7.893   3.301
  227    HA   ALA  31           HA       ALA  31 -10.308  -6.912   4.687
  228   1HB   ALA  31          1HB       ALA  31 -12.318  -8.986   5.666
  229   2HB   ALA  31          2HB       ALA  31 -11.296  -7.956   6.690
  230   3HB   ALA  31          3HB       ALA  31 -12.540  -7.218   5.665
  231    H    GLU  32           H        GLU  32 -10.849 -10.359   3.849
  232    HA   GLU  32           HA       GLU  32  -8.636 -11.366   5.351
  233   1HB   GLU  32          1HB       GLU  32 -10.201 -12.454   2.993
  234   2HB   GLU  32          2HB       GLU  32  -9.014 -13.385   3.932
  235   1HG   GLU  32          1HG       GLU  32 -10.342 -12.977   6.009
  236   2HG   GLU  32          2HG       GLU  32 -11.558 -12.112   5.064
  237    H    ASP  33           H        ASP  33  -8.916 -10.095   2.047
  238    HA   ASP  33           HA       ASP  33  -6.380 -11.049   1.083
  239   1HB   ASP  33          1HB       ASP  33  -8.193 -10.559  -0.439
  240   2HB   ASP  33          2HB       ASP  33  -8.345  -8.919   0.167
  241    H    LEU  34           H        LEU  34  -7.694  -8.052   2.421
  242    HA   LEU  34           HA       LEU  34  -5.333  -6.497   2.617
  243   1HB   LEU  34          1HB       LEU  34  -7.238  -5.303   2.935
  244   2HB   LEU  34          2HB       LEU  34  -8.024  -6.494   3.935
  245    HG   LEU  34           HG       LEU  34  -5.639  -5.056   5.131
  246   1HD1  LEU  34          1HD1      LEU  34  -6.994  -3.278   4.069
  247   2HD1  LEU  34          2HD1      LEU  34  -7.155  -3.218   5.834
  248   3HD1  LEU  34          3HD1      LEU  34  -8.441  -3.958   4.853
  249   1HD2  LEU  34          1HD2      LEU  34  -8.324  -5.967   6.281
  250   2HD2  LEU  34          2HD2      LEU  34  -7.032  -5.156   7.189
  251   3HD2  LEU  34          3HD2      LEU  34  -6.772  -6.767   6.543
  252    H    ARG  35           H        ARG  35  -6.662  -8.776   4.675
  253    HA   ARG  35           HA       ARG  35  -4.900  -8.524   6.952
  254   1HB   ARG  35          1HB       ARG  35  -7.189  -9.535   7.070
  255   2HB   ARG  35          2HB       ARG  35  -6.577 -10.988   6.284
  256   1HG   ARG  35          1HG       ARG  35  -5.026 -11.383   8.133
  257   2HG   ARG  35          2HG       ARG  35  -5.479  -9.838   8.888
  258   1HD   ARG  35          1HD       ARG  35  -7.786 -10.675   9.188
  259   2HD   ARG  35          2HD       ARG  35  -7.323 -12.225   8.448
  260    HE   ARG  35           HE       ARG  35  -5.491 -11.804  10.480
  261   1HH1  ARG  35          1HH1      ARG  35  -8.988 -12.217  10.307
  262   2HH1  ARG  35          2HH1      ARG  35  -9.171 -12.820  11.919
  263   1HH2  ARG  35          1HH2      ARG  35  -5.686 -12.603  12.634
  264   2HH2  ARG  35          2HH2      ARG  35  -7.226 -13.051  13.267
  265    H    THR  36           H        THR  36  -5.126 -10.845   4.314
  266    HA   THR  36           HA       THR  36  -2.773 -12.366   4.834
  267    HB   THR  36           HB       THR  36  -3.881 -11.547   2.106
  268    HG1  THR  36           1HG      THR  36  -5.494 -12.531   3.326
  269   1HG2  THR  36          1HG2      THR  36  -2.210 -13.959   2.943
  270   2HG2  THR  36          2HG2      THR  36  -1.643 -12.595   1.948
  271   3HG2  THR  36          3HG2      THR  36  -2.907 -13.672   1.334
  272    H    LEU  37           H        LEU  37  -3.156  -9.376   2.868
  273    HA   LEU  37           HA       LEU  37  -0.445  -8.698   2.554
  274   1HB   LEU  37          1HB       LEU  37  -1.696  -7.423   1.221
  275   2HB   LEU  37          2HB       LEU  37  -3.099  -7.515   2.248
  276    HG   LEU  37           HG       LEU  37  -2.213  -5.715   3.669
  277   1HD1  LEU  37          1HD1      LEU  37   0.257  -5.668   3.039
  278   2HD1  LEU  37          2HD1      LEU  37  -0.461  -4.198   2.386
  279   3HD1  LEU  37          3HD1      LEU  37  -0.154  -5.555   1.334
  280   1HD2  LEU  37          1HD2      LEU  37  -2.707  -3.943   1.924
  281   2HD2  LEU  37          2HD2      LEU  37  -3.901  -5.225   2.028
  282   3HD2  LEU  37          3HD2      LEU  37  -2.717  -5.235   0.711
  283    H    GLN  38           H        GLN  38  -2.587  -8.049   5.417
  284    HA   GLN  38           HA       GLN  38  -0.639  -6.533   6.790
  285   1HB   GLN  38          1HB       GLN  38  -3.059  -6.575   7.235
  286   2HB   GLN  38          2HB       GLN  38  -2.908  -8.191   7.930
  287   1HG   GLN  38          1HG       GLN  38  -1.503  -7.392   9.724
  288   2HG   GLN  38          2HG       GLN  38  -1.448  -5.770   9.015
  289   1HE2  GLN  38          1HE2      GLN  38  -3.663  -4.682   8.672
  290   2HE2  GLN  38          2HE2      GLN  38  -4.945  -5.114   9.794
  291    H    GLN  39           H        GLN  39  -1.071 -10.080   6.406
  292    HA   GLN  39           HA       GLN  39   0.778 -10.735   8.498
  293   1HB   GLN  39          1HB       GLN  39   0.177 -12.496   6.128
  294   2HB   GLN  39          2HB       GLN  39   0.829 -12.934   7.699
  295   1HG   GLN  39          1HG       GLN  39  -1.981 -12.210   6.963
  296   2HG   GLN  39          2HG       GLN  39  -1.396 -13.651   7.751
  297   1HE2  GLN  39          1HE2      GLN  39  -2.703 -10.537   8.187
  298   2HE2  GLN  39          2HE2      GLN  39  -2.644 -10.467   9.957
  299    H    LEU  40           H        LEU  40   0.990 -10.053   4.982
  300    HA   LEU  40           HA       LEU  40   3.810 -10.502   4.717
  301   1HB   LEU  40          1HB       LEU  40   2.244  -8.383   3.220
  302   2HB   LEU  40          2HB       LEU  40   3.743  -9.126   2.758
  303    HG   LEU  40           HG       LEU  40   1.041 -10.501   2.909
  304   1HD1  LEU  40          1HD1      LEU  40   1.243  -8.955   1.057
  305   2HD1  LEU  40          2HD1      LEU  40   1.191 -10.625   0.473
  306   3HD1  LEU  40          3HD1      LEU  40   2.741  -9.750   0.528
  307   1HD2  LEU  40          1HD2      LEU  40   2.023 -12.471   1.886
  308   2HD2  LEU  40          2HD2      LEU  40   2.818 -12.149   3.431
  309   3HD2  LEU  40          3HD2      LEU  40   3.633 -11.723   1.913
  310    H    PHE  41           H        PHE  41   2.001  -7.674   5.947
  311    HA   PHE  41           HA       PHE  41   4.303  -5.958   6.427
  312   1HB   PHE  41          1HB       PHE  41   1.487  -6.055   7.483
  313   2HB   PHE  41          2HB       PHE  41   2.687  -5.203   8.415
  314    HD1  PHE  41           1HD      PHE  41   3.806  -3.192   7.577
  315    HD2  PHE  41           2HD      PHE  41   0.640  -5.129   5.379
  316    HE1  PHE  41           1HE      PHE  41   3.494  -1.145   6.199
  317    HE2  PHE  41           2HE      PHE  41   0.363  -3.072   4.003
  318    HZ   PHE  41           HZ       PHE  41   1.883  -1.156   4.327
  319    H    LEU  42           H        LEU  42   2.539  -8.216   8.552
  320    HA   LEU  42           HA       LEU  42   4.312  -7.955  10.761
  321   1HB   LEU  42          1HB       LEU  42   2.359 -10.076   9.836
  322   2HB   LEU  42          2HB       LEU  42   3.212 -10.227  11.366
  323    HG   LEU  42           HG       LEU  42   1.495  -7.793  10.691
  324   1HD1  LEU  42          1HD1      LEU  42   0.071  -9.788  10.599
  325   2HD1  LEU  42          2HD1      LEU  42  -0.292  -8.826  12.037
  326   3HD1  LEU  42          3HD1      LEU  42   0.669 -10.317  12.185
  327   1HD2  LEU  42          1HD2      LEU  42   1.435  -7.496  13.144
  328   2HD2  LEU  42          2HD2      LEU  42   3.087  -7.422  12.527
  329   3HD2  LEU  42          3HD2      LEU  42   2.516  -8.893  13.344
  330    H    SER  43           H        SER  43   4.557  -9.967   7.887
  331    HA   SER  43           HA       SER  43   6.758 -11.587   8.728
  332   1HB   SER  43          1HB       SER  43   5.194 -12.153   6.887
  333   2HB   SER  43          2HB       SER  43   5.791 -10.784   5.947
  334    HG   SER  43           HG       SER  43   7.013 -12.310   5.201
  335    H    THR  44           H        THR  44   6.746  -8.897   6.283
  336    HA   THR  44           HA       THR  44   9.312  -7.992   7.263
  337    HB   THR  44           HB       THR  44  10.275  -8.063   4.928
  338    HG1  THR  44           1HG      THR  44   8.570  -8.365   3.572
  339   1HG2  THR  44          1HG2      THR  44  10.925 -10.367   4.925
  340   2HG2  THR  44          2HG2      THR  44   9.534 -10.832   5.922
  341   3HG2  THR  44          3HG2      THR  44  10.827  -9.825   6.617
  342    H    LEU  45           H        LEU  45   6.436  -7.381   5.349
  343    HA   LEU  45           HA       LEU  45   7.553  -5.229   3.929
  344   1HB   LEU  45          1HB       LEU  45   5.590  -6.664   3.296
  345   2HB   LEU  45          2HB       LEU  45   4.582  -5.761   4.387
  346    HG   LEU  45           HG       LEU  45   6.093  -4.057   2.459
  347   1HD1  LEU  45          1HD1      LEU  45   5.586  -6.019   1.010
  348   2HD1  LEU  45          2HD1      LEU  45   4.652  -4.587   0.561
  349   3HD1  LEU  45          3HD1      LEU  45   3.892  -5.919   1.484
  350   1HD2  LEU  45          1HD2      LEU  45   3.131  -4.245   3.138
  351   2HD2  LEU  45          2HD2      LEU  45   3.941  -2.929   2.255
  352   3HD2  LEU  45          3HD2      LEU  45   4.299  -3.202   3.964
  353    H    SER  46           H        SER  46   7.329  -2.995   4.008
  354    HA   SER  46           HA       SER  46   5.492  -1.887   5.957
  355   1HB   SER  46          1HB       SER  46   8.438  -1.189   5.973
  356   2HB   SER  46          2HB       SER  46   7.175  -0.173   6.717
  357    HG   SER  46           HG       SER  46   7.067  -2.892   7.312
  358    H    PHE  47           H        PHE  47   5.444   0.685   5.396
  359    HA   PHE  47           HA       PHE  47   5.441   0.869   2.443
  360   1HB   PHE  47          1HB       PHE  47   3.158   0.785   3.749
  361   2HB   PHE  47          2HB       PHE  47   3.574   2.402   4.257
  362    HD1  PHE  47           1HD      PHE  47   2.381   0.288   1.524
  363    HD2  PHE  47           2HD      PHE  47   3.841   4.232   2.469
  364    HE1  PHE  47           1HE      PHE  47   1.484   1.147  -0.622
  365    HE2  PHE  47           2HE      PHE  47   2.995   5.067   0.305
  366    HZ   PHE  47           HZ       PHE  47   1.795   3.530  -1.243
  367    H    VAL  48           H        VAL  48   5.991   2.989   1.711
  368    HA   VAL  48           HA       VAL  48   7.105   4.748   3.704
  369    HB   VAL  48           HB       VAL  48   8.671   3.007   2.330
  370   1HG1  VAL  48          1HG1      VAL  48   8.463   4.217   0.261
  371   2HG1  VAL  48          2HG1      VAL  48   9.335   5.596   0.990
  372   3HG1  VAL  48          3HG1      VAL  48  10.123   4.002   0.841
  373   1HG2  VAL  48          1HG2      VAL  48   9.211   4.122   4.417
  374   2HG2  VAL  48          2HG2      VAL  48  10.567   4.163   3.277
  375   3HG2  VAL  48          3HG2      VAL  48   9.574   5.609   3.526
  376    H    CYS  49           H        CYS  49   6.077   6.589   3.599
  377    HA   CYS  49           HA       CYS  49   3.903   6.918   1.837
  378   1HB   CYS  49          1HB       CYS  49   3.868   9.249   2.928
  379   2HB   CYS  49          2HB       CYS  49   3.680   7.851   3.956
  380    HA   PRO  50           HA       PRO  50   5.642   8.627  -1.728
  381   1HB   PRO  50          1HB       PRO  50   3.744  10.436  -2.653
  382   2HB   PRO  50          2HB       PRO  50   3.646   8.655  -2.797
  383   1HG   PRO  50          1HG       PRO  50   2.389  10.429  -0.686
  384   2HG   PRO  50          2HG       PRO  50   1.635   9.082  -1.597
  385   1HD   PRO  50          1HD       PRO  50   2.570   8.707   0.913
  386   2HD   PRO  50          2HD       PRO  50   2.826   7.452  -0.339
  387    H    TRP  51           H        TRP  51   4.592  10.966   0.685
  388    HA   TRP  51           HA       TRP  51   6.057  13.274  -0.114
  389   1HB   TRP  51          1HB       TRP  51   4.541  13.625   1.648
  390   2HB   TRP  51          2HB       TRP  51   5.025  12.161   2.498
  391    HD1  TRP  51           HD       TRP  51   7.381  15.014   1.411
  392    HE1  TRP  51           1HE      TRP  51   8.821  15.669   3.363
  393    HE3  TRP  51           3HE      TRP  51   5.036  12.257   5.048
  394    HZ2  TRP  51           2HZ      TRP  51   8.826  15.247   6.270
  395    HZ3  TRP  51           3HZ      TRP  51   5.796  12.405   7.399
  396    HH2  TRP  51           HH       TRP  51   7.683  13.891   8.022
  397    H    CYS  52           H        CYS  52   7.002  10.753   2.322
  398    HA   CYS  52           HA       CYS  52   9.670  11.769   2.429
  399   1HB   CYS  52          1HB       CYS  52  10.100  10.163   3.987
  400   2HB   CYS  52          2HB       CYS  52   8.371  10.364   4.156
  401    H    ALA  53           H        ALA  53   8.085   9.235   0.468
  402    HA   ALA  53           HA       ALA  53  10.481   8.064  -0.358
  403   1HB   ALA  53          1HB       ALA  53   8.222   7.019  -0.665
  404   2HB   ALA  53          2HB       ALA  53   7.855   8.222  -1.922
  405   3HB   ALA  53          3HB       ALA  53   9.142   7.036  -2.183
  406    H    THR  54           H        THR  54   8.693  10.877  -1.566
  407    HA   THR  54           HA       THR  54  10.382  11.373  -3.872
  408    HB   THR  54           HB       THR  54   8.467  13.243  -2.406
  409    HG1  THR  54           1HG      THR  54   7.273  11.526  -2.985
  410   1HG2  THR  54          1HG2      THR  54   8.236  14.329  -4.621
  411   2HG2  THR  54          2HG2      THR  54   9.459  13.231  -5.296
  412   3HG2  THR  54          3HG2      THR  54   9.910  14.416  -4.050
  413    H    ASN  55           H        ASN  55  10.201  12.659  -0.500
  414    HA   ASN  55           HA       ASN  55  12.332  14.614  -0.843
  415   1HB   ASN  55          1HB       ASN  55  11.196  13.234   1.639
  416   2HB   ASN  55          2HB       ASN  55  12.455  14.451   1.697
  417   1HD2  ASN  55          1HD2      ASN  55  10.019  14.952  -0.757
  418   2HD2  ASN  55          2HD2      ASN  55   9.207  16.254   0.095
  419    H    GLN  56           H        GLN  56  12.189  11.305   0.081
  420    HA   GLN  56           HA       GLN  56  13.510   9.677   0.671
  421   1HB   GLN  56          2HB       GLN  56  14.482  10.128  -1.626
  422   2HB   GLN  56          3HB       GLN  56  15.818  10.970  -0.827
  423   1HG   GLN  56          2HG       GLN  56  16.569   8.927   0.217
  424   2HG   GLN  56          3HG       GLN  56  15.029   8.116  -0.098
  425   1HE2  GLN  56          1HE2      GLN  56  17.802   9.637  -1.851
  426   2HE2  GLN  56          2HE2      GLN  56  17.736   8.515  -3.203
  427   1H    GLY   1          1H        GLY   1  14.832   0.266   3.611
  428   1HA   GLY   1          1HA       GLY   1  14.741   2.004   2.102
  429   2HA   GLY   1          2HA       GLY   1  13.774   2.967   3.242
  430    H    SER   2           H        SER   2  16.989   2.368   2.135
  431    HA   SER   2           HA       SER   2  18.196   3.747   4.439
  432   1HB   SER   2          1HB       SER   2  18.146   1.301   4.913
  433   2HB   SER   2          2HB       SER   2  18.967   0.984   3.377
  434    HG   SER   2           HG       SER   2  20.213   1.166   5.461
  435    H    HIS   3           H        HIS   3  20.582   3.968   3.945
  436    HA   HIS   3           HA       HIS   3  21.163   4.791   1.161
  437   1HB   HIS   3          1HB       HIS   3  22.900   4.729   3.670
  438   2HB   HIS   3          2HB       HIS   3  23.403   5.334   2.093
  439    HD1  HIS   3           1HD      HIS   3  22.051   6.655   5.229
  440    HD2  HIS   3           2HD      HIS   3  21.623   7.432   1.109
  441    HE1  HIS   3           1HE      HIS   3  21.097   9.018   5.016
  442    H    MET   4           H        MET   4  21.325   1.966   3.201
  443    HA   MET   4           HA       MET   4  23.300   0.526   1.607
  444   1HB   MET   4          1HB       MET   4  22.690  -0.177   3.921
  445   2HB   MET   4          2HB       MET   4  21.023  -0.449   3.402
  446   1HG   MET   4          1HG       MET   4  22.274  -2.555   3.529
  447   2HG   MET   4          2HG       MET   4  21.712  -2.228   1.898
  448   1HE   MET   4          1HE       MET   4  24.925  -0.913   3.926
  449   2HE   MET   4          2HE       MET   4  24.760  -2.648   4.292
  450   3HE   MET   4          3HE       MET   4  26.127  -2.068   3.317
  451    H    ALA   5           H        ALA   5  22.883  -0.481  -0.353
  452    HA   ALA   5           HA       ALA   5  20.389  -0.069  -1.721
  453   1HB   ALA   5          1HB       ALA   5  22.501  -0.049  -2.939
  454   2HB   ALA   5          2HB       ALA   5  22.825  -1.735  -2.444
  455   3HB   ALA   5          3HB       ALA   5  21.456  -1.366  -3.517
  456    H    GLU   6           H        GLU   6  19.153  -1.042   0.077
  457    HA   GLU   6           HA       GLU   6  19.250  -3.830   0.617
  458   1HB   GLU   6          1HB       GLU   6  17.035  -3.408   1.732
  459   2HB   GLU   6          2HB       GLU   6  18.348  -2.338   2.254
  460   1HG   GLU   6          1HG       GLU   6  17.561  -0.599   0.722
  461   2HG   GLU   6          2HG       GLU   6  16.252  -1.603   0.154
  462    HA   PRO   7           HA       PRO   7  16.381  -5.145  -2.688
  463   1HB   PRO   7          1HB       PRO   7  16.237  -7.786  -2.097
  464   2HB   PRO   7          2HB       PRO   7  17.756  -7.033  -2.649
  465   1HG   PRO   7          1HG       PRO   7  16.943  -7.697   0.189
  466   2HG   PRO   7          2HG       PRO   7  18.513  -7.997  -0.622
  467   1HD   PRO   7          1HD       PRO   7  17.936  -5.785   0.997
  468   2HD   PRO   7          2HD       PRO   7  19.197  -5.749  -0.250
  469    H    GLN   8           H        GLN   8  15.239  -3.588  -0.645
  470    HA   GLN   8           HA       GLN   8  12.736  -5.029  -0.027
  471   1HB   GLN   8          1HB       GLN   8  14.496  -3.627   1.972
  472   2HB   GLN   8          2HB       GLN   8  12.747  -3.506   2.127
  473   1HG   GLN   8          1HG       GLN   8  13.437  -5.315   3.498
  474   2HG   GLN   8          2HG       GLN   8  12.554  -5.985   2.133
  475   1HE2  GLN   8          1HE2      GLN   8  13.519  -8.114   1.796
  476   2HE2  GLN   8          2HE2      GLN   8  15.255  -8.233   1.641
  477    H    ARG   9           H        ARG   9  14.010  -1.609   0.360
  478    HA   ARG   9           HA       ARG   9  11.743  -0.293  -0.300
  479   1HB   ARG   9          1HB       ARG   9  13.974   0.689   0.360
  480   2HB   ARG   9          2HB       ARG   9  14.455   0.587  -1.316
  481   1HG   ARG   9          1HG       ARG   9  12.008   1.997  -0.659
  482   2HG   ARG   9          2HG       ARG   9  13.552   2.794  -0.365
  483   1HD   ARG   9          1HD       ARG   9  14.039   2.316  -2.865
  484   2HD   ARG   9          2HD       ARG   9  12.325   1.931  -3.006
  485    HE   ARG   9           HE       ARG   9  11.731   4.144  -2.657
  486   1HH1  ARG   9          1HH1      ARG   9  15.273   3.831  -2.234
  487   2HH1  ARG   9          2HH1      ARG   9  15.509   5.574  -2.337
  488   1HH2  ARG   9          1HH2      ARG   9  12.219   6.518  -2.744
  489   2HH2  ARG   9          2HH2      ARG   9  13.901   6.955  -2.604
  490    H    HIS  10           H        HIS  10  10.310  -1.148  -1.877
  491    HA   HIS  10           HA       HIS  10  11.275  -1.121  -4.686
  492   1HB   HIS  10          1HB       HIS  10   9.431  -3.063  -3.247
  493   2HB   HIS  10          2HB       HIS  10   9.755  -3.047  -4.987
  494    HD1  HIS  10           1HD      HIS  10  10.576  -5.444  -2.683
  495    HD2  HIS  10           2HD      HIS  10  13.034  -2.605  -4.445
  496    HE1  HIS  10           1HE      HIS  10  12.795  -6.538  -2.918
  497    H    LYS  11           H        LYS  11   9.198  -1.256  -6.182
  498    HA   LYS  11           HA       LYS  11   7.343   0.907  -5.379
  499   1HB   LYS  11          1HB       LYS  11   9.233   0.986  -7.759
  500   2HB   LYS  11          2HB       LYS  11   7.847   2.041  -7.538
  501   1HG   LYS  11          1HG       LYS  11   9.091   3.482  -6.358
  502   2HG   LYS  11          2HG       LYS  11   9.306   2.266  -5.125
  503   1HD   LYS  11          1HD       LYS  11  11.497   2.962  -5.710
  504   2HD   LYS  11          2HD       LYS  11  11.281   1.366  -6.421
  505   1HE   LYS  11          1HE       LYS  11  12.349   2.622  -8.106
  506   2HE   LYS  11          2HE       LYS  11  10.655   2.568  -8.614
  507   1HZ   LYS  11          1HZ       LYS  11  11.616   4.779  -8.816
  508   2HZ   LYS  11          2HZ       LYS  11  11.902   4.847  -7.192
  509   3HZ   LYS  11          3HZ       LYS  11  10.365   4.803  -7.787
  510    H    ILE  12           H        ILE  12   5.514  -0.337  -5.536
  511    HA   ILE  12           HA       ILE  12   5.049  -1.923  -8.015
  512    HB   ILE  12           HB       ILE  12   3.151  -1.506  -5.674
  513   1HG1  ILE  12          1HG1      ILE  12   4.925  -3.911  -6.228
  514   2HG1  ILE  12          2HG1      ILE  12   5.212  -2.711  -4.963
  515   1HG2  ILE  12          1HG2      ILE  12   3.103  -3.495  -7.988
  516   2HG2  ILE  12          2HG2      ILE  12   1.881  -3.341  -6.704
  517   3HG2  ILE  12          3HG2      ILE  12   2.087  -2.046  -7.868
  518   1HD1  ILE  12          1HD1      ILE  12   2.967  -3.227  -3.985
  519   2HD1  ILE  12          2HD1      ILE  12   2.864  -4.615  -5.109
  520   3HD1  ILE  12          3HD1      ILE  12   4.148  -4.536  -3.895
  521    H    LEU  13           H        LEU  13   4.894  -0.344  -9.617
  522    HA   LEU  13           HA       LEU  13   3.269   2.002  -9.329
  523   1HB   LEU  13          1HB       LEU  13   5.035   1.788 -11.023
  524   2HB   LEU  13          2HB       LEU  13   4.071   0.594 -11.899
  525    HG   LEU  13           HG       LEU  13   2.799   3.261 -11.176
  526   1HD1  LEU  13          1HD1      LEU  13   4.938   3.938 -12.001
  527   2HD1  LEU  13          2HD1      LEU  13   3.718   4.241 -13.264
  528   3HD1  LEU  13          3HD1      LEU  13   4.808   2.845 -13.403
  529   1HD2  LEU  13          1HD2      LEU  13   2.568   1.478 -13.646
  530   2HD2  LEU  13          2HD2      LEU  13   1.676   2.990 -13.370
  531   3HD2  LEU  13          3HD2      LEU  13   1.376   1.600 -12.339
  532    H    CYS  14           H        CYS  14   1.235   1.847  -8.811
  533    HA   CYS  14           HA       CYS  14  -0.519  -0.104 -10.221
  534   1HB   CYS  14          1HB       CYS  14  -0.198  -0.339  -7.644
  535   2HB   CYS  14          2HB       CYS  14  -1.113   1.177  -7.528
  536    HG   CYS  14           HG       CYS  14  -1.938  -1.776  -8.785
  537    H    VAL  15           H        VAL  15  -2.925   1.134  -9.705
  538    HA   VAL  15           HA       VAL  15  -2.626   3.966 -10.390
  539    HB   VAL  15           HB       VAL  15  -4.679   3.876 -11.769
  540   1HG1  VAL  15          1HG1      VAL  15  -3.607   3.094 -13.811
  541   2HG1  VAL  15          2HG1      VAL  15  -2.450   3.983 -12.810
  542   3HG1  VAL  15          3HG1      VAL  15  -2.384   2.206 -12.875
  543   1HG2  VAL  15          1HG2      VAL  15  -4.287   0.847 -11.801
  544   2HG2  VAL  15          2HG2      VAL  15  -5.612   1.708 -10.984
  545   3HG2  VAL  15          3HG2      VAL  15  -5.467   1.784 -12.741
  546    H    CYS  16           H        CYS  16  -4.386   5.228  -9.572
  547    HA   CYS  16           HA       CYS  16  -5.307   4.274  -7.036
  548   1HB   CYS  16          1HB       CYS  16  -4.998   6.733  -7.557
  549   2HB   CYS  16          2HB       CYS  16  -6.491   6.637  -8.529
  550    H    CYS  17           H        CYS  17  -6.949   3.078  -6.580
  551    HA   CYS  17           HA       CYS  17  -8.610   1.622  -8.235
  552   1HB   CYS  17          1HB       CYS  17  -8.195   1.385  -5.721
  553   2HB   CYS  17          2HB       CYS  17  -9.350   2.694  -5.477
  554    HG   CYS  17           HG       CYS  17 -11.139   1.306  -5.252
  555    H    LYS  18           H        LYS  18  -9.259   4.894  -6.935
  556    HA   LYS  18           HA       LYS  18 -11.849   4.940  -8.393
  557   1HB   LYS  18          1HB       LYS  18 -12.564   6.463  -6.612
  558   2HB   LYS  18          2HB       LYS  18 -12.211   4.823  -6.084
  559   1HG   LYS  18          1HG       LYS  18 -10.119   5.543  -5.001
  560   2HG   LYS  18          2HG       LYS  18 -10.226   7.121  -5.777
  561   1HD   LYS  18          1HD       LYS  18 -10.992   7.639  -3.676
  562   2HD   LYS  18          2HD       LYS  18 -12.489   7.390  -4.542
  563   1HE   LYS  18          1HE       LYS  18 -11.109   5.537  -2.552
  564   2HE   LYS  18          2HE       LYS  18 -12.629   6.398  -2.328
  565   1HZ   LYS  18          1HZ       LYS  18 -12.137   4.078  -4.107
  566   2HZ   LYS  18          2HZ       LYS  18 -13.600   4.896  -4.024
  567   3HZ   LYS  18          3HZ       LYS  18 -12.907   4.010  -2.777
  568    H    CYS  19           H        CYS  19  -8.765   6.438  -8.439
  569    HA   CYS  19           HA       CYS  19  -9.853   8.773  -9.889
  570   1HB   CYS  19          1HB       CYS  19  -7.057   8.657  -9.167
  571   2HB   CYS  19          2HB       CYS  19  -8.162   9.982  -9.253
  572    H    ASP  20           H        ASP  20  -8.296   5.710 -10.410
  573    HA   ASP  20           HA       ASP  20  -7.058   4.782 -11.938
  574   1HB   ASP  20          1HB       ASP  20  -9.206   5.168 -13.134
  575   2HB   ASP  20          2HB       ASP  20  -8.481   6.583 -13.897
  576    H    GLY  21           H        GLY  21  -5.851   7.040 -10.628
  577   1HA   GLY  21          1HA       GLY  21  -4.064   8.225 -12.717
  578   2HA   GLY  21          2HA       GLY  21  -4.210   8.801 -11.056
  579    H    ARG  22           H        ARG  22  -1.841   8.061 -12.508
  580    HA   ARG  22           HA       ARG  22  -0.815   5.462 -11.877
  581   1HB   ARG  22          1HB       ARG  22  -0.014   6.825 -13.714
  582   2HB   ARG  22          2HB       ARG  22   0.489   8.122 -12.643
  583   1HG   ARG  22          1HG       ARG  22   1.733   5.371 -12.366
  584   2HG   ARG  22          2HG       ARG  22   2.195   6.433 -13.697
  585   1HD   ARG  22          1HD       ARG  22   2.692   8.241 -11.926
  586   2HD   ARG  22          2HD       ARG  22   2.590   6.931 -10.735
  587    HE   ARG  22           HE       ARG  22   4.295   6.228 -12.934
  588   1HH1  ARG  22          1HH1      ARG  22   4.447   8.321  -9.997
  589   2HH1  ARG  22          2HH1      ARG  22   6.078   7.698  -9.651
  590   1HH2  ARG  22          1HH2      ARG  22   6.558   5.761 -12.402
  591   2HH2  ARG  22          2HH2      ARG  22   7.122   6.431 -10.862
  592    H    ILE  23           H        ILE  23  -0.231   4.676  -9.860
  593    HA   ILE  23           HA       ILE  23   0.928   6.666  -8.000
  594    HB   ILE  23           HB       ILE  23  -0.505   4.234  -6.935
  595   1HG1  ILE  23          1HG1      ILE  23  -1.812   6.981  -7.069
  596   2HG1  ILE  23          2HG1      ILE  23  -2.255   5.597  -8.077
  597   1HG2  ILE  23          1HG2      ILE  23  -0.256   5.551  -4.834
  598   2HG2  ILE  23          2HG2      ILE  23   1.296   5.528  -5.650
  599   3HG2  ILE  23          3HG2      ILE  23   0.280   6.969  -5.763
  600   1HD1  ILE  23          1HD1      ILE  23  -2.396   5.593  -5.035
  601   2HD1  ILE  23          2HD1      ILE  23  -3.750   5.777  -6.119
  602   3HD1  ILE  23          3HD1      ILE  23  -2.846   4.255  -6.118
  603    H    GLU  24           H        GLU  24   2.993   6.233  -7.677
  604    HA   GLU  24           HA       GLU  24   4.185   3.593  -8.186
  605   1HB   GLU  24          1HB       GLU  24   5.163   5.549  -9.063
  606   2HB   GLU  24          2HB       GLU  24   5.240   6.356  -7.487
  607   1HG   GLU  24          1HG       GLU  24   6.886   4.609  -6.765
  608   2HG   GLU  24          2HG       GLU  24   6.762   3.876  -8.374
  609    H    LEU  25           H        LEU  25   3.267   2.292  -6.536
  610    HA   LEU  25           HA       LEU  25   3.036   3.276  -3.842
  611   1HB   LEU  25          1HB       LEU  25   2.887   0.397  -4.749
  612   2HB   LEU  25          2HB       LEU  25   2.269   1.080  -3.262
  613    HG   LEU  25           HG       LEU  25   1.218   1.656  -6.080
  614   1HD1  LEU  25          1HD1      LEU  25   0.072   0.079  -3.741
  615   2HD1  LEU  25          2HD1      LEU  25   0.713  -0.612  -5.252
  616   3HD1  LEU  25          3HD1      LEU  25  -0.749   0.385  -5.288
  617   1HD2  LEU  25          1HD2      LEU  25   0.964   3.591  -4.544
  618   2HD2  LEU  25          2HD2      LEU  25   0.210   2.550  -3.336
  619   3HD2  LEU  25          3HD2      LEU  25  -0.600   2.850  -4.899
  620    H    THR  26           H        THR  26   4.980   3.760  -2.870
  621    HA   THR  26           HA       THR  26   7.243   1.959  -3.264
  622    HB   THR  26           HB       THR  26   7.185   4.430  -1.553
  623    HG1  THR  26           1HG      THR  26   6.629   4.595  -3.928
  624   1HG2  THR  26          1HG2      THR  26   9.445   2.967  -3.034
  625   2HG2  THR  26          2HG2      THR  26   9.132   2.770  -1.313
  626   3HG2  THR  26          3HG2      THR  26   9.614   4.361  -1.950
  627    H    VAL  27           H        VAL  27   7.061   0.079  -2.297
  628    HA   VAL  27           HA       VAL  27   6.136  -0.090   0.523
  629    HB   VAL  27           HB       VAL  27   4.848  -2.089   0.160
  630   1HG1  VAL  27          1HG1      VAL  27   4.206  -0.531  -2.358
  631   2HG1  VAL  27          2HG1      VAL  27   3.130  -1.489  -1.324
  632   3HG1  VAL  27          3HG1      VAL  27   3.809   0.042  -0.731
  633   1HG2  VAL  27          1HG2      VAL  27   6.030  -2.227  -2.653
  634   2HG2  VAL  27          2HG2      VAL  27   6.352  -3.345  -1.308
  635   3HG2  VAL  27          3HG2      VAL  27   4.741  -3.272  -2.019
  636    H    GLU  28           H        GLU  28   7.627  -1.188   1.791
  637    HA   GLU  28           HA       GLU  28  10.155  -1.827   0.351
  638   1HB   GLU  28          1HB       GLU  28   9.953  -0.976   3.235
  639   2HB   GLU  28          2HB       GLU  28  11.361  -1.047   2.154
  640   1HG   GLU  28          1HG       GLU  28  10.172   0.763   0.758
  641   2HG   GLU  28          2HG       GLU  28   9.160   0.966   2.197
  642    H    SER  29           H        SER  29  10.167  -4.011   0.020
  643    HA   SER  29           HA       SER  29  10.237  -5.752   2.276
  644   1HB   SER  29          1HB       SER  29   7.664  -5.377   1.837
  645   2HB   SER  29          2HB       SER  29   7.919  -6.432   0.448
  646    HG   SER  29           HG       SER  29   7.343  -7.779   2.087
  647    H    SER  30           H        SER  30  10.671  -8.004   1.524
  648    HA   SER  30           HA       SER  30  12.439  -8.220  -0.625
  649   1HB   SER  30          1HB       SER  30  10.698 -10.377   0.634
  650   2HB   SER  30          2HB       SER  30  12.243 -10.621  -0.208
  651    HG   SER  30           HG       SER  30  12.343 -10.486   2.162
  652    H    ALA  31           H        ALA  31  12.236  -8.970  -2.755
  653    HA   ALA  31           HA       ALA  31  10.118  -7.944  -4.159
  654   1HB   ALA  31          1HB       ALA  31  11.970 -10.198  -5.048
  655   2HB   ALA  31          2HB       ALA  31  11.003  -9.157  -6.114
  656   3HB   ALA  31          3HB       ALA  31  12.311  -8.452  -5.148
  657    H    GLU  32           H        GLU  32  10.440 -11.377  -3.138
  658    HA   GLU  32           HA       GLU  32   8.140 -12.282  -4.577
  659   1HB   GLU  32          1HB       GLU  32  10.183 -13.334  -2.792
  660   2HB   GLU  32          2HB       GLU  32   8.600 -13.959  -2.327
  661   1HG   GLU  32          1HG       GLU  32   8.166 -14.751  -4.607
  662   2HG   GLU  32          2HG       GLU  32   9.658 -14.012  -5.193
  663    H    ASP  33           H        ASP  33   8.519 -10.800  -1.394
  664    HA   ASP  33           HA       ASP  33   5.951 -11.584  -0.358
  665   1HB   ASP  33          1HB       ASP  33   7.840 -11.158   1.097
  666   2HB   ASP  33          2HB       ASP  33   8.038  -9.533   0.457
  667    H    LEU  34           H        LEU  34   7.427  -8.737  -1.833
  668    HA   LEU  34           HA       LEU  34   5.184  -7.034  -2.161
  669   1HB   LEU  34          1HB       LEU  34   7.158  -5.989  -2.515
  670   2HB   LEU  34          2HB       LEU  34   7.903  -7.305  -3.378
  671    HG   LEU  34           HG       LEU  34   5.680  -5.785  -4.769
  672   1HD1  LEU  34          1HD1      LEU  34   7.189  -4.063  -3.829
  673   2HD1  LEU  34          2HD1      LEU  34   7.360  -4.165  -5.589
  674   3HD1  LEU  34          3HD1      LEU  34   8.573  -4.930  -4.537
  675   1HD2  LEU  34          1HD2      LEU  34   8.270  -7.056  -5.775
  676   2HD2  LEU  34          2HD2      LEU  34   7.085  -6.195  -6.776
  677   3HD2  LEU  34          3HD2      LEU  34   6.646  -7.711  -6.007
  678    H    ARG  35           H        ARG  35   6.307  -9.602  -3.966
  679    HA   ARG  35           HA       ARG  35   4.597  -9.357  -6.306
  680   1HB   ARG  35          1HB       ARG  35   6.853 -10.467  -6.324
  681   2HB   ARG  35          2HB       ARG  35   6.138 -11.872  -5.538
  682   1HG   ARG  35          1HG       ARG  35   4.640 -12.215  -7.436
  683   2HG   ARG  35          2HG       ARG  35   5.181 -10.697  -8.187
  684   1HD   ARG  35          1HD       ARG  35   7.470 -11.640  -8.392
  685   2HD   ARG  35          2HD       ARG  35   6.893 -13.167  -7.683
  686    HE   ARG  35           HE       ARG  35   5.209 -12.523  -9.841
  687   1HH1  ARG  35          1HH1      ARG  35   8.575 -13.463  -9.364
  688   2HH1  ARG  35          2HH1      ARG  35   8.777 -14.177 -10.927
  689   1HH2  ARG  35          1HH2      ARG  35   5.429 -13.480 -11.929
  690   2HH2  ARG  35          2HH2      ARG  35   6.925 -14.186 -12.416
  691    H    THR  36           H        THR  36   4.701 -11.492  -3.513
  692    HA   THR  36           HA       THR  36   2.262 -12.924  -3.960
  693    HB   THR  36           HB       THR  36   3.401 -11.971  -1.286
  694    HG1  THR  36           1HG      THR  36   4.944 -13.155  -2.437
  695   1HG2  THR  36          1HG2      THR  36   1.575 -14.322  -1.956
  696   2HG2  THR  36          2HG2      THR  36   1.097 -12.852  -1.073
  697   3HG2  THR  36          3HG2      THR  36   2.281 -13.963  -0.367
  698    H    LEU  37           H        LEU  37   2.837  -9.827  -2.232
  699    HA   LEU  37           HA       LEU  37   0.181  -8.898  -2.064
  700   1HB   LEU  37          1HB       LEU  37   1.580  -7.731  -0.751
  701   2HB   LEU  37          2HB       LEU  37   2.937  -7.892  -1.835
  702    HG   LEU  37           HG       LEU  37   2.131  -6.108  -3.232
  703   1HD1  LEU  37          1HD1      LEU  37  -0.316  -5.862  -2.708
  704   2HD1  LEU  37          2HD1      LEU  37   0.404  -4.474  -1.911
  705   3HD1  LEU  37          3HD1      LEU  37  -0.027  -5.875  -0.975
  706   1HD2  LEU  37          1HD2      LEU  37   2.742  -4.322  -1.620
  707   2HD2  LEU  37          2HD2      LEU  37   3.786  -5.734  -1.460
  708   3HD2  LEU  37          3HD2      LEU  37   2.484  -5.450  -0.284
  709    H    GLN  38           H        GLN  38   2.432  -8.741  -4.927
  710    HA   GLN  38           HA       GLN  38   0.675  -7.169  -6.484
  711   1HB   GLN  38          1HB       GLN  38   3.071  -7.521  -6.898
  712   2HB   GLN  38          2HB       GLN  38   2.733  -9.180  -7.401
  713   1HG   GLN  38          1HG       GLN  38   1.405  -8.436  -9.282
  714   2HG   GLN  38          2HG       GLN  38   1.642  -6.743  -8.808
  715   1HE2  GLN  38          1HE2      GLN  38   3.950  -5.949  -8.705
  716   2HE2  GLN  38          2HE2      GLN  38   5.176  -6.805  -9.627
  717    H    GLN  39           H        GLN  39   0.750 -10.698  -5.783
  718    HA   GLN  39           HA       GLN  39  -1.163 -11.327  -7.823
  719   1HB   GLN  39          1HB       GLN  39  -0.722 -12.949  -5.317
  720   2HB   GLN  39          2HB       GLN  39  -1.419 -13.447  -6.852
  721   1HG   GLN  39          1HG       GLN  39   1.446 -12.938  -6.150
  722   2HG   GLN  39          2HG       GLN  39   0.730 -14.362  -6.861
  723   1HE2  GLN  39          1HE2      GLN  39   2.362 -11.448  -7.457
  724   2HE2  GLN  39          2HE2      GLN  39   2.328 -11.463  -9.226
  725    H    LEU  40           H        LEU  40  -1.308 -10.344  -4.377
  726    HA   LEU  40           HA       LEU  40  -4.161 -10.438  -4.125
  727   1HB   LEU  40          1HB       LEU  40  -2.380  -8.378  -2.799
  728   2HB   LEU  40          2HB       LEU  40  -3.961  -8.901  -2.307
  729    HG   LEU  40           HG       LEU  40  -1.418 -10.554  -2.234
  730   1HD1  LEU  40          1HD1      LEU  40  -1.554  -8.809  -0.537
  731   2HD1  LEU  40          2HD1      LEU  40  -1.651 -10.420   0.192
  732   3HD1  LEU  40          3HD1      LEU  40  -3.125  -9.439   0.004
  733   1HD2  LEU  40          1HD2      LEU  40  -2.642 -12.304  -1.057
  734   2HD2  LEU  40          2HD2      LEU  40  -3.306 -12.078  -2.680
  735   3HD2  LEU  40          3HD2      LEU  40  -4.164 -11.419  -1.273
  736    H    PHE  41           H        PHE  41  -2.020  -7.946  -5.575
  737    HA   PHE  41           HA       PHE  41  -4.122  -6.040  -6.168
  738   1HB   PHE  41          1HB       PHE  41  -1.326  -6.439  -7.244
  739   2HB   PHE  41          2HB       PHE  41  -2.449  -5.391  -8.071
  740    HD1  PHE  41           1HD      PHE  41  -3.552  -3.483  -6.823
  741    HD2  PHE  41           2HD      PHE  41  -0.028  -5.505  -5.400
  742    HE1  PHE  41           1HE      PHE  41  -3.172  -1.668  -5.188
  743    HE2  PHE  41           2HE      PHE  41   0.451  -3.598  -3.914
  744    HZ   PHE  41           HZ       PHE  41  -1.201  -1.762  -3.672
  745    H    LEU  42           H        LEU  42  -2.678  -8.675  -8.061
  746    HA   LEU  42           HA       LEU  42  -4.432  -8.357 -10.307
  747   1HB   LEU  42          1HB       LEU  42  -2.762 -10.641  -9.217
  748   2HB   LEU  42          2HB       LEU  42  -3.662 -10.789 -10.722
  749    HG   LEU  42           HG       LEU  42  -1.586  -8.597 -10.251
  750   1HD1  LEU  42          1HD1      LEU  42  -0.489 -10.783 -10.067
  751   2HD1  LEU  42          2HD1      LEU  42  -0.024  -9.971 -11.567
  752   3HD1  LEU  42          3HD1      LEU  42  -1.208 -11.298 -11.606
  753   1HD2  LEU  42          1HD2      LEU  42  -1.558  -8.462 -12.722
  754   2HD2  LEU  42          2HD2      LEU  42  -3.155  -8.086 -12.074
  755   3HD2  LEU  42          3HD2      LEU  42  -2.853  -9.677 -12.806
  756    H    SER  43           H        SER  43  -4.909  -9.964  -7.213
  757    HA   SER  43           HA       SER  43  -7.298 -11.372  -7.938
  758   1HB   SER  43          1HB       SER  43  -5.785 -12.019  -6.079
  759   2HB   SER  43          2HB       SER  43  -6.221 -10.547  -5.207
  760    HG   SER  43           HG       SER  43  -7.618 -11.867  -4.395
  761    H    THR  44           H        THR  44  -6.928  -8.575  -5.669
  762    HA   THR  44           HA       THR  44  -9.328  -7.342  -6.702
  763    HB   THR  44           HB       THR  44 -10.359  -7.199  -4.396
  764    HG1  THR  44           1HG      THR  44  -8.765  -7.755  -2.987
  765   1HG2  THR  44          1HG2      THR  44 -11.396  -9.365  -4.372
  766   2HG2  THR  44          2HG2      THR  44 -10.086 -10.076  -5.333
  767   3HG2  THR  44          3HG2      THR  44 -11.176  -8.874  -6.065
  768    H    LEU  45           H        LEU  45  -6.473  -7.214  -4.645
  769    HA   LEU  45           HA       LEU  45  -7.035  -4.887  -3.246
  770   1HB   LEU  45          1HB       LEU  45  -5.222  -6.571  -2.777
  771   2HB   LEU  45          2HB       LEU  45  -4.347  -5.940  -4.148
  772    HG   LEU  45           HG       LEU  45  -4.197  -3.700  -3.002
  773   1HD1  LEU  45          1HD1      LEU  45  -5.890  -3.719  -1.333
  774   2HD1  LEU  45          2HD1      LEU  45  -4.380  -3.917  -0.443
  775   3HD1  LEU  45          3HD1      LEU  45  -5.395  -5.333  -0.725
  776   1HD2  LEU  45          1HD2      LEU  45  -3.008  -6.124  -1.591
  777   2HD2  LEU  45          2HD2      LEU  45  -2.360  -4.459  -1.580
  778   3HD2  LEU  45          3HD2      LEU  45  -2.407  -5.384  -3.089
  779    H    SER  46           H        SER  46  -7.024  -2.759  -3.654
  780    HA   SER  46           HA       SER  46  -5.593  -1.750  -6.031
  781   1HB   SER  46          1HB       SER  46  -8.424  -1.025  -5.220
  782   2HB   SER  46          2HB       SER  46  -7.538  -0.457  -6.648
  783    HG   SER  46           HG       SER  46  -8.271  -3.183  -6.189
  784    H    PHE  47           H        PHE  47  -5.187   0.649  -5.680
  785    HA   PHE  47           HA       PHE  47  -4.871   1.173  -2.782
  786   1HB   PHE  47          1HB       PHE  47  -2.778   0.522  -4.159
  787   2HB   PHE  47          2HB       PHE  47  -2.902   2.141  -4.841
  788    HD1  PHE  47           1HD      PHE  47  -2.153   0.105  -1.869
  789    HD2  PHE  47           2HD      PHE  47  -2.616   4.153  -3.285
  790    HE1  PHE  47           1HE      PHE  47  -1.070   0.960   0.190
  791    HE2  PHE  47           2HE      PHE  47  -1.580   4.998  -1.205
  792    HZ   PHE  47           HZ       PHE  47  -0.784   3.403   0.530
  793    H    VAL  48           H        VAL  48  -4.796   3.309  -2.216
  794    HA   VAL  48           HA       VAL  48  -6.519   5.073  -3.726
  795    HB   VAL  48           HB       VAL  48  -6.899   4.239  -0.821
  796   1HG1  VAL  48          1HG1      VAL  48  -8.549   6.065  -1.265
  797   2HG1  VAL  48          2HG1      VAL  48  -9.130   5.129  -2.698
  798   3HG1  VAL  48          3HG1      VAL  48  -9.358   4.535  -1.084
  799   1HG2  VAL  48          1HG2      VAL  48  -7.071   2.273  -2.300
  800   2HG2  VAL  48          2HG2      VAL  48  -8.543   2.757  -1.595
  801   3HG2  VAL  48          3HG2      VAL  48  -8.217   3.209  -3.325
  802    H    CYS  49           H        CYS  49  -5.016   6.581  -4.082
  803    HA   CYS  49           HA       CYS  49  -2.660   7.084  -2.568
  804   1HB   CYS  49          1HB       CYS  49  -2.844   9.370  -3.854
  805   2HB   CYS  49          2HB       CYS  49  -2.548   7.884  -4.735
  806    HA   PRO  50           HA       PRO  50  -4.228   9.106   0.968
  807   1HB   PRO  50          1HB       PRO  50  -2.409  11.179   1.485
  808   2HB   PRO  50          2HB       PRO  50  -2.233   9.460   1.949
  809   1HG   PRO  50          1HG       PRO  50  -1.116  10.871  -0.487
  810   2HG   PRO  50          2HG       PRO  50  -0.292   9.711   0.604
  811   1HD   PRO  50          1HD       PRO  50  -1.259   8.883  -1.759
  812   2HD   PRO  50          2HD       PRO  50  -1.486   7.871  -0.303
  813    H    TRP  51           H        TRP  51  -3.519  11.184  -1.784
  814    HA   TRP  51           HA       TRP  51  -5.222  13.375  -1.223
  815   1HB   TRP  51          1HB       TRP  51  -3.638  13.378  -3.069
  816   2HB   TRP  51          2HB       TRP  51  -4.453  12.017  -3.836
  817    HD1  TRP  51           HD       TRP  51  -6.557  14.882  -2.457
  818    HE1  TRP  51           1HE      TRP  51  -7.785  16.019  -4.318
  819    HE3  TRP  51           3HE      TRP  51  -4.151  12.656  -6.395
  820    HZ2  TRP  51           2HZ      TRP  51  -7.590  16.153  -7.257
  821    HZ3  TRP  51           3HZ      TRP  51  -4.687  13.327  -8.719
  822    HH2  TRP  51           HH       TRP  51  -6.393  15.076  -9.161
  823    H    CYS  52           H        CYS  52  -5.993  10.271  -2.982
  824    HA   CYS  52           HA       CYS  52  -8.763  11.043  -3.272
  825   1HB   CYS  52          1HB       CYS  52  -9.070   9.119  -4.479
  826   2HB   CYS  52          2HB       CYS  52  -7.291   9.178  -4.605
  827    H    ALA  53           H        ALA  53  -6.875   9.150  -0.937
  828    HA   ALA  53           HA       ALA  53  -9.052   8.007   0.440
  829   1HB   ALA  53          1HB       ALA  53  -6.666   7.376   0.769
  830   2HB   ALA  53          2HB       ALA  53  -6.373   8.939   1.568
  831   3HB   ALA  53          3HB       ALA  53  -7.467   7.766   2.311
  832    H    THR  54           H        THR  54  -7.454  11.166   0.781
  833    HA   THR  54           HA       THR  54  -9.025  12.048   3.039
  834    HB   THR  54           HB       THR  54  -7.278  13.656   1.120
  835    HG1  THR  54           1HG      THR  54  -5.979  12.114   1.928
  836   1HG2  THR  54          1HG2      THR  54  -8.065  14.167   4.024
  837   2HG2  THR  54          2HG2      THR  54  -8.678  15.065   2.618
  838   3HG2  THR  54          3HG2      THR  54  -6.961  15.159   3.048
  839    H    ASN  55           H        ASN  55  -9.007  12.897  -0.486
  840    HA   ASN  55           HA       ASN  55 -11.165  14.846  -0.182
  841   1HB   ASN  55          1HB       ASN  55  -9.798  13.592  -2.617
  842   2HB   ASN  55          2HB       ASN  55 -11.139  14.720  -2.740
  843   1HD2  ASN  55          1HD2      ASN  55  -8.804  15.215  -0.151
  844   2HD2  ASN  55          2HD2      ASN  55  -8.040  16.610  -0.902
  845    H    GLN  56           H        GLN  56 -10.857  11.608  -1.537
  846    HA   GLN  56           HA       GLN  56 -12.267  10.198  -2.547
  847   1HB   GLN  56          2HB       GLN  56 -12.353   9.744  -0.092
  848   2HB   GLN  56          3HB       GLN  56 -13.829  10.698   0.003
  849   1HG   GLN  56          2HG       GLN  56 -14.227   8.760  -2.097
  850   2HG   GLN  56          3HG       GLN  56 -13.441   7.909  -0.777
  851   1HE2  GLN  56          1HE2      GLN  56 -15.998  10.296  -1.377
  852   2HE2  GLN  56          2HE2      GLN  56 -17.186   9.662  -0.202
  Start of MODEL    6
    1   1H    GLY   1          1H        GLY   1 -26.186  11.059   4.137
    2   1HA   GLY   1          1HA       GLY   1 -28.148   8.997   3.409
    3   2HA   GLY   1          2HA       GLY   1 -27.444  10.214   2.316
    4    H    SER   2           H        SER   2 -26.545   8.448   0.946
    5    HA   SER   2           HA       SER   2 -23.888   7.769   1.780
    6   1HB   SER   2          1HB       SER   2 -25.157   5.816   2.654
    7   2HB   SER   2          2HB       SER   2 -25.895   5.573   1.060
    8    HG   SER   2           HG       SER   2 -23.928   4.314   1.691
    9    H    HIS   3           H        HIS   3 -22.805   6.819  -0.176
   10    HA   HIS   3           HA       HIS   3 -24.058   7.568  -2.781
   11   1HB   HIS   3          1HB       HIS   3 -21.093   7.599  -2.123
   12   2HB   HIS   3          2HB       HIS   3 -21.853   8.104  -3.628
   13    HD1  HIS   3           1HD      HIS   3 -20.007   9.952  -1.590
   14    HD2  HIS   3           2HD      HIS   3 -24.176  10.004  -2.211
   15    HE1  HIS   3           1HE      HIS   3 -20.833  12.259  -0.868
   16    H    MET   4           H        MET   4 -23.628   5.075  -0.890
   17    HA   MET   4           HA       MET   4 -23.293   2.886  -0.952
   18   1HB   MET   4          1HB       MET   4 -24.113   2.652  -3.234
   19   2HB   MET   4          2HB       MET   4 -22.525   3.076  -3.891
   20   1HG   MET   4          1HG       MET   4 -21.509   1.107  -3.012
   21   2HG   MET   4          2HG       MET   4 -22.945   0.692  -2.068
   22   1HE   MET   4          1HE       MET   4 -22.236  -1.711  -3.210
   23   2HE   MET   4          2HE       MET   4 -22.441  -2.056  -4.943
   24   3HE   MET   4          3HE       MET   4 -21.115  -1.010  -4.402
   25    H    ALA   5           H        ALA   5 -21.487   1.541  -0.491
   26    HA   ALA   5           HA       ALA   5 -18.848   2.233  -1.234
   27   1HB   ALA   5          1HB       ALA   5 -19.023   3.665   0.801
   28   2HB   ALA   5          2HB       ALA   5 -19.612   2.268   1.735
   29   3HB   ALA   5          3HB       ALA   5 -17.956   2.279   1.092
   30    H    GLU   6           H        GLU   6 -17.450   0.326  -0.293
   31    HA   GLU   6           HA       GLU   6 -18.989  -2.116   0.239
   32   1HB   GLU   6          1HB       GLU   6 -17.128  -1.643  -2.142
   33   2HB   GLU   6          2HB       GLU   6 -17.530  -3.252  -1.546
   34   1HG   GLU   6          1HG       GLU   6 -19.978  -2.706  -1.848
   35   2HG   GLU   6          2HG       GLU   6 -19.495  -1.193  -2.624
   36    HA   PRO   7           HA       PRO   7 -15.390  -2.704   2.809
   37   1HB   PRO   7          1HB       PRO   7 -15.169  -5.405   3.087
   38   2HB   PRO   7          2HB       PRO   7 -16.558  -4.482   3.724
   39   1HG   PRO   7          1HG       PRO   7 -16.394  -5.968   1.077
   40   2HG   PRO   7          2HG       PRO   7 -17.663  -6.099   2.338
   41   1HD   PRO   7          1HD       PRO   7 -17.963  -4.484   0.179
   42   2HD   PRO   7          2HD       PRO   7 -18.560  -3.984   1.786
   43    H    GLN   8           H        GLN   8 -14.355  -1.689   0.861
   44    HA   GLN   8           HA       GLN   8 -12.163  -3.394  -0.189
   45   1HB   GLN   8          1HB       GLN   8 -14.226  -2.543  -1.762
   46   2HB   GLN   8          2HB       GLN   8 -13.206  -1.127  -1.889
   47   1HG   GLN   8          1HG       GLN   8 -12.695  -2.600  -3.713
   48   2HG   GLN   8          2HG       GLN   8 -11.311  -2.651  -2.621
   49   1HE2  GLN   8          1HE2      GLN   8 -10.630  -4.696  -2.022
   50   2HE2  GLN   8          2HE2      GLN   8 -11.650  -6.149  -2.053
   51    H    ARG   9           H        ARG   9 -12.961   0.104  -0.317
   52    HA   ARG   9           HA       ARG   9 -10.402   1.082   0.219
   53   1HB   ARG   9          1HB       ARG   9 -12.378   2.276  -0.766
   54   2HB   ARG   9          2HB       ARG   9 -13.019   2.470   0.849
   55   1HG   ARG   9          1HG       ARG   9 -10.400   3.464   0.094
   56   2HG   ARG   9          2HG       ARG   9 -11.858   4.422  -0.119
   57   1HD   ARG   9          1HD       ARG   9 -12.071   3.767   2.531
   58   2HD   ARG   9          2HD       ARG   9 -10.324   3.761   2.368
   59    HE   ARG   9           HE       ARG   9 -10.336   6.081   1.949
   60   1HH1  ARG   9          1HH1      ARG   9 -13.679   4.860   2.236
   61   2HH1  ARG   9          2HH1      ARG   9 -14.360   6.474   2.332
   62   1HH2  ARG   9          1HH2      ARG   9 -11.387   8.275   2.109
   63   2HH2  ARG   9          2HH2      ARG   9 -13.096   8.257   2.412
   64    H    HIS  10           H        HIS  10  -9.277   0.163   1.954
   65    HA   HIS  10           HA       HIS  10 -10.472   0.526   4.668
   66   1HB   HIS  10          1HB       HIS  10  -8.757  -1.702   3.534
   67   2HB   HIS  10          2HB       HIS  10  -9.133  -1.508   5.248
   68    HD1  HIS  10           1HD      HIS  10 -10.120  -3.982   3.196
   69    HD2  HIS  10           2HD      HIS  10 -12.348  -0.681   4.438
   70    HE1  HIS  10           1HE      HIS  10 -12.491  -4.697   3.122
   71    H    LYS  11           H        LYS  11  -8.904   0.741   6.395
   72    HA   LYS  11           HA       LYS  11  -6.657   2.513   5.549
   73   1HB   LYS  11          1HB       LYS  11  -8.933   3.042   7.488
   74   2HB   LYS  11          2HB       LYS  11  -7.481   4.013   7.378
   75   1HG   LYS  11          1HG       LYS  11  -8.417   5.263   5.769
   76   2HG   LYS  11          2HG       LYS  11  -8.394   3.874   4.712
   77   1HD   LYS  11          1HD       LYS  11 -10.630   4.776   4.755
   78   2HD   LYS  11          2HD       LYS  11 -10.638   3.192   5.522
   79   1HE   LYS  11          1HE       LYS  11 -12.045   4.686   6.794
   80   2HE   LYS  11          2HE       LYS  11 -10.623   4.292   7.766
   81   1HZ   LYS  11          1HZ       LYS  11 -11.176   6.647   7.841
   82   2HZ   LYS  11          2HZ       LYS  11 -10.921   6.795   6.218
   83   3HZ   LYS  11          3HZ       LYS  11  -9.683   6.432   7.239
   84    H    ILE  12           H        ILE  12  -5.080   0.998   6.132
   85    HA   ILE  12           HA       ILE  12  -5.142  -0.097   8.895
   86    HB   ILE  12           HB       ILE  12  -2.962  -0.426   6.811
   87   1HG1  ILE  12          1HG1      ILE  12  -5.183  -2.404   7.383
   88   2HG1  ILE  12          2HG1      ILE  12  -5.072  -1.376   5.950
   89   1HG2  ILE  12          1HG2      ILE  12  -3.594  -1.925   9.395
   90   2HG2  ILE  12          2HG2      ILE  12  -2.214  -2.243   8.313
   91   3HG2  ILE  12          3HG2      ILE  12  -2.300  -0.731   9.200
   92   1HD1  ILE  12          1HD1      ILE  12  -2.775  -2.373   5.495
   93   2HD1  ILE  12          2HD1      ILE  12  -3.182  -3.611   6.713
   94   3HD1  ILE  12          3HD1      ILE  12  -4.169  -3.422   5.254
   95    H    LEU  13           H        LEU  13  -4.761   1.616  10.313
   96    HA   LEU  13           HA       LEU  13  -2.926   3.727   9.699
   97   1HB   LEU  13          1HB       LEU  13  -4.898   3.943  11.203
   98   2HB   LEU  13          2HB       LEU  13  -4.039   3.007  12.433
   99    HG   LEU  13           HG       LEU  13  -2.637   5.387  11.152
  100   1HD1  LEU  13          1HD1      LEU  13  -4.835   6.237  11.587
  101   2HD1  LEU  13          2HD1      LEU  13  -3.697   6.889  12.794
  102   3HD1  LEU  13          3HD1      LEU  13  -4.818   5.579  13.243
  103   1HD2  LEU  13          1HD2      LEU  13  -2.649   4.298  14.007
  104   2HD2  LEU  13          2HD2      LEU  13  -1.710   5.694  13.435
  105   3HD2  LEU  13          3HD2      LEU  13  -1.352   4.087  12.815
  106    H    CYS  14           H        CYS  14  -0.881   3.477   9.579
  107    HA   CYS  14           HA       CYS  14   0.568   1.816  11.542
  108   1HB   CYS  14          1HB       CYS  14   0.247   0.833   9.097
  109   2HB   CYS  14          2HB       CYS  14   1.468   2.030   8.651
  110    HG   CYS  14           HG       CYS  14   1.586  -0.424  10.884
  111    H    VAL  15           H        VAL  15   3.153   2.525  10.612
  112    HA   VAL  15           HA       VAL  15   3.153   5.460  10.404
  113    HB   VAL  15           HB       VAL  15   5.268   5.568  11.673
  114   1HG1  VAL  15          1HG1      VAL  15   4.261   5.540  13.889
  115   2HG1  VAL  15          2HG1      VAL  15   3.122   6.200  12.706
  116   3HG1  VAL  15          3HG1      VAL  15   2.911   4.540  13.307
  117   1HG2  VAL  15          1HG2      VAL  15   4.619   2.742  12.634
  118   2HG2  VAL  15          2HG2      VAL  15   5.961   3.183  11.553
  119   3HG2  VAL  15          3HG2      VAL  15   5.927   3.797  13.209
  120    H    CYS  16           H        CYS  16   4.850   6.282   9.189
  121    HA   CYS  16           HA       CYS  16   5.787   4.632   7.001
  122   1HB   CYS  16          1HB       CYS  16   5.375   7.181   6.925
  123   2HB   CYS  16          2HB       CYS  16   6.857   7.354   7.880
  124    H    CYS  17           H        CYS  17   7.547   3.379   6.982
  125    HA   CYS  17           HA       CYS  17   9.070   2.643   9.186
  126   1HB   CYS  17          1HB       CYS  17   8.804   1.586   6.840
  127   2HB   CYS  17          2HB       CYS  17  10.104   2.651   6.313
  128    HG   CYS  17           HG       CYS  17  11.124   0.407   6.617
  129    H    LYS  18           H        LYS  18   9.617   5.286   7.003
  130    HA   LYS  18           HA       LYS  18  12.343   5.822   8.083
  131   1HB   LYS  18          1HB       LYS  18  12.751   6.636   5.746
  132   2HB   LYS  18          2HB       LYS  18  12.502   4.888   5.931
  133   1HG   LYS  18          1HG       LYS  18  10.200   5.128   5.078
  134   2HG   LYS  18          2HG       LYS  18  10.374   6.888   5.050
  135   1HD   LYS  18          1HD       LYS  18  10.624   6.013   2.831
  136   2HD   LYS  18          2HD       LYS  18  12.137   6.704   3.356
  137   1HE   LYS  18          1HE       LYS  18  11.726   3.761   3.819
  138   2HE   LYS  18          2HE       LYS  18  11.839   4.278   2.133
  139   1HZ   LYS  18          1HZ       LYS  18  13.869   4.870   4.190
  140   2HZ   LYS  18          2HZ       LYS  18  13.913   5.370   2.647
  141   3HZ   LYS  18          3HZ       LYS  18  13.975   3.715   3.006
  142    H    CYS  19           H        CYS  19   9.262   7.251   7.960
  143    HA   CYS  19           HA       CYS  19  10.424   9.926   8.452
  144   1HB   CYS  19          1HB       CYS  19   7.598   9.325   8.236
  145   2HB   CYS  19          2HB       CYS  19   8.417  10.836   8.064
  146    H    ASP  20           H        ASP  20   9.072   7.070   9.964
  147    HA   ASP  20           HA       ASP  20   7.793   6.629  11.656
  148   1HB   ASP  20          1HB       ASP  20   9.986   6.804  12.760
  149   2HB   ASP  20          2HB       ASP  20   9.605   8.465  13.238
  150    H    GLY  21           H        GLY  21   6.285   7.943  10.238
  151   1HA   GLY  21          1HA       GLY  21   4.852   9.910  11.925
  152   2HA   GLY  21          2HA       GLY  21   5.128  10.230  10.199
  153    H    ARG  22           H        ARG  22   2.630   9.898  11.565
  154    HA   ARG  22           HA       ARG  22   1.450   7.320  11.431
  155   1HB   ARG  22          1HB       ARG  22   0.711   9.106  12.883
  156   2HB   ARG  22          2HB       ARG  22   0.365  10.176  11.538
  157   1HG   ARG  22          1HG       ARG  22  -1.144   7.559  11.737
  158   2HG   ARG  22          2HG       ARG  22  -1.502   8.862  12.871
  159   1HD   ARG  22          1HD       ARG  22  -1.784  10.400  10.803
  160   2HD   ARG  22          2HD       ARG  22  -1.842   8.898   9.863
  161    HE   ARG  22           HE       ARG  22  -3.594   8.917  12.179
  162   1HH1  ARG  22          1HH1      ARG  22  -3.561  10.070   8.761
  163   2HH1  ARG  22          2HH1      ARG  22  -5.233   9.496   8.562
  164   1HH2  ARG  22          1HH2      ARG  22  -5.889   8.489  11.738
  165   2HH2  ARG  22          2HH2      ARG  22  -6.388   8.726  10.057
  166    H    ILE  23           H        ILE  23   1.008   6.158   9.597
  167    HA   ILE  23           HA       ILE  23  -0.055   7.720   7.320
  168    HB   ILE  23           HB       ILE  23   1.149   4.959   6.923
  169   1HG1  ILE  23          1HG1      ILE  23   2.504   7.527   6.016
  170   2HG1  ILE  23          2HG1      ILE  23   2.994   6.644   7.464
  171   1HG2  ILE  23          1HG2      ILE  23   0.837   5.750   4.500
  172   2HG2  ILE  23          2HG2      ILE  23  -0.667   5.723   5.397
  173   3HG2  ILE  23          3HG2      ILE  23   0.169   7.259   5.123
  174   1HD1  ILE  23          1HD1      ILE  23   3.492   4.630   6.188
  175   2HD1  ILE  23          2HD1      ILE  23   2.912   5.368   4.684
  176   3HD1  ILE  23          3HD1      ILE  23   4.345   6.000   5.451
  177    H    GLU  24           H        GLU  24  -2.178   7.452   7.238
  178    HA   GLU  24           HA       GLU  24  -3.557   5.052   8.243
  179   1HB   GLU  24          1HB       GLU  24  -4.434   7.214   8.646
  180   2HB   GLU  24          2HB       GLU  24  -4.450   7.643   6.924
  181   1HG   GLU  24          1HG       GLU  24  -6.165   5.879   6.569
  182   2HG   GLU  24          2HG       GLU  24  -6.058   5.456   8.290
  183    H    LEU  25           H        LEU  25  -2.605   3.416   6.962
  184    HA   LEU  25           HA       LEU  25  -1.913   3.786   4.223
  185   1HB   LEU  25          1HB       LEU  25  -2.402   1.160   5.634
  186   2HB   LEU  25          2HB       LEU  25  -1.531   1.383   4.148
  187    HG   LEU  25           HG       LEU  25  -0.595   2.455   6.857
  188   1HD1  LEU  25          1HD1      LEU  25   0.168  -0.062   5.299
  189   2HD1  LEU  25          2HD1      LEU  25  -0.605   0.010   6.897
  190   3HD1  LEU  25          3HD1      LEU  25   1.064   0.568   6.696
  191   1HD2  LEU  25          1HD2      LEU  25   0.254   3.645   4.833
  192   2HD2  LEU  25          2HD2      LEU  25   0.778   2.114   4.163
  193   3HD2  LEU  25          3HD2      LEU  25   1.542   2.751   5.652
  194    H    THR  26           H        THR  26  -3.620   4.426   2.961
  195    HA   THR  26           HA       THR  26  -6.122   2.970   3.196
  196    HB   THR  26           HB       THR  26  -5.547   5.279   1.348
  197    HG1  THR  26           1HG      THR  26  -5.310   5.576   3.767
  198   1HG2  THR  26          1HG2      THR  26  -8.069   3.945   2.482
  199   2HG2  THR  26          2HG2      THR  26  -7.528   3.849   0.803
  200   3HG2  THR  26          3HG2      THR  26  -8.068   5.394   1.476
  201    H    VAL  27           H        VAL  27  -5.932   0.968   2.431
  202    HA   VAL  27           HA       VAL  27  -4.997   0.631  -0.388
  203    HB   VAL  27           HB       VAL  27  -4.053  -1.610   0.185
  204   1HG1  VAL  27          1HG1      VAL  27  -3.222   0.140   2.536
  205   2HG1  VAL  27          2HG1      VAL  27  -2.299  -1.102   1.668
  206   3HG1  VAL  27          3HG1      VAL  27  -2.693   0.437   0.880
  207   1HG2  VAL  27          1HG2      VAL  27  -5.291  -1.117   2.975
  208   2HG2  VAL  27          2HG2      VAL  27  -5.811  -2.333   1.803
  209   3HG2  VAL  27          3HG2      VAL  27  -4.223  -2.458   2.558
  210    H    GLU  28           H        GLU  28  -6.433  -0.801  -1.683
  211    HA   GLU  28           HA       GLU  28  -9.177  -0.597  -0.526
  212   1HB   GLU  28          1HB       GLU  28  -8.248   0.967  -2.432
  213   2HB   GLU  28          2HB       GLU  28  -8.492  -0.423  -3.430
  214   1HG   GLU  28          1HG       GLU  28 -10.910  -0.292  -2.128
  215   2HG   GLU  28          2HG       GLU  28 -10.434   1.390  -2.080
  216    H    SER  29           H        SER  29  -9.169  -2.683   0.442
  217    HA   SER  29           HA       SER  29  -8.470  -4.980  -1.289
  218   1HB   SER  29          1HB       SER  29  -7.247  -4.131   1.351
  219   2HB   SER  29          2HB       SER  29  -6.861  -5.565   0.422
  220    HG   SER  29           HG       SER  29  -6.535  -3.545  -1.221
  221    H    SER  30           H        SER  30  -9.702  -6.704  -0.772
  222    HA   SER  30           HA       SER  30 -11.955  -6.463   0.930
  223   1HB   SER  30          1HB       SER  30 -10.669  -9.059   0.006
  224   2HB   SER  30          2HB       SER  30 -12.368  -8.775   0.384
  225    HG   SER  30           HG       SER  30 -11.960  -8.709  -1.903
  226    H    ALA  31           H        ALA  31 -12.299  -7.246   3.092
  227    HA   ALA  31           HA       ALA  31 -10.272  -6.692   4.740
  228   1HB   ALA  31          1HB       ALA  31 -12.512  -8.657   5.408
  229   2HB   ALA  31          2HB       ALA  31 -11.559  -7.729   6.579
  230   3HB   ALA  31          3HB       ALA  31 -12.637  -6.878   5.454
  231    H    GLU  32           H        GLU  32 -10.757 -10.058   3.564
  232    HA   GLU  32           HA       GLU  32  -8.672 -10.819   5.418
  233   1HB   GLU  32          1HB       GLU  32 -11.009 -12.047   5.043
  234   2HB   GLU  32          2HB       GLU  32  -9.996 -12.984   3.908
  235   1HG   GLU  32          1HG       GLU  32  -8.318 -13.299   5.724
  236   2HG   GLU  32          2HG       GLU  32  -9.285 -12.302   6.806
  237    H    ASP  33           H        ASP  33  -9.047 -10.096   2.182
  238    HA   ASP  33           HA       ASP  33  -6.685 -11.385   1.158
  239   1HB   ASP  33          1HB       ASP  33  -8.882 -10.521  -0.007
  240   2HB   ASP  33          2HB       ASP  33  -8.100  -8.947   0.057
  241    H    LEU  34           H        LEU  34  -7.777  -8.340   2.609
  242    HA   LEU  34           HA       LEU  34  -5.289  -6.941   2.625
  243   1HB   LEU  34          1HB       LEU  34  -7.293  -5.724   2.872
  244   2HB   LEU  34          2HB       LEU  34  -7.888  -6.694   4.180
  245    HG   LEU  34           HG       LEU  34  -5.333  -5.157   4.641
  246   1HD1  LEU  34          1HD1      LEU  34  -6.868  -3.524   3.573
  247   2HD1  LEU  34          2HD1      LEU  34  -6.693  -3.162   5.292
  248   3HD1  LEU  34          3HD1      LEU  34  -8.155  -3.979   4.708
  249   1HD2  LEU  34          1HD2      LEU  34  -7.735  -5.833   6.413
  250   2HD2  LEU  34          2HD2      LEU  34  -6.333  -4.867   6.921
  251   3HD2  LEU  34          3HD2      LEU  34  -6.123  -6.562   6.509
  252    H    ARG  35           H        ARG  35  -6.880  -8.909   4.919
  253    HA   ARG  35           HA       ARG  35  -4.965  -9.094   7.019
  254   1HB   ARG  35          1HB       ARG  35  -7.266 -10.114   7.065
  255   2HB   ARG  35          2HB       ARG  35  -6.654 -11.453   6.103
  256   1HG   ARG  35          1HG       ARG  35  -5.027 -11.986   7.913
  257   2HG   ARG  35          2HG       ARG  35  -5.751 -10.697   8.898
  258   1HD   ARG  35          1HD       ARG  35  -7.955 -11.899   8.758
  259   2HD   ARG  35          2HD       ARG  35  -7.166 -13.186   7.823
  260    HE   ARG  35           HE       ARG  35  -5.828 -12.658  10.308
  261   1HH1  ARG  35          1HH1      ARG  35  -8.647 -14.559   8.955
  262   2HH1  ARG  35          2HH1      ARG  35  -8.635 -15.625  10.281
  263   1HH2  ARG  35          1HH2      ARG  35  -5.909 -14.171  12.018
  264   2HH2  ARG  35          2HH2      ARG  35  -7.090 -15.431  12.016
  265    H    THR  36           H        THR  36  -5.296 -11.109   4.118
  266    HA   THR  36           HA       THR  36  -2.930 -12.665   4.457
  267    HB   THR  36           HB       THR  36  -4.171 -11.788   1.814
  268    HG1  THR  36           1HG      THR  36  -5.734 -12.792   3.153
  269   1HG2  THR  36          1HG2      THR  36  -2.475 -14.204   2.563
  270   2HG2  THR  36          2HG2      THR  36  -1.959 -12.843   1.538
  271   3HG2  THR  36          3HG2      THR  36  -3.257 -13.920   0.993
  272    H    LEU  37           H        LEU  37  -3.348  -9.565   2.661
  273    HA   LEU  37           HA       LEU  37  -0.626  -8.977   2.266
  274   1HB   LEU  37          1HB       LEU  37  -1.685  -7.420   1.104
  275   2HB   LEU  37          2HB       LEU  37  -3.175  -7.712   1.941
  276    HG   LEU  37           HG       LEU  37  -2.305  -6.105   3.785
  277   1HD1  LEU  37          1HD1      LEU  37   0.129  -6.003   2.850
  278   2HD1  LEU  37          2HD1      LEU  37  -0.634  -4.427   3.006
  279   3HD1  LEU  37          3HD1      LEU  37  -0.523  -5.207   1.426
  280   1HD2  LEU  37          1HD2      LEU  37  -2.860  -4.098   2.280
  281   2HD2  LEU  37          2HD2      LEU  37  -4.098  -5.311   2.514
  282   3HD2  LEU  37          3HD2      LEU  37  -3.160  -5.286   1.002
  283    H    GLN  38           H        GLN  38  -2.593  -8.465   5.250
  284    HA   GLN  38           HA       GLN  38  -0.598  -7.040   6.636
  285   1HB   GLN  38          1HB       GLN  38  -2.974  -7.091   7.195
  286   2HB   GLN  38          2HB       GLN  38  -2.833  -8.765   7.731
  287   1HG   GLN  38          1HG       GLN  38  -1.316  -8.151   9.525
  288   2HG   GLN  38          2HG       GLN  38  -1.346  -6.461   9.002
  289   1HE2  GLN  38          1HE2      GLN  38  -3.691  -5.487   8.820
  290   2HE2  GLN  38          2HE2      GLN  38  -4.858  -6.076   9.992
  291    H    GLN  39           H        GLN  39  -1.090 -10.556   6.077
  292    HA   GLN  39           HA       GLN  39   0.904 -11.338   7.984
  293   1HB   GLN  39          1HB       GLN  39   0.123 -12.956   5.562
  294   2HB   GLN  39          2HB       GLN  39   0.869 -13.489   7.060
  295   1HG   GLN  39          1HG       GLN  39  -1.972 -12.704   6.537
  296   2HG   GLN  39          2HG       GLN  39  -1.350 -14.183   7.230
  297   1HE2  GLN  39          1HE2      GLN  39  -2.704 -11.143   7.892
  298   2HE2  GLN  39          2HE2      GLN  39  -2.565 -11.172   9.657
  299    H    LEU  40           H        LEU  40   0.897 -10.446   4.498
  300    HA   LEU  40           HA       LEU  40   3.725 -10.802   4.120
  301   1HB   LEU  40          1HB       LEU  40   1.917  -8.848   2.690
  302   2HB   LEU  40          2HB       LEU  40   3.521  -9.333   2.199
  303    HG   LEU  40           HG       LEU  40   1.163 -11.251   2.450
  304   1HD1  LEU  40          1HD1      LEU  40   0.884  -9.564   0.634
  305   2HD1  LEU  40          2HD1      LEU  40   1.029 -11.223   0.042
  306   3HD1  LEU  40          3HD1      LEU  40   2.424 -10.126  -0.057
  307   1HD2  LEU  40          1HD2      LEU  40   2.571 -12.816   1.156
  308   2HD2  LEU  40          2HD2      LEU  40   3.330 -12.421   2.699
  309   3HD2  LEU  40          3HD2      LEU  40   3.919 -11.658   1.210
  310    H    PHE  41           H        PHE  41   1.902  -8.226   5.670
  311    HA   PHE  41           HA       PHE  41   4.071  -6.352   6.067
  312   1HB   PHE  41          1HB       PHE  41   1.382  -6.301   6.503
  313   2HB   PHE  41          2HB       PHE  41   1.953  -6.543   8.146
  314    HD1  PHE  41           1HD      PHE  41   3.639  -4.817   9.099
  315    HD2  PHE  41           2HD      PHE  41   1.427  -4.216   5.446
  316    HE1  PHE  41           1HE      PHE  41   4.067  -2.375   9.232
  317    HE2  PHE  41           2HE      PHE  41   1.879  -1.786   5.570
  318    HZ   PHE  41           HZ       PHE  41   3.204  -0.858   7.463
  319    H    LEU  42           H        LEU  42   2.758  -8.978   8.066
  320    HA   LEU  42           HA       LEU  42   4.786  -8.808  10.099
  321   1HB   LEU  42          1HB       LEU  42   2.851 -10.981   9.219
  322   2HB   LEU  42          2HB       LEU  42   3.924 -11.189  10.597
  323    HG   LEU  42           HG       LEU  42   1.889  -8.921  10.374
  324   1HD1  LEU  42          1HD1      LEU  42   0.750 -11.101  10.431
  325   2HD1  LEU  42          2HD1      LEU  42   0.518 -10.226  11.950
  326   3HD1  LEU  42          3HD1      LEU  42   1.682 -11.570  11.869
  327   1HD2  LEU  42          1HD2      LEU  42   2.243  -8.743  12.837
  328   2HD2  LEU  42          2HD2      LEU  42   3.709  -8.378  11.930
  329   3HD2  LEU  42          3HD2      LEU  42   3.538  -9.956  12.726
  330    H    SER  43           H        SER  43   4.721 -10.470   7.015
  331    HA   SER  43           HA       SER  43   7.083 -12.048   7.285
  332   1HB   SER  43          1HB       SER  43   5.556 -12.543   5.546
  333   2HB   SER  43          2HB       SER  43   5.476 -10.875   5.048
  334    HG   SER  43           HG       SER  43   6.669 -11.383   3.552
  335    H    THR  44           H        THR  44   6.967  -9.177   5.124
  336    HA   THR  44           HA       THR  44   9.205  -8.054   6.573
  337    HB   THR  44           HB       THR  44  10.635  -7.690   4.616
  338    HG1  THR  44           1HG      THR  44   8.817  -8.071   2.967
  339   1HG2  THR  44          1HG2      THR  44  11.487  -9.924   4.452
  340   2HG2  THR  44          2HG2      THR  44   9.908 -10.613   4.906
  341   3HG2  THR  44          3HG2      THR  44  10.856  -9.674   6.091
  342    H    LEU  45           H        LEU  45   6.473  -7.474   4.822
  343    HA   LEU  45           HA       LEU  45   7.237  -5.032   3.614
  344   1HB   LEU  45          1HB       LEU  45   5.373  -6.497   2.900
  345   2HB   LEU  45          2HB       LEU  45   4.362  -5.866   4.164
  346    HG   LEU  45           HG       LEU  45   5.655  -3.872   2.306
  347   1HD1  LEU  45          1HD1      LEU  45   4.847  -5.624   0.805
  348   2HD1  LEU  45          2HD1      LEU  45   3.758  -4.228   0.720
  349   3HD1  LEU  45          3HD1      LEU  45   3.288  -5.667   1.651
  350   1HD2  LEU  45          1HD2      LEU  45   2.851  -4.030   3.505
  351   2HD2  LEU  45          2HD2      LEU  45   3.535  -2.686   2.560
  352   3HD2  LEU  45          3HD2      LEU  45   4.179  -3.053   4.161
  353    H    SER  46           H        SER  46   8.015  -3.280   4.674
  354    HA   SER  46           HA       SER  46   6.285  -2.014   6.689
  355   1HB   SER  46          1HB       SER  46   8.286  -0.337   6.554
  356   2HB   SER  46          2HB       SER  46   8.441  -1.821   7.486
  357    HG   SER  46           HG       SER  46   9.999  -0.960   5.414
  358    H    PHE  47           H        PHE  47   6.251   0.489   6.053
  359    HA   PHE  47           HA       PHE  47   5.461   0.679   3.214
  360   1HB   PHE  47          1HB       PHE  47   3.494   0.391   5.039
  361   2HB   PHE  47          2HB       PHE  47   3.742   2.118   5.178
  362    HD1  PHE  47           1HD      PHE  47   2.547  -0.627   3.069
  363    HD2  PHE  47           2HD      PHE  47   3.415   3.601   3.116
  364    HE1  PHE  47           1HE      PHE  47   1.327  -0.344   0.932
  365    HE2  PHE  47           2HE      PHE  47   2.269   3.859   0.942
  366    HZ   PHE  47           HZ       PHE  47   1.237   1.888  -0.164
  367    H    VAL  48           H        VAL  48   5.472   2.626   2.316
  368    HA   VAL  48           HA       VAL  48   7.165   4.686   3.419
  369    HB   VAL  48           HB       VAL  48   7.687   2.670   1.230
  370   1HG1  VAL  48          1HG1      VAL  48   9.647   3.837   0.460
  371   2HG1  VAL  48          2HG1      VAL  48   8.190   4.790   0.120
  372   3HG1  VAL  48          3HG1      VAL  48   9.247   5.248   1.460
  373   1HG2  VAL  48          1HG2      VAL  48   8.608   2.192   3.457
  374   2HG2  VAL  48          2HG2      VAL  48   9.932   2.662   2.392
  375   3HG2  VAL  48          3HG2      VAL  48   9.282   3.813   3.565
  376    H    CYS  49           H        CYS  49   5.593   6.239   3.366
  377    HA   CYS  49           HA       CYS  49   3.506   6.540   1.448
  378   1HB   CYS  49          1HB       CYS  49   3.371   8.847   2.498
  379   2HB   CYS  49          2HB       CYS  49   3.265   7.493   3.605
  380    HA   PRO  50           HA       PRO  50   5.286   8.291  -2.062
  381   1HB   PRO  50          1HB       PRO  50   3.766  10.571  -2.698
  382   2HB   PRO  50          2HB       PRO  50   3.423   8.870  -3.123
  383   1HG   PRO  50          1HG       PRO  50   2.391  10.461  -0.765
  384   2HG   PRO  50          2HG       PRO  50   1.483   9.355  -1.847
  385   1HD   PRO  50          1HD       PRO  50   2.262   8.493   0.551
  386   2HD   PRO  50          2HD       PRO  50   2.482   7.436  -0.867
  387    H    TRP  51           H        TRP  51   5.056  10.608   0.586
  388    HA   TRP  51           HA       TRP  51   6.783  12.652  -0.385
  389   1HB   TRP  51          1HB       TRP  51   5.466  13.189   1.503
  390   2HB   TRP  51          2HB       TRP  51   5.894  11.702   2.342
  391    HD1  TRP  51           HD       TRP  51   8.561  14.051   0.891
  392    HE1  TRP  51           1HE      TRP  51  10.168  14.684   2.720
  393    HE3  TRP  51           3HE      TRP  51   5.920  12.219   4.882
  394    HZ2  TRP  51           2HZ      TRP  51  10.228  14.594   5.653
  395    HZ3  TRP  51           3HZ      TRP  51   6.768  12.539   7.186
  396    HH2  TRP  51           HH       TRP  51   8.925  13.705   7.584
  397    H    CYS  52           H        CYS  52   7.573  10.016   2.006
  398    HA   CYS  52           HA       CYS  52  10.421  10.349   1.601
  399   1HB   CYS  52          1HB       CYS  52  10.616   8.250   2.780
  400   2HB   CYS  52          2HB       CYS  52   9.632   9.414   3.602
  401    H    ALA  53           H        ALA  53   7.902   8.388  -0.033
  402    HA   ALA  53           HA       ALA  53   9.761   6.705  -1.177
  403   1HB   ALA  53          1HB       ALA  53   7.257   6.415  -1.425
  404   2HB   ALA  53          2HB       ALA  53   7.250   7.798  -2.554
  405   3HB   ALA  53          3HB       ALA  53   8.088   6.330  -3.005
  406    H    THR  54           H        THR  54   8.774   9.979  -2.027
  407    HA   THR  54           HA       THR  54  10.413  10.261  -4.397
  408    HB   THR  54           HB       THR  54   9.127  12.374  -2.605
  409    HG1  THR  54           1HG      THR  54   7.508  11.042  -3.276
  410   1HG2  THR  54          1HG2      THR  54   9.943  12.452  -5.542
  411   2HG2  THR  54          2HG2      THR  54  10.750  13.323  -4.219
  412   3HG2  THR  54          3HG2      THR  54   9.085  13.734  -4.663
  413    H    ASN  55           H        ASN  55  10.738  11.271  -0.931
  414    HA   ASN  55           HA       ASN  55  13.204  12.715  -1.412
  415   1HB   ASN  55          1HB       ASN  55  11.926  11.767   1.196
  416   2HB   ASN  55          2HB       ASN  55  13.401  12.703   1.112
  417   1HD2  ASN  55          1HD2      ASN  55  10.966  13.482  -1.282
  418   2HD2  ASN  55          2HD2      ASN  55  10.484  14.983  -0.511
  419    H    GLN  56           H        GLN  56  12.548   9.613   0.063
  420    HA   GLN  56           HA       GLN  56  13.830   7.654  -0.361
  421   1HB   GLN  56          2HB       GLN  56  15.851   8.836  -1.104
  422   2HB   GLN  56          3HB       GLN  56  16.132   9.370   0.567
  423   1HG   GLN  56          2HG       GLN  56  17.619   7.590   0.022
  424   2HG   GLN  56          3HG       GLN  56  16.504   7.017   1.244
  425   1HE2  GLN  56          1HE2      GLN  56  17.520   4.908   0.350
  426   2HE2  GLN  56          2HE2      GLN  56  16.786   4.185  -1.077
  427   1H    GLY   1          1H        GLY   1  14.095   8.196   5.718
  428   1HA   GLY   1          1HA       GLY   1  16.223   8.592   3.735
  429   2HA   GLY   1          2HA       GLY   1  16.521   8.536   5.492
  430    H    SER   2           H        SER   2  17.775   6.598   3.796
  431    HA   SER   2           HA       SER   2  16.393   4.166   4.757
  432   1HB   SER   2          1HB       SER   2  17.013   2.966   2.801
  433   2HB   SER   2          2HB       SER   2  16.168   4.413   2.272
  434    HG   SER   2           HG       SER   2  18.637   3.546   1.690
  435    H    HIS   3           H        HIS   3  18.187   2.308   4.690
  436    HA   HIS   3           HA       HIS   3  20.335   3.254   6.461
  437   1HB   HIS   3          1HB       HIS   3  19.719   0.415   5.573
  438   2HB   HIS   3          2HB       HIS   3  20.549   0.948   7.030
  439    HD1  HIS   3           1HD      HIS   3  17.104   0.090   5.675
  440    HD2  HIS   3           2HD      HIS   3  18.828   2.171   8.946
  441    HE1  HIS   3           1HE      HIS   3  15.265   0.428   7.406
  442    H    MET   4           H        MET   4  19.705   1.628   3.350
  443    HA   MET   4           HA       MET   4  21.958   2.918   2.077
  444   1HB   MET   4          1HB       MET   4  23.065   0.930   1.240
  445   2HB   MET   4          2HB       MET   4  23.202   1.036   2.971
  446   1HG   MET   4          1HG       MET   4  21.246  -0.767   1.504
  447   2HG   MET   4          2HG       MET   4  22.838  -1.255   2.042
  448   1HE   MET   4          1HE       MET   4  22.860   0.212   5.065
  449   2HE   MET   4          2HE       MET   4  22.392  -1.226   5.990
  450   3HE   MET   4          3HE       MET   4  23.560  -1.374   4.656
  451    H    ALA   5           H        ALA   5  21.833   1.335  -0.318
  452    HA   ALA   5           HA       ALA   5  19.077   1.587  -1.164
  453   1HB   ALA   5          1HB       ALA   5  20.719   2.340  -2.798
  454   2HB   ALA   5          2HB       ALA   5  21.553   0.760  -2.707
  455   3HB   ALA   5          3HB       ALA   5  19.903   0.865  -3.364
  456    H    GLU   6           H        GLU   6  17.795  -0.193  -0.716
  457    HA   GLU   6           HA       GLU   6  19.138  -2.713   0.001
  458   1HB   GLU   6          1HB       GLU   6  17.746  -2.596   2.124
  459   2HB   GLU   6          2HB       GLU   6  19.095  -1.475   1.981
  460   1HG   GLU   6          1HG       GLU   6  17.447   0.307   1.230
  461   2HG   GLU   6          2HG       GLU   6  16.158  -0.791   1.618
  462    HA   PRO   7           HA       PRO   7  16.019  -4.448  -2.341
  463   1HB   PRO   7          1HB       PRO   7  16.198  -7.083  -1.735
  464   2HB   PRO   7          2HB       PRO   7  17.614  -6.151  -2.290
  465   1HG   PRO   7          1HG       PRO   7  16.836  -6.784   0.577
  466   2HG   PRO   7          2HG       PRO   7  18.417  -7.059  -0.221
  467   1HD   PRO   7          1HD       PRO   7  17.873  -4.815   1.266
  468   2HD   PRO   7          2HD       PRO   7  18.956  -4.769  -0.153
  469    H    GLN   8           H        GLN   8  14.740  -3.104  -0.306
  470    HA   GLN   8           HA       GLN   8  12.286  -4.736   0.076
  471   1HB   GLN   8          1HB       GLN   8  13.760  -3.212   2.229
  472   2HB   GLN   8          2HB       GLN   8  12.004  -3.280   2.253
  473   1HG   GLN   8          1HG       GLN   8  12.825  -5.012   3.671
  474   2HG   GLN   8          2HG       GLN   8  12.028  -5.732   2.282
  475   1HE2  GLN   8          1HE2      GLN   8  13.124  -7.819   2.135
  476   2HE2  GLN   8          2HE2      GLN   8  14.864  -7.828   1.946
  477    H    ARG   9           H        ARG   9  13.511  -1.348   0.381
  478    HA   ARG   9           HA       ARG   9  11.140  -0.020  -0.221
  479   1HB   ARG   9          1HB       ARG   9  13.201   0.939   0.750
  480   2HB   ARG   9          2HB       ARG   9  13.982   0.838  -0.813
  481   1HG   ARG   9          1HG       ARG   9  11.530   2.375  -0.627
  482   2HG   ARG   9          2HG       ARG   9  12.995   3.066   0.061
  483   1HD   ARG   9          1HD       ARG   9  13.956   2.360  -2.369
  484   2HD   ARG   9          2HD       ARG   9  12.272   2.584  -2.821
  485    HE   ARG   9           HE       ARG   9  14.215   4.621  -1.834
  486   1HH1  ARG   9          1HH1      ARG   9  10.833   4.168  -2.971
  487   2HH1  ARG   9          2HH1      ARG   9  10.731   5.884  -3.358
  488   1HH2  ARG   9          1HH2      ARG   9  13.950   6.697  -2.344
  489   2HH2  ARG   9          2HH2      ARG   9  12.387   7.306  -2.946
  490    H    HIS  10           H        HIS  10   9.930  -1.017  -1.854
  491    HA   HIS  10           HA       HIS  10  11.015  -0.909  -4.616
  492   1HB   HIS  10          1HB       HIS  10   9.271  -2.961  -3.203
  493   2HB   HIS  10          2HB       HIS  10   9.643  -2.950  -4.933
  494    HD1  HIS  10           1HD      HIS  10  10.531  -5.310  -2.742
  495    HD2  HIS  10           2HD      HIS  10  12.882  -2.182  -4.121
  496    HE1  HIS  10           1HE      HIS  10  12.866  -6.215  -2.863
  497    H    LYS  11           H        LYS  11   9.092  -1.169  -6.239
  498    HA   LYS  11           HA       LYS  11   7.053   0.884  -5.545
  499   1HB   LYS  11          1HB       LYS  11   9.152   1.049  -7.748
  500   2HB   LYS  11          2HB       LYS  11   7.768   2.107  -7.580
  501   1HG   LYS  11          1HG       LYS  11   9.011   3.476  -6.296
  502   2HG   LYS  11          2HG       LYS  11   8.944   2.265  -5.059
  503   1HD   LYS  11          1HD       LYS  11  11.246   2.830  -5.329
  504   2HD   LYS  11          2HD       LYS  11  11.035   1.215  -5.995
  505   1HE   LYS  11          1HE       LYS  11  12.481   2.505  -7.451
  506   2HE   LYS  11          2HE       LYS  11  10.963   2.165  -8.293
  507   1HZ   LYS  11          1HZ       LYS  11  11.704   4.462  -8.565
  508   2HZ   LYS  11          2HZ       LYS  11  11.544   4.731  -6.945
  509   3HZ   LYS  11          3HZ       LYS  11  10.230   4.392  -7.880
  510    H    ILE  12           H        ILE  12   5.284  -0.414  -5.878
  511    HA   ILE  12           HA       ILE  12   5.064  -1.919  -8.437
  512    HB   ILE  12           HB       ILE  12   3.036  -1.716  -6.183
  513   1HG1  ILE  12          1HG1      ILE  12   4.941  -4.026  -6.629
  514   2HG1  ILE  12          2HG1      ILE  12   5.110  -2.804  -5.364
  515   1HG2  ILE  12          1HG2      ILE  12   3.272  -3.598  -8.575
  516   2HG2  ILE  12          2HG2      ILE  12   1.973  -3.621  -7.357
  517   3HG2  ILE  12          3HG2      ILE  12   2.131  -2.249  -8.440
  518   1HD1  ILE  12          1HD1      ILE  12   2.789  -3.398  -4.541
  519   2HD1  ILE  12          2HD1      ILE  12   2.868  -4.825  -5.608
  520   3HD1  ILE  12          3HD1      ILE  12   4.039  -4.615  -4.297
  521    H    LEU  13           H        LEU  13   4.758  -0.312 -10.041
  522    HA   LEU  13           HA       LEU  13   3.110   1.983  -9.582
  523   1HB   LEU  13          1HB       LEU  13   4.939   1.899 -11.258
  524   2HB   LEU  13          2HB       LEU  13   3.953   0.831 -12.264
  525    HG   LEU  13           HG       LEU  13   2.698   3.406 -11.250
  526   1HD1  LEU  13          1HD1      LEU  13   4.885   4.136 -11.916
  527   2HD1  LEU  13          2HD1      LEU  13   3.680   4.664 -13.117
  528   3HD1  LEU  13          3HD1      LEU  13   4.748   3.282 -13.475
  529   1HD2  LEU  13          1HD2      LEU  13   2.542   1.991 -13.954
  530   2HD2  LEU  13          2HD2      LEU  13   1.626   3.436 -13.469
  531   3HD2  LEU  13          3HD2      LEU  13   1.321   1.899 -12.671
  532    H    CYS  14           H        CYS  14   1.077   1.953  -9.371
  533    HA   CYS  14           HA       CYS  14  -0.618   0.117 -10.947
  534   1HB   CYS  14          1HB       CYS  14  -0.354  -0.404  -8.377
  535   2HB   CYS  14          2HB       CYS  14  -1.357   1.036  -8.146
  536    HG   CYS  14           HG       CYS  14  -1.973  -1.732  -9.874
  537    H    VAL  15           H        VAL  15  -3.063   1.248 -10.398
  538    HA   VAL  15           HA       VAL  15  -2.789   4.153 -10.658
  539    HB   VAL  15           HB       VAL  15  -4.731   4.194 -12.223
  540   1HG1  VAL  15          1HG1      VAL  15  -3.397   3.846 -14.233
  541   2HG1  VAL  15          2HG1      VAL  15  -2.436   4.636 -12.977
  542   3HG1  VAL  15          3HG1      VAL  15  -2.197   2.904 -13.319
  543   1HG2  VAL  15          1HG2      VAL  15  -4.077   1.251 -12.727
  544   2HG2  VAL  15          2HG2      VAL  15  -5.538   1.857 -11.906
  545   3HG2  VAL  15          3HG2      VAL  15  -5.248   2.258 -13.602
  546    H    CYS  16           H        CYS  16  -4.573   5.278  -9.849
  547    HA   CYS  16           HA       CYS  16  -5.618   4.074  -7.466
  548   1HB   CYS  16          1HB       CYS  16  -5.087   6.570  -7.876
  549   2HB   CYS  16          2HB       CYS  16  -6.623   6.628  -8.776
  550    H    CYS  17           H        CYS  17  -7.506   3.107  -7.075
  551    HA   CYS  17           HA       CYS  17  -8.972   1.979  -9.196
  552   1HB   CYS  17          1HB       CYS  17  -8.761   1.228  -6.728
  553   2HB   CYS  17          2HB       CYS  17 -10.099   2.339  -6.395
  554    HG   CYS  17           HG       CYS  17 -11.026  -0.003  -6.502
  555    H    LYS  18           H        LYS  18  -9.737   4.929  -7.276
  556    HA   LYS  18           HA       LYS  18 -12.371   5.048  -8.580
  557   1HB   LYS  18          1HB       LYS  18 -13.041   6.381  -6.767
  558   2HB   LYS  18          2HB       LYS  18 -12.069   5.080  -6.102
  559   1HG   LYS  18          1HG       LYS  18 -11.003   6.718  -4.941
  560   2HG   LYS  18          2HG       LYS  18 -10.111   6.977  -6.424
  561   1HD   LYS  18          1HD       LYS  18 -10.873   9.131  -5.776
  562   2HD   LYS  18          2HD       LYS  18 -11.931   8.672  -7.107
  563   1HE   LYS  18          1HE       LYS  18 -13.618   7.894  -5.381
  564   2HE   LYS  18          2HE       LYS  18 -12.541   8.533  -4.130
  565   1HZ   LYS  18          1HZ       LYS  18 -14.147  10.215  -4.610
  566   2HZ   LYS  18          2HZ       LYS  18 -13.927  10.080  -6.238
  567   3HZ   LYS  18          3HZ       LYS  18 -12.761  10.722  -5.259
  568    H    CYS  19           H        CYS  19  -9.267   6.634  -8.943
  569    HA   CYS  19           HA       CYS  19 -10.535   8.723 -10.588
  570   1HB   CYS  19          1HB       CYS  19  -8.924  10.240  -9.639
  571   2HB   CYS  19          2HB       CYS  19 -10.052   9.643  -8.432
  572    H    ASP  20           H        ASP  20  -8.523   6.051 -10.820
  573    HA   ASP  20           HA       ASP  20  -6.971   5.349 -12.171
  574   1HB   ASP  20          1HB       ASP  20  -8.839   5.965 -13.717
  575   2HB   ASP  20          2HB       ASP  20  -7.954   7.438 -14.124
  576    H    GLY  21           H        GLY  21  -6.176   7.643 -10.393
  577   1HA   GLY  21          1HA       GLY  21  -4.158   9.132 -11.886
  578   2HA   GLY  21          2HA       GLY  21  -4.281   9.093 -10.125
  579    H    ARG  22           H        ARG  22  -1.987   8.835 -11.849
  580    HA   ARG  22           HA       ARG  22  -0.943   6.128 -11.864
  581   1HB   ARG  22          1HB       ARG  22  -0.176   7.881 -13.384
  582   2HB   ARG  22          2HB       ARG  22   0.410   8.870 -12.055
  583   1HG   ARG  22          1HG       ARG  22   1.540   6.084 -12.492
  584   2HG   ARG  22          2HG       ARG  22   2.021   7.424 -13.534
  585   1HD   ARG  22          1HD       ARG  22   2.681   8.728 -11.452
  586   2HD   ARG  22          2HD       ARG  22   2.457   7.223 -10.536
  587    HE   ARG  22           HE       ARG  22   4.107   6.775 -12.822
  588   1HH1  ARG  22          1HH1      ARG  22   4.423   8.381  -9.603
  589   2HH1  ARG  22          2HH1      ARG  22   6.011   7.608  -9.385
  590   1HH2  ARG  22          1HH2      ARG  22   6.347   6.085 -12.399
  591   2HH2  ARG  22          2HH2      ARG  22   6.966   6.484 -10.790
  592    H    ILE  23           H        ILE  23  -0.431   4.952  -9.988
  593    HA   ILE  23           HA       ILE  23   0.745   6.550  -7.781
  594    HB   ILE  23           HB       ILE  23  -0.746   4.030  -7.139
  595   1HG1  ILE  23          1HG1      ILE  23  -2.141   6.729  -7.113
  596   2HG1  ILE  23          2HG1      ILE  23  -2.477   5.397  -8.231
  597   1HG2  ILE  23          1HG2      ILE  23  -0.653   5.108  -4.895
  598   2HG2  ILE  23          2HG2      ILE  23   0.938   5.242  -5.624
  599   3HG2  ILE  23          3HG2      ILE  23  -0.145   6.643  -5.627
  600   1HD1  ILE  23          1HD1      ILE  23  -2.768   5.162  -5.215
  601   2HD1  ILE  23          2HD1      ILE  23  -4.072   5.405  -6.342
  602   3HD1  ILE  23          3HD1      ILE  23  -3.128   3.908  -6.423
  603    H    GLU  24           H        GLU  24   2.808   6.099  -7.727
  604    HA   GLU  24           HA       GLU  24   3.917   3.460  -8.382
  605   1HB   GLU  24          1HB       GLU  24   4.964   5.488  -9.061
  606   2HB   GLU  24          2HB       GLU  24   5.115   6.076  -7.391
  607   1HG   GLU  24          1HG       GLU  24   6.656   4.206  -6.920
  608   2HG   GLU  24          2HG       GLU  24   6.390   3.578  -8.557
  609    H    LEU  25           H        LEU  25   2.889   2.078  -6.885
  610    HA   LEU  25           HA       LEU  25   2.412   2.854  -4.155
  611   1HB   LEU  25          1HB       LEU  25   2.459   0.026  -5.221
  612   2HB   LEU  25          2HB       LEU  25   1.712   0.600  -3.757
  613    HG   LEU  25           HG       LEU  25   0.789   1.218  -6.604
  614   1HD1  LEU  25          1HD1      LEU  25  -0.391  -0.543  -4.401
  615   2HD1  LEU  25          2HD1      LEU  25   0.350  -1.106  -5.913
  616   3HD1  LEU  25          3HD1      LEU  25  -1.161  -0.186  -5.958
  617   1HD2  LEU  25          1HD2      LEU  25   0.349   3.076  -5.109
  618   2HD2  LEU  25          2HD2      LEU  25  -0.354   2.010  -3.897
  619   3HD2  LEU  25          3HD2      LEU  25  -1.168   2.245  -5.472
  620    H    THR  26           H        THR  26   4.253   3.418  -3.129
  621    HA   THR  26           HA       THR  26   6.611   1.754  -3.463
  622    HB   THR  26           HB       THR  26   6.293   4.320  -1.916
  623    HG1  THR  26           1HG      THR  26   5.889   4.330  -4.290
  624   1HG2  THR  26          1HG2      THR  26   8.748   2.822  -2.986
  625   2HG2  THR  26          2HG2      THR  26   8.258   2.851  -1.297
  626   3HG2  THR  26          3HG2      THR  26   8.766   4.350  -2.094
  627    H    VAL  27           H        VAL  27   6.609  -0.068  -2.388
  628    HA   VAL  27           HA       VAL  27   5.621  -0.126   0.422
  629    HB   VAL  27           HB       VAL  27   4.567  -2.284   0.060
  630   1HG1  VAL  27          1HG1      VAL  27   3.687  -0.643  -2.336
  631   2HG1  VAL  27          2HG1      VAL  27   2.735  -1.754  -1.336
  632   3HG1  VAL  27          3HG1      VAL  27   3.299  -0.209  -0.665
  633   1HG2  VAL  27          1HG2      VAL  27   5.706  -2.143  -2.783
  634   2HG2  VAL  27          2HG2      VAL  27   6.084  -3.349  -1.533
  635   3HG2  VAL  27          3HG2      VAL  27   4.475  -3.295  -2.265
  636    H    GLU  28           H        GLU  28   6.972  -1.407   1.819
  637    HA   GLU  28           HA       GLU  28   9.675  -1.467   0.612
  638   1HB   GLU  28          1HB       GLU  28   8.690   0.321   2.266
  639   2HB   GLU  28          2HB       GLU  28   9.010  -0.887   3.463
  640   1HG   GLU  28          1HG       GLU  28  11.447  -0.833   2.307
  641   2HG   GLU  28          2HG       GLU  28  10.876   0.713   1.749
  642    H    SER  29           H        SER  29   9.576  -3.711  -0.015
  643    HA   SER  29           HA       SER  29   9.696  -5.605   2.180
  644   1HB   SER  29          1HB       SER  29   7.144  -5.268   1.534
  645   2HB   SER  29          2HB       SER  29   7.559  -6.303   0.161
  646    HG   SER  29           HG       SER  29   6.981  -7.721   1.839
  647    H    SER  30           H        SER  30  10.273  -7.680   1.510
  648    HA   SER  30           HA       SER  30  12.288  -7.887  -0.399
  649   1HB   SER  30          1HB       SER  30  10.571 -10.177   0.640
  650   2HB   SER  30          2HB       SER  30  12.291 -10.205   0.203
  651    HG   SER  30           HG       SER  30  10.988  -9.208   2.497
  652    H    ALA  31           H        ALA  31  12.366  -8.762  -2.503
  653    HA   ALA  31           HA       ALA  31  10.412  -7.808  -4.135
  654   1HB   ALA  31          1HB       ALA  31  12.345 -10.079  -4.794
  655   2HB   ALA  31          2HB       ALA  31  11.513  -9.049  -5.974
  656   3HB   ALA  31          3HB       ALA  31  12.708  -8.336  -4.874
  657    H    GLU  32           H        GLU  32  10.467 -11.199  -2.917
  658    HA   GLU  32           HA       GLU  32   8.208 -11.693  -4.636
  659   1HB   GLU  32          1HB       GLU  32  10.338 -13.253  -4.006
  660   2HB   GLU  32          2HB       GLU  32   9.040 -13.960  -3.001
  661   1HG   GLU  32          1HG       GLU  32   7.577 -14.121  -4.975
  662   2HG   GLU  32          2HG       GLU  32   8.735 -13.219  -5.952
  663    H    ASP  33           H        ASP  33   8.629 -10.789  -1.419
  664    HA   ASP  33           HA       ASP  33   6.057 -11.618  -0.422
  665   1HB   ASP  33          1HB       ASP  33   7.993 -11.075   1.012
  666   2HB   ASP  33          2HB       ASP  33   8.024  -9.435   0.380
  667    H    LEU  34           H        LEU  34   7.585  -8.913  -2.080
  668    HA   LEU  34           HA       LEU  34   5.292  -7.175  -2.400
  669   1HB   LEU  34          1HB       LEU  34   7.289  -6.137  -2.688
  670   2HB   LEU  34          2HB       LEU  34   8.004  -7.390  -3.657
  671    HG   LEU  34           HG       LEU  34   5.665  -5.923  -4.887
  672   1HD1  LEU  34          1HD1      LEU  34   7.013  -4.123  -3.859
  673   2HD1  LEU  34          2HD1      LEU  34   7.228  -4.110  -5.619
  674   3HD1  LEU  34          3HD1      LEU  34   8.479  -4.828  -4.581
  675   1HD2  LEU  34          1HD2      LEU  34   8.347  -6.884  -5.997
  676   2HD2  LEU  34          2HD2      LEU  34   7.066  -6.085  -6.933
  677   3HD2  LEU  34          3HD2      LEU  34   6.787  -7.677  -6.242
  678    H    ARG  35           H        ARG  35   6.709  -9.563  -4.306
  679    HA   ARG  35           HA       ARG  35   5.024  -9.609  -6.608
  680   1HB   ARG  35          1HB       ARG  35   7.212 -10.882  -6.407
  681   2HB   ARG  35          2HB       ARG  35   6.321 -12.120  -5.503
  682   1HG   ARG  35          1HG       ARG  35   4.830 -12.472  -7.439
  683   2HG   ARG  35          2HG       ARG  35   5.751 -11.264  -8.360
  684   1HD   ARG  35          1HD       ARG  35   7.790 -12.710  -8.105
  685   2HD   ARG  35          2HD       ARG  35   6.800 -13.902  -7.232
  686    HE   ARG  35           HE       ARG  35   5.643 -13.234  -9.757
  687   1HH1  ARG  35          1HH1      ARG  35   8.215 -15.368  -8.304
  688   2HH1  ARG  35          2HH1      ARG  35   8.244 -16.387  -9.676
  689   1HH2  ARG  35          1HH2      ARG  35   5.703 -14.708 -11.502
  690   2HH2  ARG  35          2HH2      ARG  35   6.793 -16.049 -11.486
  691    H    THR  36           H        THR  36   4.896 -11.597  -3.642
  692    HA   THR  36           HA       THR  36   2.508 -12.958  -4.268
  693    HB   THR  36           HB       THR  36   3.456 -12.128  -1.484
  694    HG1  THR  36           1HG      THR  36   5.112 -13.243  -2.575
  695   1HG2  THR  36          1HG2      THR  36   1.734 -14.463  -2.455
  696   2HG2  THR  36          2HG2      THR  36   1.160 -13.082  -1.496
  697   3HG2  THR  36          3HG2      THR  36   2.315 -14.232  -0.795
  698    H    LEU  37           H        LEU  37   2.885  -9.774  -2.520
  699    HA   LEU  37           HA       LEU  37   0.044  -9.407  -2.460
  700   1HB   LEU  37          1HB       LEU  37   0.431  -7.666  -1.203
  701   2HB   LEU  37          2HB       LEU  37   2.065  -8.240  -1.185
  702    HG   LEU  37           HG       LEU  37   2.199  -6.589  -3.398
  703   1HD1  LEU  37          1HD1      LEU  37  -0.216  -5.778  -2.995
  704   2HD1  LEU  37          2HD1      LEU  37   0.944  -4.466  -2.757
  705   3HD1  LEU  37          3HD1      LEU  37   0.236  -5.288  -1.374
  706   1HD2  LEU  37          1HD2      LEU  37   3.343  -5.083  -1.943
  707   2HD2  LEU  37          2HD2      LEU  37   3.645  -6.722  -1.330
  708   3HD2  LEU  37          3HD2      LEU  37   2.452  -5.701  -0.534
  709    H    GLN  38           H        GLN  38   2.397  -8.747  -5.041
  710    HA   GLN  38           HA       GLN  38   0.640  -7.169  -6.662
  711   1HB   GLN  38          1HB       GLN  38   2.966  -7.126  -7.108
  712   2HB   GLN  38          2HB       GLN  38   3.066  -8.862  -7.189
  713   1HG   GLN  38          1HG       GLN  38   1.506  -8.643  -9.301
  714   2HG   GLN  38          2HG       GLN  38   2.096  -6.977  -9.302
  715   1HE2  GLN  38          1HE2      GLN  38   4.645  -6.832  -9.048
  716   2HE2  GLN  38          2HE2      GLN  38   5.553  -8.118  -9.828
  717    H    GLN  39           H        GLN  39   1.066 -10.727  -6.110
  718    HA   GLN  39           HA       GLN  39  -0.726 -11.496  -8.201
  719   1HB   GLN  39          1HB       GLN  39  -0.187 -13.122  -5.725
  720   2HB   GLN  39          2HB       GLN  39  -0.814 -13.645  -7.277
  721   1HG   GLN  39          1HG       GLN  39   1.989 -12.978  -6.508
  722   2HG   GLN  39          2HG       GLN  39   1.371 -14.382  -7.333
  723   1HE2  GLN  39          1HE2      GLN  39   2.737 -11.283  -7.667
  724   2HE2  GLN  39          2HE2      GLN  39   2.811 -11.149  -9.421
  725    H    LEU  40           H        LEU  40  -1.174 -10.683  -4.709
  726    HA   LEU  40           HA       LEU  40  -3.999 -11.115  -4.645
  727   1HB   LEU  40          1HB       LEU  40  -2.579  -8.848  -3.223
  728   2HB   LEU  40          2HB       LEU  40  -4.132  -9.554  -2.859
  729    HG   LEU  40           HG       LEU  40  -1.455 -10.942  -2.532
  730   1HD1  LEU  40          1HD1      LEU  40  -1.861  -9.113  -0.916
  731   2HD1  LEU  40          2HD1      LEU  40  -1.856 -10.702  -0.130
  732   3HD1  LEU  40          3HD1      LEU  40  -3.395  -9.876  -0.452
  733   1HD2  LEU  40          1HD2      LEU  40  -2.669 -12.699  -1.327
  734   2HD2  LEU  40          2HD2      LEU  40  -3.152 -12.619  -3.030
  735   3HD2  LEU  40          3HD2      LEU  40  -4.212 -11.946  -1.771
  736    H    PHE  41           H        PHE  41  -2.132  -8.261  -5.817
  737    HA   PHE  41           HA       PHE  41  -4.472  -6.685  -6.448
  738   1HB   PHE  41          1HB       PHE  41  -1.553  -6.548  -7.116
  739   2HB   PHE  41          2HB       PHE  41  -2.665  -5.718  -8.184
  740    HD1  PHE  41           1HD      PHE  41  -3.282  -3.519  -7.710
  741    HD2  PHE  41           2HD      PHE  41  -2.019  -6.076  -4.478
  742    HE1  PHE  41           1HE      PHE  41  -3.444  -1.623  -6.143
  743    HE2  PHE  41           2HE      PHE  41  -2.201  -4.173  -2.902
  744    HZ   PHE  41           HZ       PHE  41  -2.946  -1.964  -3.715
  745    H    LEU  42           H        LEU  42  -2.512  -8.956  -8.375
  746    HA   LEU  42           HA       LEU  42  -4.037  -8.690 -10.787
  747   1HB   LEU  42          1HB       LEU  42  -2.247 -10.831  -9.607
  748   2HB   LEU  42          2HB       LEU  42  -3.004 -11.054 -11.176
  749    HG   LEU  42           HG       LEU  42  -1.253  -8.633 -10.555
  750   1HD1  LEU  42          1HD1      LEU  42   0.100 -10.652 -10.229
  751   2HD1  LEU  42          2HD1      LEU  42   0.580  -9.822 -11.712
  752   3HD1  LEU  42          3HD1      LEU  42  -0.422 -11.290 -11.800
  753   1HD2  LEU  42          1HD2      LEU  42  -1.041  -8.519 -13.018
  754   2HD2  LEU  42          2HD2      LEU  42  -2.729  -8.381 -12.522
  755   3HD2  LEU  42          3HD2      LEU  42  -2.129  -9.915 -13.184
  756    H    SER  43           H        SER  43  -4.584 -10.662  -7.871
  757    HA   SER  43           HA       SER  43  -6.675 -12.247  -9.029
  758   1HB   SER  43          1HB       SER  43  -5.167 -12.914  -7.146
  759   2HB   SER  43          2HB       SER  43  -5.942 -11.707  -6.117
  760    HG   SER  43           HG       SER  43  -7.225 -13.277  -5.676
  761    H    THR  44           H        THR  44  -6.713  -9.658  -6.528
  762    HA   THR  44           HA       THR  44  -9.516  -9.106  -6.989
  763    HB   THR  44           HB       THR  44  -9.416  -9.228  -4.319
  764    HG1  THR  44           1HG      THR  44  -7.771 -10.524  -3.501
  765   1HG2  THR  44          1HG2      THR  44  -9.955 -11.603  -4.326
  766   2HG2  THR  44          2HG2      THR  44  -9.299 -11.783  -5.967
  767   3HG2  THR  44          3HG2      THR  44 -10.745 -10.787  -5.697
  768    H    LEU  45           H        LEU  45  -6.435  -7.931  -5.802
  769    HA   LEU  45           HA       LEU  45  -7.704  -5.839  -4.235
  770   1HB   LEU  45          1HB       LEU  45  -5.296  -7.393  -4.139
  771   2HB   LEU  45          2HB       LEU  45  -4.799  -5.722  -4.248
  772    HG   LEU  45           HG       LEU  45  -6.290  -5.198  -2.339
  773   1HD1  LEU  45          1HD1      LEU  45  -7.997  -6.913  -2.425
  774   2HD1  LEU  45          2HD1      LEU  45  -7.044  -7.274  -0.972
  775   3HD1  LEU  45          3HD1      LEU  45  -6.777  -8.181  -2.472
  776   1HD2  LEU  45          1HD2      LEU  45  -4.320  -7.472  -1.786
  777   2HD2  LEU  45          2HD2      LEU  45  -4.865  -6.268  -0.611
  778   3HD2  LEU  45          3HD2      LEU  45  -3.878  -5.760  -1.988
  779    H    SER  46           H        SER  46  -7.217  -3.585  -4.093
  780    HA   SER  46           HA       SER  46  -5.981  -2.330  -6.435
  781   1HB   SER  46          1HB       SER  46  -8.029  -0.718  -6.227
  782   2HB   SER  46          2HB       SER  46  -8.198  -2.241  -7.101
  783    HG   SER  46           HG       SER  46  -9.752  -1.380  -5.128
  784    H    PHE  47           H        PHE  47  -6.060   0.233  -5.860
  785    HA   PHE  47           HA       PHE  47  -5.363   0.651  -3.039
  786   1HB   PHE  47          1HB       PHE  47  -3.277   0.116  -4.546
  787   2HB   PHE  47          2HB       PHE  47  -3.538   1.713  -5.203
  788    HD1  PHE  47           1HD      PHE  47  -2.268  -0.259  -2.405
  789    HD2  PHE  47           2HD      PHE  47  -3.358   3.736  -3.614
  790    HE1  PHE  47           1HE      PHE  47  -0.924   0.674  -0.563
  791    HE2  PHE  47           2HE      PHE  47  -2.098   4.655  -1.697
  792    HZ   PHE  47           HZ       PHE  47  -0.871   3.133  -0.168
  793    H    VAL  48           H        VAL  48  -5.399   2.890  -2.467
  794    HA   VAL  48           HA       VAL  48  -6.754   4.672  -4.275
  795    HB   VAL  48           HB       VAL  48  -7.936   3.219  -1.992
  796   1HG1  VAL  48          1HG1      VAL  48  -9.541   4.893  -1.378
  797   2HG1  VAL  48          2HG1      VAL  48  -7.901   5.315  -0.878
  798   3HG1  VAL  48          3HG1      VAL  48  -8.639   6.128  -2.284
  799   1HG2  VAL  48          1HG2      VAL  48  -8.746   2.967  -4.306
  800   2HG2  VAL  48          2HG2      VAL  48 -10.009   3.652  -3.292
  801   3HG2  VAL  48          3HG2      VAL  48  -9.103   4.704  -4.394
  802    H    CYS  49           H        CYS  49  -5.426   6.360  -4.373
  803    HA   CYS  49           HA       CYS  49  -3.139   6.689  -2.657
  804   1HB   CYS  49          1HB       CYS  49  -2.948   8.861  -3.968
  805   2HB   CYS  49          2HB       CYS  49  -2.940   7.383  -4.901
  806    HA   PRO  50           HA       PRO  50  -4.796   8.780   0.726
  807   1HB   PRO  50          1HB       PRO  50  -2.877  10.671   1.438
  808   2HB   PRO  50          2HB       PRO  50  -2.835   8.921   1.800
  809   1HG   PRO  50          1HG       PRO  50  -1.518  10.387  -0.503
  810   2HG   PRO  50          2HG       PRO  50  -0.809   9.134   0.565
  811   1HD   PRO  50          1HD       PRO  50  -1.727   8.480  -1.876
  812   2HD   PRO  50          2HD       PRO  50  -2.065   7.408  -0.484
  813    H    TRP  51           H        TRP  51  -3.771  10.935  -1.884
  814    HA   TRP  51           HA       TRP  51  -5.180  13.299  -1.118
  815   1HB   TRP  51          1HB       TRP  51  -3.583  13.534  -2.848
  816   2HB   TRP  51          2HB       TRP  51  -4.195  12.144  -3.735
  817    HD1  TRP  51           HD       TRP  51  -5.511  15.661  -2.768
  818    HE1  TRP  51           1HE      TRP  51  -7.003  16.536  -4.664
  819    HE3  TRP  51           3HE      TRP  51  -5.234  11.652  -5.953
  820    HZ2  TRP  51           2HZ      TRP  51  -7.976  15.609  -7.220
  821    HZ3  TRP  51           3HZ      TRP  51  -6.445  11.685  -8.110
  822    HH2  TRP  51           HH       TRP  51  -7.822  13.648  -8.750
  823    H    CYS  52           H        CYS  52  -6.138  10.609  -3.368
  824    HA   CYS  52           HA       CYS  52  -8.798  11.683  -3.639
  825   1HB   CYS  52          1HB       CYS  52  -9.097  10.100  -5.199
  826   2HB   CYS  52          2HB       CYS  52  -7.354  10.057  -5.154
  827    H    ALA  53           H        ALA  53  -7.219   9.311  -1.511
  828    HA   ALA  53           HA       ALA  53  -9.517   8.134  -0.493
  829   1HB   ALA  53          1HB       ALA  53  -7.187   7.302  -0.056
  830   2HB   ALA  53          2HB       ALA  53  -6.898   8.726   0.968
  831   3HB   ALA  53          3HB       ALA  53  -8.085   7.542   1.472
  832    H    THR  54           H        THR  54  -7.848  11.120   0.377
  833    HA   THR  54           HA       THR  54  -9.470  11.839   2.650
  834    HB   THR  54           HB       THR  54  -7.728  13.553   0.813
  835    HG1  THR  54           1HG      THR  54  -6.448  11.968   1.652
  836   1HG2  THR  54          1HG2      THR  54  -7.474  15.010   2.790
  837   2HG2  THR  54          2HG2      THR  54  -8.633  14.007   3.689
  838   3HG2  THR  54          3HG2      THR  54  -9.164  14.937   2.268
  839    H    ASN  55           H        ASN  55  -9.489  12.744  -0.835
  840    HA   ASN  55           HA       ASN  55 -11.652  14.643  -0.565
  841   1HB   ASN  55          1HB       ASN  55 -10.375  13.279  -2.972
  842   2HB   ASN  55          2HB       ASN  55 -11.759  14.357  -3.125
  843   1HD2  ASN  55          1HD2      ASN  55  -8.334  14.290  -1.879
  844   2HD2  ASN  55          2HD2      ASN  55  -8.199  16.039  -2.027
  845    H    GLN  56           H        GLN  56 -11.513  11.326  -1.671
  846    HA   GLN  56           HA       GLN  56 -13.038   9.774  -2.278
  847   1HB   GLN  56          2HB       GLN  56 -12.465   9.532   0.061
  848   2HB   GLN  56          3HB       GLN  56 -13.829  10.542   0.529
  849   1HG   GLN  56          2HG       GLN  56 -14.908   8.433  -1.115
  850   2HG   GLN  56          3HG       GLN  56 -13.730   7.676  -0.063
  851   1HE2  GLN  56          1HE2      GLN  56 -16.305  10.115  -0.004
  852   2HE2  GLN  56          2HE2      GLN  56 -17.021   9.659   1.571
  Start of MODEL    7
    1   1H    GLY   1          1H        GLY   1 -23.007  10.224   3.817
    2   1HA   GLY   1          1HA       GLY   1 -22.618  12.476   4.160
    3   2HA   GLY   1          2HA       GLY   1 -23.639  11.955   5.523
    4    H    SER   2           H        SER   2 -22.812  12.553   7.584
    5    HA   SER   2           HA       SER   2 -20.094  13.426   7.975
    6   1HB   SER   2          1HB       SER   2 -20.939  13.636  10.306
    7   2HB   SER   2          2HB       SER   2 -22.017  14.406   9.130
    8    HG   SER   2           HG       SER   2 -22.433  12.276  10.774
    9    H    HIS   3           H        HIS   3 -20.003  10.873   6.859
   10    HA   HIS   3           HA       HIS   3 -18.748   8.976   8.505
   11   1HB   HIS   3          1HB       HIS   3 -20.687   7.325   8.574
   12   2HB   HIS   3          2HB       HIS   3 -20.827   8.655   9.710
   13    HD1  HIS   3           1HD      HIS   3 -22.905  10.311   9.370
   14    HD2  HIS   3           2HD      HIS   3 -22.340   7.435   6.340
   15    HE1  HIS   3           1HE      HIS   3 -24.953  10.440   7.849
   16    H    MET   4           H        MET   4 -18.277   7.071   7.120
   17    HA   MET   4           HA       MET   4 -19.463   6.875   4.492
   18   1HB   MET   4          1HB       MET   4 -17.734   8.634   4.138
   19   2HB   MET   4          2HB       MET   4 -16.514   7.605   4.891
   20   1HG   MET   4          1HG       MET   4 -16.361   7.600   2.454
   21   2HG   MET   4          2HG       MET   4 -16.658   5.996   3.086
   22   1HE   MET   4          1HE       MET   4 -17.950   8.987   1.028
   23   2HE   MET   4          2HE       MET   4 -19.630   8.565   0.637
   24   3HE   MET   4          3HE       MET   4 -19.198   9.043   2.295
   25    H    ALA   5           H        ALA   5 -18.947   4.776   3.577
   26    HA   ALA   5           HA       ALA   5 -16.837   3.190   4.627
   27   1HB   ALA   5          1HB       ALA   5 -19.715   2.184   4.928
   28   2HB   ALA   5          2HB       ALA   5 -18.251   1.199   5.132
   29   3HB   ALA   5          3HB       ALA   5 -18.589   2.524   6.264
   30    H    GLU   6           H        GLU   6 -16.338   1.505   3.007
   31    HA   GLU   6           HA       GLU   6 -18.208   1.064   0.831
   32   1HB   GLU   6          1HB       GLU   6 -15.262   1.722   0.475
   33   2HB   GLU   6          2HB       GLU   6 -16.301   1.127  -0.801
   34   1HG   GLU   6          1HG       GLU   6 -17.468   3.198  -0.972
   35   2HG   GLU   6          2HG       GLU   6 -16.731   3.806   0.514
   36    HA   PRO   7           HA       PRO   7 -15.826  -2.956   1.495
   37   1HB   PRO   7          1HB       PRO   7 -16.436  -4.213  -0.800
   38   2HB   PRO   7          2HB       PRO   7 -17.674  -4.021   0.478
   39   1HG   PRO   7          1HG       PRO   7 -17.343  -2.428  -2.067
   40   2HG   PRO   7          2HG       PRO   7 -18.851  -3.040  -1.322
   41   1HD   PRO   7          1HD       PRO   7 -17.838  -0.452  -1.057
   42   2HD   PRO   7          2HD       PRO   7 -18.965  -1.175   0.110
   43    H    GLN   8           H        GLN   8 -13.892  -3.780   0.313
   44    HA   GLN   8           HA       GLN   8 -12.023  -3.619  -0.708
   45   1HB   GLN   8          1HB       GLN   8 -13.899  -2.640  -2.617
   46   2HB   GLN   8          2HB       GLN   8 -12.516  -1.613  -2.752
   47   1HG   GLN   8          1HG       GLN   8 -12.372  -3.520  -4.270
   48   2HG   GLN   8          2HG       GLN   8 -11.092  -3.658  -3.062
   49   1HE2  GLN   8          1HE2      GLN   8 -10.929  -5.958  -3.243
   50   2HE2  GLN   8          2HE2      GLN   8 -12.184  -7.017  -2.616
   51    H    ARG   9           H        ARG   9 -13.119  -0.197  -0.723
   52    HA   ARG   9           HA       ARG   9 -10.604   0.894  -0.062
   53   1HB   ARG   9          1HB       ARG   9 -12.734   1.967  -1.077
   54   2HB   ARG   9          2HB       ARG   9 -13.244   2.212   0.574
   55   1HG   ARG   9          1HG       ARG   9 -10.590   3.174  -0.053
   56   2HG   ARG   9          2HG       ARG   9 -11.935   4.042  -0.808
   57   1HD   ARG   9          1HD       ARG   9 -12.886   4.054   1.668
   58   2HD   ARG   9          2HD       ARG   9 -11.205   3.791   2.098
   59    HE   ARG   9           HE       ARG   9 -10.622   5.919   1.140
   60   1HH1  ARG   9          1HH1      ARG   9 -14.092   5.445   0.678
   61   2HH1  ARG   9          2HH1      ARG   9 -14.546   7.041   1.025
   62   1HH2  ARG   9          1HH2      ARG   9 -11.251   8.268   1.047
   63   2HH2  ARG   9          2HH2      ARG   9 -12.901   8.620   1.311
   64    H    HIS  10           H        HIS  10  -9.620  -0.207   1.699
   65    HA   HIS  10           HA       HIS  10 -10.857   0.270   4.375
   66   1HB   HIS  10          1HB       HIS  10  -9.159  -2.048   3.432
   67   2HB   HIS  10          2HB       HIS  10  -9.841  -1.857   5.048
   68    HD1  HIS  10           1HD      HIS  10 -10.459  -4.152   2.539
   69    HD2  HIS  10           2HD      HIS  10 -12.860  -0.993   3.810
   70    HE1  HIS  10           1HE      HIS  10 -12.703  -4.721   1.807
   71    H    LYS  11           H        LYS  11  -9.162   0.207   6.172
   72    HA   LYS  11           HA       LYS  11  -6.876   1.922   5.344
   73   1HB   LYS  11          1HB       LYS  11  -9.180   2.651   7.179
   74   2HB   LYS  11          2HB       LYS  11  -7.628   3.470   7.169
   75   1HG   LYS  11          1HG       LYS  11  -8.416   4.827   5.560
   76   2HG   LYS  11          2HG       LYS  11  -8.246   3.476   4.475
   77   1HD   LYS  11          1HD       LYS  11 -10.424   4.346   4.145
   78   2HD   LYS  11          2HD       LYS  11 -10.629   2.818   4.998
   79   1HE   LYS  11          1HE       LYS  11 -12.140   4.448   5.937
   80   2HE   LYS  11          2HE       LYS  11 -10.898   4.087   7.145
   81   1HZ   LYS  11          1HZ       LYS  11 -11.395   6.470   6.914
   82   2HZ   LYS  11          2HZ       LYS  11 -10.795   6.459   5.377
   83   3HZ   LYS  11          3HZ       LYS  11  -9.823   6.150   6.670
   84    H    ILE  12           H        ILE  12  -5.275   0.578   5.998
   85    HA   ILE  12           HA       ILE  12  -5.353  -0.532   8.763
   86    HB   ILE  12           HB       ILE  12  -3.177  -0.819   6.665
   87   1HG1  ILE  12          1HG1      ILE  12  -5.279  -2.898   7.329
   88   2HG1  ILE  12          2HG1      ILE  12  -5.305  -1.866   5.895
   89   1HG2  ILE  12          1HG2      ILE  12  -3.695  -2.338   9.265
   90   2HG2  ILE  12          2HG2      ILE  12  -2.321  -2.585   8.162
   91   3HG2  ILE  12          3HG2      ILE  12  -2.461  -1.083   9.053
   92   1HD1  ILE  12          1HD1      ILE  12  -3.031  -2.705   5.255
   93   2HD1  ILE  12          2HD1      ILE  12  -3.171  -3.916   6.558
   94   3HD1  ILE  12          3HD1      ILE  12  -4.312  -3.910   5.214
   95    H    LEU  13           H        LEU  13  -4.991   1.196  10.164
   96    HA   LEU  13           HA       LEU  13  -3.172   3.328   9.569
   97   1HB   LEU  13          1HB       LEU  13  -5.095   3.539  11.128
   98   2HB   LEU  13          2HB       LEU  13  -4.232   2.542  12.306
   99    HG   LEU  13           HG       LEU  13  -2.818   4.942  11.075
  100   1HD1  LEU  13          1HD1      LEU  13  -4.977   5.824  11.638
  101   2HD1  LEU  13          2HD1      LEU  13  -3.774   6.399  12.818
  102   3HD1  LEU  13          3HD1      LEU  13  -4.905   5.101  13.265
  103   1HD2  LEU  13          1HD2      LEU  13  -2.748   3.722  13.874
  104   2HD2  LEU  13          2HD2      LEU  13  -1.808   5.133  13.339
  105   3HD2  LEU  13          3HD2      LEU  13  -1.494   3.557  12.630
  106    H    CYS  14           H        CYS  14  -1.133   3.094   9.417
  107    HA   CYS  14           HA       CYS  14   0.373   1.322  11.228
  108   1HB   CYS  14          1HB       CYS  14  -0.119   0.442   8.771
  109   2HB   CYS  14          2HB       CYS  14   1.103   1.627   8.295
  110    HG   CYS  14           HG       CYS  14   1.317  -0.874  10.465
  111    H    VAL  15           H        VAL  15   2.907   2.016  10.165
  112    HA   VAL  15           HA       VAL  15   2.960   4.958  10.102
  113    HB   VAL  15           HB       VAL  15   5.198   4.917  11.162
  114   1HG1  VAL  15          1HG1      VAL  15   4.397   4.822  13.454
  115   2HG1  VAL  15          2HG1      VAL  15   3.189   5.590  12.414
  116   3HG1  VAL  15          3HG1      VAL  15   2.953   3.911  12.954
  117   1HG2  VAL  15          1HG2      VAL  15   4.505   2.072  12.029
  118   2HG2  VAL  15          2HG2      VAL  15   5.766   2.518  10.854
  119   3HG2  VAL  15          3HG2      VAL  15   5.906   3.032  12.538
  120    H    CYS  16           H        CYS  16   4.628   5.802   8.783
  121    HA   CYS  16           HA       CYS  16   5.353   4.251   6.450
  122   1HB   CYS  16          1HB       CYS  16   5.255   6.800   6.516
  123   2HB   CYS  16          2HB       CYS  16   6.723   6.754   7.519
  124    H    CYS  17           H        CYS  17   6.964   2.912   6.195
  125    HA   CYS  17           HA       CYS  17   8.408   1.661   8.183
  126   1HB   CYS  17          1HB       CYS  17   8.063   0.989   5.731
  127   2HB   CYS  17          2HB       CYS  17   9.413   2.065   5.340
  128    HG   CYS  17           HG       CYS  17  10.804   0.240   5.334
  129    H    LYS  18           H        LYS  18   9.448   4.567   6.364
  130    HA   LYS  18           HA       LYS  18  11.932   4.663   7.989
  131   1HB   LYS  18          1HB       LYS  18  12.907   5.769   6.029
  132   2HB   LYS  18          2HB       LYS  18  12.447   4.086   5.795
  133   1HG   LYS  18          1HG       LYS  18  10.452   4.812   4.479
  134   2HG   LYS  18          2HG       LYS  18  10.835   6.494   4.832
  135   1HD   LYS  18          1HD       LYS  18  11.707   6.265   2.709
  136   2HD   LYS  18          2HD       LYS  18  13.127   6.026   3.700
  137   1HE   LYS  18          1HE       LYS  18  11.459   3.904   2.258
  138   2HE   LYS  18          2HE       LYS  18  13.075   4.471   1.823
  139   1HZ   LYS  18          1HZ       LYS  18  13.811   3.483   4.005
  140   2HZ   LYS  18          2HZ       LYS  18  13.280   2.374   2.891
  141   3HZ   LYS  18          3HZ       LYS  18  12.309   2.717   4.058
  142    H    CYS  19           H        CYS  19   9.046   6.528   7.305
  143    HA   CYS  19           HA       CYS  19  10.304   8.966   8.378
  144   1HB   CYS  19          1HB       CYS  19   7.467   8.691   7.863
  145   2HB   CYS  19          2HB       CYS  19   8.456  10.108   7.892
  146    H    ASP  20           H        ASP  20   8.608   6.094   9.483
  147    HA   ASP  20           HA       ASP  20   7.423   5.534  11.243
  148   1HB   ASP  20          1HB       ASP  20   9.658   5.775  12.223
  149   2HB   ASP  20          2HB       ASP  20   9.263   7.423  12.704
  150    H    GLY  21           H        GLY  21   6.247   7.482   9.655
  151   1HA   GLY  21          1HA       GLY  21   4.777   9.272  11.566
  152   2HA   GLY  21          2HA       GLY  21   4.956   9.592   9.840
  153    H    ARG  22           H        ARG  22   2.552   9.336  11.394
  154    HA   ARG  22           HA       ARG  22   1.242   6.816  11.245
  155   1HB   ARG  22          1HB       ARG  22   0.604   8.582  12.776
  156   2HB   ARG  22          2HB       ARG  22   0.220   9.691  11.471
  157   1HG   ARG  22          1HG       ARG  22  -1.305   7.078  11.739
  158   2HG   ARG  22          2HG       ARG  22  -1.635   8.430  12.821
  159   1HD   ARG  22          1HD       ARG  22  -1.980   9.877  10.707
  160   2HD   ARG  22          2HD       ARG  22  -2.042   8.341   9.821
  161    HE   ARG  22           HE       ARG  22  -3.758   8.364  12.142
  162   1HH1  ARG  22          1HH1      ARG  22  -3.786   9.590   8.753
  163   2HH1  ARG  22          2HH1      ARG  22  -5.463   9.030   8.568
  164   1HH2  ARG  22          1HH2      ARG  22  -6.064   7.941  11.729
  165   2HH2  ARG  22          2HH2      ARG  22  -6.589   8.204  10.061
  166    H    ILE  23           H        ILE  23   0.763   5.731   9.382
  167    HA   ILE  23           HA       ILE  23  -0.401   7.385   7.217
  168    HB   ILE  23           HB       ILE  23   0.790   4.654   6.683
  169   1HG1  ILE  23          1HG1      ILE  23   2.106   7.245   5.783
  170   2HG1  ILE  23          2HG1      ILE  23   2.654   6.325   7.187
  171   1HG2  ILE  23          1HG2      ILE  23   0.387   5.503   4.294
  172   2HG2  ILE  23          2HG2      ILE  23  -1.077   5.419   5.244
  173   3HG2  ILE  23          3HG2      ILE  23  -0.287   6.983   4.989
  174   1HD1  ILE  23          1HD1      ILE  23   3.058   4.330   5.822
  175   2HD1  ILE  23          2HD1      ILE  23   2.491   5.163   4.364
  176   3HD1  ILE  23          3HD1      ILE  23   3.946   5.716   5.161
  177    H    GLU  24           H        GLU  24  -2.501   7.043   7.079
  178    HA   GLU  24           HA       GLU  24  -3.826   4.620   8.110
  179   1HB   GLU  24          1HB       GLU  24  -4.714   6.759   8.552
  180   2HB   GLU  24          2HB       GLU  24  -4.749   7.220   6.836
  181   1HG   GLU  24          1HG       GLU  24  -6.435   5.447   6.468
  182   2HG   GLU  24          2HG       GLU  24  -6.344   5.016   8.188
  183    H    LEU  25           H        LEU  25  -2.862   3.011   6.804
  184    HA   LEU  25           HA       LEU  25  -2.187   3.403   4.064
  185   1HB   LEU  25          1HB       LEU  25  -2.647   0.769   5.465
  186   2HB   LEU  25          2HB       LEU  25  -1.807   1.004   3.958
  187    HG   LEU  25           HG       LEU  25  -0.834   1.986   6.679
  188   1HD1  LEU  25          1HD1      LEU  25  -0.037  -0.414   4.952
  189   2HD1  LEU  25          2HD1      LEU  25  -0.790  -0.456   6.556
  190   3HD1  LEU  25          3HD1      LEU  25   0.866   0.145   6.373
  191   1HD2  LEU  25          1HD2      LEU  25  -0.015   3.339   4.764
  192   2HD2  LEU  25          2HD2      LEU  25   0.520   1.886   3.938
  193   3HD2  LEU  25          3HD2      LEU  25   1.298   2.386   5.465
  194    H    THR  26           H        THR  26  -3.899   4.051   2.851
  195    HA   THR  26           HA       THR  26  -6.449   2.686   3.097
  196    HB   THR  26           HB       THR  26  -5.658   5.069   1.417
  197    HG1  THR  26           1HG      THR  26  -5.487   5.217   3.818
  198   1HG2  THR  26          1HG2      THR  26  -8.385   3.954   2.280
  199   2HG2  THR  26          2HG2      THR  26  -7.721   3.890   0.646
  200   3HG2  THR  26          3HG2      THR  26  -8.117   5.457   1.377
  201    H    VAL  27           H        VAL  27  -6.166   0.669   2.332
  202    HA   VAL  27           HA       VAL  27  -5.198   0.373  -0.488
  203    HB   VAL  27           HB       VAL  27  -4.387  -1.979   0.125
  204   1HG1  VAL  27          1HG1      VAL  27  -3.382   0.014   2.199
  205   2HG1  VAL  27          2HG1      VAL  27  -2.618  -1.504   1.684
  206   3HG1  VAL  27          3HG1      VAL  27  -2.804  -0.188   0.528
  207   1HG2  VAL  27          1HG2      VAL  27  -5.457  -1.269   2.945
  208   2HG2  VAL  27          2HG2      VAL  27  -6.150  -2.479   1.849
  209   3HG2  VAL  27          3HG2      VAL  27  -4.544  -2.717   2.523
  210    H    GLU  28           H        GLU  28  -6.528  -1.048  -1.824
  211    HA   GLU  28           HA       GLU  28  -9.328  -0.947  -0.800
  212   1HB   GLU  28          1HB       GLU  28  -8.279   0.771  -2.490
  213   2HB   GLU  28          2HB       GLU  28  -8.490  -0.498  -3.640
  214   1HG   GLU  28          1HG       GLU  28 -10.915  -0.443  -2.348
  215   2HG   GLU  28          2HG       GLU  28 -10.462   1.216  -2.228
  216    H    SER  29           H        SER  29  -9.699  -3.044  -0.162
  217    HA   SER  29           HA       SER  29  -8.572  -5.302  -1.756
  218   1HB   SER  29          1HB       SER  29  -8.069  -4.436   1.131
  219   2HB   SER  29          2HB       SER  29  -7.385  -5.861   0.354
  220    HG   SER  29           HG       SER  29  -6.795  -3.732  -1.113
  221    H    SER  30           H        SER  30  -9.819  -7.293  -1.282
  222    HA   SER  30           HA       SER  30 -12.255  -6.948   0.292
  223   1HB   SER  30          1HB       SER  30 -10.850  -9.589  -0.396
  224   2HB   SER  30          2HB       SER  30 -12.563  -9.335  -0.045
  225    HG   SER  30           HG       SER  30 -11.087  -8.941  -2.382
  226    H    ALA  31           H        ALA  31 -12.586  -7.780   2.489
  227    HA   ALA  31           HA       ALA  31 -10.600  -6.894   4.115
  228   1HB   ALA  31          1HB       ALA  31 -12.784  -8.881   4.898
  229   2HB   ALA  31          2HB       ALA  31 -11.902  -7.811   6.005
  230   3HB   ALA  31          3HB       ALA  31 -12.979  -7.112   4.778
  231    H    GLU  32           H        GLU  32 -10.901 -10.355   3.189
  232    HA   GLU  32           HA       GLU  32  -8.722 -10.855   5.015
  233   1HB   GLU  32          1HB       GLU  32 -11.021 -12.241   4.686
  234   2HB   GLU  32          2HB       GLU  32  -9.865 -13.221   3.739
  235   1HG   GLU  32          1HG       GLU  32  -8.308 -13.209   5.670
  236   2HG   GLU  32          2HG       GLU  32  -9.393 -12.151   6.571
  237    H    ASP  33           H        ASP  33  -9.158 -10.369   1.730
  238    HA   ASP  33           HA       ASP  33  -6.703 -11.550   0.804
  239   1HB   ASP  33          1HB       ASP  33  -8.891 -10.688  -0.447
  240   2HB   ASP  33          2HB       ASP  33  -8.082  -9.132  -0.398
  241    H    LEU  34           H        LEU  34  -7.924  -8.495   2.178
  242    HA   LEU  34           HA       LEU  34  -5.508  -7.036   2.308
  243   1HB   LEU  34          1HB       LEU  34  -7.587  -5.916   2.573
  244   2HB   LEU  34          2HB       LEU  34  -8.108  -6.905   3.883
  245    HG   LEU  34           HG       LEU  34  -5.637  -5.212   4.239
  246   1HD1  LEU  34          1HD1      LEU  34  -7.405  -3.733   3.289
  247   2HD1  LEU  34          2HD1      LEU  34  -7.075  -3.329   4.974
  248   3HD1  LEU  34          3HD1      LEU  34  -8.527  -4.270   4.558
  249   1HD2  LEU  34          1HD2      LEU  34  -7.781  -6.243   6.143
  250   2HD2  LEU  34          2HD2      LEU  34  -6.633  -4.967   6.590
  251   3HD2  LEU  34          3HD2      LEU  34  -6.030  -6.559   6.188
  252    H    ARG  35           H        ARG  35  -7.163  -8.826   4.666
  253    HA   ARG  35           HA       ARG  35  -5.420  -8.929   6.841
  254   1HB   ARG  35          1HB       ARG  35  -7.668 -10.095   6.789
  255   2HB   ARG  35          2HB       ARG  35  -6.872 -11.442   5.964
  256   1HG   ARG  35          1HG       ARG  35  -5.301 -11.670   7.882
  257   2HG   ARG  35          2HG       ARG  35  -6.202 -10.408   8.743
  258   1HD   ARG  35          1HD       ARG  35  -8.221 -11.872   8.691
  259   2HD   ARG  35          2HD       ARG  35  -7.296 -13.088   7.779
  260    HE   ARG  35           HE       ARG  35  -5.966 -12.344  10.199
  261   1HH1  ARG  35          1HH1      ARG  35  -8.625 -14.494   8.985
  262   2HH1  ARG  35          2HH1      ARG  35  -8.452 -15.586  10.299
  263   1HH2  ARG  35          1HH2      ARG  35  -5.774 -13.861  11.886
  264   2HH2  ARG  35          2HH2      ARG  35  -6.821 -15.233  11.969
  265    H    THR  36           H        THR  36  -5.441 -11.188   4.073
  266    HA   THR  36           HA       THR  36  -3.110 -12.608   4.809
  267    HB   THR  36           HB       THR  36  -4.107 -11.997   1.977
  268    HG1  THR  36           1HG      THR  36  -5.775 -12.918   3.160
  269   1HG2  THR  36          1HG2      THR  36  -2.454 -14.326   3.051
  270   2HG2  THR  36          2HG2      THR  36  -1.859 -13.035   1.980
  271   3HG2  THR  36          3HG2      THR  36  -3.090 -14.168   1.398
  272    H    LEU  37           H        LEU  37  -3.406  -9.725   2.660
  273    HA   LEU  37           HA       LEU  37  -0.690  -9.147   2.311
  274   1HB   LEU  37          1HB       LEU  37  -1.702  -7.644   1.024
  275   2HB   LEU  37          2HB       LEU  37  -3.227  -7.913   1.814
  276    HG   LEU  37           HG       LEU  37  -2.460  -6.210   3.607
  277   1HD1  LEU  37          1HD1      LEU  37  -0.726  -4.576   2.814
  278   2HD1  LEU  37          2HD1      LEU  37  -0.577  -5.422   1.276
  279   3HD1  LEU  37          3HD1      LEU  37   0.019  -6.165   2.735
  280   1HD2  LEU  37          1HD2      LEU  37  -3.092  -4.288   2.289
  281   2HD2  LEU  37          2HD2      LEU  37  -4.197  -5.615   1.990
  282   3HD2  LEU  37          3HD2      LEU  37  -2.951  -5.209   0.797
  283    H    GLN  38           H        GLN  38  -2.769  -8.410   5.097
  284    HA   GLN  38           HA       GLN  38  -0.888  -6.749   6.474
  285   1HB   GLN  38          1HB       GLN  38  -3.192  -6.455   6.876
  286   2HB   GLN  38          2HB       GLN  38  -3.448  -8.150   7.160
  287   1HG   GLN  38          1HG       GLN  38  -1.989  -7.837   9.308
  288   2HG   GLN  38          2HG       GLN  38  -2.361  -6.121   9.074
  289   1HE2  GLN  38          1HE2      GLN  38  -4.807  -5.659   8.685
  290   2HE2  GLN  38          2HE2      GLN  38  -5.960  -6.705   9.489
  291    H    GLN  39           H        GLN  39  -1.503 -10.303   6.406
  292    HA   GLN  39           HA       GLN  39   0.238 -10.882   8.598
  293   1HB   GLN  39          1HB       GLN  39  -0.413 -12.781   6.350
  294   2HB   GLN  39          2HB       GLN  39   0.206 -13.140   7.954
  295   1HG   GLN  39          1HG       GLN  39  -2.562 -12.428   7.107
  296   2HG   GLN  39          2HG       GLN  39  -2.016 -13.732   8.124
  297   1HE2  GLN  39          1HE2      GLN  39  -3.219 -10.556   8.009
  298   2HE2  GLN  39          2HE2      GLN  39  -3.333 -10.187   9.718
  299    H    LEU  40           H        LEU  40   0.683 -10.475   5.038
  300    HA   LEU  40           HA       LEU  40   3.497 -11.039   5.006
  301   1HB   LEU  40          1HB       LEU  40   2.303  -8.799   3.376
  302   2HB   LEU  40          2HB       LEU  40   3.696  -9.790   3.061
  303    HG   LEU  40           HG       LEU  40   0.826 -10.755   2.985
  304   1HD1  LEU  40          1HD1      LEU  40   2.712 -10.198   0.686
  305   2HD1  LEU  40          2HD1      LEU  40   1.362  -9.165   1.190
  306   3HD1  LEU  40          3HD1      LEU  40   1.044 -10.798   0.575
  307   1HD2  LEU  40          1HD2      LEU  40   1.710 -12.788   1.917
  308   2HD2  LEU  40          2HD2      LEU  40   2.324 -12.606   3.568
  309   3HD2  LEU  40          3HD2      LEU  40   3.367 -12.208   2.183
  310    H    PHE  41           H        PHE  41   1.773  -7.946   5.678
  311    HA   PHE  41           HA       PHE  41   4.113  -6.433   6.303
  312   1HB   PHE  41          1HB       PHE  41   1.192  -6.154   6.978
  313   2HB   PHE  41          2HB       PHE  41   2.368  -5.171   7.823
  314    HD1  PHE  41           1HD      PHE  41   2.419  -3.008   7.028
  315    HD2  PHE  41           2HD      PHE  41   2.029  -6.229   4.175
  316    HE1  PHE  41           1HE      PHE  41   2.615  -1.409   5.179
  317    HE2  PHE  41           2HE      PHE  41   2.270  -4.617   2.327
  318    HZ   PHE  41           HZ       PHE  41   2.634  -2.220   2.802
  319    H    LEU  42           H        LEU  42   2.065  -8.413   8.449
  320    HA   LEU  42           HA       LEU  42   3.500  -7.987  10.850
  321   1HB   LEU  42          1HB       LEU  42   1.281  -8.924  10.676
  322   2HB   LEU  42          2HB       LEU  42   1.868 -10.327   9.804
  323    HG   LEU  42           HG       LEU  42   2.904  -9.843  12.592
  324   1HD1  LEU  42          1HD1      LEU  42   0.460  -9.560  12.763
  325   2HD1  LEU  42          2HD1      LEU  42   0.954 -11.098  13.481
  326   3HD1  LEU  42          3HD1      LEU  42   0.200 -11.075  11.870
  327   1HD2  LEU  42          1HD2      LEU  42   2.867 -12.340  12.641
  328   2HD2  LEU  42          2HD2      LEU  42   3.845 -11.764  11.298
  329   3HD2  LEU  42          3HD2      LEU  42   2.206 -12.369  10.992
  330    H    SER  43           H        SER  43   4.153 -10.255   8.137
  331    HA   SER  43           HA       SER  43   6.177 -11.676   9.602
  332   1HB   SER  43          1HB       SER  43   4.585 -12.651   7.935
  333   2HB   SER  43          2HB       SER  43   5.404 -11.746   6.656
  334    HG   SER  43           HG       SER  43   6.341 -13.696   6.663
  335    H    THR  44           H        THR  44   6.270  -9.699   6.593
  336    HA   THR  44           HA       THR  44   9.136  -9.355   6.821
  337    HB   THR  44           HB       THR  44   8.778  -9.764   4.209
  338    HG1  THR  44           1HG      THR  44   6.937 -10.888   3.668
  339   1HG2  THR  44          1HG2      THR  44  10.007 -11.276   5.686
  340   2HG2  THR  44          2HG2      THR  44   8.980 -12.176   4.536
  341   3HG2  THR  44          3HG2      THR  44   8.481 -12.005   6.236
  342    H    LEU  45           H        LEU  45   6.199  -7.824   6.083
  343    HA   LEU  45           HA       LEU  45   7.489  -5.894   4.219
  344   1HB   LEU  45          1HB       LEU  45   5.031  -7.481   4.248
  345   2HB   LEU  45          2HB       LEU  45   4.662  -5.796   3.971
  346    HG   LEU  45           HG       LEU  45   6.370  -5.753   2.207
  347   1HD1  LEU  45          1HD1      LEU  45   7.851  -7.584   2.836
  348   2HD1  LEU  45          2HD1      LEU  45   7.130  -7.968   1.267
  349   3HD1  LEU  45          3HD1      LEU  45   6.504  -8.722   2.750
  350   1HD2  LEU  45          1HD2      LEU  45   5.041  -7.031   0.531
  351   2HD2  LEU  45          2HD2      LEU  45   4.001  -6.118   1.630
  352   3HD2  LEU  45          3HD2      LEU  45   4.207  -7.875   1.838
  353    H    SER  46           H        SER  46   6.651  -3.690   3.833
  354    HA   SER  46           HA       SER  46   5.007  -2.452   5.847
  355   1HB   SER  46          1HB       SER  46   7.974  -1.814   5.650
  356   2HB   SER  46          2HB       SER  46   6.784  -0.695   6.353
  357    HG   SER  46           HG       SER  46   6.703  -3.350   7.233
  358    H    PHE  47           H        PHE  47   5.034   0.105   5.258
  359    HA   PHE  47           HA       PHE  47   4.894   0.353   2.314
  360   1HB   PHE  47          1HB       PHE  47   2.714   0.503   4.153
  361   2HB   PHE  47          2HB       PHE  47   3.093   2.148   3.736
  362    HD1  PHE  47           1HD      PHE  47   1.088  -0.563   2.842
  363    HD2  PHE  47           2HD      PHE  47   3.472   2.562   1.038
  364    HE1  PHE  47           1HE      PHE  47  -0.159  -0.814   0.729
  365    HE2  PHE  47           2HE      PHE  47   2.223   2.295  -1.058
  366    HZ   PHE  47           HZ       PHE  47   0.409   0.605  -1.229
  367    H    VAL  48           H        VAL  48   5.379   2.372   1.531
  368    HA   VAL  48           HA       VAL  48   6.803   4.254   3.199
  369    HB   VAL  48           HB       VAL  48   7.673   2.493   0.918
  370   1HG1  VAL  48          1HG1      VAL  48   8.293   4.767   0.110
  371   2HG1  VAL  48          2HG1      VAL  48   9.295   4.940   1.591
  372   3HG1  VAL  48          3HG1      VAL  48   9.639   3.652   0.423
  373   1HG2  VAL  48          1HG2      VAL  48   8.229   1.889   3.235
  374   2HG2  VAL  48          2HG2      VAL  48   9.696   2.341   2.364
  375   3HG2  VAL  48          3HG2      VAL  48   8.953   3.475   3.505
  376    H    CYS  49           H        CYS  49   5.574   5.998   3.100
  377    HA   CYS  49           HA       CYS  49   3.381   6.354   1.308
  378   1HB   CYS  49          1HB       CYS  49   3.306   8.639   2.401
  379   2HB   CYS  49          2HB       CYS  49   3.267   7.272   3.491
  380    HA   PRO  50           HA       PRO  50   4.968   8.136  -2.270
  381   1HB   PRO  50          1HB       PRO  50   3.353  10.351  -2.843
  382   2HB   PRO  50          2HB       PRO  50   2.997   8.635  -3.194
  383   1HG   PRO  50          1HG       PRO  50   2.126  10.283  -0.811
  384   2HG   PRO  50          2HG       PRO  50   1.151   9.144  -1.798
  385   1HD   PRO  50          1HD       PRO  50   2.141   8.373   0.572
  386   2HD   PRO  50          2HD       PRO  50   2.218   7.254  -0.819
  387    H    TRP  51           H        TRP  51   4.745  10.416   0.405
  388    HA   TRP  51           HA       TRP  51   6.401  12.495  -0.605
  389   1HB   TRP  51          1HB       TRP  51   5.073  12.935   1.334
  390   2HB   TRP  51          2HB       TRP  51   5.725  11.538   2.192
  391    HD1  TRP  51           HD       TRP  51   7.758  14.279   0.380
  392    HE1  TRP  51           1HE      TRP  51   9.557  15.118   1.912
  393    HE3  TRP  51           3HE      TRP  51   6.320  11.837   4.657
  394    HZ2  TRP  51           2HZ      TRP  51  10.204  14.953   4.769
  395    HZ3  TRP  51           3HZ      TRP  51   7.561  12.202   6.768
  396    HH2  TRP  51           HH       TRP  51   9.503  13.747   6.836
  397    H    CYS  52           H        CYS  52   7.356   9.856   1.770
  398    HA   CYS  52           HA       CYS  52  10.143  10.299   1.234
  399   1HB   CYS  52          1HB       CYS  52  10.519   8.131   2.306
  400   2HB   CYS  52          2HB       CYS  52   9.568   9.236   3.236
  401    H    ALA  53           H        ALA  53   7.647   8.232  -0.327
  402    HA   ALA  53           HA       ALA  53   9.493   6.657  -1.615
  403   1HB   ALA  53          1HB       ALA  53   7.002   6.295  -1.734
  404   2HB   ALA  53          2HB       ALA  53   6.902   7.660  -2.885
  405   3HB   ALA  53          3HB       ALA  53   7.783   6.210  -3.334
  406    H    THR  54           H        THR  54   8.386   9.924  -2.362
  407    HA   THR  54           HA       THR  54   9.981  10.297  -4.756
  408    HB   THR  54           HB       THR  54   8.627  12.332  -2.926
  409    HG1  THR  54           1HG      THR  54   7.050  10.951  -3.557
  410   1HG2  THR  54          1HG2      THR  54   8.473  13.704  -4.966
  411   2HG2  THR  54          2HG2      THR  54   9.354  12.467  -5.885
  412   3HG2  THR  54          3HG2      THR  54  10.168  13.360  -4.582
  413    H    ASN  55           H        ASN  55  10.331  11.250  -1.278
  414    HA   ASN  55           HA       ASN  55  12.752  12.821  -1.872
  415   1HB   ASN  55          1HB       ASN  55  11.152  12.306   0.685
  416   2HB   ASN  55          2HB       ASN  55  12.600  13.293   0.633
  417   1HD2  ASN  55          1HD2      ASN  55  10.450  13.401  -2.111
  418   2HD2  ASN  55          2HD2      ASN  55   9.766  14.971  -1.752
  419    H    GLN  56           H        GLN  56  12.093   9.795  -0.603
  420    HA   GLN  56           HA       GLN  56  13.122   8.097   0.468
  421   1HB   GLN  56          2HB       GLN  56  15.052   8.307  -1.134
  422   2HB   GLN  56          3HB       GLN  56  15.796   9.435  -0.007
  423   1HG   GLN  56          2HG       GLN  56  16.884   7.420   0.378
  424   2HG   GLN  56          3HG       GLN  56  15.785   7.553   1.736
  425   1HE2  GLN  56          1HE2      GLN  56  17.142   5.186   0.400
  426   2HE2  GLN  56          2HE2      GLN  56  15.863   4.039   0.141
  427   1H    GLY   1          1H        GLY   1  26.583   9.194   0.365
  428   1HA   GLY   1          1HA       GLY   1  28.674   9.422  -1.691
  429   2HA   GLY   1          2HA       GLY   1  28.992   9.177   0.050
  430    H    SER   2           H        SER   2  28.776   7.101   0.940
  431    HA   SER   2           HA       SER   2  27.323   4.959  -0.317
  432   1HB   SER   2          1HB       SER   2  27.199   4.376   2.221
  433   2HB   SER   2          2HB       SER   2  28.788   4.343   1.435
  434    HG   SER   2           HG       SER   2  28.756   5.493   3.455
  435    H    HIS   3           H        HIS   3  25.132   4.383   0.646
  436    HA   HIS   3           HA       HIS   3  23.505   6.387   1.869
  437   1HB   HIS   3          1HB       HIS   3  21.845   6.430   0.006
  438   2HB   HIS   3          2HB       HIS   3  23.354   7.211  -0.438
  439    HD1  HIS   3           1HD      HIS   3  21.289   4.073  -1.257
  440    HD2  HIS   3           2HD      HIS   3  24.846   6.058  -2.387
  441    HE1  HIS   3           1HE      HIS   3  22.116   2.966  -3.418
  442    H    MET   4           H        MET   4  21.197   5.264   2.064
  443    HA   MET   4           HA       MET   4  21.577   2.396   2.563
  444   1HB   MET   4          1HB       MET   4  19.527   2.382   3.586
  445   2HB   MET   4          2HB       MET   4  20.036   4.035   3.916
  446   1HG   MET   4          1HG       MET   4  18.679   4.655   1.789
  447   2HG   MET   4          2HG       MET   4  18.013   3.035   1.877
  448   1HE   MET   4          1HE       MET   4  17.546   2.433   4.896
  449   2HE   MET   4          2HE       MET   4  15.933   3.108   5.200
  450   3HE   MET   4          3HE       MET   4  16.254   2.216   3.695
  451    H    ALA   5           H        ALA   5  20.700   0.730   1.253
  452    HA   ALA   5           HA       ALA   5  18.588   1.254  -0.489
  453   1HB   ALA   5          1HB       ALA   5  20.260   1.864  -2.159
  454   2HB   ALA   5          2HB       ALA   5  21.175   0.356  -1.814
  455   3HB   ALA   5          3HB       ALA   5  19.547   0.285  -2.538
  456    H    GLU   6           H        GLU   6  17.594  -0.666  -0.909
  457    HA   GLU   6           HA       GLU   6  18.627  -3.094   0.461
  458   1HB   GLU   6          1HB       GLU   6  16.597  -2.947   1.876
  459   2HB   GLU   6          2HB       GLU   6  17.673  -1.587   2.091
  460   1HG   GLU   6          1HG       GLU   6  15.106  -1.545   0.439
  461   2HG   GLU   6          2HG       GLU   6  15.334  -0.982   2.087
  462    HA   PRO   7           HA       PRO   7  16.111  -5.238  -2.569
  463   1HB   PRO   7          1HB       PRO   7  16.012  -7.730  -1.554
  464   2HB   PRO   7          2HB       PRO   7  17.583  -6.962  -1.913
  465   1HG   PRO   7          1HG       PRO   7  16.199  -7.197   0.769
  466   2HG   PRO   7          2HG       PRO   7  17.916  -7.510   0.373
  467   1HD   PRO   7          1HD       PRO   7  16.867  -5.110   1.385
  468   2HD   PRO   7          2HD       PRO   7  18.424  -5.229   0.534
  469    H    GLN   8           H        GLN   8  14.636  -3.464  -1.161
  470    HA   GLN   8           HA       GLN   8  12.252  -4.845  -0.062
  471   1HB   GLN   8          1HB       GLN   8  14.411  -3.745   1.456
  472   2HB   GLN   8          2HB       GLN   8  13.129  -2.572   1.585
  473   1HG   GLN   8          1HG       GLN   8  12.958  -4.091   3.416
  474   2HG   GLN   8          2HG       GLN   8  11.588  -4.399   2.346
  475   1HE2  GLN   8          1HE2      GLN   8  11.200  -6.551   2.169
  476   2HE2  GLN   8          2HE2      GLN   8  12.370  -7.832   2.095
  477    H    ARG   9           H        ARG   9  13.517  -1.463  -0.380
  478    HA   ARG   9           HA       ARG   9  11.071  -0.296  -0.830
  479   1HB   ARG   9          1HB       ARG   9  13.330   0.672  -0.105
  480   2HB   ARG   9          2HB       ARG   9  13.749   0.711  -1.807
  481   1HG   ARG   9          1HG       ARG   9  11.184   1.970  -1.427
  482   2HG   ARG   9          2HG       ARG   9  12.333   2.617  -0.254
  483   1HD   ARG   9          1HD       ARG   9  13.860   2.683  -2.527
  484   2HD   ARG   9          2HD       ARG   9  12.255   2.865  -3.239
  485    HE   ARG   9           HE       ARG   9  13.489   4.591  -1.099
  486   1HH1  ARG   9          1HH1      ARG   9  11.192   4.498  -3.844
  487   2HH1  ARG   9          2HH1      ARG   9  10.926   6.238  -3.720
  488   1HH2  ARG   9          1HH2      ARG   9  13.006   6.615  -0.922
  489   2HH2  ARG   9          2HH2      ARG   9  11.825   7.449  -1.896
  490    H    HIS  10           H        HIS  10   9.796  -1.384  -2.267
  491    HA   HIS  10           HA       HIS  10  10.621  -1.226  -5.129
  492   1HB   HIS  10          1HB       HIS  10   8.999  -3.339  -3.684
  493   2HB   HIS  10          2HB       HIS  10   9.372  -3.295  -5.414
  494    HD1  HIS  10           1HD      HIS  10  10.397  -5.520  -3.029
  495    HD2  HIS  10           2HD      HIS  10  12.584  -2.456  -4.764
  496    HE1  HIS  10           1HE      HIS  10  12.731  -6.328  -3.075
  497    H    LYS  11           H        LYS  11   8.635  -1.489  -6.622
  498    HA   LYS  11           HA       LYS  11   6.657   0.549  -5.762
  499   1HB   LYS  11          1HB       LYS  11   8.635   0.791  -8.057
  500   2HB   LYS  11          2HB       LYS  11   7.348   1.927  -7.656
  501   1HG   LYS  11          1HG       LYS  11   8.433   2.285  -5.408
  502   2HG   LYS  11          2HG       LYS  11   9.799   1.296  -5.941
  503   1HD   LYS  11          1HD       LYS  11   8.873   3.882  -7.215
  504   2HD   LYS  11          2HD       LYS  11  10.249   3.702  -6.130
  505   1HE   LYS  11          1HE       LYS  11  11.514   2.438  -7.700
  506   2HE   LYS  11          2HE       LYS  11  10.084   2.089  -8.689
  507   1HZ   LYS  11          1HZ       LYS  11  11.414   3.780  -9.718
  508   2HZ   LYS  11          2HZ       LYS  11  11.229   4.784  -8.409
  509   3HZ   LYS  11          3HZ       LYS  11   9.917   4.329  -9.308
  510    H    ILE  12           H        ILE  12   4.872  -0.711  -6.110
  511    HA   ILE  12           HA       ILE  12   4.575  -2.168  -8.685
  512    HB   ILE  12           HB       ILE  12   2.547  -1.848  -6.445
  513   1HG1  ILE  12          1HG1      ILE  12   4.330  -4.258  -6.872
  514   2HG1  ILE  12          2HG1      ILE  12   4.627  -3.014  -5.654
  515   1HG2  ILE  12          1HG2      ILE  12   2.697  -3.785  -8.797
  516   2HG2  ILE  12          2HG2      ILE  12   1.409  -3.732  -7.571
  517   3HG2  ILE  12          3HG2      ILE  12   1.610  -2.389  -8.684
  518   1HD1  ILE  12          1HD1      ILE  12   2.366  -3.415  -4.682
  519   2HD1  ILE  12          2HD1      ILE  12   2.216  -4.838  -5.753
  520   3HD1  ILE  12          3HD1      ILE  12   3.487  -4.764  -4.526
  521    H    LEU  13           H        LEU  13   4.257  -0.663 -10.375
  522    HA   LEU  13           HA       LEU  13   2.832   1.782  -9.962
  523   1HB   LEU  13          1HB       LEU  13   4.565   1.477 -11.699
  524   2HB   LEU  13          2HB       LEU  13   3.460   0.445 -12.617
  525    HG   LEU  13           HG       LEU  13   2.455   3.159 -11.692
  526   1HD1  LEU  13          1HD1      LEU  13   4.652   3.705 -12.469
  527   2HD1  LEU  13          2HD1      LEU  13   3.446   4.246 -13.660
  528   3HD1  LEU  13          3HD1      LEU  13   4.405   2.779 -13.972
  529   1HD2  LEU  13          1HD2      LEU  13   2.072   1.613 -14.296
  530   2HD2  LEU  13          2HD2      LEU  13   1.304   3.161 -13.877
  531   3HD2  LEU  13          3HD2      LEU  13   0.901   1.713 -12.967
  532    H    CYS  14           H        CYS  14   0.804   1.918  -9.637
  533    HA   CYS  14           HA       CYS  14  -1.129   0.072 -10.956
  534   1HB   CYS  14          1HB       CYS  14  -0.729  -0.359  -8.481
  535   2HB   CYS  14          2HB       CYS  14  -1.384   1.251  -8.148
  536    HG   CYS  14           HG       CYS  14  -3.770   0.841  -8.616
  537    H    VAL  15           H        VAL  15  -3.456   1.326 -10.460
  538    HA   VAL  15           HA       VAL  15  -3.072   4.237 -10.721
  539    HB   VAL  15           HB       VAL  15  -5.270   4.412 -11.827
  540   1HG1  VAL  15          1HG1      VAL  15  -4.534   3.815 -14.070
  541   2HG1  VAL  15          2HG1      VAL  15  -3.197   4.514 -13.148
  542   3HG1  VAL  15          3HG1      VAL  15  -3.265   2.757 -13.414
  543   1HG2  VAL  15          1HG2      VAL  15  -5.117   1.392 -12.248
  544   2HG2  VAL  15          2HG2      VAL  15  -6.263   2.233 -11.174
  545   3HG2  VAL  15          3HG2      VAL  15  -6.325   2.510 -12.916
  546    H    CYS  16           H        CYS  16  -4.742   5.428  -9.605
  547    HA   CYS  16           HA       CYS  16  -5.763   4.276  -7.128
  548   1HB   CYS  16          1HB       CYS  16  -5.441   6.809  -7.520
  549   2HB   CYS  16          2HB       CYS  16  -6.783   6.721  -8.670
  550    H    CYS  17           H        CYS  17  -7.511   2.949  -7.019
  551    HA   CYS  17           HA       CYS  17  -8.869   1.982  -9.276
  552   1HB   CYS  17          1HB       CYS  17  -8.691   1.100  -6.814
  553   2HB   CYS  17          2HB       CYS  17 -10.148   2.060  -6.532
  554    HG   CYS  17           HG       CYS  17 -10.871  -0.302  -6.807
  555    H    LYS  18           H        LYS  18  -9.678   4.857  -7.334
  556    HA   LYS  18           HA       LYS  18 -12.213   5.149  -8.843
  557   1HB   LYS  18          1HB       LYS  18 -13.077   6.189  -6.836
  558   2HB   LYS  18          2HB       LYS  18 -12.636   4.496  -6.609
  559   1HG   LYS  18          1HG       LYS  18 -10.594   5.197  -5.382
  560   2HG   LYS  18          2HG       LYS  18 -10.970   6.885  -5.716
  561   1HD   LYS  18          1HD       LYS  18 -11.739   6.704  -3.589
  562   2HD   LYS  18          2HD       LYS  18 -13.227   6.428  -4.469
  563   1HE   LYS  18          1HE       LYS  18 -11.440   4.345  -3.125
  564   2HE   LYS  18          2HE       LYS  18 -12.968   4.975  -2.509
  565   1HZ   LYS  18          1HZ       LYS  18 -13.608   3.934  -4.929
  566   2HZ   LYS  18          2HZ       LYS  18 -13.911   3.310  -3.437
  567   3HZ   LYS  18          3HZ       LYS  18 -12.548   2.822  -4.276
  568    H    CYS  19           H        CYS  19  -9.211   6.856  -8.042
  569    HA   CYS  19           HA       CYS  19 -10.269   9.327  -9.235
  570   1HB   CYS  19          1HB       CYS  19  -7.511   8.738  -8.561
  571   2HB   CYS  19          2HB       CYS  19  -8.228  10.286  -8.885
  572    H    ASP  20           H        ASP  20  -8.867   6.298 -10.243
  573    HA   ASP  20           HA       ASP  20  -7.666   5.574 -11.946
  574   1HB   ASP  20          1HB       ASP  20  -9.920   5.691 -12.845
  575   2HB   ASP  20          2HB       ASP  20  -9.588   7.300 -13.487
  576    H    GLY  21           H        GLY  21  -6.054   7.062 -10.780
  577   1HA   GLY  21          1HA       GLY  21  -4.583   8.546 -12.896
  578   2HA   GLY  21          2HA       GLY  21  -4.650   9.159 -11.229
  579    H    ARG  22           H        ARG  22  -2.300   8.356 -12.662
  580    HA   ARG  22           HA       ARG  22  -1.437   5.674 -12.148
  581   1HB   ARG  22          1HB       ARG  22  -0.612   7.047 -13.971
  582   2HB   ARG  22          2HB       ARG  22  -0.006   8.278 -12.877
  583   1HG   ARG  22          1HG       ARG  22   1.093   5.443 -12.793
  584   2HG   ARG  22          2HG       ARG  22   1.596   6.597 -14.027
  585   1HD   ARG  22          1HD       ARG  22   2.156   8.209 -12.053
  586   2HD   ARG  22          2HD       ARG  22   2.079   6.752 -11.046
  587    HE   ARG  22           HE       ARG  22   3.691   6.350 -13.393
  588   1HH1  ARG  22          1HH1      ARG  22   3.953   7.968 -10.185
  589   2HH1  ARG  22          2HH1      ARG  22   5.597   7.314  -9.996
  590   1HH2  ARG  22          1HH2      ARG  22   5.981   5.815 -13.022
  591   2HH2  ARG  22          2HH2      ARG  22   6.611   6.269 -11.434
  592    H    ILE  23           H        ILE  23  -0.543   4.781 -10.308
  593    HA   ILE  23           HA       ILE  23   0.701   6.656  -8.408
  594    HB   ILE  23           HB       ILE  23  -0.820   4.217  -7.414
  595   1HG1  ILE  23          1HG1      ILE  23  -1.893   7.073  -7.285
  596   2HG1  ILE  23          2HG1      ILE  23  -2.485   5.838  -8.402
  597   1HG2  ILE  23          1HG2      ILE  23  -0.479   5.377  -5.220
  598   2HG2  ILE  23          2HG2      ILE  23   1.047   5.157  -6.019
  599   3HG2  ILE  23          3HG2      ILE  23   0.271   6.749  -6.064
  600   1HD1  ILE  23          1HD1      ILE  23  -2.584   5.611  -5.382
  601   2HD1  ILE  23          2HD1      ILE  23  -3.927   5.936  -6.442
  602   3HD1  ILE  23          3HD1      ILE  23  -3.115   4.366  -6.545
  603    H    GLU  24           H        GLU  24   2.604   5.806  -7.492
  604    HA   GLU  24           HA       GLU  24   3.612   3.259  -8.658
  605   1HB   GLU  24          1HB       GLU  24   4.604   5.164  -9.556
  606   2HB   GLU  24          2HB       GLU  24   4.941   5.892  -7.971
  607   1HG   GLU  24          1HG       GLU  24   6.560   4.127  -7.515
  608   2HG   GLU  24          2HG       GLU  24   6.085   3.274  -8.994
  609    H    LEU  25           H        LEU  25   2.820   1.882  -7.118
  610    HA   LEU  25           HA       LEU  25   2.373   2.790  -4.461
  611   1HB   LEU  25          1HB       LEU  25   2.301  -0.032  -5.504
  612   2HB   LEU  25          2HB       LEU  25   1.634   0.527  -3.989
  613    HG   LEU  25           HG       LEU  25   0.624   1.262  -6.777
  614   1HD1  LEU  25          1HD1      LEU  25  -0.551  -0.454  -4.539
  615   2HD1  LEU  25          2HD1      LEU  25   0.103  -1.052  -6.079
  616   3HD1  LEU  25          3HD1      LEU  25  -1.359  -0.058  -6.067
  617   1HD2  LEU  25          1HD2      LEU  25   0.332   3.135  -5.243
  618   2HD2  LEU  25          2HD2      LEU  25  -0.386   2.069  -4.030
  619   3HD2  LEU  25          3HD2      LEU  25  -1.218   2.375  -5.585
  620    H    THR  26           H        THR  26   4.202   3.251  -3.311
  621    HA   THR  26           HA       THR  26   6.507   1.546  -3.644
  622    HB   THR  26           HB       THR  26   6.208   4.124  -2.130
  623    HG1  THR  26           1HG      THR  26   5.849   4.059  -4.523
  624   1HG2  THR  26          1HG2      THR  26   8.674   2.579  -3.104
  625   2HG2  THR  26          2HG2      THR  26   8.178   2.731  -1.416
  626   3HG2  THR  26          3HG2      THR  26   8.690   4.171  -2.315
  627    H    VAL  27           H        VAL  27   6.253  -0.340  -2.714
  628    HA   VAL  27           HA       VAL  27   5.450  -0.506   0.151
  629    HB   VAL  27           HB       VAL  27   4.576  -2.801  -0.300
  630   1HG1  VAL  27          1HG1      VAL  27   3.407  -0.775  -2.229
  631   2HG1  VAL  27          2HG1      VAL  27   2.636  -2.231  -1.563
  632   3HG1  VAL  27          3HG1      VAL  27   3.089  -0.909  -0.482
  633   1HG2  VAL  27          1HG2      VAL  27   6.053  -3.430  -2.235
  634   2HG2  VAL  27          2HG2      VAL  27   4.351  -3.567  -2.670
  635   3HG2  VAL  27          3HG2      VAL  27   5.290  -2.184  -3.243
  636    H    GLU  28           H        GLU  28   7.016  -1.213   1.507
  637    HA   GLU  28           HA       GLU  28   9.677  -1.674   0.273
  638   1HB   GLU  28          1HB       GLU  28   8.942   0.100   2.205
  639   2HB   GLU  28          2HB       GLU  28   9.557  -1.194   3.198
  640   1HG   GLU  28          1HG       GLU  28  11.555  -1.128   1.510
  641   2HG   GLU  28          2HG       GLU  28  10.831   0.405   1.001
  642    H    SER  29           H        SER  29   9.657  -3.777  -0.315
  643    HA   SER  29           HA       SER  29   8.542  -5.842   1.497
  644   1HB   SER  29          1HB       SER  29   7.763  -5.043  -1.351
  645   2HB   SER  29          2HB       SER  29   7.085  -6.403  -0.446
  646    HG   SER  29           HG       SER  29   6.861  -4.178   1.006
  647    H    SER  30           H        SER  30   9.516  -7.928   1.061
  648    HA   SER  30           HA       SER  30  11.859  -8.028  -0.594
  649   1HB   SER  30          1HB       SER  30  10.066 -10.306   0.358
  650   2HB   SER  30          2HB       SER  30  11.711 -10.464  -0.271
  651    HG   SER  30           HG       SER  30  11.547 -10.390   2.076
  652    H    ALA  31           H        ALA  31  12.075  -8.747  -2.766
  653    HA   ALA  31           HA       ALA  31  10.186  -7.814  -4.472
  654   1HB   ALA  31          1HB       ALA  31  12.149 -10.069  -5.098
  655   2HB   ALA  31          2HB       ALA  31  11.364  -9.006  -6.283
  656   3HB   ALA  31          3HB       ALA  31  12.518  -8.325  -5.119
  657    H    GLU  32           H        GLU  32  10.305 -11.275  -3.421
  658    HA   GLU  32           HA       GLU  32   8.105 -11.751  -5.222
  659   1HB   GLU  32          1HB       GLU  32  10.237 -13.259  -4.656
  660   2HB   GLU  32          2HB       GLU  32   9.029 -13.981  -3.543
  661   1HG   GLU  32          1HG       GLU  32   7.421 -14.137  -5.435
  662   2HG   GLU  32          2HG       GLU  32   8.591 -13.380  -6.509
  663    H    ASP  33           H        ASP  33   8.386 -10.789  -2.046
  664    HA   ASP  33           HA       ASP  33   5.882 -11.865  -1.096
  665   1HB   ASP  33          1HB       ASP  33   8.049 -11.401   0.202
  666   2HB   ASP  33          2HB       ASP  33   7.631  -9.699   0.087
  667    H    LEU  34           H        LEU  34   7.349  -9.050  -2.547
  668    HA   LEU  34           HA       LEU  34   5.018  -7.307  -2.780
  669   1HB   LEU  34          1HB       LEU  34   6.984  -6.220  -3.159
  670   2HB   LEU  34          2HB       LEU  34   7.663  -7.436  -4.198
  671    HG   LEU  34           HG       LEU  34   5.208  -5.898  -5.119
  672   1HD1  LEU  34          1HD1      LEU  34   6.874  -4.239  -4.345
  673   2HD1  LEU  34          2HD1      LEU  34   6.748  -4.212  -6.108
  674   3HD1  LEU  34          3HD1      LEU  34   8.108  -5.059  -5.338
  675   1HD2  LEU  34          1HD2      LEU  34   7.524  -7.232  -6.593
  676   2HD2  LEU  34          2HD2      LEU  34   6.400  -6.103  -7.374
  677   3HD2  LEU  34          3HD2      LEU  34   5.793  -7.608  -6.732
  678    H    ARG  35           H        ARG  35   6.471  -9.646  -4.758
  679    HA   ARG  35           HA       ARG  35   4.633  -9.796  -6.951
  680   1HB   ARG  35          1HB       ARG  35   6.858 -11.011  -6.876
  681   2HB   ARG  35          2HB       ARG  35   6.075 -12.239  -5.877
  682   1HG   ARG  35          1HG       ARG  35   4.396 -12.604  -7.696
  683   2HG   ARG  35          2HG       ARG  35   5.347 -11.519  -8.726
  684   1HD   ARG  35          1HD       ARG  35   7.312 -13.085  -8.424
  685   2HD   ARG  35          2HD       ARG  35   6.259 -14.152  -7.469
  686    HE   ARG  35           HE       ARG  35   5.192 -13.498 -10.065
  687   1HH1  ARG  35          1HH1      ARG  35   7.457 -15.815  -8.420
  688   2HH1  ARG  35          2HH1      ARG  35   7.282 -16.994  -9.642
  689   1HH2  ARG  35          1HH2      ARG  35   5.048 -15.072 -11.655
  690   2HH2  ARG  35          2HH2      ARG  35   5.925 -16.565 -11.545
  691    H    THR  36           H        THR  36   4.743 -11.742  -3.959
  692    HA   THR  36           HA       THR  36   2.342 -13.142  -4.344
  693    HB   THR  36           HB       THR  36   3.610 -12.196  -1.727
  694    HG1  THR  36           1HG      THR  36   5.044 -13.449  -2.944
  695   1HG2  THR  36          1HG2      THR  36   1.641 -14.462  -2.253
  696   2HG2  THR  36          2HG2      THR  36   1.319 -12.985  -1.312
  697   3HG2  THR  36          3HG2      THR  36   2.500 -14.164  -0.725
  698    H    LEU  37           H        LEU  37   2.773  -9.981  -2.569
  699    HA   LEU  37           HA       LEU  37  -0.026  -9.666  -2.284
  700   1HB   LEU  37          1HB       LEU  37   0.425  -7.947  -1.015
  701   2HB   LEU  37          2HB       LEU  37   2.048  -8.531  -1.134
  702    HG   LEU  37           HG       LEU  37   2.036  -6.811  -3.287
  703   1HD1  LEU  37          1HD1      LEU  37   0.812  -4.730  -2.607
  704   2HD1  LEU  37          2HD1      LEU  37   0.215  -5.520  -1.152
  705   3HD1  LEU  37          3HD1      LEU  37  -0.351  -6.059  -2.719
  706   1HD2  LEU  37          1HD2      LEU  37   3.324  -5.350  -1.896
  707   2HD2  LEU  37          2HD2      LEU  37   3.626  -7.004  -1.331
  708   3HD2  LEU  37          3HD2      LEU  37   2.544  -5.956  -0.423
  709    H    GLN  38           H        GLN  38   2.058  -8.931  -5.056
  710    HA   GLN  38           HA       GLN  38   0.133  -7.387  -6.520
  711   1HB   GLN  38          1HB       GLN  38   2.394  -7.191  -7.126
  712   2HB   GLN  38          2HB       GLN  38   2.627  -8.913  -7.191
  713   1HG   GLN  38          1HG       GLN  38   0.921  -8.803  -9.235
  714   2HG   GLN  38          2HG       GLN  38   1.457  -7.123  -9.275
  715   1HE2  GLN  38          1HE2      GLN  38   4.018  -6.902  -9.154
  716   2HE2  GLN  38          2HE2      GLN  38   4.908  -8.156 -10.005
  717    H    GLN  39           H        GLN  39   0.685 -10.936  -6.019
  718    HA   GLN  39           HA       GLN  39  -1.207 -11.711  -8.026
  719   1HB   GLN  39          1HB       GLN  39  -0.491 -13.362  -5.607
  720   2HB   GLN  39          2HB       GLN  39  -1.212 -13.871  -7.122
  721   1HG   GLN  39          1HG       GLN  39   1.627 -13.150  -6.536
  722   2HG   GLN  39          2HG       GLN  39   0.986 -14.582  -7.296
  723   1HE2  GLN  39          1HE2      GLN  39   2.224 -11.441  -7.757
  724   2HE2  GLN  39          2HE2      GLN  39   2.206 -11.331  -9.508
  725    H    LEU  40           H        LEU  40  -1.405 -10.878  -4.538
  726    HA   LEU  40           HA       LEU  40  -4.253 -11.250  -4.307
  727   1HB   LEU  40          1HB       LEU  40  -2.743  -9.097  -2.866
  728   2HB   LEU  40          2HB       LEU  40  -4.231  -9.892  -2.421
  729    HG   LEU  40           HG       LEU  40  -1.472 -11.141  -2.413
  730   1HD1  LEU  40          1HD1      LEU  40  -3.319 -10.412  -0.124
  731   2HD1  LEU  40          2HD1      LEU  40  -1.880  -9.497  -0.613
  732   3HD1  LEU  40          3HD1      LEU  40  -1.706 -11.143   0.021
  733   1HD2  LEU  40          1HD2      LEU  40  -2.387 -13.098  -1.343
  734   2HD2  LEU  40          2HD2      LEU  40  -3.126 -12.884  -2.937
  735   3HD2  LEU  40          3HD2      LEU  40  -4.028 -12.449  -1.471
  736    H    PHE  41           H        PHE  41  -2.382  -8.498  -5.654
  737    HA   PHE  41           HA       PHE  41  -4.718  -6.856  -6.185
  738   1HB   PHE  41          1HB       PHE  41  -1.903  -6.846  -7.213
  739   2HB   PHE  41          2HB       PHE  41  -3.137  -6.056  -8.158
  740    HD1  PHE  41           1HD      PHE  41  -3.648  -3.812  -7.752
  741    HD2  PHE  41           2HD      PHE  41  -1.875  -6.154  -4.602
  742    HE1  PHE  41           1HE      PHE  41  -3.450  -1.787  -6.343
  743    HE2  PHE  41           2HE      PHE  41  -1.715  -4.126  -3.185
  744    HZ   PHE  41           HZ       PHE  41  -2.520  -1.951  -4.041
  745    H    LEU  42           H        LEU  42  -3.034  -9.287  -8.136
  746    HA   LEU  42           HA       LEU  42  -4.912  -9.205 -10.298
  747   1HB   LEU  42          1HB       LEU  42  -2.938 -11.268  -9.274
  748   2HB   LEU  42          2HB       LEU  42  -3.867 -11.532 -10.741
  749    HG   LEU  42           HG       LEU  42  -2.066  -9.095 -10.360
  750   1HD1  LEU  42          1HD1      LEU  42  -0.675 -11.094 -10.164
  751   2HD1  LEU  42          2HD1      LEU  42  -0.371 -10.285 -11.702
  752   3HD1  LEU  42          3HD1      LEU  42  -1.366 -11.760 -11.656
  753   1HD2  LEU  42          1HD2      LEU  42  -2.121  -8.993 -12.823
  754   2HD2  LEU  42          2HD2      LEU  42  -3.748  -8.859 -12.153
  755   3HD2  LEU  42          3HD2      LEU  42  -3.213 -10.395 -12.870
  756    H    SER  43           H        SER  43  -5.159 -10.727  -7.156
  757    HA   SER  43           HA       SER  43  -7.438 -12.339  -7.834
  758   1HB   SER  43          1HB       SER  43  -5.754 -12.835  -6.021
  759   2HB   SER  43          2HB       SER  43  -6.458 -11.519  -5.072
  760    HG   SER  43           HG       SER  43  -7.508 -13.257  -4.422
  761    H    THR  44           H        THR  44  -7.299  -9.646  -5.397
  762    HA   THR  44           HA       THR  44  -9.770  -8.574  -6.449
  763    HB   THR  44           HB       THR  44 -11.132  -8.872  -4.611
  764    HG1  THR  44           1HG      THR  44  -8.834  -9.642  -3.032
  765   1HG2  THR  44          1HG2      THR  44 -11.197 -11.197  -3.985
  766   2HG2  THR  44          2HG2      THR  44  -9.519 -11.435  -4.506
  767   3HG2  THR  44          3HG2      THR  44 -10.780 -11.058  -5.708
  768    H    LEU  45           H        LEU  45  -6.840  -7.894  -5.449
  769    HA   LEU  45           HA       LEU  45  -7.465  -5.567  -3.748
  770   1HB   LEU  45          1HB       LEU  45  -5.238  -7.383  -4.045
  771   2HB   LEU  45          2HB       LEU  45  -4.649  -5.779  -4.236
  772    HG   LEU  45           HG       LEU  45  -5.948  -5.288  -2.084
  773   1HD1  LEU  45          1HD1      LEU  45  -7.319  -7.353  -2.035
  774   2HD1  LEU  45          2HD1      LEU  45  -6.237  -7.351  -0.617
  775   3HD1  LEU  45          3HD1      LEU  45  -5.847  -8.332  -2.025
  776   1HD2  LEU  45          1HD2      LEU  45  -4.124  -6.311  -0.662
  777   2HD2  LEU  45          2HD2      LEU  45  -3.555  -5.326  -2.023
  778   3HD2  LEU  45          3HD2      LEU  45  -3.511  -7.102  -2.122
  779    H    SER  46           H        SER  46  -6.953  -3.477  -4.083
  780    HA   SER  46           HA       SER  46  -5.883  -2.422  -6.572
  781   1HB   SER  46          1HB       SER  46  -7.942  -0.823  -6.437
  782   2HB   SER  46          2HB       SER  46  -8.130  -2.412  -7.181
  783    HG   SER  46           HG       SER  46  -9.672  -1.418  -5.286
  784    H    PHE  47           H        PHE  47  -5.983   0.263  -6.038
  785    HA   PHE  47           HA       PHE  47  -5.325   0.635  -3.199
  786   1HB   PHE  47          1HB       PHE  47  -3.179   0.207  -4.548
  787   2HB   PHE  47          2HB       PHE  47  -3.516   1.707  -5.377
  788    HD1  PHE  47           1HD      PHE  47  -2.760   0.189  -2.027
  789    HD2  PHE  47           2HD      PHE  47  -3.134   3.827  -4.279
  790    HE1  PHE  47           1HE      PHE  47  -1.673   1.482  -0.179
  791    HE2  PHE  47           2HE      PHE  47  -1.977   5.079  -2.467
  792    HZ   PHE  47           HZ       PHE  47  -1.274   3.893  -0.406
  793    H    VAL  48           H        VAL  48  -5.301   2.841  -2.582
  794    HA   VAL  48           HA       VAL  48  -6.881   4.623  -4.197
  795    HB   VAL  48           HB       VAL  48  -7.659   3.148  -1.706
  796   1HG1  VAL  48          1HG1      VAL  48  -7.888   5.609  -1.102
  797   2HG1  VAL  48          2HG1      VAL  48  -9.133   5.680  -2.393
  798   3HG1  VAL  48          3HG1      VAL  48  -9.329   4.594  -1.025
  799   1HG2  VAL  48          1HG2      VAL  48  -8.576   2.464  -3.903
  800   2HG2  VAL  48          2HG2      VAL  48  -9.859   3.168  -2.920
  801   3HG2  VAL  48          3HG2      VAL  48  -9.108   4.107  -4.219
  802    H    CYS  49           H        CYS  49  -5.628   6.377  -4.329
  803    HA   CYS  49           HA       CYS  49  -3.286   6.754  -2.769
  804   1HB   CYS  49          1HB       CYS  49  -3.329   9.067  -3.882
  805   2HB   CYS  49          2HB       CYS  49  -3.229   7.666  -4.914
  806    HA   PRO  50           HA       PRO  50  -4.528   8.897   0.829
  807   1HB   PRO  50          1HB       PRO  50  -2.677  10.982   1.073
  808   2HB   PRO  50          2HB       PRO  50  -2.454   9.283   1.583
  809   1HG   PRO  50          1HG       PRO  50  -1.598  10.588  -1.011
  810   2HG   PRO  50          2HG       PRO  50  -0.660   9.479   0.044
  811   1HD   PRO  50          1HD       PRO  50  -1.856   8.540  -2.160
  812   2HD   PRO  50          2HD       PRO  50  -1.938   7.601  -0.644
  813    H    TRP  51           H        TRP  51  -4.337  10.732  -2.144
  814    HA   TRP  51           HA       TRP  51  -5.747  13.089  -1.409
  815   1HB   TRP  51          1HB       TRP  51  -4.615  13.041  -3.505
  816   2HB   TRP  51          2HB       TRP  51  -5.414  11.552  -3.996
  817    HD1  TRP  51           HD       TRP  51  -7.478  14.444  -2.588
  818    HE1  TRP  51           1HE      TRP  51  -9.137  15.204  -4.297
  819    HE3  TRP  51           3HE      TRP  51  -5.606  11.881  -6.615
  820    HZ2  TRP  51           2HZ      TRP  51  -9.579  14.829  -7.191
  821    HZ3  TRP  51           3HZ      TRP  51  -6.649  12.142  -8.848
  822    HH2  TRP  51           HH       TRP  51  -8.644  13.589  -9.142
  823    H    CYS  52           H        CYS  52  -7.127  10.141  -3.115
  824    HA   CYS  52           HA       CYS  52  -9.790  10.902  -2.373
  825   1HB   CYS  52          1HB       CYS  52 -10.323   8.456  -2.933
  826   2HB   CYS  52          2HB       CYS  52  -9.771   9.516  -4.162
  827    H    ALA  53           H        ALA  53  -7.279   8.999  -0.702
  828    HA   ALA  53           HA       ALA  53  -9.081   7.789   1.010
  829   1HB   ALA  53          1HB       ALA  53  -6.574   7.343   1.005
  830   2HB   ALA  53          2HB       ALA  53  -6.357   8.876   1.894
  831   3HB   ALA  53          3HB       ALA  53  -7.249   7.558   2.641
  832    H    THR  54           H        THR  54  -7.638  11.013   1.099
  833    HA   THR  54           HA       THR  54  -8.896  11.935   3.531
  834    HB   THR  54           HB       THR  54  -7.569  13.503   1.270
  835    HG1  THR  54           1HG      THR  54  -6.068  12.065   1.912
  836   1HG2  THR  54          1HG2      THR  54  -6.996  15.109   3.056
  837   2HG2  THR  54          2HG2      THR  54  -7.895  14.134   4.237
  838   3HG2  THR  54          3HG2      THR  54  -8.753  14.942   2.906
  839    H    ASN  55           H        ASN  55  -9.505  12.448   0.010
  840    HA   ASN  55           HA       ASN  55 -11.702  14.319   0.491
  841   1HB   ASN  55          1HB       ASN  55 -10.608  12.983  -2.039
  842   2HB   ASN  55          2HB       ASN  55 -12.007  14.035  -2.037
  843   1HD2  ASN  55          1HD2      ASN  55  -9.339  14.829   0.145
  844   2HD2  ASN  55          2HD2      ASN  55  -8.802  16.206  -0.813
  845    H    GLN  56           H        GLN  56 -11.480  11.095  -0.943
  846    HA   GLN  56           HA       GLN  56 -13.144   9.371  -0.607
  847   1HB   GLN  56          2HB       GLN  56 -15.023  10.816  -0.100
  848   2HB   GLN  56          3HB       GLN  56 -14.926  11.548  -1.715
  849   1HG   GLN  56          2HG       GLN  56 -16.738   9.817  -1.470
  850   2HG   GLN  56          3HG       GLN  56 -15.591   9.441  -2.750
  851   1HE2  GLN  56          1HE2      GLN  56 -14.227   7.632  -2.488
  852   2HE2  GLN  56          2HE2      GLN  56 -14.691   6.284  -1.358
  Start of MODEL    8
    1   1H    GLY   1          1H        GLY   1 -19.331   8.976   5.914
    2   1HA   GLY   1          1HA       GLY   1 -21.298  10.083   6.563
    3   2HA   GLY   1          2HA       GLY   1 -21.137  11.167   5.155
    4    H    SER   2           H        SER   2 -22.034  10.521   3.235
    5    HA   SER   2           HA       SER   2 -22.326   7.669   2.589
    6   1HB   SER   2          1HB       SER   2 -23.727   9.431   1.455
    7   2HB   SER   2          2HB       SER   2 -22.238  10.101   0.751
    8    HG   SER   2           HG       SER   2 -23.397   8.537  -0.578
    9    H    HIS   3           H        HIS   3 -20.868   7.348   0.430
   10    HA   HIS   3           HA       HIS   3 -18.844   6.387  -0.027
   11   1HB   HIS   3          1HB       HIS   3 -18.119   9.317   0.249
   12   2HB   HIS   3          2HB       HIS   3 -17.005   8.109  -0.376
   13    HD1  HIS   3           1HD      HIS   3 -19.174  10.539  -1.808
   14    HD2  HIS   3           2HD      HIS   3 -18.314   6.467  -2.466
   15    HE1  HIS   3           1HE      HIS   3 -19.770  10.043  -4.248
   16    H    MET   4           H        MET   4 -19.363   5.558   2.429
   17    HA   MET   4           HA       MET   4 -16.801   5.505   3.796
   18   1HB   MET   4          1HB       MET   4 -17.923   7.569   4.638
   19   2HB   MET   4          2HB       MET   4 -19.348   6.619   5.078
   20   1HG   MET   4          1HG       MET   4 -18.052   5.419   6.769
   21   2HG   MET   4          2HG       MET   4 -16.574   6.260   6.265
   22   1HE   MET   4          1HE       MET   4 -16.187   6.877   8.838
   23   2HE   MET   4          2HE       MET   4 -17.387   7.727   9.838
   24   3HE   MET   4          3HE       MET   4 -17.715   6.073   9.273
   25    H    ALA   5           H        ALA   5 -16.660   3.669   5.066
   26    HA   ALA   5           HA       ALA   5 -17.037   1.730   6.030
   27   1HB   ALA   5          1HB       ALA   5 -19.959   2.565   6.206
   28   2HB   ALA   5          2HB       ALA   5 -19.130   1.395   7.246
   29   3HB   ALA   5          3HB       ALA   5 -18.688   3.121   7.326
   30    H    GLU   6           H        GLU   6 -17.274   1.814   3.156
   31    HA   GLU   6           HA       GLU   6 -19.193  -0.340   2.558
   32   1HB   GLU   6          1HB       GLU   6 -17.194   0.832   0.601
   33   2HB   GLU   6          2HB       GLU   6 -18.758   0.107   0.277
   34   1HG   GLU   6          1HG       GLU   6 -19.520   2.213   0.130
   35   2HG   GLU   6          2HG       GLU   6 -19.569   2.201   1.856
   36    HA   PRO   7           HA       PRO   7 -16.025  -3.579   2.524
   37   1HB   PRO   7          1HB       PRO   7 -16.806  -5.238   0.511
   38   2HB   PRO   7          2HB       PRO   7 -17.711  -5.103   2.046
   39   1HG   PRO   7          1HG       PRO   7 -18.275  -3.675  -0.573
   40   2HG   PRO   7          2HG       PRO   7 -19.427  -4.602   0.447
   41   1HD   PRO   7          1HD       PRO   7 -19.230  -1.907   0.603
   42   2HD   PRO   7          2HD       PRO   7 -19.509  -2.880   2.070
   43    H    GLN   8           H        GLN   8 -14.368  -4.555   0.931
   44    HA   GLN   8           HA       GLN   8 -12.572  -4.330   0.025
   45   1HB   GLN   8          1HB       GLN   8 -14.338  -3.126  -2.032
   46   2HB   GLN   8          2HB       GLN   8 -12.568  -3.070  -2.219
   47   1HG   GLN   8          1HG       GLN   8 -13.407  -4.994  -3.405
   48   2HG   GLN   8          2HG       GLN   8 -12.444  -5.524  -2.034
   49   1HE2  GLN   8          1HE2      GLN   8 -13.433  -7.639  -1.551
   50   2HE2  GLN   8          2HE2      GLN   8 -15.158  -7.701  -1.261
   51    H    ARG   9           H        ARG   9 -14.019  -1.009  -0.123
   52    HA   ARG   9           HA       ARG   9 -11.517   0.336   0.016
   53   1HB   ARG   9          1HB       ARG   9 -13.676   1.313  -0.770
   54   2HB   ARG   9          2HB       ARG   9 -14.233   1.364   0.895
   55   1HG   ARG   9          1HG       ARG   9 -11.628   2.567   0.790
   56   2HG   ARG   9          2HG       ARG   9 -12.583   3.241  -0.518
   57   1HD   ARG   9          1HD       ARG   9 -13.584   3.068   2.347
   58   2HD   ARG   9          2HD       ARG   9 -12.653   4.445   1.752
   59    HE   ARG   9           HE       ARG   9 -15.453   3.806   1.240
   60   1HH1  ARG   9          1HH1      ARG   9 -12.738   5.826   0.121
   61   2HH1  ARG   9          2HH1      ARG   9 -13.753   6.752  -0.955
   62   1HH2  ARG   9          1HH2      ARG   9 -16.679   4.949  -0.307
   63   2HH2  ARG   9          2HH2      ARG   9 -15.901   6.133  -1.370
   64    H    HIS  10           H        HIS  10 -10.265  -0.713   1.627
   65    HA   HIS  10           HA       HIS  10 -11.149  -0.313   4.448
   66   1HB   HIS  10          1HB       HIS  10  -9.477  -2.509   3.178
   67   2HB   HIS  10          2HB       HIS  10  -9.836  -2.346   4.899
   68    HD1  HIS  10           1HD      HIS  10 -10.759  -4.814   2.870
   69    HD2  HIS  10           2HD      HIS  10 -13.112  -1.602   4.076
   70    HE1  HIS  10           1HE      HIS  10 -13.109  -5.699   3.011
   71    H    LYS  11           H        LYS  11  -9.202  -0.378   5.992
   72    HA   LYS  11           HA       LYS  11  -7.139   1.491   4.965
   73   1HB   LYS  11          1HB       LYS  11  -9.149   2.036   7.180
   74   2HB   LYS  11          2HB       LYS  11  -7.649   2.916   6.943
   75   1HG   LYS  11          1HG       LYS  11  -8.842   4.323   5.645
   76   2HG   LYS  11          2HG       LYS  11  -8.624   3.107   4.423
   77   1HD   LYS  11          1HD       LYS  11 -10.931   3.721   4.390
   78   2HD   LYS  11          2HD       LYS  11 -10.862   2.113   5.094
   79   1HE   LYS  11          1HE       LYS  11 -12.435   3.460   6.340
   80   2HE   LYS  11          2HE       LYS  11 -11.047   3.099   7.375
   81   1HZ   LYS  11          1HZ       LYS  11 -11.765   5.425   7.503
   82   2HZ   LYS  11          2HZ       LYS  11 -11.369   5.653   5.916
   83   3HZ   LYS  11          3HZ       LYS  11 -10.216   5.309   7.035
   84    H    ILE  12           H        ILE  12  -5.412   0.257   5.306
   85    HA   ILE  12           HA       ILE  12  -5.028  -1.104   7.917
   86    HB   ILE  12           HB       ILE  12  -3.221  -0.966   5.472
   87   1HG1  ILE  12          1HG1      ILE  12  -4.935  -3.278   6.435
   88   2HG1  ILE  12          2HG1      ILE  12  -5.320  -2.221   5.071
   89   1HG2  ILE  12          1HG2      ILE  12  -3.028  -2.606   8.052
   90   2HG2  ILE  12          2HG2      ILE  12  -1.903  -2.710   6.677
   91   3HG2  ILE  12          3HG2      ILE  12  -1.985  -1.240   7.629
   92   1HD1  ILE  12          1HD1      ILE  12  -3.143  -2.866   3.998
   93   2HD1  ILE  12          2HD1      ILE  12  -2.989  -4.134   5.246
   94   3HD1  ILE  12          3HD1      ILE  12  -4.359  -4.146   4.121
   95    H    LEU  13           H        LEU  13  -4.835   0.595   9.367
   96    HA   LEU  13           HA       LEU  13  -3.186   2.887   8.892
   97   1HB   LEU  13          1HB       LEU  13  -5.009   2.823  10.559
   98   2HB   LEU  13          2HB       LEU  13  -4.040   1.749  11.576
   99    HG   LEU  13           HG       LEU  13  -2.786   4.334  10.574
  100   1HD1  LEU  13          1HD1      LEU  13  -4.961   5.047  11.267
  101   2HD1  LEU  13          2HD1      LEU  13  -3.761   5.546  12.486
  102   3HD1  LEU  13          3HD1      LEU  13  -4.823   4.152  12.804
  103   1HD2  LEU  13          1HD2      LEU  13  -2.584   2.853  13.239
  104   2HD2  LEU  13          2HD2      LEU  13  -1.709   4.339  12.806
  105   3HD2  LEU  13          3HD2      LEU  13  -1.366   2.844  11.950
  106    H    CYS  14           H        CYS  14  -1.136   2.748   8.536
  107    HA   CYS  14           HA       CYS  14   0.542   0.983  10.237
  108   1HB   CYS  14          1HB       CYS  14   0.272   0.368   7.678
  109   2HB   CYS  14          2HB       CYS  14   1.322   1.768   7.413
  110    HG   CYS  14           HG       CYS  14   1.810  -0.971   9.208
  111    H    VAL  15           H        VAL  15   2.984   2.049   9.519
  112    HA   VAL  15           HA       VAL  15   2.756   4.963   9.708
  113    HB   VAL  15           HB       VAL  15   4.872   5.018  11.021
  114   1HG1  VAL  15          1HG1      VAL  15   3.817   4.676  13.192
  115   2HG1  VAL  15          2HG1      VAL  15   2.694   5.454  12.069
  116   3HG1  VAL  15          3HG1      VAL  15   2.512   3.724  12.447
  117   1HG2  VAL  15          1HG2      VAL  15   4.312   2.073  11.611
  118   2HG2  VAL  15          2HG2      VAL  15   5.659   2.692  10.625
  119   3HG2  VAL  15          3HG2      VAL  15   5.566   3.089  12.343
  120    H    CYS  16           H        CYS  16   4.471   6.033   8.608
  121    HA   CYS  16           HA       CYS  16   5.466   4.661   6.280
  122   1HB   CYS  16          1HB       CYS  16   5.164   7.201   6.445
  123   2HB   CYS  16          2HB       CYS  16   6.601   7.218   7.488
  124    H    CYS  17           H        CYS  17   7.140   3.343   6.194
  125    HA   CYS  17           HA       CYS  17   8.583   2.252   8.273
  126   1HB   CYS  17          1HB       CYS  17   8.433   1.452   5.860
  127   2HB   CYS  17          2HB       CYS  17   9.681   2.657   5.476
  128    HG   CYS  17           HG       CYS  17  11.135   0.889   5.416
  129    H    LYS  18           H        LYS  18   9.536   5.188   6.452
  130    HA   LYS  18           HA       LYS  18  11.971   5.425   8.134
  131   1HB   LYS  18          1HB       LYS  18  12.879   6.704   6.246
  132   2HB   LYS  18          2HB       LYS  18  12.528   5.019   5.870
  133   1HG   LYS  18          1HG       LYS  18  10.499   5.685   4.631
  134   2HG   LYS  18          2HG       LYS  18  10.687   7.354   5.142
  135   1HD   LYS  18          1HD       LYS  18  11.458   7.044   2.837
  136   2HD   LYS  18          2HD       LYS  18  12.774   7.570   3.877
  137   1HE   LYS  18          1HE       LYS  18  13.470   5.823   2.256
  138   2HE   LYS  18          2HE       LYS  18  13.736   5.328   3.932
  139   1HZ   LYS  18          1HZ       LYS  18  11.891   3.852   3.810
  140   2HZ   LYS  18          2HZ       LYS  18  12.630   3.582   2.431
  141   3HZ   LYS  18          3HZ       LYS  18  11.326   4.541   2.427
  142    H    CYS  19           H        CYS  19   8.900   7.009   7.660
  143    HA   CYS  19           HA       CYS  19   9.982   9.501   8.820
  144   1HB   CYS  19          1HB       CYS  19   7.210   9.163   8.056
  145   2HB   CYS  19          2HB       CYS  19   8.178  10.586   8.147
  146    H    ASP  20           H        ASP  20   8.391   6.527   9.693
  147    HA   ASP  20           HA       ASP  20   7.101   5.803  11.290
  148   1HB   ASP  20          1HB       ASP  20   9.187   6.272  12.544
  149   2HB   ASP  20          2HB       ASP  20   8.496   7.811  13.058
  150    H    GLY  21           H        GLY  21   5.998   7.839   9.635
  151   1HA   GLY  21          1HA       GLY  21   4.216   9.423  11.446
  152   2HA   GLY  21          2HA       GLY  21   4.431   9.734   9.728
  153    H    ARG  22           H        ARG  22   2.058   9.250  11.288
  154    HA   ARG  22           HA       ARG  22   0.940   6.629  10.994
  155   1HB   ARG  22          1HB       ARG  22   0.235   8.241  12.669
  156   2HB   ARG  22          2HB       ARG  22  -0.297   9.389  11.451
  157   1HG   ARG  22          1HG       ARG  22  -1.574   6.640  11.585
  158   2HG   ARG  22          2HG       ARG  22  -1.970   7.868  12.787
  159   1HD   ARG  22          1HD       ARG  22  -2.531   9.446  10.826
  160   2HD   ARG  22          2HD       ARG  22  -2.485   7.998   9.805
  161    HE   ARG  22           HE       ARG  22  -4.099   7.632  12.168
  162   1HH1  ARG  22          1HH1      ARG  22  -4.371   9.200   8.936
  163   2HH1  ARG  22          2HH1      ARG  22  -5.999   8.509   8.742
  164   1HH2  ARG  22          1HH2      ARG  22  -6.376   7.042  11.783
  165   2HH2  ARG  22          2HH2      ARG  22  -6.992   7.447  10.175
  166    H    ILE  23           H        ILE  23   0.409   5.637   9.077
  167    HA   ILE  23           HA       ILE  23  -0.802   7.386   7.013
  168    HB   ILE  23           HB       ILE  23   0.616   4.821   6.270
  169   1HG1  ILE  23          1HG1      ILE  23   1.881   7.575   5.981
  170   2HG1  ILE  23          2HG1      ILE  23   2.382   6.328   7.130
  171   1HG2  ILE  23          1HG2      ILE  23   0.321   5.856   3.996
  172   2HG2  ILE  23          2HG2      ILE  23  -1.218   5.825   4.836
  173   3HG2  ILE  23          3HG2      ILE  23  -0.297   7.336   4.750
  174   1HD1  ILE  23          1HD1      ILE  23   2.445   5.997   4.101
  175   2HD1  ILE  23          2HD1      ILE  23   3.821   6.264   5.140
  176   3HD1  ILE  23          3HD1      ILE  23   2.897   4.762   5.299
  177    H    GLU  24           H        GLU  24  -2.891   6.930   6.808
  178    HA   GLU  24           HA       GLU  24  -4.025   4.350   7.665
  179   1HB   GLU  24          1HB       GLU  24  -5.000   6.365   8.396
  180   2HB   GLU  24          2HB       GLU  24  -5.210   6.993   6.750
  181   1HG   GLU  24          1HG       GLU  24  -6.792   5.125   6.312
  182   2HG   GLU  24          2HG       GLU  24  -6.507   4.519   7.955
  183    H    LEU  25           H        LEU  25  -3.073   2.939   6.143
  184    HA   LEU  25           HA       LEU  25  -2.802   3.632   3.398
  185   1HB   LEU  25          1HB       LEU  25  -2.720   0.851   4.564
  186   2HB   LEU  25          2HB       LEU  25  -2.062   1.368   3.034
  187    HG   LEU  25           HG       LEU  25  -1.073   2.324   5.770
  188   1HD1  LEU  25          1HD1      LEU  25   0.032   0.250   3.831
  189   2HD1  LEU  25          2HD1      LEU  25  -0.668  -0.067   5.438
  190   3HD1  LEU  25          3HD1      LEU  25   0.854   0.831   5.296
  191   1HD2  LEU  25          1HD2      LEU  25  -0.678   3.874   3.812
  192   2HD2  LEU  25          2HD2      LEU  25   0.108   2.567   2.948
  193   3HD2  LEU  25          3HD2      LEU  25   0.832   3.204   4.450
  194    H    THR  26           H        THR  26  -4.645   4.072   2.351
  195    HA   THR  26           HA       THR  26  -7.020   2.438   2.767
  196    HB   THR  26           HB       THR  26  -6.665   4.779   0.902
  197    HG1  THR  26           1HG      THR  26  -6.164   5.032   3.329
  198   1HG2  THR  26          1HG2      THR  26  -9.164   3.948   2.444
  199   2HG2  THR  26          2HG2      THR  26  -8.808   3.206   0.896
  200   3HG2  THR  26          3HG2      THR  26  -9.037   4.971   1.005
  201    H    VAL  27           H        VAL  27  -7.030   0.485   1.826
  202    HA   VAL  27           HA       VAL  27  -6.167   0.247  -1.008
  203    HB   VAL  27           HB       VAL  27  -5.037  -1.901  -0.658
  204   1HG1  VAL  27          1HG1      VAL  27  -4.139  -0.217   1.703
  205   2HG1  VAL  27          2HG1      VAL  27  -3.195  -1.341   0.708
  206   3HG1  VAL  27          3HG1      VAL  27  -3.787   0.181   0.014
  207   1HG2  VAL  27          1HG2      VAL  27  -6.027  -1.793   2.237
  208   2HG2  VAL  27          2HG2      VAL  27  -6.515  -2.964   0.991
  209   3HG2  VAL  27          3HG2      VAL  27  -4.856  -2.959   1.588
  210    H    GLU  28           H        GLU  28  -7.890  -0.333  -2.197
  211    HA   GLU  28           HA       GLU  28 -10.361  -1.260  -0.864
  212   1HB   GLU  28          1HB       GLU  28 -10.011  -0.897  -3.830
  213   2HB   GLU  28          2HB       GLU  28 -11.492  -0.936  -2.864
  214   1HG   GLU  28          1HG       GLU  28 -10.445   1.191  -1.685
  215   2HG   GLU  28          2HG       GLU  28  -9.408   1.226  -3.113
  216    H    SER  29           H        SER  29  -9.954  -3.314  -0.064
  217    HA   SER  29           HA       SER  29 -10.005  -5.344  -2.085
  218   1HB   SER  29          1HB       SER  29  -7.442  -4.947  -1.504
  219   2HB   SER  29          2HB       SER  29  -7.831  -5.898  -0.062
  220    HG   SER  29           HG       SER  29  -7.318  -7.445  -1.623
  221    H    SER  30           H        SER  30 -10.500  -7.426  -1.169
  222    HA   SER  30           HA       SER  30 -12.510  -7.391   0.792
  223   1HB   SER  30          1HB       SER  30 -10.811  -9.785  -0.046
  224   2HB   SER  30          2HB       SER  30 -12.511  -9.781   0.458
  225    HG   SER  30           HG       SER  30 -11.322  -8.998  -1.987
  226    H    ALA  31           H        ALA  31 -12.543  -8.209   2.999
  227    HA   ALA  31           HA       ALA  31 -10.509  -7.158   4.556
  228   1HB   ALA  31          1HB       ALA  31 -12.498  -9.346   5.317
  229   2HB   ALA  31          2HB       ALA  31 -11.590  -8.320   6.447
  230   3HB   ALA  31          3HB       ALA  31 -12.793  -7.589   5.367
  231    H    GLU  32           H        GLU  32 -10.892 -10.631   3.638
  232    HA   GLU  32           HA       GLU  32  -8.618 -11.366   5.233
  233   1HB   GLU  32          1HB       GLU  32 -10.319 -12.819   3.228
  234   2HB   GLU  32          2HB       GLU  32  -9.003 -13.580   4.138
  235   1HG   GLU  32          1HG       GLU  32 -10.719 -12.110   5.998
  236   2HG   GLU  32          2HG       GLU  32 -11.716 -13.159   4.996
  237    H    ASP  33           H        ASP  33  -9.027 -10.263   1.975
  238    HA   ASP  33           HA       ASP  33  -6.549 -11.239   0.881
  239   1HB   ASP  33          1HB       ASP  33  -8.533 -10.619  -0.460
  240   2HB   ASP  33          2HB       ASP  33  -8.395  -8.955   0.084
  241    H    LEU  34           H        LEU  34  -7.807  -8.348   2.440
  242    HA   LEU  34           HA       LEU  34  -5.408  -6.786   2.667
  243   1HB   LEU  34          1HB       LEU  34  -7.221  -5.512   2.991
  244   2HB   LEU  34          2HB       LEU  34  -8.141  -6.716   3.846
  245    HG   LEU  34           HG       LEU  34  -5.804  -5.410   5.290
  246   1HD1  LEU  34          1HD1      LEU  34  -7.144  -3.576   4.263
  247   2HD1  LEU  34          2HD1      LEU  34  -7.355  -3.623   6.023
  248   3HD1  LEU  34          3HD1      LEU  34  -8.617  -4.287   4.963
  249   1HD2  LEU  34          1HD2      LEU  34  -8.525  -6.399   6.254
  250   2HD2  LEU  34          2HD2      LEU  34  -7.258  -5.665   7.259
  251   3HD2  LEU  34          3HD2      LEU  34  -6.983  -7.226   6.503
  252    H    ARG  35           H        ARG  35  -6.782  -9.142   4.550
  253    HA   ARG  35           HA       ARG  35  -5.066  -9.110   6.880
  254   1HB   ARG  35          1HB       ARG  35  -7.373 -10.154   6.777
  255   2HB   ARG  35          2HB       ARG  35  -6.633 -11.541   5.967
  256   1HG   ARG  35          1HG       ARG  35  -5.168 -11.871   7.962
  257   2HG   ARG  35          2HG       ARG  35  -6.012 -10.527   8.763
  258   1HD   ARG  35          1HD       ARG  35  -8.178 -11.769   8.418
  259   2HD   ARG  35          2HD       ARG  35  -7.252 -13.109   7.717
  260    HE   ARG  35           HE       ARG  35  -6.272 -12.386  10.307
  261   1HH1  ARG  35          1HH1      ARG  35  -8.925 -14.198   8.690
  262   2HH1  ARG  35          2HH1      ARG  35  -9.219 -15.221  10.055
  263   1HH2  ARG  35          1HH2      ARG  35  -6.667 -13.785  12.095
  264   2HH2  ARG  35          2HH2      ARG  35  -7.910 -14.984  12.012
  265    H    THR  36           H        THR  36  -5.205 -11.223   4.007
  266    HA   THR  36           HA       THR  36  -2.842 -12.726   4.543
  267    HB   THR  36           HB       THR  36  -3.862 -11.847   1.806
  268    HG1  THR  36           1HG      THR  36  -5.546 -12.840   2.990
  269   1HG2  THR  36          1HG2      THR  36  -2.251 -14.273   2.740
  270   2HG2  THR  36          2HG2      THR  36  -1.640 -12.937   1.738
  271   3HG2  THR  36          3HG2      THR  36  -2.882 -14.033   1.101
  272    H    LEU  37           H        LEU  37  -3.293  -9.615   2.831
  273    HA   LEU  37           HA       LEU  37  -0.573  -8.906   2.526
  274   1HB   LEU  37          1HB       LEU  37  -1.865  -7.647   1.213
  275   2HB   LEU  37          2HB       LEU  37  -3.252  -7.751   2.265
  276    HG   LEU  37           HG       LEU  37  -2.395  -5.956   3.670
  277   1HD1  LEU  37          1HD1      LEU  37   0.090  -5.929   3.080
  278   2HD1  LEU  37          2HD1      LEU  37  -0.605  -4.440   2.459
  279   3HD1  LEU  37          3HD1      LEU  37  -0.301  -5.777   1.372
  280   1HD2  LEU  37          1HD2      LEU  37  -2.895  -4.188   1.956
  281   2HD2  LEU  37          2HD2      LEU  37  -4.037  -5.528   1.894
  282   3HD2  LEU  37          3HD2      LEU  37  -2.739  -5.418   0.695
  283    H    GLN  38           H        GLN  38  -2.710  -8.462   5.391
  284    HA   GLN  38           HA       GLN  38  -0.827  -6.978   6.930
  285   1HB   GLN  38          1HB       GLN  38  -3.130  -7.028   7.515
  286   2HB   GLN  38          2HB       GLN  38  -3.121  -8.769   7.649
  287   1HG   GLN  38          1HG       GLN  38  -1.538  -8.542   9.632
  288   2HG   GLN  38          2HG       GLN  38  -1.963  -6.817   9.612
  289   1HE2  GLN  38          1HE2      GLN  38  -4.361  -6.315   9.676
  290   2HE2  GLN  38          2HE2      GLN  38  -5.478  -7.488  10.337
  291    H    GLN  39           H        GLN  39  -1.186 -10.509   6.273
  292    HA   GLN  39           HA       GLN  39   0.853 -11.226   8.157
  293   1HB   GLN  39          1HB       GLN  39   0.095 -12.920   5.803
  294   2HB   GLN  39          2HB       GLN  39   0.831 -13.375   7.330
  295   1HG   GLN  39          1HG       GLN  39  -2.014 -12.691   6.727
  296   2HG   GLN  39          2HG       GLN  39  -1.369 -14.094   7.533
  297   1HE2  GLN  39          1HE2      GLN  39  -2.869 -11.113   7.950
  298   2HE2  GLN  39          2HE2      GLN  39  -2.822 -10.960   9.700
  299    H    LEU  40           H        LEU  40   0.821 -10.207   4.724
  300    HA   LEU  40           HA       LEU  40   3.619 -10.598   4.267
  301   1HB   LEU  40          1HB       LEU  40   1.848  -8.524   2.964
  302   2HB   LEU  40          2HB       LEU  40   3.434  -9.019   2.449
  303    HG   LEU  40           HG       LEU  40   1.025 -10.874   2.562
  304   1HD1  LEU  40          1HD1      LEU  40   0.779  -9.121   0.850
  305   2HD1  LEU  40          2HD1      LEU  40   1.021 -10.714   0.120
  306   3HD1  LEU  40          3HD1      LEU  40   2.362  -9.546   0.194
  307   1HD2  LEU  40          1HD2      LEU  40   2.382 -12.431   1.244
  308   2HD2  LEU  40          2HD2      LEU  40   3.153 -12.126   2.795
  309   3HD2  LEU  40          3HD2      LEU  40   3.773 -11.328   1.335
  310    H    PHE  41           H        PHE  41   1.876  -7.945   5.906
  311    HA   PHE  41           HA       PHE  41   4.262  -6.294   6.342
  312   1HB   PHE  41          1HB       PHE  41   1.639  -6.474   7.849
  313   2HB   PHE  41          2HB       PHE  41   2.991  -5.549   8.441
  314    HD1  PHE  41           1HD      PHE  41   3.681  -3.454   7.446
  315    HD2  PHE  41           2HD      PHE  41   0.401  -5.715   5.811
  316    HE1  PHE  41           1HE      PHE  41   2.953  -1.478   6.119
  317    HE2  PHE  41           2HE      PHE  41  -0.348  -3.731   4.552
  318    HZ   PHE  41           HZ       PHE  41   0.984  -1.650   4.628
  319    H    LEU  42           H        LEU  42   2.695  -8.851   8.278
  320    HA   LEU  42           HA       LEU  42   4.701  -8.878  10.312
  321   1HB   LEU  42          1HB       LEU  42   2.657 -10.891   9.337
  322   2HB   LEU  42          2HB       LEU  42   3.701 -11.242  10.704
  323    HG   LEU  42           HG       LEU  42   1.926  -8.761  10.620
  324   1HD1  LEU  42          1HD1      LEU  42   0.467 -10.700  10.408
  325   2HD1  LEU  42          2HD1      LEU  42   0.324 -10.018  12.029
  326   3HD1  LEU  42          3HD1      LEU  42   1.269 -11.504  11.772
  327   1HD2  LEU  42          1HD2      LEU  42   2.189  -8.842  13.082
  328   2HD2  LEU  42          2HD2      LEU  42   3.759  -8.693  12.288
  329   3HD2  LEU  42          3HD2      LEU  42   3.242 -10.265  12.931
  330    H    SER  43           H        SER  43   4.644 -10.424   7.176
  331    HA   SER  43           HA       SER  43   7.016 -12.005   7.416
  332   1HB   SER  43          1HB       SER  43   5.545 -12.541   5.670
  333   2HB   SER  43          2HB       SER  43   5.313 -10.872   5.234
  334    HG   SER  43           HG       SER  43   6.548 -11.193   3.689
  335    H    THR  44           H        THR  44   6.828  -9.121   5.292
  336    HA   THR  44           HA       THR  44   9.147  -8.016   6.623
  337    HB   THR  44           HB       THR  44  10.506  -7.745   4.613
  338    HG1  THR  44           1HG      THR  44   8.639  -8.036   3.023
  339   1HG2  THR  44          1HG2      THR  44  10.709  -9.747   6.078
  340   2HG2  THR  44          2HG2      THR  44  11.260 -10.016   4.414
  341   3HG2  THR  44          3HG2      THR  44   9.675 -10.640   4.931
  342    H    LEU  45           H        LEU  45   6.328  -7.435   5.006
  343    HA   LEU  45           HA       LEU  45   7.102  -5.084   3.641
  344   1HB   LEU  45          1HB       LEU  45   5.109  -6.617   3.193
  345   2HB   LEU  45          2HB       LEU  45   4.212  -5.706   4.376
  346    HG   LEU  45           HG       LEU  45   5.530  -4.018   2.302
  347   1HD1  LEU  45          1HD1      LEU  45   4.881  -5.997   0.936
  348   2HD1  LEU  45          2HD1      LEU  45   3.896  -4.576   0.563
  349   3HD1  LEU  45          3HD1      LEU  45   3.233  -5.886   1.570
  350   1HD2  LEU  45          1HD2      LEU  45   2.667  -4.166   3.307
  351   2HD2  LEU  45          2HD2      LEU  45   3.366  -2.889   2.283
  352   3HD2  LEU  45          3HD2      LEU  45   3.932  -3.099   3.944
  353    H    SER  46           H        SER  46   6.945  -2.918   3.918
  354    HA   SER  46           HA       SER  46   5.139  -1.889   5.924
  355   1HB   SER  46          1HB       SER  46   8.096  -1.191   6.001
  356   2HB   SER  46          2HB       SER  46   6.822  -0.242   6.799
  357    HG   SER  46           HG       SER  46   6.748  -2.997   7.235
  358    H    PHE  47           H        PHE  47   4.979   0.647   5.460
  359    HA   PHE  47           HA       PHE  47   4.935   0.836   2.507
  360   1HB   PHE  47          1HB       PHE  47   2.719   0.614   3.837
  361   2HB   PHE  47          2HB       PHE  47   3.029   2.257   4.369
  362    HD1  PHE  47           1HD      PHE  47   2.084   0.085   1.560
  363    HD2  PHE  47           2HD      PHE  47   3.083   4.134   2.658
  364    HE1  PHE  47           1HE      PHE  47   1.235   0.894  -0.626
  365    HE2  PHE  47           2HE      PHE  47   2.233   4.932   0.471
  366    HZ   PHE  47           HZ       PHE  47   1.313   3.315  -1.177
  367    H    VAL  48           H        VAL  48   5.424   2.770   1.651
  368    HA   VAL  48           HA       VAL  48   6.650   4.793   3.300
  369    HB   VAL  48           HB       VAL  48   7.884   2.807   1.486
  370   1HG1  VAL  48          1HG1      VAL  48   8.528   4.760   0.157
  371   2HG1  VAL  48          2HG1      VAL  48   9.336   5.439   1.605
  372   3HG1  VAL  48          3HG1      VAL  48   9.852   3.882   0.909
  373   1HG2  VAL  48          1HG2      VAL  48   8.261   2.702   3.813
  374   2HG2  VAL  48          2HG2      VAL  48   9.751   3.343   3.159
  375   3HG2  VAL  48          3HG2      VAL  48   8.642   4.438   3.948
  376    H    CYS  49           H        CYS  49   5.629   6.559   2.992
  377    HA   CYS  49           HA       CYS  49   3.545   6.864   1.088
  378   1HB   CYS  49          1HB       CYS  49   3.592   9.255   1.968
  379   2HB   CYS  49          2HB       CYS  49   3.327   7.971   3.134
  380    HA   PRO  50           HA       PRO  50   5.698   7.818  -2.481
  381   1HB   PRO  50          1HB       PRO  50   4.105   9.654  -3.857
  382   2HB   PRO  50          2HB       PRO  50   3.856   7.884  -3.767
  383   1HG   PRO  50          1HG       PRO  50   2.577  10.044  -2.073
  384   2HG   PRO  50          2HG       PRO  50   1.792   8.634  -2.855
  385   1HD   PRO  50          1HD       PRO  50   2.420   8.569  -0.242
  386   2HD   PRO  50          2HD       PRO  50   2.706   7.132  -1.263
  387    H    TRP  51           H        TRP  51   4.841  10.629  -0.558
  388    HA   TRP  51           HA       TRP  51   6.601  12.585  -1.642
  389   1HB   TRP  51          1HB       TRP  51   4.921  13.289  -0.109
  390   2HB   TRP  51          2HB       TRP  51   5.392  12.094   1.093
  391    HD1  TRP  51           HD       TRP  51   6.912  15.258  -0.542
  392    HE1  TRP  51           1HE      TRP  51   8.449  16.415   1.149
  393    HE3  TRP  51           3HE      TRP  51   6.455  11.969   3.367
  394    HZ2  TRP  51           2HZ      TRP  51   9.396  15.957   3.844
  395    HZ3  TRP  51           3HZ      TRP  51   7.685  12.363   5.476
  396    HH2  TRP  51           HH       TRP  51   9.163  14.339   5.723
  397    H    CYS  52           H        CYS  52   7.138  10.408   1.252
  398    HA   CYS  52           HA       CYS  52   9.912  11.160   1.369
  399   1HB   CYS  52          1HB       CYS  52  10.159   9.589   3.086
  400   2HB   CYS  52          2HB       CYS  52   8.541  10.237   3.272
  401    H    ALA  53           H        ALA  53   8.079   8.576  -0.239
  402    HA   ALA  53           HA       ALA  53  10.222   6.911  -0.756
  403   1HB   ALA  53          1HB       ALA  53   7.772   6.375  -1.159
  404   2HB   ALA  53          2HB       ALA  53   7.829   7.405  -2.603
  405   3HB   ALA  53          3HB       ALA  53   8.824   5.956  -2.540
  406    H    THR  54           H        THR  54   8.994   9.696  -2.540
  407    HA   THR  54           HA       THR  54  10.796   9.553  -4.791
  408    HB   THR  54           HB       THR  54   9.106  11.869  -3.731
  409    HG1  THR  54           1HG      THR  54   7.715  10.254  -4.106
  410   1HG2  THR  54          1HG2      THR  54   9.089  12.610  -6.096
  411   2HG2  THR  54          2HG2      THR  54  10.184  11.279  -6.529
  412   3HG2  THR  54          3HG2      THR  54  10.741  12.585  -5.457
  413    H    ASN  55           H        ASN  55  10.672  11.499  -1.753
  414    HA   ASN  55           HA       ASN  55  12.983  13.099  -2.416
  415   1HB   ASN  55          1HB       ASN  55  11.496  12.589   0.197
  416   2HB   ASN  55          2HB       ASN  55  12.958  13.567   0.116
  417   1HD2  ASN  55          1HD2      ASN  55   9.587  13.366  -1.162
  418   2HD2  ASN  55          2HD2      ASN  55   9.553  15.084  -1.573
  419    H    GLN  56           H        GLN  56  12.539  10.332  -0.243
  420    HA   GLN  56           HA       GLN  56  13.922   9.004   0.907
  421   1HB   GLN  56          2HB       GLN  56  13.708   8.077  -1.362
  422   2HB   GLN  56          3HB       GLN  56  15.186   8.899  -1.846
  423   1HG   GLN  56          2HG       GLN  56  15.823   7.338   0.499
  424   2HG   GLN  56          3HG       GLN  56  14.836   6.320  -0.539
  425   1HE2  GLN  56          1HE2      GLN  56  17.527   8.627  -0.701
  426   2HE2  GLN  56          2HE2      GLN  56  18.501   7.759  -1.925
  427   1H    GLY   1          1H        GLY   1  20.920  -0.465   5.025
  428   1HA   GLY   1          1HA       GLY   1  19.853   1.537   5.603
  429   2HA   GLY   1          2HA       GLY   1  20.590   0.921   7.108
  430    H    SER   2           H        SER   2  20.278   3.626   5.214
  431    HA   SER   2           HA       SER   2  21.493   5.193   4.196
  432   1HB   SER   2          1HB       SER   2  22.854   5.655   6.214
  433   2HB   SER   2          2HB       SER   2  23.960   4.341   5.765
  434    HG   SER   2           HG       SER   2  24.358   6.660   5.079
  435    H    HIS   3           H        HIS   3  22.941   5.157   2.336
  436    HA   HIS   3           HA       HIS   3  23.384   4.246   0.297
  437   1HB   HIS   3          1HB       HIS   3  24.903   2.292   2.061
  438   2HB   HIS   3          2HB       HIS   3  25.134   2.487   0.331
  439    HD1  HIS   3           1HD      HIS   3  25.152   5.162   3.238
  440    HD2  HIS   3           2HD      HIS   3  27.282   3.779  -0.144
  441    HE1  HIS   3           1HE      HIS   3  27.216   6.635   2.999
  442    H    MET   4           H        MET   4  20.930   3.240   1.635
  443    HA   MET   4           HA       MET   4  20.832   0.419   1.364
  444   1HB   MET   4          1HB       MET   4  18.619   0.641   2.406
  445   2HB   MET   4          2HB       MET   4  19.926   1.451   3.257
  446   1HG   MET   4          1HG       MET   4  19.125   3.625   2.125
  447   2HG   MET   4          2HG       MET   4  17.669   2.725   1.701
  448   1HE   MET   4          1HE       MET   4  15.955   1.768   3.451
  449   2HE   MET   4          2HE       MET   4  17.216   0.826   4.281
  450   3HE   MET   4          3HE       MET   4  16.139   1.885   5.214
  451    H    ALA   5           H        ALA   5  21.298   0.759  -1.062
  452    HA   ALA   5           HA       ALA   5  18.998   0.587  -2.790
  453   1HB   ALA   5          1HB       ALA   5  20.646  -0.278  -4.411
  454   2HB   ALA   5          2HB       ALA   5  21.249   1.192  -3.622
  455   3HB   ALA   5          3HB       ALA   5  21.861  -0.404  -3.123
  456    H    GLU   6           H        GLU   6  18.284  -0.829  -0.610
  457    HA   GLU   6           HA       GLU   6  19.251  -3.596  -0.683
  458   1HB   GLU   6          1HB       GLU   6  17.553  -1.932   1.208
  459   2HB   GLU   6          2HB       GLU   6  17.764  -3.675   1.445
  460   1HG   GLU   6          1HG       GLU   6  20.106  -3.495   1.770
  461   2HG   GLU   6          2HG       GLU   6  20.181  -1.876   1.092
  462    HA   PRO   7           HA       PRO   7  15.852  -5.156  -2.962
  463   1HB   PRO   7          1HB       PRO   7  15.871  -7.804  -2.374
  464   2HB   PRO   7          2HB       PRO   7  17.290  -6.993  -3.085
  465   1HG   PRO   7          1HG       PRO   7  16.777  -7.542  -0.138
  466   2HG   PRO   7          2HG       PRO   7  18.223  -7.987  -1.104
  467   1HD   PRO   7          1HD       PRO   7  18.138  -5.701   0.379
  468   2HD   PRO   7          2HD       PRO   7  18.964  -5.751  -1.207
  469    H    GLN   8           H        GLN   8  14.872  -3.732  -0.853
  470    HA   GLN   8           HA       GLN   8  12.345  -5.154  -0.226
  471   1HB   GLN   8          1HB       GLN   8  14.121  -3.721   1.749
  472   2HB   GLN   8          2HB       GLN   8  12.374  -3.604   1.916
  473   1HG   GLN   8          1HG       GLN   8  13.148  -5.380   3.320
  474   2HG   GLN   8          2HG       GLN   8  12.142  -6.034   2.039
  475   1HE2  GLN   8          1HE2      GLN   8  12.988  -8.240   1.868
  476   2HE2  GLN   8          2HE2      GLN   8  14.693  -8.450   1.530
  477    H    ARG   9           H        ARG   9  13.927  -1.866  -0.367
  478    HA   ARG   9           HA       ARG   9  11.494  -0.437  -0.514
  479   1HB   ARG   9          1HB       ARG   9  13.730   0.495   0.059
  480   2HB   ARG   9          2HB       ARG   9  14.160   0.436  -1.639
  481   1HG   ARG   9          1HG       ARG   9  11.831   1.919  -0.744
  482   2HG   ARG   9          2HG       ARG   9  13.432   2.636  -0.699
  483   1HD   ARG   9          1HD       ARG   9  13.435   1.951  -3.277
  484   2HD   ARG   9          2HD       ARG   9  11.685   1.929  -3.059
  485    HE   ARG   9           HE       ARG   9  11.654   4.236  -2.898
  486   1HH1  ARG   9          1HH1      ARG   9  15.019   3.135  -2.634
  487   2HH1  ARG   9          2HH1      ARG   9  15.690   4.745  -2.715
  488   1HH2  ARG   9          1HH2      ARG   9  12.613   6.438  -3.105
  489   2HH2  ARG   9          2HH2      ARG   9  14.339   6.518  -3.154
  490    H    HIS  10           H        HIS  10   9.997  -1.401  -1.999
  491    HA   HIS  10           HA       HIS  10  10.801  -1.360  -4.863
  492   1HB   HIS  10          1HB       HIS  10   9.050  -3.307  -3.315
  493   2HB   HIS  10          2HB       HIS  10   9.312  -3.300  -5.065
  494    HD1  HIS  10           1HD      HIS  10  10.268  -5.646  -2.820
  495    HD2  HIS  10           2HD      HIS  10  12.614  -2.728  -4.591
  496    HE1  HIS  10           1HE      HIS  10  12.536  -6.686  -3.131
  497    H    LYS  11           H        LYS  11   8.804  -1.353  -6.324
  498    HA   LYS  11           HA       LYS  11   6.981   0.786  -5.364
  499   1HB   LYS  11          1HB       LYS  11   8.909   0.982  -7.712
  500   2HB   LYS  11          2HB       LYS  11   7.588   2.082  -7.373
  501   1HG   LYS  11          1HG       LYS  11   9.054   3.334  -6.222
  502   2HG   LYS  11          2HG       LYS  11   8.895   2.143  -4.958
  503   1HD   LYS  11          1HD       LYS  11  11.236   2.534  -5.320
  504   2HD   LYS  11          2HD       LYS  11  10.872   0.913  -5.898
  505   1HE   LYS  11          1HE       LYS  11  12.369   1.974  -7.460
  506   2HE   LYS  11          2HE       LYS  11  10.796   1.787  -8.244
  507   1HZ   LYS  11          1HZ       LYS  11  11.772   3.970  -8.627
  508   2HZ   LYS  11          2HZ       LYS  11  11.738   4.308  -7.014
  509   3HZ   LYS  11          3HZ       LYS  11  10.345   4.115  -7.865
  510    H    ILE  12           H        ILE  12   5.121  -0.355  -5.639
  511    HA   ILE  12           HA       ILE  12   4.629  -1.691  -8.252
  512    HB   ILE  12           HB       ILE  12   2.734  -1.390  -5.892
  513   1HG1  ILE  12          1HG1      ILE  12   4.382  -3.817  -6.705
  514   2HG1  ILE  12          2HG1      ILE  12   4.735  -2.767  -5.328
  515   1HG2  ILE  12          1HG2      ILE  12   2.605  -3.080  -8.433
  516   2HG2  ILE  12          2HG2      ILE  12   1.387  -3.056  -7.136
  517   3HG2  ILE  12          3HG2      ILE  12   1.645  -1.625  -8.119
  518   1HD1  ILE  12          1HD1      ILE  12   2.475  -3.282  -4.384
  519   2HD1  ILE  12          2HD1      ILE  12   2.312  -4.544  -5.640
  520   3HD1  ILE  12          3HD1      ILE  12   3.617  -4.632  -4.442
  521    H    LEU  13           H        LEU  13   4.668   0.052  -9.671
  522    HA   LEU  13           HA       LEU  13   3.159   2.446  -9.230
  523   1HB   LEU  13          1HB       LEU  13   4.981   2.287 -10.890
  524   2HB   LEU  13          2HB       LEU  13   3.952   1.279 -11.919
  525    HG   LEU  13           HG       LEU  13   2.822   3.905 -10.883
  526   1HD1  LEU  13          1HD1      LEU  13   5.038   4.529 -11.535
  527   2HD1  LEU  13          2HD1      LEU  13   3.865   5.129 -12.732
  528   3HD1  LEU  13          3HD1      LEU  13   4.862   3.699 -13.105
  529   1HD2  LEU  13          1HD2      LEU  13   2.585   2.504 -13.586
  530   2HD2  LEU  13          2HD2      LEU  13   1.768   4.013 -13.115
  531   3HD2  LEU  13          3HD2      LEU  13   1.356   2.508 -12.307
  532    H    CYS  14           H        CYS  14   1.112   2.426  -8.867
  533    HA   CYS  14           HA       CYS  14  -0.671   0.765 -10.561
  534   1HB   CYS  14          1HB       CYS  14  -0.450   0.168  -7.999
  535   2HB   CYS  14          2HB       CYS  14  -1.381   1.653  -7.746
  536    HG   CYS  14           HG       CYS  14  -2.098  -1.046  -9.526
  537    H    VAL  15           H        VAL  15  -3.024   1.984  -9.948
  538    HA   VAL  15           HA       VAL  15  -2.625   4.875 -10.139
  539    HB   VAL  15           HB       VAL  15  -4.639   5.028 -11.605
  540   1HG1  VAL  15          1HG1      VAL  15  -3.431   4.654 -13.688
  541   2HG1  VAL  15          2HG1      VAL  15  -2.372   5.382 -12.476
  542   3HG1  VAL  15          3HG1      VAL  15  -2.226   3.647 -12.851
  543   1HG2  VAL  15          1HG2      VAL  15  -4.154   2.064 -12.169
  544   2HG2  VAL  15          2HG2      VAL  15  -5.546   2.734 -11.282
  545   3HG2  VAL  15          3HG2      VAL  15  -5.307   3.132 -12.986
  546    H    CYS  16           H        CYS  16  -4.354   6.035  -9.206
  547    HA   CYS  16           HA       CYS  16  -5.660   4.825  -6.932
  548   1HB   CYS  16          1HB       CYS  16  -5.155   7.327  -7.274
  549   2HB   CYS  16          2HB       CYS  16  -6.490   7.328  -8.446
  550    H    CYS  17           H        CYS  17  -7.301   3.500  -7.045
  551    HA   CYS  17           HA       CYS  17  -8.417   2.488  -9.357
  552   1HB   CYS  17          1HB       CYS  17  -8.389   1.579  -6.916
  553   2HB   CYS  17          2HB       CYS  17  -9.922   2.439  -6.718
  554    HG   CYS  17           HG       CYS  17  -9.084   0.076  -8.901
  555    H    LYS  18           H        LYS  18  -9.462   5.416  -7.798
  556    HA   LYS  18           HA       LYS  18 -11.930   5.492  -9.444
  557   1HB   LYS  18          1HB       LYS  18 -12.842   6.829  -7.532
  558   2HB   LYS  18          2HB       LYS  18 -12.587   5.101  -7.305
  559   1HG   LYS  18          1HG       LYS  18 -10.449   5.663  -6.023
  560   2HG   LYS  18          2HG       LYS  18 -10.865   7.368  -6.166
  561   1HD   LYS  18          1HD       LYS  18 -11.641   6.602  -4.030
  562   2HD   LYS  18          2HD       LYS  18 -13.082   6.814  -5.059
  563   1HE   LYS  18          1HE       LYS  18 -13.127   4.371  -5.516
  564   2HE   LYS  18          2HE       LYS  18 -11.624   4.171  -4.636
  565   1HZ   LYS  18          1HZ       LYS  18 -13.237   3.489  -3.241
  566   2HZ   LYS  18          2HZ       LYS  18 -14.268   4.786  -3.513
  567   3HZ   LYS  18          3HZ       LYS  18 -12.866   4.956  -2.643
  568    H    CYS  19           H        CYS  19  -9.020   7.442  -8.663
  569    HA   CYS  19           HA       CYS  19 -10.193   9.492 -10.435
  570   1HB   CYS  19          1HB       CYS  19  -8.837  11.045  -9.427
  571   2HB   CYS  19          2HB       CYS  19  -9.642  10.203  -8.121
  572    H    ASP  20           H        ASP  20  -8.214   6.797 -10.611
  573    HA   ASP  20           HA       ASP  20  -6.671   6.044 -11.958
  574   1HB   ASP  20          1HB       ASP  20  -8.443   6.715 -13.565
  575   2HB   ASP  20          2HB       ASP  20  -7.549   8.203 -13.875
  576    H    GLY  21           H        GLY  21  -5.882   8.215 -10.076
  577   1HA   GLY  21          1HA       GLY  21  -3.811   9.757 -11.480
  578   2HA   GLY  21          2HA       GLY  21  -4.049   9.758  -9.735
  579    H    ARG  22           H        ARG  22  -1.691   9.436 -11.367
  580    HA   ARG  22           HA       ARG  22  -0.701   6.720 -11.382
  581   1HB   ARG  22          1HB       ARG  22   0.070   8.478 -12.900
  582   2HB   ARG  22          2HB       ARG  22   0.731   9.420 -11.572
  583   1HG   ARG  22          1HG       ARG  22   1.748   6.606 -12.098
  584   2HG   ARG  22          2HG       ARG  22   2.240   7.948 -13.131
  585   1HD   ARG  22          1HD       ARG  22   3.012   9.186 -11.037
  586   2HD   ARG  22          2HD       ARG  22   2.781   7.661 -10.159
  587    HE   ARG  22           HE       ARG  22   4.326   7.260 -12.537
  588   1HH1  ARG  22          1HH1      ARG  22   4.824   8.690  -9.269
  589   2HH1  ARG  22          2HH1      ARG  22   6.376   7.832  -9.131
  590   1HH2  ARG  22          1HH2      ARG  22   6.537   6.420 -12.217
  591   2HH2  ARG  22          2HH2      ARG  22   7.226   6.715 -10.614
  592    H    ILE  23           H        ILE  23  -0.138   5.509  -9.558
  593    HA   ILE  23           HA       ILE  23   1.090   7.042  -7.335
  594    HB   ILE  23           HB       ILE  23  -0.471   4.559  -6.698
  595   1HG1  ILE  23          1HG1      ILE  23  -1.816   7.280  -6.788
  596   2HG1  ILE  23          2HG1      ILE  23  -2.147   5.892  -7.842
  597   1HG2  ILE  23          1HG2      ILE  23  -0.424   5.654  -4.476
  598   2HG2  ILE  23          2HG2      ILE  23   1.195   5.714  -5.167
  599   3HG2  ILE  23          3HG2      ILE  23   0.172   7.161  -5.205
  600   1HD1  ILE  23          1HD1      ILE  23  -2.560   5.882  -4.837
  601   2HD1  ILE  23          2HD1      ILE  23  -3.808   5.992  -6.065
  602   3HD1  ILE  23          3HD1      ILE  23  -2.838   4.516  -5.945
  603    H    GLU  24           H        GLU  24   3.149   6.495  -7.217
  604    HA   GLU  24           HA       GLU  24   4.107   3.832  -8.018
  605   1HB   GLU  24          1HB       GLU  24   5.202   5.806  -8.753
  606   2HB   GLU  24          2HB       GLU  24   5.510   6.364  -7.095
  607   1HG   GLU  24          1HG       GLU  24   6.943   4.376  -6.742
  608   2HG   GLU  24          2HG       GLU  24   6.525   3.792  -8.363
  609    H    LEU  25           H        LEU  25   3.025   2.536  -6.481
  610    HA   LEU  25           HA       LEU  25   2.822   3.260  -3.737
  611   1HB   LEU  25          1HB       LEU  25   2.536   0.480  -4.892
  612   2HB   LEU  25          2HB       LEU  25   1.915   1.055  -3.365
  613    HG   LEU  25           HG       LEU  25   0.991   2.024  -6.114
  614   1HD1  LEU  25          1HD1      LEU  25  -0.263   0.074  -4.131
  615   2HD1  LEU  25          2HD1      LEU  25   0.407  -0.316  -5.731
  616   3HD1  LEU  25          3HD1      LEU  25  -1.043   0.696  -5.600
  617   1HD2  LEU  25          1HD2      LEU  25   0.712   3.675  -4.252
  618   2HD2  LEU  25          2HD2      LEU  25  -0.147   2.464  -3.305
  619   3HD2  LEU  25          3HD2      LEU  25  -0.850   3.065  -4.827
  620    H    THR  26           H        THR  26   4.776   3.585  -2.727
  621    HA   THR  26           HA       THR  26   6.877   1.639  -3.207
  622    HB   THR  26           HB       THR  26   7.001   4.162  -1.590
  623    HG1  THR  26           1HG      THR  26   6.519   4.264  -3.926
  624   1HG2  THR  26          1HG2      THR  26   9.159   2.290  -2.707
  625   2HG2  THR  26          2HG2      THR  26   8.767   2.494  -0.996
  626   3HG2  THR  26          3HG2      THR  26   9.464   3.842  -1.909
  627    H    VAL  27           H        VAL  27   6.615  -0.198  -2.264
  628    HA   VAL  27           HA       VAL  27   5.809  -0.348   0.596
  629    HB   VAL  27           HB       VAL  27   4.809  -2.520   0.229
  630   1HG1  VAL  27          1HG1      VAL  27   3.824  -0.779  -2.058
  631   2HG1  VAL  27          2HG1      VAL  27   2.933  -2.012  -1.146
  632   3HG1  VAL  27          3HG1      VAL  27   3.447  -0.518  -0.346
  633   1HG2  VAL  27          1HG2      VAL  27   5.765  -2.334  -2.675
  634   2HG2  VAL  27          2HG2      VAL  27   6.282  -3.523  -1.456
  635   3HG2  VAL  27          3HG2      VAL  27   4.625  -3.541  -2.053
  636    H    GLU  28           H        GLU  28   7.544  -0.860   1.831
  637    HA   GLU  28           HA       GLU  28   9.996  -1.682   0.391
  638   1HB   GLU  28          1HB       GLU  28   9.988  -0.929   3.306
  639   2HB   GLU  28          2HB       GLU  28  11.312  -1.010   2.131
  640   1HG   GLU  28          1HG       GLU  28  10.189   0.865   0.868
  641   2HG   GLU  28          2HG       GLU  28   9.252   1.105   2.343
  642    H    SER  29           H        SER  29   9.718  -3.841  -0.062
  643    HA   SER  29           HA       SER  29   9.651  -5.652   2.165
  644   1HB   SER  29          1HB       SER  29   7.118  -5.143   1.555
  645   2HB   SER  29          2HB       SER  29   7.427  -6.230   0.196
  646    HG   SER  29           HG       SER  29   6.807  -7.605   1.876
  647    H    SER  30           H        SER  30  10.053  -7.812   1.470
  648    HA   SER  30           HA       SER  30  11.986  -8.127  -0.513
  649   1HB   SER  30          1HB       SER  30  10.120 -10.279   0.581
  650   2HB   SER  30          2HB       SER  30  11.796 -10.471   0.045
  651    HG   SER  30           HG       SER  30  10.736  -9.402   2.425
  652    H    ALA  31           H        ALA  31  11.927  -8.942  -2.661
  653    HA   ALA  31           HA       ALA  31   9.923  -7.885  -4.219
  654   1HB   ALA  31          1HB       ALA  31  11.721 -10.247  -4.943
  655   2HB   ALA  31          2HB       ALA  31  10.867  -9.200  -6.094
  656   3HB   ALA  31          3HB       ALA  31  12.161  -8.524  -5.080
  657    H    GLU  32           H        GLU  32  10.014 -11.287  -3.045
  658    HA   GLU  32           HA       GLU  32   7.651 -11.781  -4.610
  659   1HB   GLU  32          1HB       GLU  32   9.803 -13.298  -4.077
  660   2HB   GLU  32          2HB       GLU  32   8.639 -13.947  -2.884
  661   1HG   GLU  32          1HG       GLU  32   6.973 -14.256  -4.695
  662   2HG   GLU  32          2HG       GLU  32   8.032 -13.429  -5.836
  663    H    ASP  33           H        ASP  33   8.242 -10.787  -1.454
  664    HA   ASP  33           HA       ASP  33   5.729 -11.564  -0.283
  665   1HB   ASP  33          1HB       ASP  33   7.736 -10.968   1.026
  666   2HB   ASP  33          2HB       ASP  33   7.729  -9.357   0.336
  667    H    LEU  34           H        LEU  34   7.142  -8.887  -2.145
  668    HA   LEU  34           HA       LEU  34   4.788  -7.303  -2.434
  669   1HB   LEU  34          1HB       LEU  34   6.609  -6.082  -2.871
  670   2HB   LEU  34          2HB       LEU  34   7.490  -7.345  -3.675
  671    HG   LEU  34           HG       LEU  34   5.120  -6.112  -5.139
  672   1HD1  LEU  34          1HD1      LEU  34   6.455  -4.214  -4.255
  673   2HD1  LEU  34          2HD1      LEU  34   6.668  -4.371  -6.008
  674   3HD1  LEU  34          3HD1      LEU  34   7.925  -4.976  -4.907
  675   1HD2  LEU  34          1HD2      LEU  34   7.832  -7.134  -6.103
  676   2HD2  LEU  34          2HD2      LEU  34   6.538  -6.466  -7.121
  677   3HD2  LEU  34          3HD2      LEU  34   6.293  -7.987  -6.277
  678    H    ARG  35           H        ARG  35   6.128  -9.717  -4.275
  679    HA   ARG  35           HA       ARG  35   4.348  -9.869  -6.526
  680   1HB   ARG  35          1HB       ARG  35   6.563 -11.092  -6.385
  681   2HB   ARG  35          2HB       ARG  35   5.744 -12.316  -5.404
  682   1HG   ARG  35          1HG       ARG  35   4.131 -12.687  -7.286
  683   2HG   ARG  35          2HG       ARG  35   5.095 -11.572  -8.278
  684   1HD   ARG  35          1HD       ARG  35   7.065 -13.099  -7.975
  685   2HD   ARG  35          2HD       ARG  35   6.043 -14.179  -7.001
  686    HE   ARG  35           HE       ARG  35   4.877 -13.613  -9.556
  687   1HH1  ARG  35          1HH1      ARG  35   7.354 -15.771  -7.995
  688   2HH1  ARG  35          2HH1      ARG  35   7.216 -16.952  -9.223
  689   1HH2  ARG  35          1HH2      ARG  35   4.731 -15.261 -11.127
  690   2HH2  ARG  35          2HH2      ARG  35   5.716 -16.676 -11.019
  691    H    THR  36           H        THR  36   4.395 -11.710  -3.479
  692    HA   THR  36           HA       THR  36   1.944 -13.101  -3.845
  693    HB   THR  36           HB       THR  36   3.042 -12.053  -1.200
  694    HG1  THR  36           1HG      THR  36   4.652 -13.244  -2.289
  695   1HG2  THR  36          1HG2      THR  36   1.269 -14.436  -1.923
  696   2HG2  THR  36          2HG2      THR  36   0.765 -12.994  -1.013
  697   3HG2  THR  36          3HG2      THR  36   1.944 -14.122  -0.316
  698    H    LEU  37           H        LEU  37   2.553  -9.861  -2.415
  699    HA   LEU  37           HA       LEU  37  -0.146  -9.056  -2.149
  700   1HB   LEU  37          1HB       LEU  37   1.073  -7.616  -0.994
  701   2HB   LEU  37          2HB       LEU  37   2.526  -7.986  -1.878
  702    HG   LEU  37           HG       LEU  37   1.827  -6.358  -3.658
  703   1HD1  LEU  37          1HD1      LEU  37  -0.648  -6.027  -2.990
  704   2HD1  LEU  37          2HD1      LEU  37   0.217  -4.518  -2.749
  705   3HD1  LEU  37          3HD1      LEU  37  -0.142  -5.543  -1.381
  706   1HD2  LEU  37          1HD2      LEU  37   2.490  -4.408  -2.176
  707   2HD2  LEU  37          2HD2      LEU  37   3.562  -5.792  -2.087
  708   3HD2  LEU  37          3HD2      LEU  37   2.373  -5.511  -0.799
  709    H    GLN  38           H        GLN  38   1.951  -8.954  -5.047
  710    HA   GLN  38           HA       GLN  38   0.080  -7.544  -6.698
  711   1HB   GLN  38          1HB       GLN  38   2.370  -7.633  -7.303
  712   2HB   GLN  38          2HB       GLN  38   2.397  -9.374  -7.235
  713   1HG   GLN  38          1HG       GLN  38   0.788  -9.377  -9.243
  714   2HG   GLN  38          2HG       GLN  38   1.247  -7.672  -9.423
  715   1HE2  GLN  38          1HE2      GLN  38   3.701  -7.259  -9.455
  716   2HE2  GLN  38          2HE2      GLN  38   4.759  -8.526 -10.034
  717    H    GLN  39           H        GLN  39   0.371 -11.008  -5.726
  718    HA   GLN  39           HA       GLN  39  -1.676 -11.843  -7.558
  719   1HB   GLN  39          1HB       GLN  39  -0.956 -13.318  -5.045
  720   2HB   GLN  39          2HB       GLN  39  -1.726 -13.906  -6.509
  721   1HG   GLN  39          1HG       GLN  39   1.151 -13.262  -6.010
  722   2HG   GLN  39          2HG       GLN  39   0.447 -14.717  -6.663
  723   1HE2  GLN  39          1HE2      GLN  39   1.973 -11.779  -7.386
  724   2HE2  GLN  39          2HE2      GLN  39   1.908 -11.814  -9.144
  725    H    LEU  40           H        LEU  40  -1.594 -10.501  -4.255
  726    HA   LEU  40           HA       LEU  40  -4.409 -10.766  -3.763
  727   1HB   LEU  40          1HB       LEU  40  -2.506  -8.740  -2.578
  728   2HB   LEU  40          2HB       LEU  40  -4.124  -9.081  -2.034
  729    HG   LEU  40           HG       LEU  40  -1.874 -11.131  -2.052
  730   1HD1  LEU  40          1HD1      LEU  40  -1.455  -9.309  -0.447
  731   2HD1  LEU  40          2HD1      LEU  40  -1.810 -10.835   0.371
  732   3HD1  LEU  40          3HD1      LEU  40  -3.058  -9.572   0.254
  733   1HD2  LEU  40          1HD2      LEU  40  -3.321 -12.495  -0.637
  734   2HD2  LEU  40          2HD2      LEU  40  -4.113 -12.202  -2.180
  735   3HD2  LEU  40          3HD2      LEU  40  -4.616 -11.284  -0.748
  736    H    PHE  41           H        PHE  41  -2.555  -8.344  -5.600
  737    HA   PHE  41           HA       PHE  41  -4.834  -6.601  -6.192
  738   1HB   PHE  41          1HB       PHE  41  -2.185  -7.083  -7.568
  739   2HB   PHE  41          2HB       PHE  41  -3.472  -6.258  -8.396
  740    HD1  PHE  41           1HD      PHE  41  -4.205  -4.032  -7.782
  741    HD2  PHE  41           2HD      PHE  41  -0.992  -5.984  -5.671
  742    HE1  PHE  41           1HE      PHE  41  -3.463  -1.851  -6.866
  743    HE2  PHE  41           2HE      PHE  41  -0.223  -3.792  -4.821
  744    HZ   PHE  41           HZ       PHE  41  -1.491  -1.734  -5.377
  745    H    LEU  42           H        LEU  42  -3.407  -9.394  -7.907
  746    HA   LEU  42           HA       LEU  42  -5.428  -9.508  -9.914
  747   1HB   LEU  42          1HB       LEU  42  -3.488 -11.534  -8.765
  748   2HB   LEU  42          2HB       LEU  42  -4.560 -11.948 -10.094
  749    HG   LEU  42           HG       LEU  42  -2.645  -9.575 -10.234
  750   1HD1  LEU  42          1HD1      LEU  42  -1.303 -11.579  -9.860
  751   2HD1  LEU  42          2HD1      LEU  42  -1.131 -11.043 -11.533
  752   3HD1  LEU  42          3HD1      LEU  42  -2.163 -12.441 -11.152
  753   1HD2  LEU  42          1HD2      LEU  42  -2.928  -9.858 -12.678
  754   2HD2  LEU  42          2HD2      LEU  42  -4.476  -9.532 -11.895
  755   3HD2  LEU  42          3HD2      LEU  42  -4.074 -11.187 -12.398
  756    H    SER  43           H        SER  43  -5.424 -10.796  -6.656
  757    HA   SER  43           HA       SER  43  -7.893 -12.238  -6.750
  758   1HB   SER  43          1HB       SER  43  -6.400 -12.687  -4.982
  759   2HB   SER  43          2HB       SER  43  -6.139 -10.993  -4.667
  760    HG   SER  43           HG       SER  43  -7.376 -11.192  -3.108
  761    H    THR  44           H        THR  44  -7.506  -9.188  -4.885
  762    HA   THR  44           HA       THR  44  -9.772  -8.078  -6.300
  763    HB   THR  44           HB       THR  44 -11.083  -7.546  -4.312
  764    HG1  THR  44           1HG      THR  44  -9.184  -7.832  -2.735
  765   1HG2  THR  44          1HG2      THR  44 -11.973  -9.736  -3.908
  766   2HG2  THR  44          2HG2      THR  44 -10.435 -10.502  -4.372
  767   3HG2  THR  44          3HG2      THR  44 -11.424  -9.654  -5.592
  768    H    LEU  45           H        LEU  45  -6.913  -7.501  -4.722
  769    HA   LEU  45           HA       LEU  45  -7.542  -4.999  -3.609
  770   1HB   LEU  45          1HB       LEU  45  -5.622  -6.504  -2.990
  771   2HB   LEU  45          2HB       LEU  45  -4.699  -5.823  -4.306
  772    HG   LEU  45           HG       LEU  45  -5.915  -3.815  -2.448
  773   1HD1  LEU  45          1HD1      LEU  45  -5.214  -5.586  -0.859
  774   2HD1  LEU  45          2HD1      LEU  45  -4.169  -4.161  -0.745
  775   3HD1  LEU  45          3HD1      LEU  45  -3.607  -5.618  -1.601
  776   1HD2  LEU  45          1HD2      LEU  45  -3.088  -4.137  -3.523
  777   2HD2  LEU  45          2HD2      LEU  45  -3.765  -2.710  -2.704
  778   3HD2  LEU  45          3HD2      LEU  45  -4.358  -3.181  -4.299
  779    H    SER  46           H        SER  46  -7.379  -2.887  -4.122
  780    HA   SER  46           HA       SER  46  -5.598  -2.076  -6.251
  781   1HB   SER  46          1HB       SER  46  -8.566  -1.418  -6.322
  782   2HB   SER  46          2HB       SER  46  -7.326  -0.507  -7.219
  783    HG   SER  46           HG       SER  46  -7.247  -3.295  -7.419
  784    H    PHE  47           H        PHE  47  -5.497   0.531  -6.068
  785    HA   PHE  47           HA       PHE  47  -5.343   1.011  -3.156
  786   1HB   PHE  47          1HB       PHE  47  -3.199   0.541  -4.603
  787   2HB   PHE  47          2HB       PHE  47  -3.425   2.185  -5.163
  788    HD1  PHE  47           1HD      PHE  47  -2.412   0.014  -2.388
  789    HD2  PHE  47           2HD      PHE  47  -3.297   4.095  -3.465
  790    HE1  PHE  47           1HE      PHE  47  -1.308   0.812  -0.317
  791    HE2  PHE  47           2HE      PHE  47  -2.249   4.877  -1.372
  792    HZ   PHE  47           HZ       PHE  47  -1.239   3.238   0.208
  793    H    VAL  48           H        VAL  48  -5.450   3.167  -2.566
  794    HA   VAL  48           HA       VAL  48  -6.692   5.024  -4.387
  795    HB   VAL  48           HB       VAL  48  -8.117   5.544  -2.092
  796   1HG1  VAL  48          1HG1      VAL  48 -10.030   4.572  -3.289
  797   2HG1  VAL  48          2HG1      VAL  48  -8.984   5.501  -4.378
  798   3HG1  VAL  48          3HG1      VAL  48  -8.926   3.721  -4.389
  799   1HG2  VAL  48          1HG2      VAL  48  -7.502   3.610  -0.923
  800   2HG2  VAL  48          2HG2      VAL  48  -9.207   3.478  -1.385
  801   3HG2  VAL  48          3HG2      VAL  48  -7.973   2.532  -2.240
  802    H    CYS  49           H        CYS  49  -5.639   6.879  -4.354
  803    HA   CYS  49           HA       CYS  49  -3.228   7.171  -2.799
  804   1HB   CYS  49          1HB       CYS  49  -3.211   9.454  -3.841
  805   2HB   CYS  49          2HB       CYS  49  -3.406   8.150  -4.996
  806    HA   PRO  50           HA       PRO  50  -4.696   9.031   0.906
  807   1HB   PRO  50          1HB       PRO  50  -2.902  11.109   1.407
  808   2HB   PRO  50          2HB       PRO  50  -2.637   9.376   1.761
  809   1HG   PRO  50          1HG       PRO  50  -1.745  10.943  -0.676
  810   2HG   PRO  50          2HG       PRO  50  -0.792   9.788   0.313
  811   1HD   PRO  50          1HD       PRO  50  -1.887   8.996  -2.005
  812   2HD   PRO  50          2HD       PRO  50  -1.961   7.924  -0.580
  813    H    TRP  51           H        TRP  51  -4.233  11.170  -1.884
  814    HA   TRP  51           HA       TRP  51  -5.843  13.342  -0.983
  815   1HB   TRP  51          1HB       TRP  51  -4.344  13.467  -2.926
  816   2HB   TRP  51          2HB       TRP  51  -5.339  12.302  -3.794
  817    HD1  TRP  51           HD       TRP  51  -5.461  15.897  -2.444
  818    HE1  TRP  51           1HE      TRP  51  -7.255  17.228  -3.694
  819    HE3  TRP  51           3HE      TRP  51  -7.437  12.125  -5.289
  820    HZ2  TRP  51           2HZ      TRP  51  -9.327  16.717  -5.653
  821    HZ3  TRP  51           3HZ      TRP  51  -9.353  12.568  -6.791
  822    HH2  TRP  51           HH       TRP  51 -10.299  14.847  -6.984
  823    H    CYS  52           H        CYS  52  -6.717  10.302  -2.765
  824    HA   CYS  52           HA       CYS  52  -9.562  10.941  -2.744
  825   1HB   CYS  52          1HB       CYS  52  -7.955   8.477  -3.471
  826   2HB   CYS  52          2HB       CYS  52  -9.714   8.443  -3.345
  827    H    ALA  53           H        ALA  53  -7.316   9.104  -0.614
  828    HA   ALA  53           HA       ALA  53  -9.355   7.990   1.048
  829   1HB   ALA  53          1HB       ALA  53  -6.915   7.413   1.143
  830   2HB   ALA  53          2HB       ALA  53  -6.625   8.989   1.933
  831   3HB   ALA  53          3HB       ALA  53  -7.637   7.776   2.726
  832    H    THR  54           H        THR  54  -7.928  11.228   0.894
  833    HA   THR  54           HA       THR  54  -9.301  12.204   3.262
  834    HB   THR  54           HB       THR  54  -7.763  13.693   1.097
  835    HG1  THR  54           1HG      THR  54  -6.399  12.213   1.954
  836   1HG2  THR  54          1HG2      THR  54  -7.330  15.352   2.885
  837   2HG2  THR  54          2HG2      THR  54  -8.395  14.449   3.983
  838   3HG2  THR  54          3HG2      THR  54  -9.061  15.229   2.530
  839    H    ASN  55           H        ASN  55  -9.755  12.628  -0.297
  840    HA   ASN  55           HA       ASN  55 -12.157  14.328   0.248
  841   1HB   ASN  55          1HB       ASN  55 -10.373  14.235  -2.219
  842   2HB   ASN  55          2HB       ASN  55 -11.654  15.384  -1.881
  843   1HD2  ASN  55          1HD2      ASN  55  -8.360  14.433  -1.092
  844   2HD2  ASN  55          2HD2      ASN  55  -7.952  15.957  -0.270
  845    H    GLN  56           H        GLN  56 -11.263  11.332  -1.142
  846    HA   GLN  56           HA       GLN  56 -11.754  10.120  -2.891
  847   1HB   GLN  56          2HB       GLN  56 -13.754   9.729  -1.278
  848   2HB   GLN  56          3HB       GLN  56 -14.692  10.643  -2.475
  849   1HG   GLN  56          2HG       GLN  56 -13.527   9.005  -4.221
  850   2HG   GLN  56          3HG       GLN  56 -13.138   8.045  -2.796
  851   1HE2  GLN  56          1HE2      GLN  56 -15.864   9.684  -4.415
  852   2HE2  GLN  56          2HE2      GLN  56 -17.101   8.472  -4.027
  Start of MODEL    9
    1   1H    GLY   1          1H        GLY   1 -22.856  15.203  11.226
    2   1HA   GLY   1          1HA       GLY   1 -23.420  15.730   8.968
    3   2HA   GLY   1          2HA       GLY   1 -21.654  15.721   9.192
    4    H    SER   2           H        SER   2 -21.459  15.282   6.819
    5    HA   SER   2           HA       SER   2 -22.417  13.084   5.479
    6   1HB   SER   2          1HB       SER   2 -19.616  14.256   5.262
    7   2HB   SER   2          2HB       SER   2 -20.597  13.530   3.973
    8    HG   SER   2           HG       SER   2 -20.689  15.793   3.869
    9    H    HIS   3           H        HIS   3 -21.816  10.881   5.340
   10    HA   HIS   3           HA       HIS   3 -19.401   9.885   6.577
   11   1HB   HIS   3          1HB       HIS   3 -20.691   8.275   8.004
   12   2HB   HIS   3          2HB       HIS   3 -20.800   9.941   8.554
   13    HD1  HIS   3           1HD      HIS   3 -23.237  11.193   8.139
   14    HD2  HIS   3           2HD      HIS   3 -22.979   7.059   7.299
   15    HE1  HIS   3           1HE      HIS   3 -25.635  10.309   7.967
   16    H    MET   4           H        MET   4 -18.923   7.770   5.710
   17    HA   MET   4           HA       MET   4 -20.882   6.176   4.437
   18   1HB   MET   4          1HB       MET   4 -20.347   7.841   2.570
   19   2HB   MET   4          2HB       MET   4 -18.661   7.351   2.677
   20   1HG   MET   4          1HG       MET   4 -19.863   6.255   0.817
   21   2HG   MET   4          2HG       MET   4 -19.203   5.098   1.947
   22   1HE   MET   4          1HE       MET   4 -22.602   7.202   2.474
   23   2HE   MET   4          2HE       MET   4 -22.449   6.938   0.719
   24   3HE   MET   4          3HE       MET   4 -23.731   6.117   1.638
   25    H    ALA   5           H        ALA   5 -19.859   4.063   3.918
   26    HA   ALA   5           HA       ALA   5 -17.078   3.784   3.908
   27   1HB   ALA   5          1HB       ALA   5 -16.878   1.958   5.535
   28   2HB   ALA   5          2HB       ALA   5 -17.306   3.476   6.351
   29   3HB   ALA   5          3HB       ALA   5 -18.555   2.222   6.072
   30    H    GLU   6           H        GLU   6 -16.596   1.574   3.060
   31    HA   GLU   6           HA       GLU   6 -18.827   0.198   1.734
   32   1HB   GLU   6          1HB       GLU   6 -17.703   0.799  -0.446
   33   2HB   GLU   6          2HB       GLU   6 -18.399   2.173   0.376
   34   1HG   GLU   6          1HG       GLU   6 -15.456   1.402   0.447
   35   2HG   GLU   6          2HG       GLU   6 -16.196   2.525  -0.674
   36    HA   PRO   7           HA       PRO   7 -15.630  -3.017   1.883
   37   1HB   PRO   7          1HB       PRO   7 -16.125  -4.584  -0.276
   38   2HB   PRO   7          2HB       PRO   7 -17.276  -4.473   1.088
   39   1HG   PRO   7          1HG       PRO   7 -17.395  -3.063  -1.581
   40   2HG   PRO   7          2HG       PRO   7 -18.721  -3.869  -0.686
   41   1HD   PRO   7          1HD       PRO   7 -18.181  -1.154  -0.666
   42   2HD   PRO   7          2HD       PRO   7 -19.056  -1.956   0.648
   43    H    GLN   8           H        GLN   8 -13.839  -3.951   0.344
   44    HA   GLN   8           HA       GLN   8 -12.035  -3.707  -0.775
   45   1HB   GLN   8          1HB       GLN   8 -14.074  -2.639  -2.501
   46   2HB   GLN   8          2HB       GLN   8 -12.583  -1.767  -2.767
   47   1HG   GLN   8          1HG       GLN   8 -12.821  -3.738  -4.241
   48   2HG   GLN   8          2HG       GLN   8 -11.397  -3.862  -3.205
   49   1HE2  GLN   8          1HE2      GLN   8 -11.196  -6.072  -2.993
   50   2HE2  GLN   8          2HE2      GLN   8 -12.397  -7.132  -2.287
   51    H    ARG   9           H        ARG   9 -13.094  -0.282  -0.806
   52    HA   ARG   9           HA       ARG   9 -10.622   0.902  -0.168
   53   1HB   ARG   9          1HB       ARG   9 -12.874   1.932  -0.939
   54   2HB   ARG   9          2HB       ARG   9 -13.317   1.930   0.732
   55   1HG   ARG   9          1HG       ARG   9 -10.887   3.273  -0.110
   56   2HG   ARG   9          2HG       ARG   9 -12.454   4.056  -0.238
   57   1HD   ARG   9          1HD       ARG   9 -12.644   3.408   2.332
   58   2HD   ARG   9          2HD       ARG   9 -10.896   3.306   2.244
   59    HE   ARG   9           HE       ARG   9 -10.753   5.633   1.812
   60   1HH1  ARG   9          1HH1      ARG   9 -14.233   4.629   2.238
   61   2HH1  ARG   9          2HH1      ARG   9 -14.745   6.286   2.229
   62   1HH2  ARG   9          1HH2      ARG   9 -11.618   7.845   1.920
   63   2HH2  ARG   9          2HH2      ARG   9 -13.354   7.997   2.089
   64    H    HIS  10           H        HIS  10  -9.447  -0.164   1.478
   65    HA   HIS  10           HA       HIS  10 -10.628  -0.017   4.236
   66   1HB   HIS  10          1HB       HIS  10  -8.986  -2.293   3.111
   67   2HB   HIS  10          2HB       HIS  10  -9.504  -2.109   4.786
   68    HD1  HIS  10           1HD      HIS  10 -10.415  -4.435   2.465
   69    HD2  HIS  10           2HD      HIS  10 -12.653  -1.234   3.898
   70    HE1  HIS  10           1HE      HIS  10 -12.747  -5.091   2.171
   71    H    LYS  11           H        LYS  11  -9.111   0.219   5.977
   72    HA   LYS  11           HA       LYS  11  -6.847   1.896   5.053
   73   1HB   LYS  11          1HB       LYS  11  -9.116   2.448   6.991
   74   2HB   LYS  11          2HB       LYS  11  -7.713   3.500   6.727
   75   1HG   LYS  11          1HG       LYS  11  -8.332   3.888   4.434
   76   2HG   LYS  11          2HG       LYS  11  -9.608   2.677   4.451
   77   1HD   LYS  11          1HD       LYS  11 -10.443   5.009   4.536
   78   2HD   LYS  11          2HD       LYS  11 -10.992   3.984   5.885
   79   1HE   LYS  11          1HE       LYS  11  -9.348   4.912   7.378
   80   2HE   LYS  11          2HE       LYS  11  -8.481   5.657   6.049
   81   1HZ   LYS  11          1HZ       LYS  11  -9.611   7.185   7.344
   82   2HZ   LYS  11          2HZ       LYS  11 -11.109   6.508   7.089
   83   3HZ   LYS  11          3HZ       LYS  11 -10.288   7.231   5.828
   84    H    ILE  12           H        ILE  12  -5.167   0.629   5.703
   85    HA   ILE  12           HA       ILE  12  -5.108  -0.376   8.493
   86    HB   ILE  12           HB       ILE  12  -2.942  -0.608   6.381
   87   1HG1  ILE  12          1HG1      ILE  12  -4.934  -2.783   7.097
   88   2HG1  ILE  12          2HG1      ILE  12  -5.145  -1.720   5.705
   89   1HG2  ILE  12          1HG2      ILE  12  -3.421  -2.044   9.026
   90   2HG2  ILE  12          2HG2      ILE  12  -2.082  -2.364   7.897
   91   3HG2  ILE  12          3HG2      ILE  12  -2.181  -0.815   8.723
   92   1HD1  ILE  12          1HD1      ILE  12  -2.926  -2.393   4.826
   93   2HD1  ILE  12          2HD1      ILE  12  -2.849  -3.637   6.107
   94   3HD1  ILE  12          3HD1      ILE  12  -4.133  -3.678   4.883
   95    H    LEU  13           H        LEU  13  -4.888   1.403   9.851
   96    HA   LEU  13           HA       LEU  13  -3.171   3.612   9.264
   97   1HB   LEU  13          1HB       LEU  13  -5.150   3.693  10.762
   98   2HB   LEU  13          2HB       LEU  13  -4.251   2.786  11.982
   99    HG   LEU  13           HG       LEU  13  -2.954   5.253  10.777
  100   1HD1  LEU  13          1HD1      LEU  13  -5.191   6.001  11.122
  101   2HD1  LEU  13          2HD1      LEU  13  -4.145   6.681  12.392
  102   3HD1  LEU  13          3HD1      LEU  13  -5.225   5.313  12.766
  103   1HD2  LEU  13          1HD2      LEU  13  -3.015   4.133  13.617
  104   2HD2  LEU  13          2HD2      LEU  13  -2.116   5.572  13.089
  105   3HD2  LEU  13          3HD2      LEU  13  -1.671   3.988  12.466
  106    H    CYS  14           H        CYS  14  -1.093   3.447   9.117
  107    HA   CYS  14           HA       CYS  14   0.411   1.785  11.084
  108   1HB   CYS  14          1HB       CYS  14   0.052   0.766   8.667
  109   2HB   CYS  14          2HB       CYS  14   1.315   1.919   8.200
  110    HG   CYS  14           HG       CYS  14   1.326  -0.461  10.517
  111    H    VAL  15           H        VAL  15   2.986   2.393   9.985
  112    HA   VAL  15           HA       VAL  15   3.147   5.329  10.019
  113    HB   VAL  15           HB       VAL  15   5.266   5.195  11.303
  114   1HG1  VAL  15          1HG1      VAL  15   4.251   5.008  13.519
  115   2HG1  VAL  15          2HG1      VAL  15   3.177   5.869  12.411
  116   3HG1  VAL  15          3HG1      VAL  15   2.838   4.177  12.837
  117   1HG2  VAL  15          1HG2      VAL  15   4.435   2.340  12.002
  118   2HG2  VAL  15          2HG2      VAL  15   5.815   2.794  10.976
  119   3HG2  VAL  15          3HG2      VAL  15   5.798   3.250  12.682
  120    H    CYS  16           H        CYS  16   4.927   6.127   8.869
  121    HA   CYS  16           HA       CYS  16   5.807   4.549   6.585
  122   1HB   CYS  16          1HB       CYS  16   5.443   7.084   6.535
  123   2HB   CYS  16          2HB       CYS  16   6.850   7.236   7.609
  124    H    CYS  17           H        CYS  17   7.621   3.377   6.460
  125    HA   CYS  17           HA       CYS  17   9.362   2.683   8.558
  126   1HB   CYS  17          1HB       CYS  17   9.228   1.396   6.527
  127   2HB   CYS  17          2HB       CYS  17   9.696   2.773   5.530
  128    HG   CYS  17           HG       CYS  17  11.478   0.855   5.642
  129    H    LYS  18           H        LYS  18   9.664   5.405   6.257
  130    HA   LYS  18           HA       LYS  18  12.209   6.183   7.586
  131   1HB   LYS  18          1HB       LYS  18  12.965   6.672   5.263
  132   2HB   LYS  18          2HB       LYS  18  12.757   4.979   5.702
  133   1HG   LYS  18          1HG       LYS  18  10.579   4.944   4.417
  134   2HG   LYS  18          2HG       LYS  18  10.803   6.656   4.078
  135   1HD   LYS  18          1HD       LYS  18  11.634   5.739   2.131
  136   2HD   LYS  18          2HD       LYS  18  13.097   5.916   3.052
  137   1HE   LYS  18          1HE       LYS  18  11.444   3.390   2.632
  138   2HE   LYS  18          2HE       LYS  18  12.992   3.742   1.872
  139   1HZ   LYS  18          1HZ       LYS  18  12.984   2.151   3.731
  140   2HZ   LYS  18          2HZ       LYS  18  12.648   3.329   4.778
  141   3HZ   LYS  18          3HZ       LYS  18  14.091   3.376   3.941
  142    H    CYS  19           H        CYS  19   9.184   7.478   6.547
  143    HA   CYS  19           HA       CYS  19  10.110  10.250   6.912
  144   1HB   CYS  19          1HB       CYS  19   7.400   9.216   6.946
  145   2HB   CYS  19          2HB       CYS  19   7.877  10.887   6.890
  146    H    ASP  20           H        ASP  20   9.291   7.454   8.814
  147    HA   ASP  20           HA       ASP  20   8.473   7.040  10.834
  148   1HB   ASP  20          1HB       ASP  20  10.792   7.589  11.315
  149   2HB   ASP  20          2HB       ASP  20  10.358   9.279  11.578
  150    H    GLY  21           H        GLY  21   6.410   7.858   9.849
  151   1HA   GLY  21          1HA       GLY  21   5.132   9.781  11.620
  152   2HA   GLY  21          2HA       GLY  21   5.202  10.204   9.886
  153    H    ARG  22           H        ARG  22   2.793   9.735  11.329
  154    HA   ARG  22           HA       ARG  22   1.749   7.075  11.085
  155   1HB   ARG  22          1HB       ARG  22   0.937   8.649  12.704
  156   2HB   ARG  22          2HB       ARG  22   0.557   9.855  11.490
  157   1HG   ARG  22          1HG       ARG  22  -0.884   7.177  11.490
  158   2HG   ARG  22          2HG       ARG  22  -1.306   8.451  12.634
  159   1HD   ARG  22          1HD       ARG  22  -1.475  10.003  10.510
  160   2HD   ARG  22          2HD       ARG  22  -1.614   8.469   9.633
  161    HE   ARG  22           HE       ARG  22  -3.360   8.585  11.921
  162   1HH1  ARG  22          1HH1      ARG  22  -3.192   9.852   8.553
  163   2HH1  ARG  22          2HH1      ARG  22  -4.918   9.485   8.331
  164   1HH2  ARG  22          1HH2      ARG  22  -5.705   8.447  11.472
  165   2HH2  ARG  22          2HH2      ARG  22  -6.171   8.829   9.812
  166    H    ILE  23           H        ILE  23   0.729   6.083   9.382
  167    HA   ILE  23           HA       ILE  23  -0.152   7.795   7.146
  168    HB   ILE  23           HB       ILE  23   0.848   4.962   6.687
  169   1HG1  ILE  23          1HG1      ILE  23   2.430   7.400   5.795
  170   2HG1  ILE  23          2HG1      ILE  23   2.817   6.532   7.281
  171   1HG2  ILE  23          1HG2      ILE  23   0.762   5.856   4.250
  172   2HG2  ILE  23          2HG2      ILE  23  -0.777   5.713   5.053
  173   3HG2  ILE  23          3HG2      ILE  23  -0.003   7.305   4.909
  174   1HD1  ILE  23          1HD1      ILE  23   3.230   4.458   6.096
  175   2HD1  ILE  23          2HD1      ILE  23   2.743   5.168   4.548
  176   3HD1  ILE  23          3HD1      ILE  23   4.184   5.753   5.348
  177    H    GLU  24           H        GLU  24  -2.136   7.017   6.211
  178    HA   GLU  24           HA       GLU  24  -3.629   4.981   7.787
  179   1HB   GLU  24          1HB       GLU  24  -4.349   7.123   8.307
  180   2HB   GLU  24          2HB       GLU  24  -4.461   7.637   6.608
  181   1HG   GLU  24          1HG       GLU  24  -6.346   6.114   6.283
  182   2HG   GLU  24          2HG       GLU  24  -6.126   5.452   7.901
  183    H    LEU  25           H        LEU  25  -2.885   3.312   6.496
  184    HA   LEU  25           HA       LEU  25  -2.328   3.702   3.780
  185   1HB   LEU  25          1HB       LEU  25  -2.635   1.135   5.290
  186   2HB   LEU  25          2HB       LEU  25  -1.861   1.316   3.734
  187    HG   LEU  25           HG       LEU  25  -0.849   2.577   6.331
  188   1HD1  LEU  25          1HD1      LEU  25  -0.025   0.044   4.850
  189   2HD1  LEU  25          2HD1      LEU  25  -0.684   0.160   6.491
  190   3HD1  LEU  25          3HD1      LEU  25   0.937   0.794   6.139
  191   1HD2  LEU  25          1HD2      LEU  25  -0.146   3.719   4.179
  192   2HD2  LEU  25          2HD2      LEU  25   0.475   2.183   3.595
  193   3HD2  LEU  25          3HD2      LEU  25   1.223   2.960   5.012
  194    H    THR  26           H        THR  26  -4.215   4.292   2.694
  195    HA   THR  26           HA       THR  26  -6.617   2.640   2.892
  196    HB   THR  26           HB       THR  26  -6.076   5.072   1.192
  197    HG1  THR  26           1HG      THR  26  -5.792   5.326   3.561
  198   1HG2  THR  26          1HG2      THR  26  -8.637   3.730   2.206
  199   2HG2  THR  26          2HG2      THR  26  -8.083   3.750   0.537
  200   3HG2  THR  26          3HG2      THR  26  -8.578   5.263   1.315
  201    H    VAL  27           H        VAL  27  -5.999   0.683   2.055
  202    HA   VAL  27           HA       VAL  27  -5.238   0.586  -0.828
  203    HB   VAL  27           HB       VAL  27  -4.478  -1.803  -0.446
  204   1HG1  VAL  27          1HG1      VAL  27  -3.467  -0.240   1.962
  205   2HG1  VAL  27          2HG1      VAL  27  -2.666  -1.510   1.021
  206   3HG1  VAL  27          3HG1      VAL  27  -2.961   0.089   0.302
  207   1HG2  VAL  27          1HG2      VAL  27  -6.336  -2.371   1.224
  208   2HG2  VAL  27          2HG2      VAL  27  -4.725  -2.860   1.757
  209   3HG2  VAL  27          3HG2      VAL  27  -5.487  -1.418   2.450
  210    H    GLU  28           H        GLU  28  -6.575  -1.347  -1.936
  211    HA   GLU  28           HA       GLU  28  -9.414  -1.045  -1.067
  212   1HB   GLU  28          1HB       GLU  28  -8.149   0.454  -2.951
  213   2HB   GLU  28          2HB       GLU  28  -8.595  -0.823  -3.895
  214   1HG   GLU  28          1HG       GLU  28 -11.024  -0.414  -3.013
  215   2HG   GLU  28          2HG       GLU  28 -10.373   1.139  -2.535
  216    H    SER  29           H        SER  29  -9.625  -3.158  -0.248
  217    HA   SER  29           HA       SER  29  -8.667  -5.468  -1.856
  218   1HB   SER  29          1HB       SER  29  -7.959  -4.575   0.991
  219   2HB   SER  29          2HB       SER  29  -7.395  -6.051   0.219
  220    HG   SER  29           HG       SER  29  -6.797  -4.033  -1.380
  221    H    SER  30           H        SER  30  -9.794  -7.540  -1.083
  222    HA   SER  30           HA       SER  30 -12.211  -7.046   0.484
  223   1HB   SER  30          1HB       SER  30 -10.829  -9.677  -0.188
  224   2HB   SER  30          2HB       SER  30 -12.476  -9.479   0.421
  225    HG   SER  30           HG       SER  30 -12.277  -9.705  -1.918
  226    H    ALA  31           H        ALA  31 -12.551  -7.980   2.731
  227    HA   ALA  31           HA       ALA  31 -10.580  -7.018   4.432
  228   1HB   ALA  31          1HB       ALA  31 -12.756  -9.054   5.083
  229   2HB   ALA  31          2HB       ALA  31 -11.874  -8.050   6.252
  230   3HB   ALA  31          3HB       ALA  31 -12.940  -7.281   5.063
  231    H    GLU  32           H        GLU  32 -11.108 -10.494   3.580
  232    HA   GLU  32           HA       GLU  32  -8.990 -11.408   5.301
  233   1HB   GLU  32          1HB       GLU  32 -10.662 -12.626   3.113
  234   2HB   GLU  32          2HB       GLU  32  -9.385 -13.545   3.919
  235   1HG   GLU  32          1HG       GLU  32 -11.621 -12.207   5.506
  236   2HG   GLU  32          2HG       GLU  32 -11.817 -13.799   4.793
  237    H    ASP  33           H        ASP  33  -9.116 -10.094   2.100
  238    HA   ASP  33           HA       ASP  33  -6.699 -11.309   1.106
  239   1HB   ASP  33          1HB       ASP  33  -8.896 -10.596  -0.097
  240   2HB   ASP  33          2HB       ASP  33  -8.212  -8.971  -0.091
  241    H    LEU  34           H        LEU  34  -7.873  -8.323   2.448
  242    HA   LEU  34           HA       LEU  34  -5.438  -6.763   2.654
  243   1HB   LEU  34          1HB       LEU  34  -7.389  -5.580   2.943
  244   2HB   LEU  34          2HB       LEU  34  -8.111  -6.726   4.042
  245    HG   LEU  34           HG       LEU  34  -5.601  -5.344   4.988
  246   1HD1  LEU  34          1HD1      LEU  34  -6.889  -3.514   3.969
  247   2HD1  LEU  34          2HD1      LEU  34  -6.970  -3.397   5.736
  248   3HD1  LEU  34          3HD1      LEU  34  -8.348  -4.058   4.836
  249   1HD2  LEU  34          1HD2      LEU  34  -8.228  -6.097   6.355
  250   2HD2  LEU  34          2HD2      LEU  34  -6.845  -5.310   7.145
  251   3HD2  LEU  34          3HD2      LEU  34  -6.685  -6.947   6.528
  252    H    ARG  35           H        ARG  35  -7.023  -9.070   4.706
  253    HA   ARG  35           HA       ARG  35  -5.107  -9.121   6.825
  254   1HB   ARG  35          1HB       ARG  35  -7.426 -10.125   6.837
  255   2HB   ARG  35          2HB       ARG  35  -6.770 -11.492   5.950
  256   1HG   ARG  35          1HG       ARG  35  -5.151 -11.916   7.817
  257   2HG   ARG  35          2HG       ARG  35  -5.926 -10.593   8.742
  258   1HD   ARG  35          1HD       ARG  35  -8.102 -11.734   8.538
  259   2HD   ARG  35          2HD       ARG  35  -7.347 -12.993   7.534
  260    HE   ARG  35           HE       ARG  35  -6.066 -12.862  10.074
  261   1HH1  ARG  35          1HH1      ARG  35  -9.090 -13.880   8.446
  262   2HH1  ARG  35          2HH1      ARG  35  -9.368 -15.245   9.455
  263   1HH2  ARG  35          1HH2      ARG  35  -6.485 -14.635  11.530
  264   2HH2  ARG  35          2HH2      ARG  35  -7.885 -15.630  11.323
  265    H    THR  36           H        THR  36  -5.430 -11.150   3.923
  266    HA   THR  36           HA       THR  36  -3.111 -12.742   4.267
  267    HB   THR  36           HB       THR  36  -4.341 -11.745   1.659
  268    HG1  THR  36           1HG      THR  36  -5.857 -12.841   2.966
  269   1HG2  THR  36          1HG2      THR  36  -2.594 -14.176   2.233
  270   2HG2  THR  36          2HG2      THR  36  -2.120 -12.753   1.275
  271   3HG2  THR  36          3HG2      THR  36  -3.415 -13.816   0.698
  272    H    LEU  37           H        LEU  37  -3.393  -9.557   2.534
  273    HA   LEU  37           HA       LEU  37  -0.560  -9.359   2.260
  274   1HB   LEU  37          1HB       LEU  37  -1.014  -7.672   0.909
  275   2HB   LEU  37          2HB       LEU  37  -2.658  -8.160   1.104
  276    HG   LEU  37           HG       LEU  37  -2.549  -6.426   3.198
  277   1HD1  LEU  37          1HD1      LEU  37  -0.144  -5.792   2.761
  278   2HD1  LEU  37          2HD1      LEU  37  -1.237  -4.421   2.541
  279   3HD1  LEU  37          3HD1      LEU  37  -0.590  -5.280   1.137
  280   1HD2  LEU  37          1HD2      LEU  37  -3.723  -4.888   1.852
  281   2HD2  LEU  37          2HD2      LEU  37  -4.081  -6.475   1.149
  282   3HD2  LEU  37          3HD2      LEU  37  -2.909  -5.419   0.365
  283    H    GLN  38           H        GLN  38  -2.622  -8.561   5.005
  284    HA   GLN  38           HA       GLN  38  -0.660  -7.091   6.490
  285   1HB   GLN  38          1HB       GLN  38  -2.897  -6.902   7.144
  286   2HB   GLN  38          2HB       GLN  38  -3.116  -8.626   7.189
  287   1HG   GLN  38          1HG       GLN  38  -1.448  -8.638   9.188
  288   2HG   GLN  38          2HG       GLN  38  -1.814  -6.907   9.268
  289   1HE2  GLN  38          1HE2      GLN  38  -4.296  -6.412   9.203
  290   2HE2  GLN  38          2HE2      GLN  38  -5.359  -7.578   9.968
  291    H    GLN  39           H        GLN  39  -1.226 -10.626   5.915
  292    HA   GLN  39           HA       GLN  39   0.794 -11.402   7.803
  293   1HB   GLN  39          1HB       GLN  39  -0.036 -13.062   5.437
  294   2HB   GLN  39          2HB       GLN  39   0.718 -13.558   6.940
  295   1HG   GLN  39          1HG       GLN  39  -2.124 -12.784   6.421
  296   2HG   GLN  39          2HG       GLN  39  -1.495 -14.227   7.178
  297   1HE2  GLN  39          1HE2      GLN  39  -2.833 -11.166   7.694
  298   2HE2  GLN  39          2HE2      GLN  39  -2.721 -11.051   9.442
  299    H    LEU  40           H        LEU  40   0.772 -10.572   4.303
  300    HA   LEU  40           HA       LEU  40   3.585 -10.938   3.893
  301   1HB   LEU  40          1HB       LEU  40   1.803  -8.911   2.529
  302   2HB   LEU  40          2HB       LEU  40   3.385  -9.421   2.008
  303    HG   LEU  40           HG       LEU  40   0.978 -11.278   2.215
  304   1HD1  LEU  40          1HD1      LEU  40   0.690  -9.564   0.456
  305   2HD1  LEU  40          2HD1      LEU  40   0.913 -11.179  -0.232
  306   3HD1  LEU  40          3HD1      LEU  40   2.258 -10.015  -0.226
  307   1HD2  LEU  40          1HD2      LEU  40   2.323 -12.853   0.884
  308   2HD2  LEU  40          2HD2      LEU  40   3.120 -12.511   2.421
  309   3HD2  LEU  40          3HD2      LEU  40   3.705 -11.737   0.936
  310    H    PHE  41           H        PHE  41   1.826  -8.324   5.454
  311    HA   PHE  41           HA       PHE  41   3.978  -6.453   5.856
  312   1HB   PHE  41          1HB       PHE  41   1.277  -6.562   6.342
  313   2HB   PHE  41          2HB       PHE  41   1.913  -6.658   7.971
  314    HD1  PHE  41           1HD      PHE  41   3.831  -4.753   8.442
  315    HD2  PHE  41           2HD      PHE  41   0.651  -4.545   5.531
  316    HE1  PHE  41           1HE      PHE  41   3.922  -2.274   8.506
  317    HE2  PHE  41           2HE      PHE  41   0.712  -2.085   5.635
  318    HZ   PHE  41           HZ       PHE  41   2.378  -0.934   7.090
  319    H    LEU  42           H        LEU  42   2.645  -9.040   7.896
  320    HA   LEU  42           HA       LEU  42   4.656  -8.868   9.936
  321   1HB   LEU  42          1HB       LEU  42   2.695 -11.019   9.063
  322   2HB   LEU  42          2HB       LEU  42   3.745 -11.234  10.457
  323    HG   LEU  42           HG       LEU  42   1.803  -8.891  10.204
  324   1HD1  LEU  42          1HD1      LEU  42   0.531 -10.985  10.169
  325   2HD1  LEU  42          2HD1      LEU  42   0.311 -10.155  11.712
  326   3HD1  LEU  42          3HD1      LEU  42   1.391 -11.565  11.610
  327   1HD2  LEU  42          1HD2      LEU  42   2.079  -8.761  12.666
  328   2HD2  LEU  42          2HD2      LEU  42   3.616  -8.513  11.836
  329   3HD2  LEU  42          3HD2      LEU  42   3.271 -10.077  12.605
  330    H    SER  43           H        SER  43   4.588 -10.572   6.876
  331    HA   SER  43           HA       SER  43   6.946 -12.155   7.178
  332   1HB   SER  43          1HB       SER  43   5.424 -12.714   5.467
  333   2HB   SER  43          2HB       SER  43   5.300 -11.066   4.923
  334    HG   SER  43           HG       SER  43   6.502 -11.603   3.418
  335    H    THR  44           H        THR  44   6.800  -9.347   4.948
  336    HA   THR  44           HA       THR  44   9.098  -8.212   6.290
  337    HB   THR  44           HB       THR  44  10.493  -7.950   4.310
  338    HG1  THR  44           1HG      THR  44   8.624  -8.336   2.694
  339   1HG2  THR  44          1HG2      THR  44  11.276 -10.213   4.155
  340   2HG2  THR  44          2HG2      THR  44   9.693 -10.846   4.666
  341   3HG2  THR  44          3HG2      THR  44  10.699  -9.917   5.809
  342    H    LEU  45           H        LEU  45   6.325  -7.652   4.578
  343    HA   LEU  45           HA       LEU  45   7.084  -5.251   3.287
  344   1HB   LEU  45          1HB       LEU  45   5.215  -6.731   2.626
  345   2HB   LEU  45          2HB       LEU  45   4.226  -6.097   3.905
  346    HG   LEU  45           HG       LEU  45   5.464  -4.125   1.987
  347   1HD1  LEU  45          1HD1      LEU  45   4.583  -5.892   0.532
  348   2HD1  LEU  45          2HD1      LEU  45   3.538  -4.462   0.458
  349   3HD1  LEU  45          3HD1      LEU  45   3.040  -5.879   1.410
  350   1HD2  LEU  45          1HD2      LEU  45   2.712  -4.256   3.310
  351   2HD2  LEU  45          2HD2      LEU  45   3.369  -2.935   2.306
  352   3HD2  LEU  45          3HD2      LEU  45   4.072  -3.275   3.885
  353    H    SER  46           H        SER  46   7.833  -3.426   4.267
  354    HA   SER  46           HA       SER  46   6.050  -2.152   6.252
  355   1HB   SER  46          1HB       SER  46   8.063  -0.468   6.252
  356   2HB   SER  46          2HB       SER  46   8.130  -1.965   7.181
  357    HG   SER  46           HG       SER  46   9.775  -1.122   5.116
  358    H    PHE  47           H        PHE  47   6.166   0.382   5.651
  359    HA   PHE  47           HA       PHE  47   5.261   0.607   2.841
  360   1HB   PHE  47          1HB       PHE  47   3.598   0.767   5.240
  361   2HB   PHE  47          2HB       PHE  47   3.569   2.275   4.351
  362    HD1  PHE  47           1HD      PHE  47   2.546  -1.212   4.339
  363    HD2  PHE  47           2HD      PHE  47   2.940   2.301   1.881
  364    HE1  PHE  47           1HE      PHE  47   0.926  -2.168   2.718
  365    HE2  PHE  47           2HE      PHE  47   1.366   1.327   0.240
  366    HZ   PHE  47           HZ       PHE  47   0.345  -0.918   0.666
  367    H    VAL  48           H        VAL  48   5.532   2.451   1.853
  368    HA   VAL  48           HA       VAL  48   7.179   4.497   3.047
  369    HB   VAL  48           HB       VAL  48   7.801   2.521   0.838
  370   1HG1  VAL  48          1HG1      VAL  48   8.603   4.770   0.044
  371   2HG1  VAL  48          2HG1      VAL  48   9.585   4.876   1.527
  372   3HG1  VAL  48          3HG1      VAL  48   9.887   3.586   0.349
  373   1HG2  VAL  48          1HG2      VAL  48   8.433   1.827   3.126
  374   2HG2  VAL  48          2HG2      VAL  48   9.871   2.206   2.200
  375   3HG2  VAL  48          3HG2      VAL  48   9.249   3.369   3.386
  376    H    CYS  49           H        CYS  49   5.536   5.938   2.927
  377    HA   CYS  49           HA       CYS  49   3.510   6.289   0.922
  378   1HB   CYS  49          1HB       CYS  49   3.282   8.513   2.108
  379   2HB   CYS  49          2HB       CYS  49   3.196   7.087   3.131
  380    HA   PRO  50           HA       PRO  50   5.298   8.155  -2.440
  381   1HB   PRO  50          1HB       PRO  50   3.774  10.427  -3.077
  382   2HB   PRO  50          2HB       PRO  50   3.425   8.725  -3.496
  383   1HG   PRO  50          1HG       PRO  50   2.398  10.330  -1.147
  384   2HG   PRO  50          2HG       PRO  50   1.491   9.213  -2.218
  385   1HD   PRO  50          1HD       PRO  50   2.306   8.399   0.201
  386   2HD   PRO  50          2HD       PRO  50   2.479   7.303  -1.199
  387    H    TRP  51           H        TRP  51   5.033  10.410   0.236
  388    HA   TRP  51           HA       TRP  51   6.796  12.452  -0.657
  389   1HB   TRP  51          1HB       TRP  51   5.384  12.810   1.270
  390   2HB   TRP  51          2HB       TRP  51   6.087  11.431   2.113
  391    HD1  TRP  51           HD       TRP  51   8.451  13.861   0.370
  392    HE1  TRP  51           1HE      TRP  51   9.930  14.963   2.046
  393    HE3  TRP  51           3HE      TRP  51   5.945  12.436   4.612
  394    HZ2  TRP  51           2HZ      TRP  51   9.992  15.315   4.975
  395    HZ3  TRP  51           3HZ      TRP  51   6.742  13.190   6.836
  396    HH2  TRP  51           HH       TRP  51   8.767  14.611   7.030
  397    H    CYS  52           H        CYS  52   7.560   9.623   1.560
  398    HA   CYS  52           HA       CYS  52  10.405   9.991   1.103
  399   1HB   CYS  52          1HB       CYS  52  10.596   7.697   2.050
  400   2HB   CYS  52          2HB       CYS  52   9.906   8.896   3.080
  401    H    ALA  53           H        ALA  53   7.814   8.125  -0.551
  402    HA   ALA  53           HA       ALA  53   9.566   6.430  -1.816
  403   1HB   ALA  53          1HB       ALA  53   7.046   6.375  -2.126
  404   2HB   ALA  53          2HB       ALA  53   7.201   7.778  -3.224
  405   3HB   ALA  53          3HB       ALA  53   7.936   6.252  -3.671
  406    H    THR  54           H        THR  54   8.713   9.744  -2.566
  407    HA   THR  54           HA       THR  54  10.466  10.171  -4.808
  408    HB   THR  54           HB       THR  54   9.120  12.179  -2.936
  409    HG1  THR  54           1HG      THR  54   7.492  10.938  -3.659
  410   1HG2  THR  54          1HG2      THR  54   9.120  13.638  -4.919
  411   2HG2  THR  54          2HG2      THR  54   9.949  12.388  -5.866
  412   3HG2  THR  54          3HG2      THR  54  10.784  13.174  -4.509
  413    H    ASN  55           H        ASN  55  10.592  11.362  -1.371
  414    HA   ASN  55           HA       ASN  55  13.163  12.655  -1.794
  415   1HB   ASN  55          1HB       ASN  55  11.471  12.158   0.714
  416   2HB   ASN  55          2HB       ASN  55  12.975  13.057   0.715
  417   1HD2  ASN  55          1HD2      ASN  55  10.977  13.504  -2.116
  418   2HD2  ASN  55          2HD2      ASN  55  10.343  15.063  -1.623
  419    H    GLN  56           H        GLN  56  12.139   9.700  -0.416
  420    HA   GLN  56           HA       GLN  56  13.015   7.924   0.619
  421   1HB   GLN  56          2HB       GLN  56  15.074   8.239  -0.806
  422   2HB   GLN  56          3HB       GLN  56  15.802   9.088   0.563
  423   1HG   GLN  56          2HG       GLN  56  16.193   7.154   1.689
  424   2HG   GLN  56          3HG       GLN  56  14.576   6.525   1.378
  425   1HE2  GLN  56          1HE2      GLN  56  17.879   6.150   0.571
  426   2HE2  GLN  56          2HE2      GLN  56  17.636   5.074  -0.796
  427   1H    GLY   1          1H        GLY   1  13.524  10.568   5.577
  428   1HA   GLY   1          1HA       GLY   1  15.820  10.008   6.174
  429   2HA   GLY   1          2HA       GLY   1  14.598   8.952   6.921
  430    H    SER   2           H        SER   2  15.492   6.964   7.019
  431    HA   SER   2           HA       SER   2  16.226   4.944   6.427
  432   1HB   SER   2          1HB       SER   2  14.713   5.431   4.366
  433   2HB   SER   2          2HB       SER   2  16.215   5.654   3.476
  434    HG   SER   2           HG       SER   2  16.688   3.486   3.736
  435    H    HIS   3           H        HIS   3  17.901   3.785   5.214
  436    HA   HIS   3           HA       HIS   3  20.065   5.211   3.976
  437   1HB   HIS   3          1HB       HIS   3  20.808   4.807   6.380
  438   2HB   HIS   3          2HB       HIS   3  20.615   3.076   6.097
  439    HD1  HIS   3           1HD      HIS   3  22.845   1.932   5.219
  440    HD2  HIS   3           2HD      HIS   3  22.567   6.080   4.470
  441    HE1  HIS   3           1HE      HIS   3  25.007   2.620   4.077
  442    H    MET   4           H        MET   4  21.421   2.909   3.317
  443    HA   MET   4           HA       MET   4  21.549   1.152   1.980
  444   1HB   MET   4          1HB       MET   4  20.829   0.619   4.584
  445   2HB   MET   4          2HB       MET   4  19.712  -0.404   3.697
  446   1HG   MET   4          1HG       MET   4  21.686  -1.676   4.127
  447   2HG   MET   4          2HG       MET   4  21.697  -1.300   2.402
  448   1HE   MET   4          1HE       MET   4  24.196  -1.979   2.155
  449   2HE   MET   4          2HE       MET   4  25.494  -1.414   3.231
  450   3HE   MET   4          3HE       MET   4  24.195  -2.446   3.872
  451    H    ALA   5           H        ALA   5  20.881   1.150  -0.048
  452    HA   ALA   5           HA       ALA   5  18.160   0.911  -0.923
  453   1HB   ALA   5          1HB       ALA   5  19.214   0.765  -3.149
  454   2HB   ALA   5          2HB       ALA   5  19.893   2.108  -2.208
  455   3HB   ALA   5          3HB       ALA   5  20.810   0.591  -2.394
  456    H    GLU   6           H        GLU   6  18.124  -1.080   0.753
  457    HA   GLU   6           HA       GLU   6  19.040  -3.623  -0.343
  458   1HB   GLU   6          1HB       GLU   6  17.389  -2.788   2.077
  459   2HB   GLU   6          2HB       GLU   6  17.656  -4.489   1.675
  460   1HG   GLU   6          1HG       GLU   6  20.119  -4.111   1.667
  461   2HG   GLU   6          2HG       GLU   6  19.849  -2.431   2.117
  462    HA   PRO   7           HA       PRO   7  15.589  -4.624  -2.835
  463   1HB   PRO   7          1HB       PRO   7  15.556  -7.332  -2.906
  464   2HB   PRO   7          2HB       PRO   7  16.969  -6.390  -3.449
  465   1HG   PRO   7          1HG       PRO   7  16.540  -7.625  -0.701
  466   2HG   PRO   7          2HG       PRO   7  17.942  -7.850  -1.801
  467   1HD   PRO   7          1HD       PRO   7  17.983  -6.003   0.177
  468   2HD   PRO   7          2HD       PRO   7  18.716  -5.651  -1.416
  469    H    GLN   8           H        GLN   8  14.521  -3.581  -0.758
  470    HA   GLN   8           HA       GLN   8  12.037  -5.159  -0.323
  471   1HB   GLN   8          1HB       GLN   8  13.632  -3.658   1.761
  472   2HB   GLN   8          2HB       GLN   8  11.879  -3.725   1.873
  473   1HG   GLN   8          1HG       GLN   8  12.786  -5.463   3.237
  474   2HG   GLN   8          2HG       GLN   8  11.890  -6.169   1.905
  475   1HE2  GLN   8          1HE2      GLN   8  12.954  -8.267   1.716
  476   2HE2  GLN   8          2HE2      GLN   8  14.680  -8.293   1.393
  477    H    ARG   9           H        ARG   9  13.340  -1.803  -0.005
  478    HA   ARG   9           HA       ARG   9  10.994  -0.415  -0.553
  479   1HB   ARG   9          1HB       ARG   9  13.133   0.447   0.405
  480   2HB   ARG   9          2HB       ARG   9  13.824   0.440  -1.206
  481   1HG   ARG   9          1HG       ARG   9  11.368   1.935  -0.846
  482   2HG   ARG   9          2HG       ARG   9  12.820   2.596  -0.096
  483   1HD   ARG   9          1HD       ARG   9  13.756   2.092  -2.612
  484   2HD   ARG   9          2HD       ARG   9  12.068   2.405  -2.992
  485    HE   ARG   9           HE       ARG   9  14.017   4.252  -1.638
  486   1HH1  ARG   9          1HH1      ARG   9  10.896   4.078  -3.425
  487   2HH1  ARG   9          2HH1      ARG   9  10.933   5.826  -3.667
  488   1HH2  ARG   9          1HH2      ARG   9  13.861   6.373  -1.885
  489   2HH2  ARG   9          2HH2      ARG   9  12.489   7.132  -2.711
  490    H    HIS  10           H        HIS  10   9.753  -1.380  -2.192
  491    HA   HIS  10           HA       HIS  10  10.826  -1.235  -4.954
  492   1HB   HIS  10          1HB       HIS  10   9.016  -3.215  -3.532
  493   2HB   HIS  10          2HB       HIS  10   9.328  -3.212  -5.275
  494    HD1  HIS  10           1HD      HIS  10  10.194  -5.624  -3.118
  495    HD2  HIS  10           2HD      HIS  10  12.611  -2.553  -4.512
  496    HE1  HIS  10           1HE      HIS  10  12.496  -6.599  -3.303
  497    H    LYS  11           H        LYS  11   9.062  -1.209  -6.619
  498    HA   LYS  11           HA       LYS  11   7.063   0.873  -5.874
  499   1HB   LYS  11          1HB       LYS  11   9.285   1.023  -7.941
  500   2HB   LYS  11          2HB       LYS  11   7.940   2.141  -7.836
  501   1HG   LYS  11          1HG       LYS  11   9.056   3.403  -6.353
  502   2HG   LYS  11          2HG       LYS  11   9.026   2.081  -5.219
  503   1HD   LYS  11          1HD       LYS  11  11.310   2.764  -5.460
  504   2HD   LYS  11          2HD       LYS  11  11.135   1.179  -6.201
  505   1HE   LYS  11          1HE       LYS  11  12.544   2.538  -7.608
  506   2HE   LYS  11          2HE       LYS  11  11.016   2.259  -8.455
  507   1HZ   LYS  11          1HZ       LYS  11  11.772   4.558  -8.602
  508   2HZ   LYS  11          2HZ       LYS  11  11.645   4.739  -6.968
  509   3HZ   LYS  11          3HZ       LYS  11  10.311   4.470  -7.900
  510    H    ILE  12           H        ILE  12   5.318  -0.506  -6.287
  511    HA   ILE  12           HA       ILE  12   5.156  -1.831  -8.943
  512    HB   ILE  12           HB       ILE  12   3.011  -1.723  -6.805
  513   1HG1  ILE  12          1HG1      ILE  12   4.968  -4.005  -7.082
  514   2HG1  ILE  12          2HG1      ILE  12   5.025  -2.762  -5.821
  515   1HG2  ILE  12          1HG2      ILE  12   3.470  -3.577  -9.183
  516   2HG2  ILE  12          2HG2      ILE  12   2.086  -3.646  -8.061
  517   3HG2  ILE  12          3HG2      ILE  12   2.290  -2.259  -9.121
  518   1HD1  ILE  12          1HD1      ILE  12   2.590  -3.364  -5.265
  519   2HD1  ILE  12          2HD1      ILE  12   2.875  -4.845  -6.216
  520   3HD1  ILE  12          3HD1      ILE  12   3.851  -4.482  -4.780
  521    H    LEU  13           H        LEU  13   4.822  -0.199 -10.509
  522    HA   LEU  13           HA       LEU  13   3.197   2.097  -9.974
  523   1HB   LEU  13          1HB       LEU  13   4.997   2.055 -11.679
  524   2HB   LEU  13          2HB       LEU  13   3.985   1.029 -12.706
  525    HG   LEU  13           HG       LEU  13   2.786   3.584 -11.573
  526   1HD1  LEU  13          1HD1      LEU  13   4.956   4.313 -12.294
  527   2HD1  LEU  13          2HD1      LEU  13   3.719   4.886 -13.440
  528   3HD1  LEU  13          3HD1      LEU  13   4.757   3.503 -13.869
  529   1HD2  LEU  13          1HD2      LEU  13   1.329   2.154 -12.980
  530   2HD2  LEU  13          2HD2      LEU  13   2.514   2.231 -14.297
  531   3HD2  LEU  13          3HD2      LEU  13   1.649   3.691 -13.766
  532    H    CYS  14           H        CYS  14   1.164   2.052  -9.705
  533    HA   CYS  14           HA       CYS  14  -0.584   0.246 -11.235
  534   1HB   CYS  14          1HB       CYS  14  -0.076  -0.391  -8.704
  535   2HB   CYS  14          2HB       CYS  14  -1.146   0.965  -8.336
  536    HG   CYS  14           HG       CYS  14  -1.721  -1.731 -10.178
  537    H    VAL  15           H        VAL  15  -3.000   1.307 -10.186
  538    HA   VAL  15           HA       VAL  15  -2.753   4.219 -10.408
  539    HB   VAL  15           HB       VAL  15  -4.894   4.344 -11.650
  540   1HG1  VAL  15          1HG1      VAL  15  -3.957   3.959 -13.859
  541   2HG1  VAL  15          2HG1      VAL  15  -2.738   4.666 -12.792
  542   3HG1  VAL  15          3HG1      VAL  15  -2.675   2.930 -13.181
  543   1HG2  VAL  15          1HG2      VAL  15  -4.498   1.377 -12.237
  544   2HG2  VAL  15          2HG2      VAL  15  -5.778   2.068 -11.211
  545   3HG2  VAL  15          3HG2      VAL  15  -5.725   2.449 -12.938
  546    H    CYS  16           H        CYS  16  -4.398   5.350  -9.393
  547    HA   CYS  16           HA       CYS  16  -5.691   4.224  -7.027
  548   1HB   CYS  16          1HB       CYS  16  -5.032   6.701  -7.382
  549   2HB   CYS  16          2HB       CYS  16  -6.274   6.744  -8.620
  550    H    CYS  17           H        CYS  17  -7.090   2.623  -7.554
  551    HA   CYS  17           HA       CYS  17  -8.242   2.005  -9.995
  552   1HB   CYS  17          1HB       CYS  17  -8.104   0.470  -8.192
  553   2HB   CYS  17          2HB       CYS  17  -9.113   1.483  -7.133
  554    HG   CYS  17           HG       CYS  17 -10.704  -0.163  -7.392
  555    H    LYS  18           H        LYS  18  -9.514   4.242  -7.616
  556    HA   LYS  18           HA       LYS  18 -12.141   4.442  -8.890
  557   1HB   LYS  18          1HB       LYS  18 -12.629   5.902  -6.939
  558   2HB   LYS  18          2HB       LYS  18 -12.059   4.286  -6.503
  559   1HG   LYS  18          1HG       LYS  18  -9.750   5.219  -6.145
  560   2HG   LYS  18          2HG       LYS  18 -10.380   6.839  -6.455
  561   1HD   LYS  18          1HD       LYS  18 -11.222   4.928  -4.235
  562   2HD   LYS  18          2HD       LYS  18 -10.135   6.343  -4.090
  563   1HE   LYS  18          1HE       LYS  18 -11.783   7.810  -4.776
  564   2HE   LYS  18          2HE       LYS  18 -13.039   6.553  -4.854
  565   1HZ   LYS  18          1HZ       LYS  18 -11.610   7.594  -2.464
  566   2HZ   LYS  18          2HZ       LYS  18 -12.662   6.283  -2.446
  567   3HZ   LYS  18          3HZ       LYS  18 -13.169   7.801  -2.890
  568    H    CYS  19           H        CYS  19  -9.081   6.283  -9.089
  569    HA   CYS  19           HA       CYS  19 -10.574   8.321 -10.614
  570   1HB   CYS  19          1HB       CYS  19  -9.403   9.923  -9.622
  571   2HB   CYS  19          2HB       CYS  19  -9.706   8.863  -8.274
  572    H    ASP  20           H        ASP  20  -8.435   5.816 -11.010
  573    HA   ASP  20           HA       ASP  20  -6.965   5.129 -12.456
  574   1HB   ASP  20          1HB       ASP  20  -8.825   5.710 -14.010
  575   2HB   ASP  20          2HB       ASP  20  -7.997   7.227 -14.358
  576    H    GLY  21           H        GLY  21  -6.268   7.432 -10.638
  577   1HA   GLY  21          1HA       GLY  21  -4.250   8.969 -12.122
  578   2HA   GLY  21          2HA       GLY  21  -4.489   9.047 -10.382
  579    H    ARG  22           H        ARG  22  -2.102   8.758 -11.973
  580    HA   ARG  22           HA       ARG  22  -0.993   6.094 -11.906
  581   1HB   ARG  22          1HB       ARG  22  -0.228   7.840 -13.437
  582   2HB   ARG  22          2HB       ARG  22   0.318   8.856 -12.112
  583   1HG   ARG  22          1HG       ARG  22   1.506   6.086 -12.508
  584   2HG   ARG  22          2HG       ARG  22   1.979   7.429 -13.546
  585   1HD   ARG  22          1HD       ARG  22   2.582   8.738 -11.425
  586   2HD   ARG  22          2HD       ARG  22   2.424   7.198 -10.554
  587    HE   ARG  22           HE       ARG  22   4.068   6.887 -12.868
  588   1HH1  ARG  22          1HH1      ARG  22   4.388   8.409  -9.615
  589   2HH1  ARG  22          2HH1      ARG  22   6.005   7.690  -9.443
  590   1HH2  ARG  22          1HH2      ARG  22   6.331   6.262 -12.509
  591   2HH2  ARG  22          2HH2      ARG  22   6.966   6.615 -10.897
  592    H    ILE  23           H        ILE  23  -0.321   4.947 -10.088
  593    HA   ILE  23           HA       ILE  23   0.911   6.591  -7.958
  594    HB   ILE  23           HB       ILE  23  -0.542   4.059  -7.229
  595   1HG1  ILE  23          1HG1      ILE  23  -1.800   6.820  -7.017
  596   2HG1  ILE  23          2HG1      ILE  23  -2.296   5.544  -8.135
  597   1HG2  ILE  23          1HG2      ILE  23  -0.264   5.044  -4.963
  598   2HG2  ILE  23          2HG2      ILE  23   1.280   5.063  -5.791
  599   3HG2  ILE  23          3HG2      ILE  23   0.334   6.558  -5.680
  600   1HD1  ILE  23          1HD1      ILE  23  -2.412   5.363  -5.109
  601   2HD1  ILE  23          2HD1      ILE  23  -3.765   5.455  -6.218
  602   3HD1  ILE  23          3HD1      ILE  23  -2.751   4.012  -6.227
  603    H    GLU  24           H        GLU  24   2.945   6.062  -7.761
  604    HA   GLU  24           HA       GLU  24   4.034   3.467  -8.628
  605   1HB   GLU  24          1HB       GLU  24   5.074   5.519  -9.207
  606   2HB   GLU  24          2HB       GLU  24   5.223   6.038  -7.515
  607   1HG   GLU  24          1HG       GLU  24   6.771   4.143  -7.136
  608   2HG   GLU  24          2HG       GLU  24   6.535   3.628  -8.817
  609    H    LEU  25           H        LEU  25   3.012   2.021  -7.196
  610    HA   LEU  25           HA       LEU  25   2.479   2.676  -4.448
  611   1HB   LEU  25          1HB       LEU  25   2.601  -0.090  -5.652
  612   2HB   LEU  25          2HB       LEU  25   1.856   0.370  -4.147
  613    HG   LEU  25           HG       LEU  25   0.880   1.093  -6.946
  614   1HD1  LEU  25          1HD1      LEU  25  -0.245  -0.721  -4.752
  615   2HD1  LEU  25          2HD1      LEU  25   0.471  -1.257  -6.287
  616   3HD1  LEU  25          3HD1      LEU  25  -1.049  -0.348  -6.286
  617   1HD2  LEU  25          1HD2      LEU  25   0.448   2.914  -5.412
  618   2HD2  LEU  25          2HD2      LEU  25  -0.202   1.813  -4.202
  619   3HD2  LEU  25          3HD2      LEU  25  -1.064   2.070  -5.751
  620    H    THR  26           H        THR  26   4.259   3.219  -3.347
  621    HA   THR  26           HA       THR  26   6.641   1.598  -3.671
  622    HB   THR  26           HB       THR  26   6.250   4.215  -2.263
  623    HG1  THR  26           1HG      THR  26   5.937   4.135  -4.600
  624   1HG2  THR  26          1HG2      THR  26   8.768   2.664  -3.089
  625   2HG2  THR  26          2HG2      THR  26   8.209   2.871  -1.431
  626   3HG2  THR  26          3HG2      THR  26   8.735   4.285  -2.360
  627    H    VAL  27           H        VAL  27   6.359  -0.265  -2.724
  628    HA   VAL  27           HA       VAL  27   5.502  -0.329   0.140
  629    HB   VAL  27           HB       VAL  27   4.355  -2.449  -0.252
  630   1HG1  VAL  27          1HG1      VAL  27   3.488  -0.621  -2.519
  631   2HG1  VAL  27          2HG1      VAL  27   2.513  -1.790  -1.609
  632   3HG1  VAL  27          3HG1      VAL  27   3.125  -0.332  -0.806
  633   1HG2  VAL  27          1HG2      VAL  27   5.445  -2.249  -3.110
  634   2HG2  VAL  27          2HG2      VAL  27   5.752  -3.526  -1.906
  635   3HG2  VAL  27          3HG2      VAL  27   4.152  -3.344  -2.631
  636    H    GLU  28           H        GLU  28   6.811  -1.644   1.493
  637    HA   GLU  28           HA       GLU  28   9.484  -1.811   0.236
  638   1HB   GLU  28          1HB       GLU  28   8.617   0.005   1.896
  639   2HB   GLU  28          2HB       GLU  28   8.864  -1.229   3.100
  640   1HG   GLU  28          1HG       GLU  28  11.289  -1.327   1.911
  641   2HG   GLU  28          2HG       GLU  28  10.819   0.278   1.418
  642    H    SER  29           H        SER  29   9.318  -4.047  -0.381
  643    HA   SER  29           HA       SER  29   9.484  -5.922   1.833
  644   1HB   SER  29          1HB       SER  29   6.915  -5.589   1.211
  645   2HB   SER  29          2HB       SER  29   7.319  -6.659  -0.138
  646    HG   SER  29           HG       SER  29   6.772  -8.047   1.559
  647    H    SER  30           H        SER  30  10.095  -7.974   1.186
  648    HA   SER  30           HA       SER  30  12.038  -8.233  -0.779
  649   1HB   SER  30          1HB       SER  30  10.290 -10.488   0.294
  650   2HB   SER  30          2HB       SER  30  11.997 -10.557  -0.168
  651    HG   SER  30           HG       SER  30  10.759  -9.529   2.159
  652    H    ALA  31           H        ALA  31  12.024  -9.037  -2.902
  653    HA   ALA  31           HA       ALA  31   9.972  -8.112  -4.438
  654   1HB   ALA  31          1HB       ALA  31  11.939 -10.308  -5.219
  655   2HB   ALA  31          2HB       ALA  31  11.028  -9.273  -6.339
  656   3HB   ALA  31          3HB       ALA  31  12.252  -8.553  -5.275
  657    H    GLU  32           H        GLU  32  10.219 -11.511  -3.298
  658    HA   GLU  32           HA       GLU  32   8.031 -12.335  -4.981
  659   1HB   GLU  32          1HB       GLU  32   9.656 -13.683  -2.839
  660   2HB   GLU  32          2HB       GLU  32   8.338 -14.483  -3.713
  661   1HG   GLU  32          1HG       GLU  32  10.245 -13.145  -5.555
  662   2HG   GLU  32          2HG       GLU  32  11.030 -14.332  -4.529
  663    H    ASP  33           H        ASP  33   8.375 -11.143  -1.711
  664    HA   ASP  33           HA       ASP  33   5.830 -12.002  -0.674
  665   1HB   ASP  33          1HB       ASP  33   7.743 -11.480   0.764
  666   2HB   ASP  33          2HB       ASP  33   7.828  -9.847   0.128
  667    H    LEU  34           H        LEU  34   7.259  -9.156  -2.211
  668    HA   LEU  34           HA       LEU  34   4.922  -7.545  -2.485
  669   1HB   LEU  34          1HB       LEU  34   6.949  -6.471  -2.741
  670   2HB   LEU  34          2HB       LEU  34   7.633  -7.661  -3.819
  671    HG   LEU  34           HG       LEU  34   5.278  -6.042  -4.800
  672   1HD1  LEU  34          1HD1      LEU  34   6.854  -4.409  -3.802
  673   2HD1  LEU  34          2HD1      LEU  34   6.899  -4.294  -5.567
  674   3HD1  LEU  34          3HD1      LEU  34   8.184  -5.163  -4.705
  675   1HD2  LEU  34          1HD2      LEU  34   7.751  -7.209  -6.164
  676   2HD2  LEU  34          2HD2      LEU  34   6.583  -6.139  -6.966
  677   3HD2  LEU  34          3HD2      LEU  34   6.069  -7.713  -6.405
  678    H    ARG  35           H        ARG  35   6.400  -9.781  -4.581
  679    HA   ARG  35           HA       ARG  35   4.690  -9.814  -6.827
  680   1HB   ARG  35          1HB       ARG  35   6.884 -11.072  -6.650
  681   2HB   ARG  35          2HB       ARG  35   6.032 -12.314  -5.733
  682   1HG   ARG  35          1HG       ARG  35   4.527 -12.698  -7.683
  683   2HG   ARG  35          2HG       ARG  35   5.485 -11.523  -8.614
  684   1HD   ARG  35          1HD       ARG  35   7.524 -12.942  -8.182
  685   2HD   ARG  35          2HD       ARG  35   6.499 -14.077  -7.284
  686    HE   ARG  35           HE       ARG  35   5.469 -13.671  -9.911
  687   1HH1  ARG  35          1HH1      ARG  35   8.072 -15.377  -8.146
  688   2HH1  ARG  35          2HH1      ARG  35   8.185 -16.670  -9.291
  689   1HH2  ARG  35          1HH2      ARG  35   5.648 -15.372 -11.448
  690   2HH2  ARG  35          2HH2      ARG  35   6.800 -16.643 -11.209
  691    H    THR  36           H        THR  36   4.566 -11.844  -3.902
  692    HA   THR  36           HA       THR  36   2.154 -13.220  -4.493
  693    HB   THR  36           HB       THR  36   3.159 -12.366  -1.739
  694    HG1  THR  36           1HG      THR  36   4.793 -13.491  -2.852
  695   1HG2  THR  36          1HG2      THR  36   1.403 -14.693  -2.640
  696   2HG2  THR  36          2HG2      THR  36   0.867 -13.291  -1.685
  697   3HG2  THR  36          3HG2      THR  36   2.025 -14.442  -0.996
  698    H    LEU  37           H        LEU  37   2.643 -10.145  -2.683
  699    HA   LEU  37           HA       LEU  37  -0.038  -9.314  -2.474
  700   1HB   LEU  37          1HB       LEU  37   1.104  -7.865  -1.270
  701   2HB   LEU  37          2HB       LEU  37   2.600  -8.252  -2.069
  702    HG   LEU  37           HG       LEU  37   1.944  -6.629  -3.919
  703   1HD1  LEU  37          1HD1      LEU  37   0.299  -4.812  -3.193
  704   2HD1  LEU  37          2HD1      LEU  37   0.104  -5.562  -1.617
  705   3HD1  LEU  37          3HD1      LEU  37  -0.565  -6.340  -3.036
  706   1HD2  LEU  37          1HD2      LEU  37   2.491  -4.662  -2.257
  707   2HD2  LEU  37          2HD2      LEU  37   3.683  -5.902  -2.655
  708   3HD2  LEU  37          3HD2      LEU  37   2.771  -6.000  -1.133
  709    H    GLN  38           H        GLN  38   2.198  -8.979  -5.294
  710    HA   GLN  38           HA       GLN  38   0.397  -7.430  -6.842
  711   1HB   GLN  38          1HB       GLN  38   2.814  -7.538  -7.167
  712   2HB   GLN  38          2HB       GLN  38   2.699  -9.220  -7.679
  713   1HG   GLN  38          1HG       GLN  38   1.368  -8.596  -9.637
  714   2HG   GLN  38          2HG       GLN  38   1.450  -6.893  -9.157
  715   1HE2  GLN  38          1HE2      GLN  38   3.811  -6.046  -8.780
  716   2HE2  GLN  38          2HE2      GLN  38   5.058  -6.762  -9.792
  717    H    GLN  39           H        GLN  39   0.724 -10.974  -6.304
  718    HA   GLN  39           HA       GLN  39  -1.036 -11.706  -8.439
  719   1HB   GLN  39          1HB       GLN  39  -0.637 -13.309  -5.912
  720   2HB   GLN  39          2HB       GLN  39  -1.237 -13.840  -7.471
  721   1HG   GLN  39          1HG       GLN  39   1.571 -13.203  -6.661
  722   2HG   GLN  39          2HG       GLN  39   0.940 -14.657  -7.387
  723   1HE2  GLN  39          1HE2      GLN  39   2.385 -11.605  -7.953
  724   2HE2  GLN  39          2HE2      GLN  39   2.421 -11.668  -9.725
  725    H    LEU  40           H        LEU  40  -1.468 -10.816  -4.976
  726    HA   LEU  40           HA       LEU  40  -4.313 -11.097  -4.898
  727   1HB   LEU  40          1HB       LEU  40  -2.930  -8.797  -3.552
  728   2HB   LEU  40          2HB       LEU  40  -4.392  -9.638  -3.105
  729    HG   LEU  40           HG       LEU  40  -1.579 -10.724  -2.892
  730   1HD1  LEU  40          1HD1      LEU  40  -3.527  -9.886  -0.730
  731   2HD1  LEU  40          2HD1      LEU  40  -2.110  -8.959  -1.267
  732   3HD1  LEU  40          3HD1      LEU  40  -1.891 -10.532  -0.483
  733   1HD2  LEU  40          1HD2      LEU  40  -2.514 -12.618  -1.655
  734   2HD2  LEU  40          2HD2      LEU  40  -3.085 -12.594  -3.330
  735   3HD2  LEU  40          3HD2      LEU  40  -4.156 -12.051  -2.017
  736    H    PHE  41           H        PHE  41  -2.287  -8.382  -6.111
  737    HA   PHE  41           HA       PHE  41  -4.550  -6.710  -6.802
  738   1HB   PHE  41          1HB       PHE  41  -1.631  -6.702  -7.496
  739   2HB   PHE  41          2HB       PHE  41  -2.727  -5.817  -8.534
  740    HD1  PHE  41           1HD      PHE  41  -3.227  -3.595  -8.041
  741    HD2  PHE  41           2HD      PHE  41  -2.044  -6.231  -4.843
  742    HE1  PHE  41           1HE      PHE  41  -3.288  -1.704  -6.457
  743    HE2  PHE  41           2HE      PHE  41  -2.146  -4.334  -3.248
  744    HZ   PHE  41           HZ       PHE  41  -2.787  -2.088  -4.036
  745    H    LEU  42           H        LEU  42  -2.694  -9.089  -8.689
  746    HA   LEU  42           HA       LEU  42  -4.205  -8.809 -11.110
  747   1HB   LEU  42          1HB       LEU  42  -2.518 -10.994  -9.863
  748   2HB   LEU  42          2HB       LEU  42  -3.277 -11.228 -11.429
  749    HG   LEU  42           HG       LEU  42  -1.434  -8.862 -10.872
  750   1HD1  LEU  42          1HD1      LEU  42  -0.155 -10.904 -10.444
  751   2HD1  LEU  42          2HD1      LEU  42   0.370 -10.158 -11.957
  752   3HD1  LEU  42          3HD1      LEU  42  -0.680 -11.595 -11.993
  753   1HD2  LEU  42          1HD2      LEU  42  -1.174  -8.847 -13.328
  754   2HD2  LEU  42          2HD2      LEU  42  -2.867  -8.635 -12.874
  755   3HD2  LEU  42          3HD2      LEU  42  -2.304 -10.211 -13.467
  756    H    SER  43           H        SER  43  -4.865 -10.610  -8.118
  757    HA   SER  43           HA       SER  43  -7.036 -12.147  -9.200
  758   1HB   SER  43          1HB       SER  43  -5.776 -13.099  -7.437
  759   2HB   SER  43          2HB       SER  43  -5.784 -11.632  -6.489
  760    HG   SER  43           HG       SER  43  -7.738 -11.998  -5.736
  761    H    THR  44           H        THR  44  -6.972  -9.737  -6.593
  762    HA   THR  44           HA       THR  44  -9.739  -9.018  -7.050
  763    HB   THR  44           HB       THR  44  -9.492  -9.296  -4.313
  764    HG1  THR  44           1HG      THR  44  -7.984 -10.650  -3.721
  765   1HG2  THR  44          1HG2      THR  44 -10.484 -11.509  -4.622
  766   2HG2  THR  44          2HG2      THR  44 -10.005 -11.483  -6.342
  767   3HG2  THR  44          3HG2      THR  44 -11.188 -10.292  -5.736
  768    H    LEU  45           H        LEU  45  -6.730  -7.920  -6.208
  769    HA   LEU  45           HA       LEU  45  -7.718  -5.716  -4.510
  770   1HB   LEU  45          1HB       LEU  45  -5.305  -7.335  -4.606
  771   2HB   LEU  45          2HB       LEU  45  -4.865  -5.657  -4.611
  772    HG   LEU  45           HG       LEU  45  -6.435  -5.355  -2.661
  773   1HD1  LEU  45          1HD1      LEU  45  -7.849  -7.347  -2.926
  774   2HD1  LEU  45          2HD1      LEU  45  -6.955  -7.507  -1.399
  775   3HD1  LEU  45          3HD1      LEU  45  -6.425  -8.387  -2.839
  776   1HD2  LEU  45          1HD2      LEU  45  -4.881  -6.340  -1.009
  777   2HD2  LEU  45          2HD2      LEU  45  -4.011  -5.527  -2.314
  778   3HD2  LEU  45          3HD2      LEU  45  -4.122  -7.303  -2.283
  779    H    SER  46           H        SER  46  -7.211  -3.574  -4.511
  780    HA   SER  46           HA       SER  46  -5.796  -2.371  -6.764
  781   1HB   SER  46          1HB       SER  46  -7.752  -0.601  -6.492
  782   2HB   SER  46          2HB       SER  46  -7.869  -1.963  -7.617
  783    HG   SER  46           HG       SER  46  -9.615  -1.252  -5.803
  784    H    PHE  47           H        PHE  47  -5.792   0.220  -6.094
  785    HA   PHE  47           HA       PHE  47  -5.152   0.464  -3.240
  786   1HB   PHE  47          1HB       PHE  47  -3.070  -0.003  -4.778
  787   2HB   PHE  47          2HB       PHE  47  -3.342   1.612  -5.376
  788    HD1  PHE  47           1HD      PHE  47  -2.172  -0.446  -2.550
  789    HD2  PHE  47           2HD      PHE  47  -2.985   3.584  -3.843
  790    HE1  PHE  47           1HE      PHE  47  -0.799   0.442  -0.705
  791    HE2  PHE  47           2HE      PHE  47  -1.682   4.465  -1.947
  792    HZ   PHE  47           HZ       PHE  47  -0.564   2.896  -0.370
  793    H    VAL  48           H        VAL  48  -4.965   2.799  -2.670
  794    HA   VAL  48           HA       VAL  48  -6.588   4.516  -4.329
  795    HB   VAL  48           HB       VAL  48  -6.970   4.481  -1.324
  796   1HG1  VAL  48          1HG1      VAL  48  -9.241   5.072  -2.047
  797   2HG1  VAL  48          2HG1      VAL  48  -8.036   6.108  -2.893
  798   3HG1  VAL  48          3HG1      VAL  48  -8.775   4.701  -3.726
  799   1HG2  VAL  48          1HG2      VAL  48  -7.419   2.131  -1.798
  800   2HG2  VAL  48          2HG2      VAL  48  -8.950   2.980  -1.584
  801   3HG2  VAL  48          3HG2      VAL  48  -8.410   2.604  -3.224
  802    H    CYS  49           H        CYS  49  -5.522   6.460  -4.671
  803    HA   CYS  49           HA       CYS  49  -3.007   6.968  -3.340
  804   1HB   CYS  49          1HB       CYS  49  -3.088   9.132  -4.545
  805   2HB   CYS  49          2HB       CYS  49  -3.339   7.754  -5.596
  806    HA   PRO  50           HA       PRO  50  -4.313   8.872   0.378
  807   1HB   PRO  50          1HB       PRO  50  -2.652  11.157   0.542
  808   2HB   PRO  50          2HB       PRO  50  -2.325   9.508   1.146
  809   1HG   PRO  50          1HG       PRO  50  -1.508  10.747  -1.488
  810   2HG   PRO  50          2HG       PRO  50  -0.542   9.700  -0.396
  811   1HD   PRO  50          1HD       PRO  50  -1.643   8.644  -2.579
  812   2HD   PRO  50          2HD       PRO  50  -1.761   7.765  -1.033
  813    H    TRP  51           H        TRP  51  -4.297  10.970  -2.472
  814    HA   TRP  51           HA       TRP  51  -5.944  13.088  -1.527
  815   1HB   TRP  51          1HB       TRP  51  -4.683  13.347  -3.548
  816   2HB   TRP  51          2HB       TRP  51  -5.367  11.893  -4.255
  817    HD1  TRP  51           HD       TRP  51  -7.201  14.981  -2.786
  818    HE1  TRP  51           1HE      TRP  51  -8.869  15.845  -4.505
  819    HE3  TRP  51           3HE      TRP  51  -6.009  11.882  -6.695
  820    HZ2  TRP  51           2HZ      TRP  51  -9.596  15.288  -7.255
  821    HZ3  TRP  51           3HZ      TRP  51  -7.188  12.102  -8.858
  822    HH2  TRP  51           HH       TRP  51  -8.986  13.786  -9.147
  823    H    CYS  52           H        CYS  52  -6.941  10.359  -3.693
  824    HA   CYS  52           HA       CYS  52  -9.702  10.795  -3.257
  825   1HB   CYS  52          1HB       CYS  52  -8.268   8.276  -4.190
  826   2HB   CYS  52          2HB       CYS  52  -9.979   8.658  -4.411
  827    H    ALA  53           H        ALA  53  -7.361   8.794  -1.543
  828    HA   ALA  53           HA       ALA  53  -9.092   7.155  -0.013
  829   1HB   ALA  53          1HB       ALA  53  -6.672   6.823  -0.083
  830   2HB   ALA  53          2HB       ALA  53  -6.397   8.439   0.598
  831   3HB   ALA  53          3HB       ALA  53  -7.153   7.213   1.595
  832    H    THR  54           H        THR  54  -7.645  10.360   0.731
  833    HA   THR  54           HA       THR  54  -9.016  10.713   3.213
  834    HB   THR  54           HB       THR  54  -7.699  12.784   1.392
  835    HG1  THR  54           1HG      THR  54  -6.152  11.372   1.745
  836   1HG2  THR  54          1HG2      THR  54  -7.233  13.988   3.505
  837   2HG2  THR  54          2HG2      THR  54  -8.146  12.764   4.413
  838   3HG2  THR  54          3HG2      THR  54  -8.977  13.820   3.246
  839    H    ASN  55           H        ASN  55  -9.578  11.985  -0.106
  840    HA   ASN  55           HA       ASN  55 -11.741  13.720   0.755
  841   1HB   ASN  55          1HB       ASN  55 -10.749  12.881  -2.007
  842   2HB   ASN  55          2HB       ASN  55 -12.127  13.946  -1.755
  843   1HD2  ASN  55          1HD2      ASN  55  -8.638  13.621  -0.960
  844   2HD2  ASN  55          2HD2      ASN  55  -8.432  15.352  -0.642
  845    H    GLN  56           H        GLN  56 -11.555  10.487  -0.568
  846    HA   GLN  56           HA       GLN  56 -13.018   8.840  -0.877
  847   1HB   GLN  56          2HB       GLN  56 -14.523   9.735   0.897
  848   2HB   GLN  56          3HB       GLN  56 -15.332  10.704  -0.333
  849   1HG   GLN  56          2HG       GLN  56 -16.621   9.023  -0.996
  850   2HG   GLN  56          3HG       GLN  56 -15.229   7.998  -1.312
  851   1HE2  GLN  56          1HE2      GLN  56 -17.362   6.685  -0.678
  852   2HE2  GLN  56          2HE2      GLN  56 -17.027   5.843   0.819
  Start of MODEL   10
    1   1H    GLY   1          1H        GLY   1 -17.415   9.644  -3.069
    2   1HA   GLY   1          1HA       GLY   1 -19.430  10.344  -1.841
    3   2HA   GLY   1          2HA       GLY   1 -19.762   9.228  -3.193
    4    H    SER   2           H        SER   2 -21.437   9.575  -0.808
    5    HA   SER   2           HA       SER   2 -20.803   7.241   0.870
    6   1HB   SER   2          1HB       SER   2 -22.621   9.596   1.446
    7   2HB   SER   2          2HB       SER   2 -21.918   8.448   2.601
    8    HG   SER   2           HG       SER   2 -20.740  10.390   2.551
    9    H    HIS   3           H        HIS   3 -23.000   7.778  -1.631
   10    HA   HIS   3           HA       HIS   3 -25.374   6.698  -0.361
   11   1HB   HIS   3          1HB       HIS   3 -25.181   8.307  -2.381
   12   2HB   HIS   3          2HB       HIS   3 -24.883   6.862  -3.347
   13    HD1  HIS   3           1HD      HIS   3 -27.080   4.974  -2.083
   14    HD2  HIS   3           2HD      HIS   3 -27.587   9.030  -3.068
   15    HE1  HIS   3           1HE      HIS   3 -29.626   5.351  -2.444
   16    H    MET   4           H        MET   4 -22.485   5.172  -1.299
   17    HA   MET   4           HA       MET   4 -23.724   2.549  -1.098
   18   1HB   MET   4          1HB       MET   4 -23.486   3.053  -3.591
   19   2HB   MET   4          2HB       MET   4 -21.751   3.256  -3.327
   20   1HG   MET   4          1HG       MET   4 -22.137   1.056  -4.192
   21   2HG   MET   4          2HG       MET   4 -21.648   0.872  -2.517
   22   1HE   MET   4          1HE       MET   4 -22.826  -1.371  -4.246
   23   2HE   MET   4          2HE       MET   4 -22.610  -1.713  -2.513
   24   3HE   MET   4          3HE       MET   4 -24.149  -2.102  -3.305
   25    H    ALA   5           H        ALA   5 -22.154   1.061  -0.169
   26    HA   ALA   5           HA       ALA   5 -19.396   1.780  -0.037
   27   1HB   ALA   5          1HB       ALA   5 -20.971   1.316   2.548
   28   2HB   ALA   5          2HB       ALA   5 -19.200   1.379   2.413
   29   3HB   ALA   5          3HB       ALA   5 -20.164   2.833   2.083
   30    H    GLU   6           H        GLU   6 -18.174  -0.214   0.246
   31    HA   GLU   6           HA       GLU   6 -19.678  -2.721   0.429
   32   1HB   GLU   6          1HB       GLU   6 -17.874  -1.901  -1.898
   33   2HB   GLU   6          2HB       GLU   6 -18.372  -3.567  -1.563
   34   1HG   GLU   6          1HG       GLU   6 -20.752  -2.922  -1.762
   35   2HG   GLU   6          2HG       GLU   6 -20.275  -1.264  -2.145
   36    HA   PRO   7           HA       PRO   7 -16.262  -3.464   3.050
   37   1HB   PRO   7          1HB       PRO   7 -16.259  -6.154   3.381
   38   2HB   PRO   7          2HB       PRO   7 -17.679  -5.158   3.798
   39   1HG   PRO   7          1HG       PRO   7 -17.197  -6.665   1.198
   40   2HG   PRO   7          2HG       PRO   7 -18.630  -6.762   2.275
   41   1HD   PRO   7          1HD       PRO   7 -18.566  -5.113   0.106
   42   2HD   PRO   7          2HD       PRO   7 -19.382  -4.626   1.623
   43    H    GLN   8           H        GLN   8 -15.085  -2.601   0.939
   44    HA   GLN   8           HA       GLN   8 -12.761  -4.390   0.481
   45   1HB   GLN   8          1HB       GLN   8 -14.334  -2.842  -1.596
   46   2HB   GLN   8          2HB       GLN   8 -12.610  -3.136  -1.798
   47   1HG   GLN   8          1HG       GLN   8 -13.797  -4.832  -2.992
   48   2HG   GLN   8          2HG       GLN   8 -12.938  -5.565  -1.649
   49   1HE2  GLN   8          1HE2      GLN   8 -14.226  -7.440  -1.132
   50   2HE2  GLN   8          2HE2      GLN   8 -15.946  -7.243  -0.836
   51    H    ARG   9           H        ARG   9 -13.877  -0.931   0.188
   52    HA   ARG   9           HA       ARG   9 -11.315   0.218   0.423
   53   1HB   ARG   9          1HB       ARG   9 -13.389   1.399  -0.320
   54   2HB   ARG   9          2HB       ARG   9 -13.946   1.432   1.350
   55   1HG   ARG   9          1HG       ARG   9 -11.374   2.550   0.612
   56   2HG   ARG   9          2HG       ARG   9 -12.827   3.514   0.405
   57   1HD   ARG   9          1HD       ARG   9 -13.259   3.373   2.846
   58   2HD   ARG   9          2HD       ARG   9 -11.798   2.418   3.066
   59    HE   ARG   9           HE       ARG   9 -10.407   4.200   2.459
   60   1HH1  ARG   9          1HH1      ARG   9 -13.721   5.219   2.972
   61   2HH1  ARG   9          2HH1      ARG   9 -13.403   6.893   3.200
   62   1HH2  ARG   9          1HH2      ARG   9  -9.822   6.277   2.671
   63   2HH2  ARG   9          2HH2      ARG   9 -10.972   7.581   2.627
   64    H    HIS  10           H        HIS  10  -9.946  -0.479   2.037
   65    HA   HIS  10           HA       HIS  10 -10.955  -0.431   4.847
   66   1HB   HIS  10          1HB       HIS  10  -9.300  -2.567   3.462
   67   2HB   HIS  10          2HB       HIS  10  -9.601  -2.446   5.207
   68    HD1  HIS  10           1HD      HIS  10 -10.636  -4.901   3.128
   69    HD2  HIS  10           2HD      HIS  10 -12.846  -1.735   4.604
   70    HE1  HIS  10           1HE      HIS  10 -12.962  -5.785   3.469
   71    H    LYS  11           H        LYS  11  -9.367  -0.078   6.462
   72    HA   LYS  11           HA       LYS  11  -7.179   1.622   5.426
   73   1HB   LYS  11          1HB       LYS  11  -9.558   2.256   7.125
   74   2HB   LYS  11          2HB       LYS  11  -8.030   3.156   7.334
   75   1HG   LYS  11          1HG       LYS  11  -7.960   3.869   5.114
   76   2HG   LYS  11          2HG       LYS  11  -9.190   2.733   4.564
   77   1HD   LYS  11          1HD       LYS  11  -9.881   5.078   4.684
   78   2HD   LYS  11          2HD       LYS  11 -10.961   3.954   5.507
   79   1HE   LYS  11          1HE       LYS  11 -10.545   4.790   7.522
   80   2HE   LYS  11          2HE       LYS  11  -8.853   5.223   7.190
   81   1HZ   LYS  11          1HZ       LYS  11 -10.291   7.178   7.463
   82   2HZ   LYS  11          2HZ       LYS  11 -11.118   6.762   6.093
   83   3HZ   LYS  11          3HZ       LYS  11  -9.494   7.109   6.028
   84    H    ILE  12           H        ILE  12  -5.500   0.444   5.973
   85    HA   ILE  12           HA       ILE  12  -5.150  -0.194   8.875
   86    HB   ILE  12           HB       ILE  12  -3.271  -0.748   6.548
   87   1HG1  ILE  12          1HG1      ILE  12  -5.076  -2.614   8.162
   88   2HG1  ILE  12          2HG1      ILE  12  -5.394  -2.083   6.512
   89   1HG2  ILE  12          1HG2      ILE  12  -3.168  -1.601   9.490
   90   2HG2  ILE  12          2HG2      ILE  12  -1.956  -1.974   8.238
   91   3HG2  ILE  12          3HG2      ILE  12  -2.173  -0.324   8.789
   92   1HD1  ILE  12          1HD1      ILE  12  -3.450  -3.188   5.656
   93   2HD1  ILE  12          2HD1      ILE  12  -2.989  -3.734   7.298
   94   3HD1  ILE  12          3HD1      ILE  12  -4.480  -4.320   6.561
   95    H    LEU  13           H        LEU  13  -5.150   1.884   9.719
   96    HA   LEU  13           HA       LEU  13  -3.313   3.901   8.814
   97   1HB   LEU  13          1HB       LEU  13  -5.267   4.426  10.205
   98   2HB   LEU  13          2HB       LEU  13  -4.549   3.564  11.569
   99    HG   LEU  13           HG       LEU  13  -2.925   5.729  10.179
  100   1HD1  LEU  13          1HD1      LEU  13  -5.081   6.766  10.411
  101   2HD1  LEU  13          2HD1      LEU  13  -3.979   7.432  11.645
  102   3HD1  LEU  13          3HD1      LEU  13  -5.207   6.234  12.106
  103   1HD2  LEU  13          1HD2      LEU  13  -1.797   4.548  12.014
  104   2HD2  LEU  13          2HD2      LEU  13  -3.169   4.851  13.096
  105   3HD2  LEU  13          3HD2      LEU  13  -2.156   6.191  12.526
  106    H    CYS  14           H        CYS  14  -1.280   3.331   8.586
  107    HA   CYS  14           HA       CYS  14   0.054   1.857  10.812
  108   1HB   CYS  14          1HB       CYS  14  -0.239   0.758   8.397
  109   2HB   CYS  14          2HB       CYS  14   1.148   1.787   8.000
  110    HG   CYS  14           HG       CYS  14   1.780  -0.780   8.676
  111    H    VAL  15           H        VAL  15   2.664   2.304  10.067
  112    HA   VAL  15           HA       VAL  15   2.949   5.233   9.923
  113    HB   VAL  15           HB       VAL  15   4.871   5.054  11.502
  114   1HG1  VAL  15          1HG1      VAL  15   3.488   5.178  13.503
  115   2HG1  VAL  15          2HG1      VAL  15   2.693   5.996  12.153
  116   3HG1  VAL  15          3HG1      VAL  15   2.134   4.384  12.665
  117   1HG2  VAL  15          1HG2      VAL  15   3.654   2.357  12.279
  118   2HG2  VAL  15          2HG2      VAL  15   5.200   2.578  11.421
  119   3HG2  VAL  15          3HG2      VAL  15   5.007   3.194  13.065
  120    H    CYS  16           H        CYS  16   4.870   5.936   9.047
  121    HA   CYS  16           HA       CYS  16   5.609   4.433   6.755
  122   1HB   CYS  16          1HB       CYS  16   5.429   6.979   7.001
  123   2HB   CYS  16          2HB       CYS  16   6.989   6.915   7.866
  124    H    CYS  17           H        CYS  17   7.337   3.289   6.292
  125    HA   CYS  17           HA       CYS  17   8.962   1.945   8.134
  126   1HB   CYS  17          1HB       CYS  17   8.639   1.453   5.616
  127   2HB   CYS  17          2HB       CYS  17   9.867   2.695   5.333
  128    HG   CYS  17           HG       CYS  17  11.251   0.876   4.970
  129    H    LYS  18           H        LYS  18   9.822   4.909   6.271
  130    HA   LYS  18           HA       LYS  18  12.468   4.853   7.572
  131   1HB   LYS  18          1HB       LYS  18  13.202   6.223   5.776
  132   2HB   LYS  18          2HB       LYS  18  12.408   4.781   5.152
  133   1HG   LYS  18          1HG       LYS  18  10.588   5.987   4.262
  134   2HG   LYS  18          2HG       LYS  18  10.798   7.340   5.371
  135   1HD   LYS  18          1HD       LYS  18  11.572   8.156   3.279
  136   2HD   LYS  18          2HD       LYS  18  12.982   7.886   4.267
  137   1HE   LYS  18          1HE       LYS  18  13.629   7.058   2.213
  138   2HE   LYS  18          2HE       LYS  18  13.152   5.575   3.057
  139   1HZ   LYS  18          1HZ       LYS  18  11.447   7.116   1.189
  140   2HZ   LYS  18          2HZ       LYS  18  11.048   5.667   1.915
  141   3HZ   LYS  18          3HZ       LYS  18  12.247   5.704   0.816
  142    H    CYS  19           H        CYS  19   9.551   6.785   7.759
  143    HA   CYS  19           HA       CYS  19  11.036   8.815   9.301
  144   1HB   CYS  19          1HB       CYS  19   9.588  10.434   8.288
  145   2HB   CYS  19          2HB       CYS  19  10.579   9.621   7.084
  146    H    ASP  20           H        ASP  20   8.836   6.341   9.741
  147    HA   ASP  20           HA       ASP  20   7.246   5.847  11.155
  148   1HB   ASP  20          1HB       ASP  20   9.186   6.420  12.636
  149   2HB   ASP  20          2HB       ASP  20   8.414   7.976  12.953
  150    H    GLY  21           H        GLY  21   6.688   8.193   9.282
  151   1HA   GLY  21          1HA       GLY  21   4.829   9.903  10.739
  152   2HA   GLY  21          2HA       GLY  21   5.012   9.862   8.980
  153    H    ARG  22           H        ARG  22   2.593   9.908  10.538
  154    HA   ARG  22           HA       ARG  22   1.254   7.352  10.595
  155   1HB   ARG  22          1HB       ARG  22   0.439   9.160  11.936
  156   2HB   ARG  22          2HB       ARG  22   0.300  10.252  10.568
  157   1HG   ARG  22          1HG       ARG  22  -1.406   7.738  10.790
  158   2HG   ARG  22          2HG       ARG  22  -1.832   9.260  11.583
  159   1HD   ARG  22          1HD       ARG  22  -1.601  10.363   9.256
  160   2HD   ARG  22          2HD       ARG  22  -1.656   8.716   8.606
  161    HE   ARG  22           HE       ARG  22  -3.817   8.968  10.353
  162   1HH1  ARG  22          1HH1      ARG  22  -2.734  10.437   7.335
  163   2HH1  ARG  22          2HH1      ARG  22  -4.320  10.761   6.718
  164   1HH2  ARG  22          1HH2      ARG  22  -5.960   9.456   9.594
  165   2HH2  ARG  22          2HH2      ARG  22  -6.190  10.177   8.042
  166    H    ILE  23           H        ILE  23   0.557   6.146   8.881
  167    HA   ILE  23           HA       ILE  23  -0.194   7.624   6.427
  168    HB   ILE  23           HB       ILE  23   0.932   4.813   6.317
  169   1HG1  ILE  23          1HG1      ILE  23   2.523   7.367   5.841
  170   2HG1  ILE  23          2HG1      ILE  23   2.791   6.167   7.112
  171   1HG2  ILE  23          1HG2      ILE  23   0.941   5.336   3.900
  172   2HG2  ILE  23          2HG2      ILE  23  -0.631   5.808   4.528
  173   3HG2  ILE  23          3HG2      ILE  23   0.595   7.047   4.231
  174   1HD1  ILE  23          1HD1      ILE  23   3.296   4.429   5.446
  175   2HD1  ILE  23          2HD1      ILE  23   3.096   5.619   4.136
  176   3HD1  ILE  23          3HD1      ILE  23   4.384   5.821   5.303
  177    H    GLU  24           H        GLU  24  -2.368   7.500   6.327
  178    HA   GLU  24           HA       GLU  24  -3.874   5.198   7.346
  179   1HB   GLU  24          1HB       GLU  24  -4.848   7.424   7.462
  180   2HB   GLU  24          2HB       GLU  24  -4.726   7.621   5.716
  181   1HG   GLU  24          1HG       GLU  24  -6.094   5.103   6.338
  182   2HG   GLU  24          2HG       GLU  24  -6.798   6.385   7.303
  183    H    LEU  25           H        LEU  25  -3.280   3.313   6.234
  184    HA   LEU  25           HA       LEU  25  -2.886   3.453   3.351
  185   1HB   LEU  25          1HB       LEU  25  -3.005   0.956   5.061
  186   2HB   LEU  25          2HB       LEU  25  -2.364   1.124   3.443
  187    HG   LEU  25           HG       LEU  25  -1.189   2.411   5.960
  188   1HD1  LEU  25          1HD1      LEU  25  -0.967  -0.030   5.970
  189   2HD1  LEU  25          2HD1      LEU  25   0.605   0.738   5.680
  190   3HD1  LEU  25          3HD1      LEU  25  -0.288  -0.001   4.327
  191   1HD2  LEU  25          1HD2      LEU  25  -0.722   3.663   3.838
  192   2HD2  LEU  25          2HD2      LEU  25  -0.092   2.187   3.109
  193   3HD2  LEU  25          3HD2      LEU  25   0.740   2.920   4.505
  194    H    THR  26           H        THR  26  -5.069   4.288   2.850
  195    HA   THR  26           HA       THR  26  -7.225   2.305   2.995
  196    HB   THR  26           HB       THR  26  -7.107   4.606   1.019
  197    HG1  THR  26           1HG      THR  26  -7.513   5.411   3.264
  198   1HG2  THR  26          1HG2      THR  26  -9.284   2.675   2.007
  199   2HG2  THR  26          2HG2      THR  26  -8.544   2.627   0.401
  200   3HG2  THR  26          3HG2      THR  26  -9.536   4.008   0.845
  201    H    VAL  27           H        VAL  27  -6.475   0.389   2.306
  202    HA   VAL  27           HA       VAL  27  -5.644   0.141  -0.555
  203    HB   VAL  27           HB       VAL  27  -4.850  -2.113  -0.171
  204   1HG1  VAL  27          1HG1      VAL  27  -4.177  -0.793   2.486
  205   2HG1  VAL  27          2HG1      VAL  27  -3.263  -1.999   1.558
  206   3HG1  VAL  27          3HG1      VAL  27  -3.432  -0.360   0.937
  207   1HG2  VAL  27          1HG2      VAL  27  -6.431  -1.987   2.467
  208   2HG2  VAL  27          2HG2      VAL  27  -6.824  -2.980   1.044
  209   3HG2  VAL  27          3HG2      VAL  27  -5.377  -3.318   1.976
  210    H    GLU  28           H        GLU  28  -7.254  -1.430  -1.751
  211    HA   GLU  28           HA       GLU  28  -9.904  -1.430  -0.372
  212   1HB   GLU  28          1HB       GLU  28  -9.684  -0.780  -3.304
  213   2HB   GLU  28          2HB       GLU  28 -11.087  -0.705  -2.217
  214   1HG   GLU  28          1HG       GLU  28  -9.809   1.086  -0.927
  215   2HG   GLU  28          2HG       GLU  28  -8.780   1.159  -2.363
  216    H    SER  29           H        SER  29 -10.078  -3.516   0.204
  217    HA   SER  29           HA       SER  29 -10.660  -5.324  -1.828
  218   1HB   SER  29          1HB       SER  29  -7.989  -5.471  -1.727
  219   2HB   SER  29          2HB       SER  29  -8.322  -6.503  -0.336
  220    HG   SER  29           HG       SER  29  -8.414  -7.872  -2.172
  221    H    SER  30           H        SER  30 -11.256  -7.455  -0.930
  222    HA   SER  30           HA       SER  30 -12.889  -7.348   1.302
  223   1HB   SER  30          1HB       SER  30 -11.480  -9.770   0.119
  224   2HB   SER  30          2HB       SER  30 -12.990  -9.782   1.051
  225    HG   SER  30           HG       SER  30 -13.207  -9.791  -1.306
  226    H    ALA  31           H        ALA  31 -12.723  -8.095   3.452
  227    HA   ALA  31           HA       ALA  31 -10.527  -7.082   4.740
  228   1HB   ALA  31          1HB       ALA  31 -12.483  -9.155   5.828
  229   2HB   ALA  31          2HB       ALA  31 -11.450  -8.086   6.798
  230   3HB   ALA  31          3HB       ALA  31 -12.733  -7.392   5.791
  231    H    GLU  32           H        GLU  32 -10.994 -10.527   3.891
  232    HA   GLU  32           HA       GLU  32  -8.687 -11.412   5.353
  233   1HB   GLU  32          1HB       GLU  32 -10.465 -12.679   3.268
  234   2HB   GLU  32          2HB       GLU  32  -9.152 -13.527   4.123
  235   1HG   GLU  32          1HG       GLU  32 -10.240 -12.889   6.319
  236   2HG   GLU  32          2HG       GLU  32 -11.607 -12.231   5.417
  237    H    ASP  33           H        ASP  33  -9.194 -10.168   2.105
  238    HA   ASP  33           HA       ASP  33  -6.778 -11.206   0.932
  239   1HB   ASP  33          1HB       ASP  33  -8.880 -10.461  -0.293
  240   2HB   ASP  33          2HB       ASP  33  -8.477  -8.802   0.136
  241    H    LEU  34           H        LEU  34  -7.956  -8.257   2.457
  242    HA   LEU  34           HA       LEU  34  -5.536  -6.789   2.564
  243   1HB   LEU  34          1HB       LEU  34  -7.440  -5.556   2.975
  244   2HB   LEU  34          2HB       LEU  34  -8.134  -6.703   4.094
  245    HG   LEU  34           HG       LEU  34  -5.620  -5.173   4.873
  246   1HD1  LEU  34          1HD1      LEU  34  -7.288  -3.538   4.101
  247   2HD1  LEU  34          2HD1      LEU  34  -7.125  -3.456   5.859
  248   3HD1  LEU  34          3HD1      LEU  34  -8.507  -4.316   5.148
  249   1HD2  LEU  34          1HD2      LEU  34  -7.888  -6.462   6.466
  250   2HD2  LEU  34          2HD2      LEU  34  -6.753  -5.299   7.176
  251   3HD2  LEU  34          3HD2      LEU  34  -6.150  -6.817   6.571
  252    H    ARG  35           H        ARG  35  -6.995  -8.927   4.791
  253    HA   ARG  35           HA       ARG  35  -5.098  -8.967   6.861
  254   1HB   ARG  35          1HB       ARG  35  -7.389 -10.103   6.854
  255   2HB   ARG  35          2HB       ARG  35  -6.601 -11.501   6.118
  256   1HG   ARG  35          1HG       ARG  35  -5.087 -11.681   8.049
  257   2HG   ARG  35          2HG       ARG  35  -5.782 -10.201   8.750
  258   1HD   ARG  35          1HD       ARG  35  -8.009 -11.346   8.835
  259   2HD   ARG  35          2HD       ARG  35  -7.227 -12.837   8.259
  260    HE   ARG  35           HE       ARG  35  -5.812 -11.832  10.500
  261   1HH1  ARG  35          1HH1      ARG  35  -8.899 -13.394   9.768
  262   2HH1  ARG  35          2HH1      ARG  35  -9.130 -14.062  11.344
  263   1HH2  ARG  35          1HH2      ARG  35  -6.073 -12.724  12.605
  264   2HH2  ARG  35          2HH2      ARG  35  -7.461 -13.669  13.000
  265    H    THR  36           H        THR  36  -5.287 -11.039   3.987
  266    HA   THR  36           HA       THR  36  -2.876 -12.489   4.448
  267    HB   THR  36           HB       THR  36  -4.057 -11.704   1.739
  268    HG1  THR  36           1HG      THR  36  -5.656 -12.695   3.029
  269   1HG2  THR  36          1HG2      THR  36  -2.373 -14.092   2.623
  270   2HG2  THR  36          2HG2      THR  36  -1.822 -12.763   1.577
  271   3HG2  THR  36          3HG2      THR  36  -3.093 -13.867   1.017
  272    H    LEU  37           H        LEU  37  -3.415  -9.409   2.654
  273    HA   LEU  37           HA       LEU  37  -0.720  -8.682   2.222
  274   1HB   LEU  37          1HB       LEU  37  -1.909  -7.140   1.135
  275   2HB   LEU  37          2HB       LEU  37  -3.347  -7.493   2.054
  276    HG   LEU  37           HG       LEU  37  -2.456  -5.964   3.895
  277   1HD1  LEU  37          1HD1      LEU  37  -0.021  -5.765   2.896
  278   2HD1  LEU  37          2HD1      LEU  37  -0.800  -4.199   3.088
  279   3HD1  LEU  37          3HD1      LEU  37  -0.723  -4.970   1.503
  280   1HD2  LEU  37          1HD2      LEU  37  -3.194  -3.936   2.780
  281   2HD2  LEU  37          2HD2      LEU  37  -4.289  -5.272   2.524
  282   3HD2  LEU  37          3HD2      LEU  37  -3.189  -4.784   1.217
  283    H    GLN  38           H        GLN  38  -2.679  -8.341   5.189
  284    HA   GLN  38           HA       GLN  38  -0.728  -6.817   6.631
  285   1HB   GLN  38          1HB       GLN  38  -3.032  -6.711   7.207
  286   2HB   GLN  38          2HB       GLN  38  -3.130  -8.442   7.395
  287   1HG   GLN  38          1HG       GLN  38  -1.558  -8.228   9.404
  288   2HG   GLN  38          2HG       GLN  38  -1.913  -6.491   9.323
  289   1HE2  GLN  38          1HE2      GLN  38  -4.316  -5.915   9.286
  290   2HE2  GLN  38          2HE2      GLN  38  -5.463  -7.012  10.023
  291    H    GLN  39           H        GLN  39  -1.198 -10.346   6.114
  292    HA   GLN  39           HA       GLN  39   0.757 -11.073   8.089
  293   1HB   GLN  39          1HB       GLN  39  -0.014 -12.736   5.693
  294   2HB   GLN  39          2HB       GLN  39   0.747 -13.248   7.193
  295   1HG   GLN  39          1HG       GLN  39  -2.107 -12.548   6.658
  296   2HG   GLN  39          2HG       GLN  39  -1.442 -13.941   7.467
  297   1HE2  GLN  39          1HE2      GLN  39  -2.818 -10.859   7.864
  298   2HE2  GLN  39          2HE2      GLN  39  -2.721 -10.702   9.613
  299    H    LEU  40           H        LEU  40   0.835 -10.255   4.602
  300    HA   LEU  40           HA       LEU  40   3.669 -10.620   4.273
  301   1HB   LEU  40          1HB       LEU  40   1.821  -8.745   2.784
  302   2HB   LEU  40          2HB       LEU  40   3.450  -9.159   2.314
  303    HG   LEU  40           HG       LEU  40   1.226 -11.232   2.611
  304   1HD1  LEU  40          1HD1      LEU  40   0.643  -9.629   0.849
  305   2HD1  LEU  40          2HD1      LEU  40   1.077 -11.194   0.159
  306   3HD1  LEU  40          3HD1      LEU  40   2.240  -9.847   0.118
  307   1HD2  LEU  40          1HD2      LEU  40   2.690 -12.676   1.274
  308   2HD2  LEU  40          2HD2      LEU  40   3.514 -12.187   2.756
  309   3HD2  LEU  40          3HD2      LEU  40   3.926 -11.399   1.223
  310    H    PHE  41           H        PHE  41   1.759  -7.989   5.646
  311    HA   PHE  41           HA       PHE  41   3.896  -6.097   6.023
  312   1HB   PHE  41          1HB       PHE  41   1.203  -5.990   6.267
  313   2HB   PHE  41          2HB       PHE  41   1.628  -6.144   7.963
  314    HD1  PHE  41           1HD      PHE  41   3.425  -4.396   8.856
  315    HD2  PHE  41           2HD      PHE  41   1.196  -3.938   5.192
  316    HE1  PHE  41           1HE      PHE  41   3.954  -1.978   8.829
  317    HE2  PHE  41           2HE      PHE  41   1.720  -1.525   5.170
  318    HZ   PHE  41           HZ       PHE  41   3.130  -0.534   6.970
  319    H    LEU  42           H        LEU  42   2.491  -8.572   8.142
  320    HA   LEU  42           HA       LEU  42   4.377  -8.234  10.281
  321   1HB   LEU  42          1HB       LEU  42   2.523 -10.478   9.418
  322   2HB   LEU  42          2HB       LEU  42   3.489 -10.586  10.883
  323    HG   LEU  42           HG       LEU  42   1.581  -8.254  10.405
  324   1HD1  LEU  42          1HD1      LEU  42   0.255 -10.303  10.268
  325   2HD1  LEU  42          2HD1      LEU  42  -0.078  -9.454  11.780
  326   3HD1  LEU  42          3HD1      LEU  42   0.962 -10.899  11.783
  327   1HD2  LEU  42          1HD2      LEU  42   1.639  -8.068  12.861
  328   2HD2  LEU  42          2HD2      LEU  42   3.265  -7.923  12.185
  329   3HD2  LEU  42          3HD2      LEU  42   2.761  -9.443  12.954
  330    H    SER  43           H        SER  43   4.497 -10.126   7.323
  331    HA   SER  43           HA       SER  43   6.845 -11.665   7.798
  332   1HB   SER  43          1HB       SER  43   5.453 -12.319   6.027
  333   2HB   SER  43          2HB       SER  43   5.257 -10.689   5.461
  334    HG   SER  43           HG       SER  43   6.547 -11.135   3.991
  335    H    THR  44           H        THR  44   6.719  -8.904   5.527
  336    HA   THR  44           HA       THR  44   8.963  -7.695   6.893
  337    HB   THR  44           HB       THR  44  10.314  -7.325   4.830
  338    HG1  THR  44           1HG      THR  44   8.600  -7.981   3.238
  339   1HG2  THR  44          1HG2      THR  44  10.783  -9.106   6.494
  340   2HG2  THR  44          2HG2      THR  44  11.377  -9.468   4.857
  341   3HG2  THR  44          3HG2      THR  44   9.895 -10.254   5.460
  342    H    LEU  45           H        LEU  45   6.303  -7.312   4.826
  343    HA   LEU  45           HA       LEU  45   7.069  -4.941   3.602
  344   1HB   LEU  45          1HB       LEU  45   5.220  -6.445   2.884
  345   2HB   LEU  45          2HB       LEU  45   4.166  -5.748   4.075
  346    HG   LEU  45           HG       LEU  45   5.543  -3.819   2.220
  347   1HD1  LEU  45          1HD1      LEU  45   4.880  -5.636   0.719
  348   2HD1  LEU  45          2HD1      LEU  45   3.802  -4.248   0.507
  349   3HD1  LEU  45          3HD1      LEU  45   3.259  -5.664   1.440
  350   1HD2  LEU  45          1HD2      LEU  45   2.668  -4.003   3.235
  351   2HD2  LEU  45          2HD2      LEU  45   3.385  -2.659   2.317
  352   3HD2  LEU  45          3HD2      LEU  45   3.938  -2.995   3.959
  353    H    SER  46           H        SER  46   7.570  -3.039   4.308
  354    HA   SER  46           HA       SER  46   5.840  -1.761   6.348
  355   1HB   SER  46          1HB       SER  46   8.628  -1.009   5.378
  356   2HB   SER  46          2HB       SER  46   7.683  -0.203   6.659
  357    HG   SER  46           HG       SER  46   8.390  -2.947   6.712
  358    H    PHE  47           H        PHE  47   5.595   0.646   5.621
  359    HA   PHE  47           HA       PHE  47   5.095   0.776   2.702
  360   1HB   PHE  47          1HB       PHE  47   3.022   0.313   4.268
  361   2HB   PHE  47          2HB       PHE  47   3.170   2.010   4.671
  362    HD1  PHE  47           1HD      PHE  47   2.027  -0.421   2.223
  363    HD2  PHE  47           2HD      PHE  47   3.059   3.740   2.729
  364    HE1  PHE  47           1HE      PHE  47   0.835   0.143   0.124
  365    HE2  PHE  47           2HE      PHE  47   1.928   4.279   0.602
  366    HZ   PHE  47           HZ       PHE  47   0.811   2.483  -0.709
  367    H    VAL  48           H        VAL  48   5.344   2.819   1.831
  368    HA   VAL  48           HA       VAL  48   6.534   4.841   3.507
  369    HB   VAL  48           HB       VAL  48   7.760   3.029   1.524
  370   1HG1  VAL  48          1HG1      VAL  48   9.545   4.243   0.802
  371   2HG1  VAL  48          2HG1      VAL  48   8.108   5.093   0.260
  372   3HG1  VAL  48          3HG1      VAL  48   9.053   5.710   1.659
  373   1HG2  VAL  48          1HG2      VAL  48   8.436   2.772   3.726
  374   2HG2  VAL  48          2HG2      VAL  48   9.758   3.788   3.115
  375   3HG2  VAL  48          3HG2      VAL  48   8.516   4.513   4.066
  376    H    CYS  49           H        CYS  49   5.587   6.609   3.320
  377    HA   CYS  49           HA       CYS  49   3.360   7.022   1.571
  378   1HB   CYS  49          1HB       CYS  49   3.512   9.363   2.640
  379   2HB   CYS  49          2HB       CYS  49   3.226   7.989   3.685
  380    HA   PRO  50           HA       PRO  50   5.278   8.413  -2.023
  381   1HB   PRO  50          1HB       PRO  50   3.620  10.419  -3.033
  382   2HB   PRO  50          2HB       PRO  50   3.347   8.655  -3.144
  383   1HG   PRO  50          1HG       PRO  50   2.240  10.591  -1.095
  384   2HG   PRO  50          2HG       PRO  50   1.371   9.304  -1.993
  385   1HD   PRO  50          1HD       PRO  50   2.187   8.879   0.531
  386   2HD   PRO  50          2HD       PRO  50   2.384   7.592  -0.694
  387    H    TRP  51           H        TRP  51   4.638  10.958   0.314
  388    HA   TRP  51           HA       TRP  51   6.359  13.011  -0.639
  389   1HB   TRP  51          1HB       TRP  51   4.812  13.505   1.110
  390   2HB   TRP  51          2HB       TRP  51   5.366  12.159   2.098
  391    HD1  TRP  51           HD       TRP  51   6.958  15.399   0.673
  392    HE1  TRP  51           1HE      TRP  51   8.574  16.360   2.406
  393    HE3  TRP  51           3HE      TRP  51   6.382  11.885   4.368
  394    HZ2  TRP  51           2HZ      TRP  51   9.486  15.713   5.076
  395    HZ3  TRP  51           3HZ      TRP  51   7.633  12.097   6.491
  396    HH2  TRP  51           HH       TRP  51   9.187  13.995   6.854
  397    H    CYS  52           H        CYS  52   7.060  10.515   1.917
  398    HA   CYS  52           HA       CYS  52   9.890  11.098   1.811
  399   1HB   CYS  52          1HB       CYS  52  10.077   9.632   3.569
  400   2HB   CYS  52          2HB       CYS  52   8.416  10.174   3.692
  401    H    ALA  53           H        ALA  53   7.749   8.951   0.023
  402    HA   ALA  53           HA       ALA  53   9.784   7.210  -0.735
  403   1HB   ALA  53          1HB       ALA  53   7.338   6.772  -1.177
  404   2HB   ALA  53          2HB       ALA  53   7.376   8.025  -2.441
  405   3HB   ALA  53          3HB       ALA  53   8.339   6.562  -2.633
  406    H    THR  54           H        THR  54   8.563  10.248  -2.086
  407    HA   THR  54           HA       THR  54  10.333  10.489  -4.332
  408    HB   THR  54           HB       THR  54   8.773  12.637  -2.815
  409    HG1  THR  54           1HG      THR  54   7.296  11.144  -3.419
  410   1HG2  THR  54          1HG2      THR  54   8.705  13.792  -4.997
  411   2HG2  THR  54          2HG2      THR  54   9.726  12.526  -5.711
  412   3HG2  THR  54          3HG2      THR  54  10.374  13.591  -4.441
  413    H    ASN  55           H        ASN  55  10.367  11.848  -0.996
  414    HA   ASN  55           HA       ASN  55  12.804  13.382  -1.492
  415   1HB   ASN  55          1HB       ASN  55  11.226  12.810   1.057
  416   2HB   ASN  55          2HB       ASN  55  12.699  13.769   1.016
  417   1HD2  ASN  55          1HD2      ASN  55   9.386  13.616  -0.396
  418   2HD2  ASN  55          2HD2      ASN  55   9.383  15.325  -0.818
  419    H    GLN  56           H        GLN  56  12.104  10.249  -0.270
  420    HA   GLN  56           HA       GLN  56  13.280   8.493   0.443
  421   1HB   GLN  56          2HB       GLN  56  15.176   9.225  -1.093
  422   2HB   GLN  56          3HB       GLN  56  15.877  10.017   0.328
  423   1HG   GLN  56          2HG       GLN  56  16.031   7.822   1.482
  424   2HG   GLN  56          3HG       GLN  56  15.196   7.049   0.134
  425   1HE2  GLN  56          1HE2      GLN  56  17.914   9.462   0.177
  426   2HE2  GLN  56          2HE2      GLN  56  19.020   8.416  -0.705
  427   1H    GLY   1          1H        GLY   1  22.900   3.014   5.237
  428   1HA   GLY   1          1HA       GLY   1  23.107   4.308   7.872
  429   2HA   GLY   1          2HA       GLY   1  24.322   3.226   7.146
  430    H    SER   2           H        SER   2  26.021   4.869   6.959
  431    HA   SER   2           HA       SER   2  25.725   7.357   5.740
  432   1HB   SER   2          1HB       SER   2  28.123   5.493   5.556
  433   2HB   SER   2          2HB       SER   2  28.131   7.267   5.552
  434    HG   SER   2           HG       SER   2  27.613   7.261   7.693
  435    H    HIS   3           H        HIS   3  25.742   4.169   4.306
  436    HA   HIS   3           HA       HIS   3  25.031   5.390   1.734
  437   1HB   HIS   3          1HB       HIS   3  26.419   2.693   2.016
  438   2HB   HIS   3          2HB       HIS   3  25.944   3.493   0.522
  439    HD1  HIS   3           1HD      HIS   3  29.006   2.632   1.832
  440    HD2  HIS   3           2HD      HIS   3  27.292   6.376   0.933
  441    HE1  HIS   3           1HE      HIS   3  30.940   4.276   1.524
  442    H    MET   4           H        MET   4  23.278   3.985   0.692
  443    HA   MET   4           HA       MET   4  22.186   1.834   2.242
  444   1HB   MET   4          1HB       MET   4  21.229   4.097   3.227
  445   2HB   MET   4          2HB       MET   4  20.328   4.187   1.712
  446   1HG   MET   4          1HG       MET   4  18.905   3.163   3.343
  447   2HG   MET   4          2HG       MET   4  19.396   1.896   2.240
  448   1HE   MET   4          1HE       MET   4  17.999   1.178   4.867
  449   2HE   MET   4          2HE       MET   4  18.651  -0.021   3.730
  450   3HE   MET   4          3HE       MET   4  19.017  -0.154   5.465
  451    H    ALA   5           H        ALA   5  20.500   0.813   1.040
  452    HA   ALA   5           HA       ALA   5  19.063   1.044  -1.084
  453   1HB   ALA   5          1HB       ALA   5  20.297   0.114  -3.010
  454   2HB   ALA   5          2HB       ALA   5  20.767   1.780  -2.610
  455   3HB   ALA   5          3HB       ALA   5  21.828   0.408  -2.144
  456    H    GLU   6           H        GLU   6  17.982  -0.865  -1.132
  457    HA   GLU   6           HA       GLU   6  19.203  -3.255   0.076
  458   1HB   GLU   6          1HB       GLU   6  17.568  -2.991   1.927
  459   2HB   GLU   6          2HB       GLU   6  18.744  -1.701   1.863
  460   1HG   GLU   6          1HG       GLU   6  15.805  -1.556   1.084
  461   2HG   GLU   6          2HG       GLU   6  16.664  -0.831   2.441
  462    HA   PRO   7           HA       PRO   7  16.171  -5.232  -2.397
  463   1HB   PRO   7          1HB       PRO   7  16.255  -7.776  -1.486
  464   2HB   PRO   7          2HB       PRO   7  17.721  -6.947  -2.073
  465   1HG   PRO   7          1HG       PRO   7  16.829  -7.337   0.791
  466   2HG   PRO   7          2HG       PRO   7  18.455  -7.584   0.089
  467   1HD   PRO   7          1HD       PRO   7  17.591  -5.252   1.381
  468   2HD   PRO   7          2HD       PRO   7  18.942  -5.300   0.235
  469    H    GLN   8           H        GLN   8  14.887  -3.628  -0.445
  470    HA   GLN   8           HA       GLN   8  12.392  -5.152   0.062
  471   1HB   GLN   8          1HB       GLN   8  13.964  -3.603   2.128
  472   2HB   GLN   8          2HB       GLN   8  12.207  -3.572   2.173
  473   1HG   GLN   8          1HG       GLN   8  12.940  -5.273   3.667
  474   2HG   GLN   8          2HG       GLN   8  12.097  -6.021   2.324
  475   1HE2  GLN   8          1HE2      GLN   8  13.099  -8.146   2.178
  476   2HE2  GLN   8          2HE2      GLN   8  14.837  -8.240   1.975
  477    H    ARG   9           H        ARG   9  13.874  -1.845   0.036
  478    HA   ARG   9           HA       ARG   9  11.471  -0.386  -0.194
  479   1HB   ARG   9          1HB       ARG   9  13.602   0.528   0.538
  480   2HB   ARG   9          2HB       ARG   9  14.292   0.135  -1.040
  481   1HG   ARG   9          1HG       ARG   9  12.022   1.858  -1.432
  482   2HG   ARG   9          2HG       ARG   9  13.094   2.575  -0.219
  483   1HD   ARG   9          1HD       ARG   9  13.961   1.625  -2.957
  484   2HD   ARG   9          2HD       ARG   9  13.647   3.302  -2.492
  485    HE   ARG   9           HE       ARG   9  15.761   1.520  -1.253
  486   1HH1  ARG   9          1HH1      ARG   9  15.094   4.764  -2.544
  487   2HH1  ARG   9          2HH1      ARG   9  16.411   5.477  -1.617
  488   1HH2  ARG   9          1HH2      ARG   9  17.246   2.535   0.117
  489   2HH2  ARG   9          2HH2      ARG   9  17.669   4.220  -0.221
  490    H    HIS  10           H        HIS  10   9.987  -1.134  -1.792
  491    HA   HIS  10           HA       HIS  10  10.979  -1.188  -4.596
  492   1HB   HIS  10          1HB       HIS  10   9.135  -3.109  -3.137
  493   2HB   HIS  10          2HB       HIS  10   9.443  -3.115  -4.877
  494    HD1  HIS  10           1HD      HIS  10  10.278  -5.471  -2.548
  495    HD2  HIS  10           2HD      HIS  10  12.757  -2.642  -4.292
  496    HE1  HIS  10           1HE      HIS  10  12.531  -6.523  -2.658
  497    H    LYS  11           H        LYS  11   9.067  -1.134  -6.159
  498    HA   LYS  11           HA       LYS  11   7.124   0.927  -5.282
  499   1HB   LYS  11          1HB       LYS  11   9.219   1.258  -7.458
  500   2HB   LYS  11          2HB       LYS  11   7.761   2.227  -7.316
  501   1HG   LYS  11          1HG       LYS  11   8.928   3.639  -6.025
  502   2HG   LYS  11          2HG       LYS  11   8.715   2.457  -4.769
  503   1HD   LYS  11          1HD       LYS  11  11.022   3.043  -4.765
  504   2HD   LYS  11          2HD       LYS  11  10.929   1.420  -5.440
  505   1HE   LYS  11          1HE       LYS  11  12.511   2.752  -6.717
  506   2HE   LYS  11          2HE       LYS  11  11.123   2.357  -7.739
  507   1HZ   LYS  11          1HZ       LYS  11  11.845   4.688  -7.915
  508   2HZ   LYS  11          2HZ       LYS  11  11.419   4.948  -6.341
  509   3HZ   LYS  11          3HZ       LYS  11  10.285   4.573  -7.467
  510    H    ILE  12           H        ILE  12   5.362  -0.339  -5.617
  511    HA   ILE  12           HA       ILE  12   5.035  -1.689  -8.247
  512    HB   ILE  12           HB       ILE  12   3.014  -1.501  -5.995
  513   1HG1  ILE  12          1HG1      ILE  12   4.834  -3.862  -6.532
  514   2HG1  ILE  12          2HG1      ILE  12   5.059  -2.690  -5.225
  515   1HG2  ILE  12          1HG2      ILE  12   3.195  -3.284  -8.465
  516   2HG2  ILE  12          2HG2      ILE  12   1.889  -3.314  -7.252
  517   3HG2  ILE  12          3HG2      ILE  12   2.105  -1.902  -8.275
  518   1HD1  ILE  12          1HD1      ILE  12   2.710  -3.205  -4.431
  519   2HD1  ILE  12          2HD1      ILE  12   2.748  -4.613  -5.530
  520   3HD1  ILE  12          3HD1      ILE  12   3.920  -4.461  -4.209
  521    H    LEU  13           H        LEU  13   4.987   0.073  -9.650
  522    HA   LEU  13           HA       LEU  13   3.231   2.312  -9.301
  523   1HB   LEU  13          1HB       LEU  13   5.151   2.308 -10.851
  524   2HB   LEU  13          2HB       LEU  13   4.287   1.197 -11.920
  525    HG   LEU  13           HG       LEU  13   2.893   3.745 -11.012
  526   1HD1  LEU  13          1HD1      LEU  13   5.093   4.503 -11.606
  527   2HD1  LEU  13          2HD1      LEU  13   3.928   4.980 -12.867
  528   3HD1  LEU  13          3HD1      LEU  13   5.035   3.611 -13.148
  529   1HD2  LEU  13          1HD2      LEU  13   2.881   2.222 -13.662
  530   2HD2  LEU  13          2HD2      LEU  13   1.953   3.698 -13.316
  531   3HD2  LEU  13          3HD2      LEU  13   1.587   2.215 -12.450
  532    H    CYS  14           H        CYS  14   1.176   2.014  -8.941
  533    HA   CYS  14           HA       CYS  14  -0.334   0.294 -10.839
  534   1HB   CYS  14          1HB       CYS  14  -0.203  -0.477  -8.311
  535   2HB   CYS  14          2HB       CYS  14  -1.347   0.853  -8.042
  536    HG   CYS  14           HG       CYS  14  -1.529  -1.773 -10.062
  537    H    VAL  15           H        VAL  15  -2.848   1.201 -10.310
  538    HA   VAL  15           HA       VAL  15  -2.726   4.136 -10.489
  539    HB   VAL  15           HB       VAL  15  -4.694   4.073 -11.998
  540   1HG1  VAL  15          1HG1      VAL  15  -3.395   3.756 -14.032
  541   2HG1  VAL  15          2HG1      VAL  15  -2.431   4.587 -12.805
  542   3HG1  VAL  15          3HG1      VAL  15  -2.142   2.861 -13.140
  543   1HG2  VAL  15          1HG2      VAL  15  -3.935   1.145 -12.468
  544   2HG2  VAL  15          2HG2      VAL  15  -5.405   1.709 -11.634
  545   3HG2  VAL  15          3HG2      VAL  15  -5.159   2.085 -13.341
  546    H    CYS  16           H        CYS  16  -4.466   5.184  -9.587
  547    HA   CYS  16           HA       CYS  16  -5.389   4.026  -7.156
  548   1HB   CYS  16          1HB       CYS  16  -5.035   6.536  -7.765
  549   2HB   CYS  16          2HB       CYS  16  -6.624   6.435  -8.575
  550    H    CYS  17           H        CYS  17  -7.198   2.986  -6.663
  551    HA   CYS  17           HA       CYS  17  -8.772   1.647  -8.549
  552   1HB   CYS  17          1HB       CYS  17  -8.399   1.095  -6.086
  553   2HB   CYS  17          2HB       CYS  17  -9.595   2.336  -5.704
  554    HG   CYS  17           HG       CYS  17 -11.069   0.637  -5.410
  555    H    LYS  18           H        LYS  18  -9.554   4.764  -6.864
  556    HA   LYS  18           HA       LYS  18 -12.167   4.761  -8.239
  557   1HB   LYS  18          1HB       LYS  18 -12.946   6.096  -6.465
  558   2HB   LYS  18          2HB       LYS  18 -12.027   4.765  -5.773
  559   1HG   LYS  18          1HG       LYS  18 -10.982   6.295  -4.526
  560   2HG   LYS  18          2HG       LYS  18 -10.088   6.727  -5.980
  561   1HD   LYS  18          1HD       LYS  18 -10.837   8.736  -5.082
  562   2HD   LYS  18          2HD       LYS  18 -11.948   8.466  -6.425
  563   1HE   LYS  18          1HE       LYS  18 -13.713   7.856  -4.954
  564   2HE   LYS  18          2HE       LYS  18 -12.601   7.538  -3.610
  565   1HZ   LYS  18          1HZ       LYS  18 -12.192   9.838  -3.355
  566   2HZ   LYS  18          2HZ       LYS  18 -13.838   9.672  -3.418
  567   3HZ   LYS  18          3HZ       LYS  18 -13.039  10.233  -4.730
  568    H    CYS  19           H        CYS  19  -9.108   6.481  -8.510
  569    HA   CYS  19           HA       CYS  19 -10.476   8.423 -10.243
  570   1HB   CYS  19          1HB       CYS  19  -8.998  10.064  -9.396
  571   2HB   CYS  19          2HB       CYS  19  -9.965   9.406  -8.083
  572    H    ASP  20           H        ASP  20  -8.411   5.802 -10.438
  573    HA   ASP  20           HA       ASP  20  -6.892   5.094 -11.828
  574   1HB   ASP  20          1HB       ASP  20  -8.781   5.728 -13.353
  575   2HB   ASP  20          2HB       ASP  20  -7.884   7.191 -13.767
  576    H    GLY  21           H        GLY  21  -6.125   7.500 -10.105
  577   1HA   GLY  21          1HA       GLY  21  -4.148   8.960 -11.661
  578   2HA   GLY  21          2HA       GLY  21  -4.282   9.007  -9.902
  579    H    ARG  22           H        ARG  22  -1.953   8.770 -11.578
  580    HA   ARG  22           HA       ARG  22  -0.802   6.122 -11.517
  581   1HB   ARG  22          1HB       ARG  22  -0.093   7.881 -13.052
  582   2HB   ARG  22          2HB       ARG  22   0.439   8.912 -11.730
  583   1HG   ARG  22          1HG       ARG  22   1.707   6.181 -12.067
  584   2HG   ARG  22          2HG       ARG  22   2.100   7.470 -13.205
  585   1HD   ARG  22          1HD       ARG  22   2.707   8.941 -11.200
  586   2HD   ARG  22          2HD       ARG  22   2.610   7.467 -10.215
  587    HE   ARG  22           HE       ARG  22   4.245   7.124 -12.567
  588   1HH1  ARG  22          1HH1      ARG  22   4.491   8.581  -9.279
  589   2HH1  ARG  22          2HH1      ARG  22   6.111   7.869  -9.089
  590   1HH2  ARG  22          1HH2      ARG  22   6.515   6.494 -12.166
  591   2HH2  ARG  22          2HH2      ARG  22   7.110   6.843 -10.538
  592    H    ILE  23           H        ILE  23  -0.307   4.997  -9.621
  593    HA   ILE  23           HA       ILE  23   0.829   6.636  -7.419
  594    HB   ILE  23           HB       ILE  23  -0.736   4.093  -6.922
  595   1HG1  ILE  23          1HG1      ILE  23  -1.813   6.931  -6.606
  596   2HG1  ILE  23          2HG1      ILE  23  -2.340   5.744  -7.804
  597   1HG2  ILE  23          1HG2      ILE  23  -0.557   4.961  -4.576
  598   2HG2  ILE  23          2HG2      ILE  23   1.042   4.880  -5.301
  599   3HG2  ILE  23          3HG2      ILE  23   0.211   6.441  -5.174
  600   1HD1  ILE  23          1HD1      ILE  23  -2.652   5.412  -4.805
  601   2HD1  ILE  23          2HD1      ILE  23  -3.913   5.770  -5.965
  602   3HD1  ILE  23          3HD1      ILE  23  -3.086   4.202  -6.037
  603    H    GLU  24           H        GLU  24   2.923   6.263  -7.422
  604    HA   GLU  24           HA       GLU  24   4.115   3.659  -8.068
  605   1HB   GLU  24          1HB       GLU  24   5.078   5.702  -8.826
  606   2HB   GLU  24          2HB       GLU  24   5.267   6.322  -7.170
  607   1HG   GLU  24          1HG       GLU  24   6.838   4.450  -6.717
  608   2HG   GLU  24          2HG       GLU  24   6.573   3.845  -8.362
  609    H    LEU  25           H        LEU  25   3.017   2.373  -6.517
  610    HA   LEU  25           HA       LEU  25   2.714   3.079  -3.796
  611   1HB   LEU  25          1HB       LEU  25   2.766   0.278  -4.927
  612   2HB   LEU  25          2HB       LEU  25   2.040   0.773  -3.424
  613    HG   LEU  25           HG       LEU  25   1.085   1.728  -6.162
  614   1HD1  LEU  25          1HD1      LEU  25   0.111  -0.596  -4.450
  615   2HD1  LEU  25          2HD1      LEU  25   0.831  -0.683  -6.070
  616   3HD1  LEU  25          3HD1      LEU  25  -0.750   0.078  -5.858
  617   1HD2  LEU  25          1HD2      LEU  25   0.472   3.045  -4.008
  618   2HD2  LEU  25          2HD2      LEU  25  -0.356   1.599  -3.451
  619   3HD2  LEU  25          3HD2      LEU  25  -0.914   2.422  -4.928
  620    H    THR  26           H        THR  26   4.647   3.619  -2.761
  621    HA   THR  26           HA       THR  26   6.938   1.861  -3.138
  622    HB   THR  26           HB       THR  26   6.806   4.375  -1.491
  623    HG1  THR  26           1HG      THR  26   6.335   4.434  -3.880
  624   1HG2  THR  26          1HG2      THR  26   9.135   2.762  -2.651
  625   2HG2  THR  26          2HG2      THR  26   8.707   2.857  -0.946
  626   3HG2  THR  26          3HG2      THR  26   9.266   4.310  -1.802
  627    H    VAL  27           H        VAL  27   6.675  -0.012  -2.224
  628    HA   VAL  27           HA       VAL  27   5.772  -0.187   0.604
  629    HB   VAL  27           HB       VAL  27   4.522  -2.187   0.216
  630   1HG1  VAL  27          1HG1      VAL  27   3.829  -0.517  -2.215
  631   2HG1  VAL  27          2HG1      VAL  27   2.774  -1.520  -1.207
  632   3HG1  VAL  27          3HG1      VAL  27   3.464  -0.020  -0.554
  633   1HG2  VAL  27          1HG2      VAL  27   5.662  -2.183  -2.631
  634   2HG2  VAL  27          2HG2      VAL  27   5.983  -3.384  -1.355
  635   3HG2  VAL  27          3HG2      VAL  27   4.370  -3.247  -2.054
  636    H    GLU  28           H        GLU  28   7.310  -1.131   1.877
  637    HA   GLU  28           HA       GLU  28   9.844  -1.712   0.431
  638   1HB   GLU  28          1HB       GLU  28   9.660  -0.632   3.247
  639   2HB   GLU  28          2HB       GLU  28  11.047  -0.675   2.134
  640   1HG   GLU  28          1HG       GLU  28   9.757   0.844   0.595
  641   2HG   GLU  28          2HG       GLU  28   8.794   1.184   2.037
  642    H    SER  29           H        SER  29   9.693  -3.874   0.096
  643    HA   SER  29           HA       SER  29   9.624  -5.651   2.386
  644   1HB   SER  29          1HB       SER  29   7.106  -5.217   1.589
  645   2HB   SER  29          2HB       SER  29   7.545  -6.322   0.289
  646    HG   SER  29           HG       SER  29   6.855  -7.688   1.954
  647    H    SER  30           H        SER  30  10.143  -7.809   1.753
  648    HA   SER  30           HA       SER  30  12.107  -8.127  -0.209
  649   1HB   SER  30          1HB       SER  30  10.304 -10.327   0.872
  650   2HB   SER  30          2HB       SER  30  12.002 -10.441   0.379
  651    HG   SER  30           HG       SER  30  10.838  -9.397   2.729
  652    H    ALA  31           H        ALA  31  12.084  -8.923  -2.339
  653    HA   ALA  31           HA       ALA  31  10.088  -7.874  -3.879
  654   1HB   ALA  31          1HB       ALA  31  11.945 -10.168  -4.671
  655   2HB   ALA  31          2HB       ALA  31  11.104  -9.077  -5.788
  656   3HB   ALA  31          3HB       ALA  31  12.360  -8.433  -4.710
  657    H    GLU  32           H        GLU  32  10.139 -11.275  -2.734
  658    HA   GLU  32           HA       GLU  32   7.852 -11.743  -4.427
  659   1HB   GLU  32          1HB       GLU  32  10.012 -13.257  -3.962
  660   2HB   GLU  32          2HB       GLU  32   8.839 -14.002  -2.835
  661   1HG   GLU  32          1HG       GLU  32   7.205 -14.203  -4.694
  662   2HG   GLU  32          2HG       GLU  32   8.285 -13.313  -5.769
  663    H    ASP  33           H        ASP  33   8.383 -10.953  -1.199
  664    HA   ASP  33           HA       ASP  33   5.842 -11.768  -0.121
  665   1HB   ASP  33          1HB       ASP  33   7.733 -11.233   1.309
  666   2HB   ASP  33          2HB       ASP  33   7.907  -9.644   0.592
  667    H    LEU  34           H        LEU  34   7.286  -8.998  -1.824
  668    HA   LEU  34           HA       LEU  34   4.944  -7.425  -2.104
  669   1HB   LEU  34          1HB       LEU  34   6.864  -6.254  -2.378
  670   2HB   LEU  34          2HB       LEU  34   7.681  -7.461  -3.329
  671    HG   LEU  34           HG       LEU  34   5.339  -6.009  -4.587
  672   1HD1  LEU  34          1HD1      LEU  34   6.748  -4.246  -3.569
  673   2HD1  LEU  34          2HD1      LEU  34   6.968  -4.242  -5.326
  674   3HD1  LEU  34          3HD1      LEU  34   8.190  -4.994  -4.283
  675   1HD2  LEU  34          1HD2      LEU  34   7.980  -7.038  -5.727
  676   2HD2  LEU  34          2HD2      LEU  34   6.717  -6.192  -6.643
  677   3HD2  LEU  34          3HD2      LEU  34   6.393  -7.778  -5.969
  678    H    ARG  35           H        ARG  35   6.383  -9.697  -4.134
  679    HA   ARG  35           HA       ARG  35   4.631  -9.747  -6.381
  680   1HB   ARG  35          1HB       ARG  35   6.830 -11.004  -6.269
  681   2HB   ARG  35          2HB       ARG  35   5.995 -12.254  -5.341
  682   1HG   ARG  35          1HG       ARG  35   4.405 -12.561  -7.247
  683   2HG   ARG  35          2HG       ARG  35   5.374 -11.416  -8.195
  684   1HD   ARG  35          1HD       ARG  35   7.330 -12.954  -7.971
  685   2HD   ARG  35          2HD       ARG  35   6.331 -14.054  -6.993
  686    HE   ARG  35           HE       ARG  35   5.123 -13.444  -9.522
  687   1HH1  ARG  35          1HH1      ARG  35   7.574 -15.661  -8.006
  688   2HH1  ARG  35          2HH1      ARG  35   7.383 -16.837  -9.237
  689   1HH2  ARG  35          1HH2      ARG  35   4.904 -15.087 -11.089
  690   2HH2  ARG  35          2HH2      ARG  35   5.858 -16.523 -11.000
  691    H    THR  36           H        THR  36   4.598 -11.761  -3.444
  692    HA   THR  36           HA       THR  36   2.170 -13.140  -3.964
  693    HB   THR  36           HB       THR  36   3.187 -12.235  -1.232
  694    HG1  THR  36           1HG      THR  36   4.826 -13.362  -2.313
  695   1HG2  THR  36          1HG2      THR  36   1.467 -14.612  -2.082
  696   2HG2  THR  36          2HG2      THR  36   0.893 -13.197  -1.173
  697   3HG2  THR  36          3HG2      THR  36   2.074 -14.304  -0.445
  698    H    LEU  37           H        LEU  37   2.702 -10.011  -2.271
  699    HA   LEU  37           HA       LEU  37   0.013  -9.184  -2.048
  700   1HB   LEU  37          1HB       LEU  37   1.223  -7.758  -0.851
  701   2HB   LEU  37          2HB       LEU  37   2.686  -8.106  -1.729
  702    HG   LEU  37           HG       LEU  37   1.947  -6.505  -3.534
  703   1HD1  LEU  37          1HD1      LEU  37  -0.558  -6.235  -2.695
  704   2HD1  LEU  37          2HD1      LEU  37   0.293  -4.695  -2.628
  705   3HD1  LEU  37          3HD1      LEU  37   0.060  -5.633  -1.170
  706   1HD2  LEU  37          1HD2      LEU  37   2.544  -4.515  -2.065
  707   2HD2  LEU  37          2HD2      LEU  37   3.701  -5.843  -2.121
  708   3HD2  LEU  37          3HD2      LEU  37   2.593  -5.679  -0.737
  709    H    GLN  38           H        GLN  38   2.217  -8.925  -4.916
  710    HA   GLN  38           HA       GLN  38   0.396  -7.410  -6.468
  711   1HB   GLN  38          1HB       GLN  38   2.775  -7.562  -6.897
  712   2HB   GLN  38          2HB       GLN  38   2.638  -9.278  -7.258
  713   1HG   GLN  38          1HG       GLN  38   1.215  -8.786  -9.221
  714   2HG   GLN  38          2HG       GLN  38   1.450  -7.053  -8.918
  715   1HE2  GLN  38          1HE2      GLN  38   3.797  -6.287  -8.847
  716   2HE2  GLN  38          2HE2      GLN  38   5.006  -7.246  -9.686
  717    H    GLN  39           H        GLN  39   0.656 -10.933  -5.766
  718    HA   GLN  39           HA       GLN  39  -1.214 -11.687  -7.804
  719   1HB   GLN  39          1HB       GLN  39  -0.680 -13.264  -5.297
  720   2HB   GLN  39          2HB       GLN  39  -1.353 -13.807  -6.822
  721   1HG   GLN  39          1HG       GLN  39   1.489 -13.180  -6.134
  722   2HG   GLN  39          2HG       GLN  39   0.819 -14.619  -6.857
  723   1HE2  GLN  39          1HE2      GLN  39   2.285 -11.580  -7.439
  724   2HE2  GLN  39          2HE2      GLN  39   2.265 -11.612  -9.208
  725    H    LEU  40           H        LEU  40  -1.434 -10.661  -4.375
  726    HA   LEU  40           HA       LEU  40  -4.268 -10.974  -4.103
  727   1HB   LEU  40          1HB       LEU  40  -2.642  -8.746  -2.835
  728   2HB   LEU  40          2HB       LEU  40  -4.178  -9.365  -2.332
  729    HG   LEU  40           HG       LEU  40  -1.511 -10.797  -2.193
  730   1HD1  LEU  40          1HD1      LEU  40  -1.875  -9.049  -0.512
  731   2HD1  LEU  40          2HD1      LEU  40  -1.818 -10.661   0.221
  732   3HD1  LEU  40          3HD1      LEU  40  -3.382  -9.846  -0.017
  733   1HD2  LEU  40          1HD2      LEU  40  -2.596 -12.655  -1.051
  734   2HD2  LEU  40          2HD2      LEU  40  -3.227 -12.495  -2.691
  735   3HD2  LEU  40          3HD2      LEU  40  -4.191 -11.918  -1.315
  736    H    PHE  41           H        PHE  41  -2.317  -8.349  -5.549
  737    HA   PHE  41           HA       PHE  41  -4.519  -6.584  -6.200
  738   1HB   PHE  41          1HB       PHE  41  -1.668  -6.873  -7.052
  739   2HB   PHE  41          2HB       PHE  41  -2.737  -6.162  -8.229
  740    HD1  PHE  41           1HD      PHE  41  -3.824  -4.008  -7.869
  741    HD2  PHE  41           2HD      PHE  41  -1.076  -5.668  -4.989
  742    HE1  PHE  41           1HE      PHE  41  -3.527  -1.767  -6.858
  743    HE2  PHE  41           2HE      PHE  41  -0.830  -3.407  -3.953
  744    HZ   PHE  41           HZ       PHE  41  -2.087  -1.490  -4.855
  745    H    LEU  42           H        LEU  42  -2.827  -9.101  -8.096
  746    HA   LEU  42           HA       LEU  42  -4.489  -8.934 -10.394
  747   1HB   LEU  42          1HB       LEU  42  -2.722 -11.083  -9.201
  748   2HB   LEU  42          2HB       LEU  42  -3.564 -11.353 -10.717
  749    HG   LEU  42           HG       LEU  42  -1.730  -8.951 -10.324
  750   1HD1  LEU  42          1HD1      LEU  42  -0.399 -10.961  -9.898
  751   2HD1  LEU  42          2HD1      LEU  42   0.040 -10.254 -11.457
  752   3HD1  LEU  42          3HD1      LEU  42  -0.988 -11.707 -11.396
  753   1HD2  LEU  42          1HD2      LEU  42  -1.603  -9.005 -12.789
  754   2HD2  LEU  42          2HD2      LEU  42  -3.276  -8.819 -12.253
  755   3HD2  LEU  42          3HD2      LEU  42  -2.704 -10.399 -12.828
  756    H    SER  43           H        SER  43  -4.920 -10.777  -7.389
  757    HA   SER  43           HA       SER  43  -7.259 -12.230  -8.153
  758   1HB   SER  43          1HB       SER  43  -6.016 -12.895  -6.219
  759   2HB   SER  43          2HB       SER  43  -6.065 -11.296  -5.511
  760    HG   SER  43           HG       SER  43  -8.104 -11.535  -4.886
  761    H    THR  44           H        THR  44  -6.971  -9.353  -6.058
  762    HA   THR  44           HA       THR  44  -9.619  -8.460  -6.815
  763    HB   THR  44           HB       THR  44  -9.875  -8.548  -4.100
  764    HG1  THR  44           1HG      THR  44  -8.126  -9.617  -3.388
  765   1HG2  THR  44          1HG2      THR  44 -11.116 -10.605  -4.310
  766   2HG2  THR  44          2HG2      THR  44 -10.344 -10.969  -5.866
  767   3HG2  THR  44          3HG2      THR  44 -11.427  -9.564  -5.716
  768    H    LEU  45           H        LEU  45  -6.683  -7.830  -4.973
  769    HA   LEU  45           HA       LEU  45  -7.732  -5.539  -3.704
  770   1HB   LEU  45          1HB       LEU  45  -5.915  -7.067  -2.886
  771   2HB   LEU  45          2HB       LEU  45  -4.803  -6.350  -4.026
  772    HG   LEU  45           HG       LEU  45  -6.165  -4.370  -2.259
  773   1HD1  LEU  45          1HD1      LEU  45  -5.903  -6.289  -0.680
  774   2HD1  LEU  45          2HD1      LEU  45  -4.924  -4.881  -0.261
  775   3HD1  LEU  45          3HD1      LEU  45  -4.166  -6.305  -1.023
  776   1HD2  LEU  45          1HD2      LEU  45  -3.214  -4.901  -2.818
  777   2HD2  LEU  45          2HD2      LEU  45  -3.919  -3.442  -2.082
  778   3HD2  LEU  45          3HD2      LEU  45  -4.244  -3.825  -3.777
  779    H    SER  46           H        SER  46  -7.261  -3.314  -3.811
  780    HA   SER  46           HA       SER  46  -5.422  -2.400  -5.864
  781   1HB   SER  46          1HB       SER  46  -8.343  -1.592  -5.826
  782   2HB   SER  46          2HB       SER  46  -7.074  -0.660  -6.663
  783    HG   SER  46           HG       SER  46  -7.070  -3.410  -7.114
  784    H    PHE  47           H        PHE  47  -5.528   0.309  -5.512
  785    HA   PHE  47           HA       PHE  47  -5.308   0.734  -2.606
  786   1HB   PHE  47          1HB       PHE  47  -3.041   0.319  -3.879
  787   2HB   PHE  47          2HB       PHE  47  -3.321   1.891  -4.577
  788    HD1  PHE  47           1HD      PHE  47  -2.599   0.037  -1.448
  789    HD2  PHE  47           2HD      PHE  47  -3.184   3.940  -3.179
  790    HE1  PHE  47           1HE      PHE  47  -1.688   1.103   0.610
  791    HE2  PHE  47           2HE      PHE  47  -2.308   4.989  -1.112
  792    HZ   PHE  47           HZ       PHE  47  -1.565   3.569   0.787
  793    H    VAL  48           H        VAL  48  -5.582   2.972  -2.043
  794    HA   VAL  48           HA       VAL  48  -6.465   4.687  -4.174
  795    HB   VAL  48           HB       VAL  48  -8.237   3.156  -2.689
  796   1HG1  VAL  48          1HG1      VAL  48  -9.770   4.441  -1.574
  797   2HG1  VAL  48          2HG1      VAL  48  -8.196   4.790  -0.853
  798   3HG1  VAL  48          3HG1      VAL  48  -8.949   5.966  -1.972
  799   1HG2  VAL  48          1HG2      VAL  48  -8.443   3.955  -4.993
  800   2HG2  VAL  48          2HG2      VAL  48  -9.930   4.156  -4.045
  801   3HG2  VAL  48          3HG2      VAL  48  -8.870   5.550  -4.373
  802    H    CYS  49           H        CYS  49  -5.394   6.504  -4.096
  803    HA   CYS  49           HA       CYS  49  -3.380   6.905  -2.142
  804   1HB   CYS  49          1HB       CYS  49  -3.123   9.105  -3.421
  805   2HB   CYS  49          2HB       CYS  49  -2.914   7.617  -4.316
  806    HA   PRO  50           HA       PRO  50  -5.509   8.769   1.041
  807   1HB   PRO  50          1HB       PRO  50  -3.773  10.656   2.136
  808   2HB   PRO  50          2HB       PRO  50  -3.725   8.886   2.388
  809   1HG   PRO  50          1HG       PRO  50  -2.147  10.536   0.398
  810   2HG   PRO  50          2HG       PRO  50  -1.559   9.220   1.465
  811   1HD   PRO  50          1HD       PRO  50  -2.106   8.737  -1.125
  812   2HD   PRO  50          2HD       PRO  50  -2.590   7.555   0.125
  813    H    TRP  51           H        TRP  51  -4.321  11.102  -1.335
  814    HA   TRP  51           HA       TRP  51  -5.909  13.359  -0.565
  815   1HB   TRP  51          1HB       TRP  51  -4.400  14.016  -2.170
  816   2HB   TRP  51          2HB       TRP  51  -4.445  12.472  -3.012
  817    HD1  TRP  51           HD       TRP  51  -7.073  15.269  -2.471
  818    HE1  TRP  51           1HE      TRP  51  -8.587  15.370  -4.499
  819    HE3  TRP  51           3HE      TRP  51  -4.670  11.834  -5.416
  820    HZ2  TRP  51           2HZ      TRP  51  -8.678  14.211  -7.169
  821    HZ3  TRP  51           3HZ      TRP  51  -5.533  11.312  -7.675
  822    HH2  TRP  51           HH       TRP  51  -7.534  12.484  -8.560
  823    H    CYS  52           H        CYS  52  -6.513  10.874  -3.104
  824    HA   CYS  52           HA       CYS  52  -9.193  11.728  -3.555
  825   1HB   CYS  52          1HB       CYS  52  -9.218  10.104  -5.177
  826   2HB   CYS  52          2HB       CYS  52  -7.498  10.314  -4.970
  827    H    ALA  53           H        ALA  53  -7.715   9.399  -1.375
  828    HA   ALA  53           HA       ALA  53 -10.120   8.128  -0.667
  829   1HB   ALA  53          1HB       ALA  53  -7.719   7.227  -0.438
  830   2HB   ALA  53          2HB       ALA  53  -7.588   8.220   1.027
  831   3HB   ALA  53          3HB       ALA  53  -8.783   6.920   0.936
  832    H    THR  54           H        THR  54  -8.559  11.081   0.439
  833    HA   THR  54           HA       THR  54 -10.359  11.429   2.737
  834    HB   THR  54           HB       THR  54  -8.408  13.381   1.444
  835    HG1  THR  54           1HG      THR  54  -7.252  11.648   2.122
  836   1HG2  THR  54          1HG2      THR  54  -8.402  14.455   3.675
  837   2HG2  THR  54          2HG2      THR  54  -9.646  13.317   4.233
  838   3HG2  THR  54          3HG2      THR  54 -10.020  14.497   2.957
  839    H    ASN  55           H        ASN  55 -10.019  12.684  -0.630
  840    HA   ASN  55           HA       ASN  55 -12.316  14.460  -0.549
  841   1HB   ASN  55          1HB       ASN  55 -11.006  12.937  -2.855
  842   2HB   ASN  55          2HB       ASN  55 -12.351  14.050  -3.058
  843   1HD2  ASN  55          1HD2      ASN  55 -10.124  15.062  -0.578
  844   2HD2  ASN  55          2HD2      ASN  55  -9.346  16.285  -1.566
  845    H    GLN  56           H        GLN  56 -11.884  11.108  -1.228
  846    HA   GLN  56           HA       GLN  56 -13.190   9.272  -1.170
  847   1HB   GLN  56          2HB       GLN  56 -12.697  10.275   1.150
  848   2HB   GLN  56          3HB       GLN  56 -14.376  10.736   1.197
  849   1HG   GLN  56          2HG       GLN  56 -14.385   8.012   0.317
  850   2HG   GLN  56          3HG       GLN  56 -13.089   8.104   1.495
  851   1HE2  GLN  56          1HE2      GLN  56 -16.338   9.491   1.045
  852   2HE2  GLN  56          2HE2      GLN  56 -16.992   9.050   2.651
  Start of MODEL   11
    1   1H    GLY   1          1H        GLY   1 -18.109  12.419  -1.549
    2   1HA   GLY   1          1HA       GLY   1 -18.082  11.222   0.511
    3   2HA   GLY   1          2HA       GLY   1 -19.747  11.665   0.060
    4    H    SER   2           H        SER   2 -20.869   9.882   1.048
    5    HA   SER   2           HA       SER   2 -20.218   7.158   0.640
    6   1HB   SER   2          1HB       SER   2 -22.945   8.491   0.945
    7   2HB   SER   2          2HB       SER   2 -22.549   6.792   1.280
    8    HG   SER   2           HG       SER   2 -22.525   8.035   3.190
    9    H    HIS   3           H        HIS   3 -21.080   5.666  -0.915
   10    HA   HIS   3           HA       HIS   3 -22.694   6.622  -3.137
   11   1HB   HIS   3          1HB       HIS   3 -20.445   7.233  -3.938
   12   2HB   HIS   3          2HB       HIS   3 -19.860   5.598  -3.653
   13    HD1  HIS   3           1HD      HIS   3 -20.244   3.905  -5.680
   14    HD2  HIS   3           2HD      HIS   3 -22.498   7.466  -5.857
   15    HE1  HIS   3           1HE      HIS   3 -21.439   3.909  -7.930
   16    H    MET   4           H        MET   4 -20.433   3.868  -2.575
   17    HA   MET   4           HA       MET   4 -22.702   1.971  -2.446
   18   1HB   MET   4          1HB       MET   4 -21.990   2.235  -4.774
   19   2HB   MET   4          2HB       MET   4 -20.319   1.853  -4.352
   20   1HG   MET   4          1HG       MET   4 -20.830  -0.414  -3.952
   21   2HG   MET   4          2HG       MET   4 -22.569  -0.100  -3.793
   22   1HE   MET   4          1HE       MET   4 -22.215  -2.369  -7.045
   23   2HE   MET   4          2HE       MET   4 -20.879  -2.343  -5.881
   24   3HE   MET   4          3HE       MET   4 -22.557  -2.366  -5.297
   25    H    ALA   5           H        ALA   5 -22.350   1.608  -0.285
   26    HA   ALA   5           HA       ALA   5 -19.727   1.486   0.878
   27   1HB   ALA   5          1HB       ALA   5 -20.997   1.082   2.967
   28   2HB   ALA   5          2HB       ALA   5 -21.618   2.489   2.080
   29   3HB   ALA   5          3HB       ALA   5 -22.498   0.943   2.031
   30    H    GLU   6           H        GLU   6 -18.522  -0.301   0.216
   31    HA   GLU   6           HA       GLU   6 -19.668  -2.980   0.762
   32   1HB   GLU   6          1HB       GLU   6 -18.016  -2.088  -1.636
   33   2HB   GLU   6          2HB       GLU   6 -18.407  -3.768  -1.245
   34   1HG   GLU   6          1HG       GLU   6 -20.835  -3.242  -1.391
   35   2HG   GLU   6          2HG       GLU   6 -20.440  -1.597  -1.901
   36    HA   PRO   7           HA       PRO   7 -15.997  -3.381   3.173
   37   1HB   PRO   7          1HB       PRO   7 -15.771  -6.052   3.531
   38   2HB   PRO   7          2HB       PRO   7 -17.220  -5.158   4.064
   39   1HG   PRO   7          1HG       PRO   7 -16.859  -6.668   1.447
   40   2HG   PRO   7          2HG       PRO   7 -18.179  -6.852   2.649
   41   1HD   PRO   7          1HD       PRO   7 -18.432  -5.242   0.467
   42   2HD   PRO   7          2HD       PRO   7 -19.145  -4.789   2.044
   43    H    GLN   8           H        GLN   8 -15.075  -2.451   0.993
   44    HA   GLN   8           HA       GLN   8 -12.686  -4.097   0.327
   45   1HB   GLN   8          1HB       GLN   8 -14.515  -2.604  -1.556
   46   2HB   GLN   8          2HB       GLN   8 -12.788  -2.690  -1.895
   47   1HG   GLN   8          1HG       GLN   8 -13.898  -4.459  -3.083
   48   2HG   GLN   8          2HG       GLN   8 -12.821  -5.133  -1.865
   49   1HE2  GLN   8          1HE2      GLN   8 -13.865  -7.210  -1.429
   50   2HE2  GLN   8          2HE2      GLN   8 -15.525  -7.193  -0.857
   51    H    ARG   9           H        ARG   9 -13.911  -0.677   0.136
   52    HA   ARG   9           HA       ARG   9 -11.385   0.530   0.161
   53   1HB   ARG   9          1HB       ARG   9 -13.579   1.549  -0.471
   54   2HB   ARG   9          2HB       ARG   9 -13.954   1.720   1.229
   55   1HG   ARG   9          1HG       ARG   9 -11.540   2.907   0.140
   56   2HG   ARG   9          2HG       ARG   9 -13.083   3.725  -0.028
   57   1HD   ARG   9          1HD       ARG   9 -12.979   3.135   2.698
   58   2HD   ARG   9          2HD       ARG   9 -11.293   3.507   2.328
   59    HE   ARG   9           HE       ARG   9 -13.662   5.273   1.742
   60   1HH1  ARG   9          1HH1      ARG   9 -10.204   5.215   2.746
   61   2HH1  ARG   9          2HH1      ARG   9 -10.224   6.967   2.926
   62   1HH2  ARG   9          1HH2      ARG   9 -13.527   7.387   2.000
   63   2HH2  ARG   9          2HH2      ARG   9 -12.002   8.195   2.445
   64    H    HIS  10           H        HIS  10  -9.879  -0.312   1.742
   65    HA   HIS  10           HA       HIS  10 -10.699   0.059   4.579
   66   1HB   HIS  10          1HB       HIS  10  -9.126  -2.148   3.216
   67   2HB   HIS  10          2HB       HIS  10  -9.313  -1.954   4.965
   68    HD1  HIS  10           1HD      HIS  10 -10.563  -4.439   2.953
   69    HD2  HIS  10           2HD      HIS  10 -12.533  -1.211   4.664
   70    HE1  HIS  10           1HE      HIS  10 -12.852  -5.267   3.493
   71    H    LYS  11           H        LYS  11  -8.721  -0.047   6.041
   72    HA   LYS  11           HA       LYS  11  -6.676   1.862   5.071
   73   1HB   LYS  11          1HB       LYS  11  -8.801   2.233   7.191
   74   2HB   LYS  11          2HB       LYS  11  -7.308   3.188   7.141
   75   1HG   LYS  11          1HG       LYS  11  -7.865   4.243   5.118
   76   2HG   LYS  11          2HG       LYS  11  -9.108   3.055   4.700
   77   1HD   LYS  11          1HD       LYS  11 -10.014   5.235   5.420
   78   2HD   LYS  11          2HD       LYS  11 -10.612   3.837   6.323
   79   1HE   LYS  11          1HE       LYS  11  -9.467   4.425   8.291
   80   2HE   LYS  11          2HE       LYS  11  -8.177   5.201   7.388
   81   1HZ   LYS  11          1HZ       LYS  11  -9.080   6.927   8.275
   82   2HZ   LYS  11          2HZ       LYS  11 -10.672   6.396   8.250
   83   3HZ   LYS  11          3HZ       LYS  11  -9.921   6.967   6.877
   84    H    ILE  12           H        ILE  12  -4.956   0.534   5.479
   85    HA   ILE  12           HA       ILE  12  -4.664  -0.578   8.234
   86    HB   ILE  12           HB       ILE  12  -2.825  -0.787   5.827
   87   1HG1  ILE  12          1HG1      ILE  12  -4.691  -2.816   7.087
   88   2HG1  ILE  12          2HG1      ILE  12  -4.835  -2.072   5.493
   89   1HG2  ILE  12          1HG2      ILE  12  -2.679  -2.062   8.620
   90   2HG2  ILE  12          2HG2      ILE  12  -1.494  -2.289   7.310
   91   3HG2  ILE  12          3HG2      ILE  12  -1.648  -0.729   8.089
   92   1HD1  ILE  12          1HD1      ILE  12  -2.631  -3.072   4.842
   93   2HD1  ILE  12          2HD1      ILE  12  -2.669  -4.006   6.366
   94   3HD1  ILE  12          3HD1      ILE  12  -3.920  -4.241   5.147
   95    H    LEU  13           H        LEU  13  -4.561   1.324   9.452
   96    HA   LEU  13           HA       LEU  13  -2.775   3.466   8.769
   97   1HB   LEU  13          1HB       LEU  13  -4.725   3.740  10.267
   98   2HB   LEU  13          2HB       LEU  13  -3.883   2.824  11.523
   99    HG   LEU  13           HG       LEU  13  -2.418   5.143  10.207
  100   1HD1  LEU  13          1HD1      LEU  13  -4.610   6.035  10.544
  101   2HD1  LEU  13          2HD1      LEU  13  -3.485   6.720  11.746
  102   3HD1  LEU  13          3HD1      LEU  13  -4.642   5.449  12.229
  103   1HD2  LEU  13          1HD2      LEU  13  -2.541   4.190  13.109
  104   2HD2  LEU  13          2HD2      LEU  13  -1.534   5.516  12.483
  105   3HD2  LEU  13          3HD2      LEU  13  -1.221   3.864  11.971
  106    H    CYS  14           H        CYS  14  -0.705   3.144   8.575
  107    HA   CYS  14           HA       CYS  14   0.703   1.731  10.788
  108   1HB   CYS  14          1HB       CYS  14   0.725   0.589   8.416
  109   2HB   CYS  14          2HB       CYS  14   1.861   1.886   7.993
  110    HG   CYS  14           HG       CYS  14   1.973  -0.424  10.365
  111    H    VAL  15           H        VAL  15   3.237   2.566  10.302
  112    HA   VAL  15           HA       VAL  15   3.172   5.471   9.916
  113    HB   VAL  15           HB       VAL  15   5.035   5.686  11.571
  114   1HG1  VAL  15          1HG1      VAL  15   3.553   5.860  13.511
  115   2HG1  VAL  15          2HG1      VAL  15   2.765   6.471  12.052
  116   3HG1  VAL  15          3HG1      VAL  15   2.321   4.870  12.694
  117   1HG2  VAL  15          1HG2      VAL  15   4.073   2.982  12.625
  118   2HG2  VAL  15          2HG2      VAL  15   5.624   3.270  11.797
  119   3HG2  VAL  15          3HG2      VAL  15   5.295   4.048  13.347
  120    H    CYS  16           H        CYS  16   5.057   6.254   8.966
  121    HA   CYS  16           HA       CYS  16   5.999   4.539   6.915
  122   1HB   CYS  16          1HB       CYS  16   5.742   7.090   6.855
  123   2HB   CYS  16          2HB       CYS  16   7.273   7.165   7.768
  124    H    CYS  17           H        CYS  17   7.731   3.312   6.720
  125    HA   CYS  17           HA       CYS  17   9.062   2.328   9.000
  126   1HB   CYS  17          1HB       CYS  17   8.761   1.258   6.679
  127   2HB   CYS  17          2HB       CYS  17  10.181   2.179   6.170
  128    HG   CYS  17           HG       CYS  17  10.963  -0.158   6.583
  129    H    LYS  18           H        LYS  18  10.113   4.846   6.703
  130    HA   LYS  18           HA       LYS  18  12.746   4.980   8.007
  131   1HB   LYS  18          1HB       LYS  18  13.438   5.895   5.892
  132   2HB   LYS  18          2HB       LYS  18  12.613   4.351   5.668
  133   1HG   LYS  18          1HG       LYS  18  10.500   5.572   5.012
  134   2HG   LYS  18          2HG       LYS  18  11.346   7.101   5.163
  135   1HD   LYS  18          1HD       LYS  18  11.827   4.834   3.211
  136   2HD   LYS  18          2HD       LYS  18  11.344   6.485   2.831
  137   1HE   LYS  18          1HE       LYS  18  14.041   5.525   3.843
  138   2HE   LYS  18          2HE       LYS  18  13.657   6.142   2.226
  139   1HZ   LYS  18          1HZ       LYS  18  14.690   7.895   3.373
  140   2HZ   LYS  18          2HZ       LYS  18  13.701   7.749   4.723
  141   3HZ   LYS  18          3HZ       LYS  18  13.220   8.328   3.226
  142    H    CYS  19           H        CYS  19   9.828   6.930   7.840
  143    HA   CYS  19           HA       CYS  19  11.315   9.131   9.087
  144   1HB   CYS  19          1HB       CYS  19   9.976  10.620   7.796
  145   2HB   CYS  19          2HB       CYS  19  10.977   9.626   6.746
  146    H    ASP  20           H        ASP  20   9.006   6.799   9.752
  147    HA   ASP  20           HA       ASP  20   7.422   6.529  11.202
  148   1HB   ASP  20          1HB       ASP  20   9.357   7.312  12.589
  149   2HB   ASP  20          2HB       ASP  20   8.578   8.895  12.685
  150    H    GLY  21           H        GLY  21   6.832   8.547   8.996
  151   1HA   GLY  21          1HA       GLY  21   4.910  10.398  10.178
  152   2HA   GLY  21          2HA       GLY  21   5.072  10.075   8.449
  153    H    ARG  22           H        ARG  22   2.689  10.282  10.052
  154    HA   ARG  22           HA       ARG  22   1.460   7.702  10.521
  155   1HB   ARG  22          1HB       ARG  22   0.764   9.780  11.623
  156   2HB   ARG  22          2HB       ARG  22   0.257  10.483  10.093
  157   1HG   ARG  22          1HG       ARG  22  -1.040   7.879  10.873
  158   2HG   ARG  22          2HG       ARG  22  -1.380   9.278  11.890
  159   1HD   ARG  22          1HD       ARG  22  -2.047  10.562   9.800
  160   2HD   ARG  22          2HD       ARG  22  -1.951   9.022   8.920
  161    HE   ARG  22           HE       ARG  22  -3.540   8.822  11.313
  162   1HH1  ARG  22          1HH1      ARG  22  -3.864  10.122   8.011
  163   2HH1  ARG  22          2HH1      ARG  22  -5.467   9.437   7.779
  164   1HH2  ARG  22          1HH2      ARG  22  -5.727   8.140  11.053
  165   2HH2  ARG  22          2HH2      ARG  22  -6.485   8.252   9.498
  166    H    ILE  23           H        ILE  23   0.996   6.209   8.874
  167    HA   ILE  23           HA       ILE  23   0.055   7.398   6.324
  168    HB   ILE  23           HB       ILE  23   1.333   4.674   6.344
  169   1HG1  ILE  23          1HG1      ILE  23   2.871   7.242   5.802
  170   2HG1  ILE  23          2HG1      ILE  23   3.119   6.135   7.158
  171   1HG2  ILE  23          1HG2      ILE  23   1.398   5.238   3.898
  172   2HG2  ILE  23          2HG2      ILE  23  -0.218   5.552   4.514
  173   3HG2  ILE  23          3HG2      ILE  23   0.902   6.898   4.253
  174   1HD1  ILE  23          1HD1      ILE  23   3.493   5.322   4.245
  175   2HD1  ILE  23          2HD1      ILE  23   4.762   5.724   5.369
  176   3HD1  ILE  23          3HD1      ILE  23   3.747   4.305   5.681
  177    H    GLU  24           H        GLU  24  -2.038   7.245   6.390
  178    HA   GLU  24           HA       GLU  24  -3.485   4.916   7.436
  179   1HB   GLU  24          1HB       GLU  24  -4.206   7.152   7.809
  180   2HB   GLU  24          2HB       GLU  24  -4.276   7.512   6.076
  181   1HG   GLU  24          1HG       GLU  24  -6.166   6.010   5.810
  182   2HG   GLU  24          2HG       GLU  24  -5.938   5.360   7.439
  183    H    LEU  25           H        LEU  25  -2.556   3.263   6.113
  184    HA   LEU  25           HA       LEU  25  -2.212   3.571   3.326
  185   1HB   LEU  25          1HB       LEU  25  -2.450   1.000   4.853
  186   2HB   LEU  25          2HB       LEU  25  -1.747   1.198   3.270
  187    HG   LEU  25           HG       LEU  25  -0.633   2.500   5.803
  188   1HD1  LEU  25          1HD1      LEU  25   0.174  -0.078   4.411
  189   2HD1  LEU  25          2HD1      LEU  25  -0.478   0.099   6.055
  190   3HD1  LEU  25          3HD1      LEU  25   1.128   0.741   5.677
  191   1HD2  LEU  25          1HD2      LEU  25  -0.040   3.511   3.519
  192   2HD2  LEU  25          2HD2      LEU  25   0.594   1.945   3.040
  193   3HD2  LEU  25          3HD2      LEU  25   1.367   2.842   4.372
  194    H    THR  26           H        THR  26  -4.069   4.158   2.312
  195    HA   THR  26           HA       THR  26  -6.567   2.725   2.800
  196    HB   THR  26           HB       THR  26  -6.154   5.053   0.997
  197    HG1  THR  26           1HG      THR  26  -5.412   5.321   3.334
  198   1HG2  THR  26          1HG2      THR  26  -8.512   4.274   2.772
  199   2HG2  THR  26          2HG2      THR  26  -8.359   3.525   1.199
  200   3HG2  THR  26          3HG2      THR  26  -8.514   5.291   1.305
  201    H    VAL  27           H        VAL  27  -6.459   0.717   2.011
  202    HA   VAL  27           HA       VAL  27  -5.797   0.339  -0.871
  203    HB   VAL  27           HB       VAL  27  -4.585  -1.750  -0.424
  204   1HG1  VAL  27          1HG1      VAL  27  -3.649   0.220   1.677
  205   2HG1  VAL  27          2HG1      VAL  27  -2.731  -1.001   0.784
  206   3HG1  VAL  27          3HG1      VAL  27  -3.390   0.407  -0.067
  207   1HG2  VAL  27          1HG2      VAL  27  -5.504  -1.325   2.494
  208   2HG2  VAL  27          2HG2      VAL  27  -5.989  -2.656   1.419
  209   3HG2  VAL  27          3HG2      VAL  27  -4.307  -2.511   1.957
  210    H    GLU  28           H        GLU  28  -7.556  -0.242  -1.952
  211    HA   GLU  28           HA       GLU  28 -10.009  -0.996  -0.480
  212   1HB   GLU  28          1HB       GLU  28  -9.831  -0.747  -3.488
  213   2HB   GLU  28          2HB       GLU  28 -11.244  -0.713  -2.436
  214   1HG   GLU  28          1HG       GLU  28 -10.117   1.431  -1.408
  215   2HG   GLU  28          2HG       GLU  28  -9.131   1.395  -2.874
  216    H    SER  29           H        SER  29  -9.989  -3.130   0.199
  217    HA   SER  29           HA       SER  29 -10.080  -5.059  -1.910
  218   1HB   SER  29          1HB       SER  29  -7.532  -4.820  -1.193
  219   2HB   SER  29          2HB       SER  29  -8.019  -5.880   0.136
  220    HG   SER  29           HG       SER  29  -7.470  -7.292  -1.546
  221    H    SER  30           H        SER  30 -10.848  -7.109  -1.187
  222    HA   SER  30           HA       SER  30 -12.775  -7.124   0.831
  223   1HB   SER  30          1HB       SER  30 -11.211  -9.506  -0.252
  224   2HB   SER  30          2HB       SER  30 -12.874  -9.506   0.369
  225    HG   SER  30           HG       SER  30 -12.100  -9.129  -2.113
  226    H    ALA  31           H        ALA  31 -12.778  -7.817   2.979
  227    HA   ALA  31           HA       ALA  31 -10.645  -6.983   4.444
  228   1HB   ALA  31          1HB       ALA  31 -12.752  -8.987   5.359
  229   2HB   ALA  31          2HB       ALA  31 -11.752  -7.965   6.411
  230   3HB   ALA  31          3HB       ALA  31 -12.934  -7.215   5.323
  231    H    GLU  32           H        GLU  32 -11.104 -10.409   3.437
  232    HA   GLU  32           HA       GLU  32  -8.887 -11.238   5.082
  233   1HB   GLU  32          1HB       GLU  32 -10.863 -12.592   3.305
  234   2HB   GLU  32          2HB       GLU  32  -9.345 -13.429   3.703
  235   1HG   GLU  32          1HG       GLU  32  -9.735 -13.096   6.117
  236   2HG   GLU  32          2HG       GLU  32 -11.229 -12.219   5.781
  237    H    ASP  33           H        ASP  33  -9.277 -10.186   1.774
  238    HA   ASP  33           HA       ASP  33  -6.789 -11.226   0.764
  239   1HB   ASP  33          1HB       ASP  33  -8.654 -10.681  -0.706
  240   2HB   ASP  33          2HB       ASP  33  -8.685  -9.021  -0.128
  241    H    LEU  34           H        LEU  34  -8.050  -8.264   2.215
  242    HA   LEU  34           HA       LEU  34  -5.626  -6.760   2.443
  243   1HB   LEU  34          1HB       LEU  34  -7.638  -5.614   2.737
  244   2HB   LEU  34          2HB       LEU  34  -8.252  -6.720   3.945
  245    HG   LEU  34           HG       LEU  34  -5.695  -5.310   4.649
  246   1HD1  LEU  34          1HD1      LEU  34  -6.968  -3.506   3.586
  247   2HD1  LEU  34          2HD1      LEU  34  -6.919  -3.271   5.344
  248   3HD1  LEU  34          3HD1      LEU  34  -8.379  -3.944   4.582
  249   1HD2  LEU  34          1HD2      LEU  34  -8.276  -5.818   6.216
  250   2HD2  LEU  34          2HD2      LEU  34  -6.785  -5.105   6.871
  251   3HD2  LEU  34          3HD2      LEU  34  -6.799  -6.782   6.348
  252    H    ARG  35           H        ARG  35  -7.210  -8.855   4.652
  253    HA   ARG  35           HA       ARG  35  -5.412  -8.920   6.806
  254   1HB   ARG  35          1HB       ARG  35  -7.641 -10.108   6.814
  255   2HB   ARG  35          2HB       ARG  35  -6.907 -11.411   5.875
  256   1HG   ARG  35          1HG       ARG  35  -5.284 -11.852   7.640
  257   2HG   ARG  35          2HG       ARG  35  -5.960 -10.538   8.626
  258   1HD   ARG  35          1HD       ARG  35  -8.068 -11.753   8.833
  259   2HD   ARG  35          2HD       ARG  35  -7.503 -12.998   7.696
  260    HE   ARG  35           HE       ARG  35  -5.590 -12.873   9.713
  261   1HH1  ARG  35          1HH1      ARG  35  -8.993 -13.781   9.465
  262   2HH1  ARG  35          2HH1      ARG  35  -8.967 -14.888  10.793
  263   1HH2  ARG  35          1HH2      ARG  35  -5.504 -14.355  11.466
  264   2HH2  ARG  35          2HH2      ARG  35  -6.915 -15.218  11.955
  265    H    THR  36           H        THR  36  -5.483 -11.050   3.987
  266    HA   THR  36           HA       THR  36  -3.140 -12.540   4.538
  267    HB   THR  36           HB       THR  36  -4.160 -11.790   1.771
  268    HG1  THR  36           1HG      THR  36  -5.857 -12.700   2.991
  269   1HG2  THR  36          1HG2      THR  36  -2.613 -14.206   2.832
  270   2HG2  THR  36          2HG2      THR  36  -1.944 -12.935   1.787
  271   3HG2  THR  36          3HG2      THR  36  -3.213 -14.013   1.176
  272    H    LEU  37           H        LEU  37  -3.470  -9.463   2.650
  273    HA   LEU  37           HA       LEU  37  -0.683  -9.037   2.345
  274   1HB   LEU  37          1HB       LEU  37  -1.431  -7.351   1.115
  275   2HB   LEU  37          2HB       LEU  37  -3.046  -7.746   1.624
  276    HG   LEU  37           HG       LEU  37  -2.541  -6.156   3.676
  277   1HD1  LEU  37          1HD1      LEU  37  -0.065  -5.756   3.084
  278   2HD1  LEU  37          2HD1      LEU  37  -0.987  -4.255   3.013
  279   3HD1  LEU  37          3HD1      LEU  37  -0.560  -5.107   1.538
  280   1HD2  LEU  37          1HD2      LEU  37  -3.758  -4.552   2.677
  281   2HD2  LEU  37          2HD2      LEU  37  -4.074  -5.856   1.519
  282   3HD2  LEU  37          3HD2      LEU  37  -2.870  -4.637   1.144
  283    H    GLN  38           H        GLN  38  -2.832  -8.308   5.126
  284    HA   GLN  38           HA       GLN  38  -0.838  -6.894   6.576
  285   1HB   GLN  38          1HB       GLN  38  -3.289  -6.732   6.839
  286   2HB   GLN  38          2HB       GLN  38  -3.293  -8.297   7.662
  287   1HG   GLN  38          1HG       GLN  38  -2.106  -7.448   9.525
  288   2HG   GLN  38          2HG       GLN  38  -1.510  -6.047   8.623
  289   1HE2  GLN  38          1HE2      GLN  38  -4.801  -7.500   9.317
  290   2HE2  GLN  38          2HE2      GLN  38  -5.506  -5.927   9.651
  291    H    GLN  39           H        GLN  39  -1.460 -10.371   6.122
  292    HA   GLN  39           HA       GLN  39   0.246 -11.199   8.280
  293   1HB   GLN  39          1HB       GLN  39  -0.382 -12.832   5.828
  294   2HB   GLN  39          2HB       GLN  39   0.225 -13.366   7.387
  295   1HG   GLN  39          1HG       GLN  39  -2.545 -12.509   6.643
  296   2HG   GLN  39          2HG       GLN  39  -2.013 -14.002   7.371
  297   1HE2  GLN  39          1HE2      GLN  39  -3.073 -10.757   7.933
  298   2HE2  GLN  39          2HE2      GLN  39  -3.081 -10.831   9.714
  299    H    LEU  40           H        LEU  40   0.659 -10.480   4.766
  300    HA   LEU  40           HA       LEU  40   3.478 -11.008   4.669
  301   1HB   LEU  40          1HB       LEU  40   1.997  -8.862   3.114
  302   2HB   LEU  40          2HB       LEU  40   3.568  -9.520   2.762
  303    HG   LEU  40           HG       LEU  40   0.966 -11.097   2.660
  304   1HD1  LEU  40          1HD1      LEU  40   1.127  -9.369   0.909
  305   2HD1  LEU  40          2HD1      LEU  40   1.241 -10.998   0.229
  306   3HD1  LEU  40          3HD1      LEU  40   2.706 -10.008   0.427
  307   1HD2  LEU  40          1HD2      LEU  40   2.305 -12.833   1.513
  308   2HD2  LEU  40          2HD2      LEU  40   2.856 -12.586   3.169
  309   3HD2  LEU  40          3HD2      LEU  40   3.786 -11.895   1.823
  310    H    PHE  41           H        PHE  41   1.633  -8.210   5.830
  311    HA   PHE  41           HA       PHE  41   3.832  -6.442   6.371
  312   1HB   PHE  41          1HB       PHE  41   1.126  -6.268   6.432
  313   2HB   PHE  41          2HB       PHE  41   1.445  -6.355   8.158
  314    HD1  PHE  41           1HD      PHE  41   3.782  -4.708   8.642
  315    HD2  PHE  41           2HD      PHE  41   0.654  -4.169   5.711
  316    HE1  PHE  41           1HE      PHE  41   4.294  -2.297   8.528
  317    HE2  PHE  41           2HE      PHE  41   1.180  -1.780   5.595
  318    HZ   PHE  41           HZ       PHE  41   3.020  -0.817   6.984
  319    H    LEU  42           H        LEU  42   2.103  -8.771   8.453
  320    HA   LEU  42           HA       LEU  42   3.812  -8.502  10.724
  321   1HB   LEU  42          1HB       LEU  42   1.965 -10.668   9.676
  322   2HB   LEU  42          2HB       LEU  42   2.850 -10.893  11.177
  323    HG   LEU  42           HG       LEU  42   1.058  -8.467  10.729
  324   1HD1  LEU  42          1HD1      LEU  42  -0.334 -10.457  10.435
  325   2HD1  LEU  42          2HD1      LEU  42  -0.700  -9.677  11.979
  326   3HD1  LEU  42          3HD1      LEU  42   0.291 -11.155  11.944
  327   1HD2  LEU  42          1HD2      LEU  42   1.013  -8.408  13.199
  328   2HD2  LEU  42          2HD2      LEU  42   2.670  -8.288  12.601
  329   3HD2  LEU  42          3HD2      LEU  42   2.082  -9.827  13.264
  330    H    SER  43           H        SER  43   4.095 -10.536   7.838
  331    HA   SER  43           HA       SER  43   6.301 -12.121   8.723
  332   1HB   SER  43          1HB       SER  43   4.772 -12.849   6.982
  333   2HB   SER  43          2HB       SER  43   5.143 -11.450   5.985
  334    HG   SER  43           HG       SER  43   7.064 -12.217   5.464
  335    H    THR  44           H        THR  44   6.195  -9.548   6.235
  336    HA   THR  44           HA       THR  44   9.047  -9.145   6.535
  337    HB   THR  44           HB       THR  44   8.025  -9.170   3.773
  338    HG1  THR  44           1HG      THR  44   6.891 -10.849   3.767
  339   1HG2  THR  44          1HG2      THR  44   9.921 -10.633   3.371
  340   2HG2  THR  44          2HG2      THR  44  10.191 -10.805   5.124
  341   3HG2  THR  44          3HG2      THR  44  10.406  -9.220   4.335
  342    H    LEU  45           H        LEU  45   5.994  -7.772   5.461
  343    HA   LEU  45           HA       LEU  45   7.296  -5.660   3.976
  344   1HB   LEU  45          1HB       LEU  45   5.434  -6.876   3.095
  345   2HB   LEU  45          2HB       LEU  45   4.389  -6.468   4.407
  346    HG   LEU  45           HG       LEU  45   5.511  -4.201   2.773
  347   1HD1  LEU  45          1HD1      LEU  45   4.785  -5.856   1.081
  348   2HD1  LEU  45          2HD1      LEU  45   3.723  -4.438   1.125
  349   3HD1  LEU  45          3HD1      LEU  45   3.204  -5.972   1.871
  350   1HD2  LEU  45          1HD2      LEU  45   2.761  -4.747   3.993
  351   2HD2  LEU  45          2HD2      LEU  45   3.280  -3.253   3.185
  352   3HD2  LEU  45          3HD2      LEU  45   4.012  -3.723   4.722
  353    H    SER  46           H        SER  46   7.363  -3.514   4.288
  354    HA   SER  46           HA       SER  46   5.923  -2.231   6.507
  355   1HB   SER  46          1HB       SER  46   8.064  -0.660   6.366
  356   2HB   SER  46          2HB       SER  46   8.033  -2.090   7.390
  357    HG   SER  46           HG       SER  46   9.777  -1.503   5.376
  358    H    PHE  47           H        PHE  47   6.217   0.399   5.826
  359    HA   PHE  47           HA       PHE  47   5.600   0.617   2.969
  360   1HB   PHE  47          1HB       PHE  47   3.557   0.584   5.018
  361   2HB   PHE  47          2HB       PHE  47   3.656   2.196   4.351
  362    HD1  PHE  47           1HD      PHE  47   2.608  -1.208   3.771
  363    HD2  PHE  47           2HD      PHE  47   3.457   2.529   1.794
  364    HE1  PHE  47           1HE      PHE  47   1.258  -1.934   1.814
  365    HE2  PHE  47           2HE      PHE  47   2.133   1.802  -0.152
  366    HZ   PHE  47           HZ       PHE  47   0.999  -0.421  -0.139
  367    H    VAL  48           H        VAL  48   5.553   2.684   2.166
  368    HA   VAL  48           HA       VAL  48   7.157   4.658   3.521
  369    HB   VAL  48           HB       VAL  48   7.893   2.765   1.307
  370   1HG1  VAL  48          1HG1      VAL  48   8.371   4.984   0.296
  371   2HG1  VAL  48          2HG1      VAL  48   9.451   5.324   1.685
  372   3HG1  VAL  48          3HG1      VAL  48   9.790   3.976   0.602
  373   1HG2  VAL  48          1HG2      VAL  48   8.730   2.282   3.568
  374   2HG2  VAL  48          2HG2      VAL  48  10.080   2.819   2.578
  375   3HG2  VAL  48          3HG2      VAL  48   9.342   3.928   3.739
  376    H    CYS  49           H        CYS  49   5.883   6.381   3.369
  377    HA   CYS  49           HA       CYS  49   3.619   6.760   1.553
  378   1HB   CYS  49          1HB       CYS  49   3.738   9.078   2.568
  379   2HB   CYS  49          2HB       CYS  49   3.520   7.742   3.679
  380    HA   PRO  50           HA       PRO  50   5.535   8.270  -2.021
  381   1HB   PRO  50          1HB       PRO  50   3.911  10.359  -2.892
  382   2HB   PRO  50          2HB       PRO  50   3.579   8.611  -3.080
  383   1HG   PRO  50          1HG       PRO  50   2.587  10.480  -0.910
  384   2HG   PRO  50          2HG       PRO  50   1.649   9.275  -1.853
  385   1HD   PRO  50          1HD       PRO  50   2.510   8.689   0.624
  386   2HD   PRO  50          2HD       PRO  50   2.630   7.461  -0.669
  387    H    TRP  51           H        TRP  51   5.022  10.638   0.507
  388    HA   TRP  51           HA       TRP  51   6.655  12.782  -0.389
  389   1HB   TRP  51          1HB       TRP  51   5.229  13.157   1.477
  390   2HB   TRP  51          2HB       TRP  51   5.819  11.734   2.328
  391    HD1  TRP  51           HD       TRP  51   7.781  14.778   0.917
  392    HE1  TRP  51           1HE      TRP  51   9.322  15.676   2.732
  393    HE3  TRP  51           3HE      TRP  51   6.345  11.721   4.779
  394    HZ2  TRP  51           2HZ      TRP  51   9.880  15.147   5.529
  395    HZ3  TRP  51           3HZ      TRP  51   7.382  11.972   7.013
  396    HH2  TRP  51           HH       TRP  51   9.152  13.665   7.396
  397    H    CYS  52           H        CYS  52   7.564  10.177   2.014
  398    HA   CYS  52           HA       CYS  52  10.358  10.773   1.677
  399   1HB   CYS  52          1HB       CYS  52  10.771   8.769   2.950
  400   2HB   CYS  52          2HB       CYS  52   9.497   9.724   3.676
  401    H    ALA  53           H        ALA  53   8.092   8.535   0.011
  402    HA   ALA  53           HA       ALA  53  10.092   6.974  -1.043
  403   1HB   ALA  53          1HB       ALA  53   7.635   6.502  -1.349
  404   2HB   ALA  53          2HB       ALA  53   7.556   7.836  -2.529
  405   3HB   ALA  53          3HB       ALA  53   8.528   6.417  -2.892
  406    H    THR  54           H        THR  54   8.835  10.084  -2.130
  407    HA   THR  54           HA       THR  54  10.504  10.437  -4.459
  408    HB   THR  54           HB       THR  54   8.971  12.477  -2.778
  409    HG1  THR  54           1HG      THR  54   7.485  11.027  -3.379
  410   1HG2  THR  54          1HG2      THR  54   8.800  13.738  -4.896
  411   2HG2  THR  54          2HG2      THR  54   9.817  12.528  -5.707
  412   3HG2  THR  54          3HG2      THR  54  10.491  13.541  -4.409
  413    H    ASN  55           H        ASN  55  10.610  11.657  -1.066
  414    HA   ASN  55           HA       ASN  55  12.942  13.334  -1.606
  415   1HB   ASN  55          1HB       ASN  55  11.360  12.742   0.933
  416   2HB   ASN  55          2HB       ASN  55  12.790  13.772   0.899
  417   1HD2  ASN  55          1HD2      ASN  55   9.560  13.398  -0.642
  418   2HD2  ASN  55          2HD2      ASN  55   9.499  15.077  -1.179
  419    H    GLN  56           H        GLN  56  12.528  10.172  -0.706
  420    HA   GLN  56           HA       GLN  56  13.847   8.418  -0.285
  421   1HB   GLN  56          2HB       GLN  56  15.541   9.570  -1.803
  422   2HB   GLN  56          3HB       GLN  56  16.335  10.157  -0.343
  423   1HG   GLN  56          2HG       GLN  56  17.373   8.175  -0.026
  424   2HG   GLN  56          3HG       GLN  56  15.858   7.281  -0.118
  425   1HE2  GLN  56          1HE2      GLN  56  18.675   8.365  -1.972
  426   2HE2  GLN  56          2HE2      GLN  56  18.285   7.428  -3.407
  427   1H    GLY   1          1H        GLY   1  17.442   7.672   9.310
  428   1HA   GLY   1          1HA       GLY   1  19.724   7.350   9.900
  429   2HA   GLY   1          2HA       GLY   1  19.055   5.865   9.182
  430    H    SER   2           H        SER   2  21.019   5.057   8.288
  431    HA   SER   2           HA       SER   2  21.757   6.264   5.772
  432   1HB   SER   2          1HB       SER   2  24.166   6.018   6.184
  433   2HB   SER   2          2HB       SER   2  23.461   7.172   7.325
  434    HG   SER   2           HG       SER   2  24.515   5.936   8.679
  435    H    HIS   3           H        HIS   3  23.434   4.368   4.860
  436    HA   HIS   3           HA       HIS   3  23.686   2.319   4.062
  437   1HB   HIS   3          1HB       HIS   3  22.826   1.459   6.843
  438   2HB   HIS   3          2HB       HIS   3  23.545   0.413   5.635
  439    HD1  HIS   3           1HD      HIS   3  24.601   3.653   7.584
  440    HD2  HIS   3           2HD      HIS   3  26.120   0.230   5.614
  441    HE1  HIS   3           1HE      HIS   3  27.121   3.623   7.967
  442    H    MET   4           H        MET   4  20.486   2.989   5.154
  443    HA   MET   4           HA       MET   4  19.122   0.725   4.265
  444   1HB   MET   4          1HB       MET   4  18.424   2.548   5.890
  445   2HB   MET   4          2HB       MET   4  18.016   3.550   4.493
  446   1HG   MET   4          1HG       MET   4  16.427   1.721   3.760
  447   2HG   MET   4          2HG       MET   4  16.843   0.839   5.233
  448   1HE   MET   4          1HE       MET   4  13.934   1.228   4.601
  449   2HE   MET   4          2HE       MET   4  14.477   0.585   6.165
  450   3HE   MET   4          3HE       MET   4  13.244   1.865   6.109
  451    H    ALA   5           H        ALA   5  20.500   0.650   2.175
  452    HA   ALA   5           HA       ALA   5  18.851   1.527  -0.037
  453   1HB   ALA   5          1HB       ALA   5  21.871   1.154  -0.006
  454   2HB   ALA   5          2HB       ALA   5  20.899   1.468  -1.459
  455   3HB   ALA   5          3HB       ALA   5  21.004   2.699  -0.181
  456    H    GLU   6           H        GLU   6  17.636  -0.373   0.696
  457    HA   GLU   6           HA       GLU   6  18.992  -2.986   0.320
  458   1HB   GLU   6          1HB       GLU   6  17.071  -1.973   2.455
  459   2HB   GLU   6          2HB       GLU   6  17.541  -3.667   2.286
  460   1HG   GLU   6          1HG       GLU   6  19.867  -3.169   2.732
  461   2HG   GLU   6          2HG       GLU   6  19.564  -1.432   2.735
  462    HA   PRO   7           HA       PRO   7  15.694  -3.909  -2.414
  463   1HB   PRO   7          1HB       PRO   7  15.665  -6.616  -2.509
  464   2HB   PRO   7          2HB       PRO   7  17.120  -5.678  -2.939
  465   1HG   PRO   7          1HG       PRO   7  16.484  -6.937  -0.242
  466   2HG   PRO   7          2HG       PRO   7  17.965  -7.154  -1.235
  467   1HD   PRO   7          1HD       PRO   7  17.840  -5.316   0.767
  468   2HD   PRO   7          2HD       PRO   7  18.722  -4.974  -0.752
  469    H    GLN   8           H        GLN   8  14.477  -2.879  -0.390
  470    HA   GLN   8           HA       GLN   8  12.042  -4.557  -0.004
  471   1HB   GLN   8          1HB       GLN   8  13.479  -2.908   2.091
  472   2HB   GLN   8          2HB       GLN   8  11.741  -3.182   2.170
  473   1HG   GLN   8          1HG       GLN   8  12.804  -4.805   3.555
  474   2HG   GLN   8          2HG       GLN   8  12.044  -5.610   2.190
  475   1HE2  GLN   8          1HE2      GLN   8  13.343  -7.521   1.914
  476   2HE2  GLN   8          2HE2      GLN   8  15.081  -7.361   1.704
  477    H    ARG   9           H        ARG   9  13.132  -1.115   0.303
  478    HA   ARG   9           HA       ARG   9  10.708   0.121  -0.313
  479   1HB   ARG   9          1HB       ARG   9  12.776   1.174   0.593
  480   2HB   ARG   9          2HB       ARG   9  13.485   1.118  -1.011
  481   1HG   ARG   9          1HG       ARG   9  10.977   2.498  -0.538
  482   2HG   ARG   9          2HG       ARG   9  12.516   3.295  -0.219
  483   1HD   ARG   9          1HD       ARG   9  12.967   2.499  -2.764
  484   2HD   ARG   9          2HD       ARG   9  11.215   2.572  -2.839
  485    HE   ARG   9           HE       ARG   9  11.271   4.901  -2.600
  486   1HH1  ARG   9          1HH1      ARG   9  14.583   3.594  -2.224
  487   2HH1  ARG   9          2HH1      ARG   9  15.308   5.179  -2.477
  488   1HH2  ARG   9          1HH2      ARG   9  12.412   7.024  -2.907
  489   2HH2  ARG   9          2HH2      ARG   9  14.162   6.947  -2.819
  490    H    HIS  10           H        HIS  10   9.456  -0.686  -1.976
  491    HA   HIS  10           HA       HIS  10  10.674  -0.898  -4.694
  492   1HB   HIS  10          1HB       HIS  10   8.963  -2.886  -3.176
  493   2HB   HIS  10          2HB       HIS  10   9.228  -2.932  -4.924
  494    HD1  HIS  10           1HD      HIS  10  10.296  -5.235  -2.761
  495    HD2  HIS  10           2HD      HIS  10  12.505  -2.089  -4.324
  496    HE1  HIS  10           1HE      HIS  10  12.640  -6.099  -3.006
  497    H    LYS  11           H        LYS  11   9.271  -0.616  -6.420
  498    HA   LYS  11           HA       LYS  11   7.117   1.330  -5.734
  499   1HB   LYS  11          1HB       LYS  11   9.467   1.418  -7.632
  500   2HB   LYS  11          2HB       LYS  11   8.153   2.580  -7.685
  501   1HG   LYS  11          1HG       LYS  11   8.830   3.691  -5.794
  502   2HG   LYS  11          2HG       LYS  11   9.354   2.236  -4.976
  503   1HD   LYS  11          1HD       LYS  11  11.271   3.669  -5.374
  504   2HD   LYS  11          2HD       LYS  11  11.409   2.148  -6.252
  505   1HE   LYS  11          1HE       LYS  11  12.144   3.774  -7.781
  506   2HE   LYS  11          2HE       LYS  11  10.503   3.367  -8.304
  507   1HZ   LYS  11          1HZ       LYS  11  10.296   5.574  -8.333
  508   2HZ   LYS  11          2HZ       LYS  11  11.461   5.881  -7.153
  509   3HZ   LYS  11          3HZ       LYS  11   9.885   5.426  -6.850
  510    H    ILE  12           H        ILE  12   5.398  -0.080  -6.191
  511    HA   ILE  12           HA       ILE  12   5.309  -1.414  -8.833
  512    HB   ILE  12           HB       ILE  12   3.083  -1.337  -6.772
  513   1HG1  ILE  12          1HG1      ILE  12   5.138  -3.566  -6.953
  514   2HG1  ILE  12          2HG1      ILE  12   5.223  -2.272  -5.751
  515   1HG2  ILE  12          1HG2      ILE  12   3.740  -3.222  -9.074
  516   2HG2  ILE  12          2HG2      ILE  12   2.325  -3.340  -7.995
  517   3HG2  ILE  12          3HG2      ILE  12   2.490  -1.966  -9.082
  518   1HD1  ILE  12          1HD1      ILE  12   2.893  -2.852  -5.002
  519   2HD1  ILE  12          2HD1      ILE  12   3.037  -4.338  -5.985
  520   3HD1  ILE  12          3HD1      ILE  12   4.158  -4.021  -4.643
  521    H    LEU  13           H        LEU  13   4.978   0.122 -10.439
  522    HA   LEU  13           HA       LEU  13   3.398   2.469 -10.013
  523   1HB   LEU  13          1HB       LEU  13   5.298   2.300 -11.589
  524   2HB   LEU  13          2HB       LEU  13   4.327   1.276 -12.650
  525    HG   LEU  13           HG       LEU  13   3.170   3.932 -11.718
  526   1HD1  LEU  13          1HD1      LEU  13   5.427   4.517 -12.307
  527   2HD1  LEU  13          2HD1      LEU  13   4.320   5.084 -13.573
  528   3HD1  LEU  13          3HD1      LEU  13   5.305   3.625 -13.844
  529   1HD2  LEU  13          1HD2      LEU  13   1.710   2.571 -13.119
  530   2HD2  LEU  13          2HD2      LEU  13   2.997   2.351 -14.324
  531   3HD2  LEU  13          3HD2      LEU  13   2.264   3.944 -14.069
  532    H    CYS  14           H        CYS  14   1.342   2.461  -9.800
  533    HA   CYS  14           HA       CYS  14  -0.399   0.593 -11.322
  534   1HB   CYS  14          1HB       CYS  14  -0.070   0.075  -8.838
  535   2HB   CYS  14          2HB       CYS  14  -0.836   1.627  -8.478
  536    HG   CYS  14           HG       CYS  14  -3.157   1.096  -8.973
  537    H    VAL  15           H        VAL  15  -2.814   1.706 -10.805
  538    HA   VAL  15           HA       VAL  15  -2.592   4.648 -10.991
  539    HB   VAL  15           HB       VAL  15  -4.855   4.685 -11.992
  540   1HG1  VAL  15          1HG1      VAL  15  -4.171   4.172 -14.276
  541   2HG1  VAL  15          2HG1      VAL  15  -2.868   4.983 -13.400
  542   3HG1  VAL  15          3HG1      VAL  15  -2.786   3.229 -13.685
  543   1HG2  VAL  15          1HG2      VAL  15  -4.488   1.696 -12.493
  544   2HG2  VAL  15          2HG2      VAL  15  -5.639   2.416 -11.340
  545   3HG2  VAL  15          3HG2      VAL  15  -5.812   2.728 -13.069
  546    H    CYS  16           H        CYS  16  -4.266   5.732  -9.813
  547    HA   CYS  16           HA       CYS  16  -5.146   4.586  -7.301
  548   1HB   CYS  16          1HB       CYS  16  -4.919   7.104  -7.763
  549   2HB   CYS  16          2HB       CYS  16  -6.317   6.944  -8.843
  550    H    CYS  17           H        CYS  17  -6.864   3.403  -6.995
  551    HA   CYS  17           HA       CYS  17  -8.331   2.001  -8.904
  552   1HB   CYS  17          1HB       CYS  17  -8.101   1.537  -6.415
  553   2HB   CYS  17          2HB       CYS  17  -9.285   2.822  -6.129
  554    HG   CYS  17           HG       CYS  17 -10.814   1.089  -5.856
  555    H    LYS  18           H        LYS  18  -9.190   5.153  -7.383
  556    HA   LYS  18           HA       LYS  18 -11.539   5.319  -9.185
  557   1HB   LYS  18          1HB       LYS  18 -12.631   6.461  -7.378
  558   2HB   LYS  18          2HB       LYS  18 -12.204   4.804  -6.961
  559   1HG   LYS  18          1HG       LYS  18 -10.378   5.604  -5.511
  560   2HG   LYS  18          2HG       LYS  18 -10.588   7.250  -6.058
  561   1HD   LYS  18          1HD       LYS  18 -11.869   7.441  -4.187
  562   2HD   LYS  18          2HD       LYS  18 -13.138   6.830  -5.211
  563   1HE   LYS  18          1HE       LYS  18 -11.472   5.281  -3.187
  564   2HE   LYS  18          2HE       LYS  18 -13.167   5.727  -3.054
  565   1HZ   LYS  18          1HZ       LYS  18 -13.602   4.176  -4.935
  566   2HZ   LYS  18          2HZ       LYS  18 -12.903   3.435  -3.604
  567   3HZ   LYS  18          3HZ       LYS  18 -12.001   3.665  -4.834
  568    H    CYS  19           H        CYS  19  -8.631   7.080  -8.238
  569    HA   CYS  19           HA       CYS  19  -9.660   9.550  -9.446
  570   1HB   CYS  19          1HB       CYS  19  -6.905   8.962  -8.760
  571   2HB   CYS  19          2HB       CYS  19  -7.620  10.506  -9.079
  572    H    ASP  20           H        ASP  20  -8.369   6.484 -10.432
  573    HA   ASP  20           HA       ASP  20  -7.335   5.668 -12.202
  574   1HB   ASP  20          1HB       ASP  20  -9.632   6.120 -12.978
  575   2HB   ASP  20          2HB       ASP  20  -9.083   7.648 -13.664
  576    H    GLY  21           H        GLY  21  -5.763   7.507 -10.914
  577   1HA   GLY  21          1HA       GLY  21  -4.207   8.807 -13.121
  578   2HA   GLY  21          2HA       GLY  21  -4.309   9.492 -11.492
  579    H    ARG  22           H        ARG  22  -1.896   8.669 -12.827
  580    HA   ARG  22           HA       ARG  22  -1.153   5.990 -12.138
  581   1HB   ARG  22          1HB       ARG  22  -0.254   7.181 -14.057
  582   2HB   ARG  22          2HB       ARG  22   0.452   8.435 -13.036
  583   1HG   ARG  22          1HG       ARG  22   1.203   5.537 -12.596
  584   2HG   ARG  22          2HG       ARG  22   1.882   6.391 -13.973
  585   1HD   ARG  22          1HD       ARG  22   2.092   7.952 -11.452
  586   2HD   ARG  22          2HD       ARG  22   2.866   6.378 -11.381
  587    HE   ARG  22           HE       ARG  22   3.435   7.928 -13.791
  588   1HH1  ARG  22          1HH1      ARG  22   4.529   7.337 -10.488
  589   2HH1  ARG  22          2HH1      ARG  22   6.179   7.759 -10.776
  590   1HH2  ARG  22          1HH2      ARG  22   5.629   8.522 -14.209
  591   2HH2  ARG  22          2HH2      ARG  22   6.793   8.490 -12.937
  592    H    ILE  23           H        ILE  23  -0.221   5.205 -10.285
  593    HA   ILE  23           HA       ILE  23   0.926   7.164  -8.395
  594    HB   ILE  23           HB       ILE  23  -0.576   4.675  -7.475
  595   1HG1  ILE  23          1HG1      ILE  23  -1.530   7.557  -7.147
  596   2HG1  ILE  23          2HG1      ILE  23  -2.206   6.407  -8.303
  597   1HG2  ILE  23          1HG2      ILE  23  -0.109   5.694  -5.227
  598   2HG2  ILE  23          2HG2      ILE  23   1.381   5.482  -6.102
  599   3HG2  ILE  23          3HG2      ILE  23   0.652   7.091  -6.021
  600   1HD1  ILE  23          1HD1      ILE  23  -2.847   4.872  -6.475
  601   2HD1  ILE  23          2HD1      ILE  23  -2.222   6.025  -5.276
  602   3HD1  ILE  23          3HD1      ILE  23  -3.582   6.474  -6.273
  603    H    GLU  24           H        GLU  24   2.991   6.620  -7.920
  604    HA   GLU  24           HA       GLU  24   4.104   3.988  -8.668
  605   1HB   GLU  24          1HB       GLU  24   5.386   6.070  -9.084
  606   2HB   GLU  24          2HB       GLU  24   5.359   6.436  -7.355
  607   1HG   GLU  24          1HG       GLU  24   6.496   4.185  -6.981
  608   2HG   GLU  24          2HG       GLU  24   6.588   4.009  -8.739
  609    H    LEU  25           H        LEU  25   3.125   2.457  -7.248
  610    HA   LEU  25           HA       LEU  25   2.526   3.187  -4.511
  611   1HB   LEU  25          1HB       LEU  25   2.590   0.384  -5.647
  612   2HB   LEU  25          2HB       LEU  25   1.819   0.929  -4.181
  613    HG   LEU  25           HG       LEU  25   0.979   1.648  -7.029
  614   1HD1  LEU  25          1HD1      LEU  25  -0.200  -0.179  -4.889
  615   2HD1  LEU  25          2HD1      LEU  25   0.497  -0.682  -6.442
  616   3HD1  LEU  25          3HD1      LEU  25  -1.015   0.243  -6.409
  617   1HD2  LEU  25          1HD2      LEU  25   0.485   3.475  -5.502
  618   2HD2  LEU  25          2HD2      LEU  25  -0.218   2.369  -4.328
  619   3HD2  LEU  25          3HD2      LEU  25  -1.016   2.642  -5.907
  620    H    THR  26           H        THR  26   4.485   3.826  -3.610
  621    HA   THR  26           HA       THR  26   6.696   1.921  -3.527
  622    HB   THR  26           HB       THR  26   6.450   4.479  -1.946
  623    HG1  THR  26           1HG      THR  26   6.336   4.724  -4.278
  624   1HG2  THR  26          1HG2      THR  26   8.798   2.699  -2.812
  625   2HG2  THR  26          2HG2      THR  26   8.197   2.872  -1.158
  626   3HG2  THR  26          3HG2      THR  26   8.957   4.253  -1.978
  627    H    VAL  27           H        VAL  27   6.143   0.094  -2.544
  628    HA   VAL  27           HA       VAL  27   5.134   0.202   0.267
  629    HB   VAL  27           HB       VAL  27   4.312  -2.061   0.090
  630   1HG1  VAL  27          1HG1      VAL  27   3.919  -1.223  -2.810
  631   2HG1  VAL  27          2HG1      VAL  27   2.854  -2.160  -1.746
  632   3HG1  VAL  27          3HG1      VAL  27   3.078  -0.425  -1.481
  633   1HG2  VAL  27          1HG2      VAL  27   6.132  -2.308  -2.380
  634   2HG2  VAL  27          2HG2      VAL  27   6.355  -3.124  -0.815
  635   3HG2  VAL  27          3HG2      VAL  27   4.998  -3.554  -1.840
  636    H    GLU  28           H        GLU  28   6.585  -1.633   1.589
  637    HA   GLU  28           HA       GLU  28   9.359  -1.413   0.557
  638   1HB   GLU  28          1HB       GLU  28   8.475   0.413   2.225
  639   2HB   GLU  28          2HB       GLU  28   8.637  -0.834   3.413
  640   1HG   GLU  28          1HG       GLU  28  11.113  -0.955   2.244
  641   2HG   GLU  28          2HG       GLU  28  10.691   0.694   1.890
  642    H    SER  29           H        SER  29   9.408  -3.650  -0.070
  643    HA   SER  29           HA       SER  29   9.587  -5.487   2.138
  644   1HB   SER  29          1HB       SER  29   7.048  -5.348   1.743
  645   2HB   SER  29          2HB       SER  29   7.350  -6.178   0.201
  646    HG   SER  29           HG       SER  29   6.974  -7.795   1.745
  647    H    SER  30           H        SER  30  10.275  -7.572   1.476
  648    HA   SER  30           HA       SER  30  12.185  -7.663  -0.589
  649   1HB   SER  30          1HB       SER  30  10.705  -9.972   0.736
  650   2HB   SER  30          2HB       SER  30  12.290 -10.050  -0.057
  651    HG   SER  30           HG       SER  30  12.295  -9.808   2.309
  652    H    ALA  31           H        ALA  31  12.169  -8.601  -2.643
  653    HA   ALA  31           HA       ALA  31  10.108  -7.741  -4.163
  654   1HB   ALA  31          1HB       ALA  31  12.064  -9.965  -4.909
  655   2HB   ALA  31          2HB       ALA  31  11.148  -8.963  -6.050
  656   3HB   ALA  31          3HB       ALA  31  12.381  -8.213  -5.015
  657    H    GLU  32           H        GLU  32  10.282 -11.090  -2.894
  658    HA   GLU  32           HA       GLU  32   8.017 -11.701  -4.573
  659   1HB   GLU  32          1HB       GLU  32  10.267 -13.107  -4.151
  660   2HB   GLU  32          2HB       GLU  32   9.157 -13.912  -3.005
  661   1HG   GLU  32          1HG       GLU  32   7.513 -14.229  -4.817
  662   2HG   GLU  32          2HG       GLU  32   8.478 -13.235  -5.906
  663    H    ASP  33           H        ASP  33   8.567 -10.934  -1.313
  664    HA   ASP  33           HA       ASP  33   6.019 -11.818  -0.300
  665   1HB   ASP  33          1HB       ASP  33   7.822 -11.308   1.223
  666   2HB   ASP  33          2HB       ASP  33   8.046  -9.711   0.522
  667    H    LEU  34           H        LEU  34   7.469  -8.963  -1.925
  668    HA   LEU  34           HA       LEU  34   5.090  -7.450  -2.128
  669   1HB   LEU  34          1HB       LEU  34   7.074  -6.308  -2.434
  670   2HB   LEU  34          2HB       LEU  34   7.740  -7.445  -3.574
  671    HG   LEU  34           HG       LEU  34   5.288  -5.853  -4.380
  672   1HD1  LEU  34          1HD1      LEU  34   6.940  -4.248  -3.445
  673   2HD1  LEU  34          2HD1      LEU  34   6.835  -4.072  -5.200
  674   3HD1  LEU  34          3HD1      LEU  34   8.198  -4.954  -4.480
  675   1HD2  LEU  34          1HD2      LEU  34   7.675  -6.970  -5.938
  676   2HD2  LEU  34          2HD2      LEU  34   6.442  -5.897  -6.630
  677   3HD2  LEU  34          3HD2      LEU  34   5.985  -7.490  -6.071
  678    H    ARG  35           H        ARG  35   6.545  -9.597  -4.332
  679    HA   ARG  35           HA       ARG  35   4.699  -9.769  -6.447
  680   1HB   ARG  35          1HB       ARG  35   6.883 -11.032  -6.340
  681   2HB   ARG  35          2HB       ARG  35   6.072 -12.259  -5.364
  682   1HG   ARG  35          1HG       ARG  35   4.495 -12.688  -7.230
  683   2HG   ARG  35          2HG       ARG  35   5.356 -11.484  -8.212
  684   1HD   ARG  35          1HD       ARG  35   7.446 -12.867  -7.973
  685   2HD   ARG  35          2HD       ARG  35   6.507 -14.077  -7.074
  686    HE   ARG  35           HE       ARG  35   5.244 -13.518  -9.551
  687   1HH1  ARG  35          1HH1      ARG  35   8.102 -15.374  -8.269
  688   2HH1  ARG  35          2HH1      ARG  35   8.193 -16.346  -9.672
  689   1HH2  ARG  35          1HH2      ARG  35   5.402 -14.927 -11.346
  690   2HH2  ARG  35          2HH2      ARG  35   6.635 -16.134 -11.410
  691    H    THR  36           H        THR  36   4.713 -11.657  -3.436
  692    HA   THR  36           HA       THR  36   2.220 -12.978  -3.830
  693    HB   THR  36           HB       THR  36   3.376 -12.147  -1.141
  694    HG1  THR  36           1HG      THR  36   4.971 -13.272  -2.354
  695   1HG2  THR  36          1HG2      THR  36   1.603 -14.470  -2.028
  696   2HG2  THR  36          2HG2      THR  36   1.086 -13.089  -1.037
  697   3HG2  THR  36          3HG2      THR  36   2.272 -14.246  -0.402
  698    H    LEU  37           H        LEU  37   2.900  -9.826  -2.211
  699    HA   LEU  37           HA       LEU  37   0.223  -8.980  -1.886
  700   1HB   LEU  37          1HB       LEU  37   1.415  -7.441  -0.808
  701   2HB   LEU  37          2HB       LEU  37   2.875  -7.899  -1.633
  702    HG   LEU  37           HG       LEU  37   2.147  -6.391  -3.570
  703   1HD1  LEU  37          1HD1      LEU  37  -0.274  -5.914  -2.679
  704   2HD1  LEU  37          2HD1      LEU  37   0.646  -4.424  -2.801
  705   3HD1  LEU  37          3HD1      LEU  37   0.411  -5.188  -1.243
  706   1HD2  LEU  37          1HD2      LEU  37   2.982  -4.370  -2.416
  707   2HD2  LEU  37          2HD2      LEU  37   4.002  -5.782  -2.269
  708   3HD2  LEU  37          3HD2      LEU  37   2.984  -5.288  -0.896
  709    H    GLN  38           H        GLN  38   2.285  -8.815  -4.847
  710    HA   GLN  38           HA       GLN  38   0.405  -7.341  -6.361
  711   1HB   GLN  38          1HB       GLN  38   2.766  -7.463  -6.845
  712   2HB   GLN  38          2HB       GLN  38   2.659  -9.184  -7.189
  713   1HG   GLN  38          1HG       GLN  38   1.213  -8.754  -9.133
  714   2HG   GLN  38          2HG       GLN  38   1.335  -7.009  -8.826
  715   1HE2  GLN  38          1HE2      GLN  38   3.628  -6.089  -8.769
  716   2HE2  GLN  38          2HE2      GLN  38   4.879  -6.946  -9.657
  717    H    GLN  39           H        GLN  39   0.697 -10.845  -5.609
  718    HA   GLN  39           HA       GLN  39  -1.251 -11.646  -7.560
  719   1HB   GLN  39          1HB       GLN  39  -0.631 -13.146  -5.018
  720   2HB   GLN  39          2HB       GLN  39  -1.366 -13.736  -6.501
  721   1HG   GLN  39          1HG       GLN  39   1.501 -13.092  -5.940
  722   2HG   GLN  39          2HG       GLN  39   0.807 -14.556  -6.578
  723   1HE2  GLN  39          1HE2      GLN  39   2.284 -11.566  -7.342
  724   2HE2  GLN  39          2HE2      GLN  39   2.212 -11.689  -9.107
  725    H    LEU  40           H        LEU  40  -1.346 -10.520  -4.149
  726    HA   LEU  40           HA       LEU  40  -4.202 -10.736  -3.904
  727   1HB   LEU  40          1HB       LEU  40  -2.334  -8.828  -2.483
  728   2HB   LEU  40          2HB       LEU  40  -4.014  -9.107  -2.080
  729    HG   LEU  40           HG       LEU  40  -1.908 -11.317  -2.053
  730   1HD1  LEU  40          1HD1      LEU  40  -1.358  -9.546  -0.416
  731   2HD1  LEU  40          2HD1      LEU  40  -1.854 -11.047   0.371
  732   3HD1  LEU  40          3HD1      LEU  40  -2.994  -9.684   0.256
  733   1HD2  LEU  40          1HD2      LEU  40  -3.548 -12.531  -0.673
  734   2HD2  LEU  40          2HD2      LEU  40  -4.248 -12.147  -2.244
  735   3HD2  LEU  40          3HD2      LEU  40  -4.698 -11.185  -0.826
  736    H    PHE  41           H        PHE  41  -2.137  -8.292  -5.472
  737    HA   PHE  41           HA       PHE  41  -4.317  -6.452  -6.047
  738   1HB   PHE  41          1HB       PHE  41  -1.538  -6.778  -7.108
  739   2HB   PHE  41          2HB       PHE  41  -2.705  -6.042  -8.173
  740    HD1  PHE  41           1HD      PHE  41  -3.009  -3.721  -8.094
  741    HD2  PHE  41           2HD      PHE  41  -1.515  -5.774  -4.618
  742    HE1  PHE  41           1HE      PHE  41  -2.834  -1.565  -6.898
  743    HE2  PHE  41           2HE      PHE  41  -1.351  -3.597  -3.417
  744    HZ   PHE  41           HZ       PHE  41  -2.038  -1.511  -4.538
  745    H    LEU  42           H        LEU  42  -2.954  -9.193  -7.851
  746    HA   LEU  42           HA       LEU  42  -4.861  -9.087  -9.983
  747   1HB   LEU  42          1HB       LEU  42  -3.142 -11.287  -8.801
  748   2HB   LEU  42          2HB       LEU  42  -4.194 -11.587 -10.175
  749    HG   LEU  42           HG       LEU  42  -2.022  -9.442 -10.166
  750   1HD1  LEU  42          1HD1      LEU  42  -1.011 -11.665  -9.897
  751   2HD1  LEU  42          2HD1      LEU  42  -0.688 -11.027 -11.511
  752   3HD1  LEU  42          3HD1      LEU  42  -1.933 -12.278 -11.283
  753   1HD2  LEU  42          1HD2      LEU  42  -2.279  -9.567 -12.640
  754   2HD2  LEU  42          2HD2      LEU  42  -3.764  -9.024 -11.859
  755   3HD2  LEU  42          3HD2      LEU  42  -3.635 -10.699 -12.436
  756    H    SER  43           H        SER  43  -5.144 -10.433  -6.744
  757    HA   SER  43           HA       SER  43  -7.692 -11.706  -7.099
  758   1HB   SER  43          1HB       SER  43  -6.393 -12.397  -5.269
  759   2HB   SER  43          2HB       SER  43  -6.012 -10.768  -4.793
  760    HG   SER  43           HG       SER  43  -7.412 -10.928  -3.377
  761    H    THR  44           H        THR  44  -7.173  -8.812  -5.072
  762    HA   THR  44           HA       THR  44  -9.182  -7.339  -6.541
  763    HB   THR  44           HB       THR  44 -10.491  -6.766  -4.444
  764    HG1  THR  44           1HG      THR  44  -9.063  -7.554  -2.818
  765   1HG2  THR  44          1HG2      THR  44 -11.262  -8.422  -6.143
  766   2HG2  THR  44          2HG2      THR  44 -11.881  -8.705  -4.494
  767   3HG2  THR  44          3HG2      THR  44 -10.559  -9.712  -5.132
  768    H    LEU  45           H        LEU  45  -6.571  -7.350  -4.390
  769    HA   LEU  45           HA       LEU  45  -6.822  -4.964  -3.055
  770   1HB   LEU  45          1HB       LEU  45  -5.154  -6.783  -2.622
  771   2HB   LEU  45          2HB       LEU  45  -4.212  -6.182  -3.971
  772    HG   LEU  45           HG       LEU  45  -3.767  -4.089  -2.835
  773   1HD1  LEU  45          1HD1      LEU  45  -5.441  -5.243  -0.576
  774   2HD1  LEU  45          2HD1      LEU  45  -5.710  -3.706  -1.466
  775   3HD1  LEU  45          3HD1      LEU  45  -4.317  -3.892  -0.400
  776   1HD2  LEU  45          1HD2      LEU  45  -3.281  -6.457  -0.966
  777   2HD2  LEU  45          2HD2      LEU  45  -2.254  -5.016  -1.183
  778   3HD2  LEU  45          3HD2      LEU  45  -2.410  -6.221  -2.479
  779    H    SER  46           H        SER  46  -7.143  -2.952  -3.703
  780    HA   SER  46           HA       SER  46  -5.699  -1.955  -6.080
  781   1HB   SER  46          1HB       SER  46  -8.545  -1.365  -5.166
  782   2HB   SER  46          2HB       SER  46  -7.746  -0.747  -6.619
  783    HG   SER  46           HG       SER  46  -8.307  -3.522  -6.091
  784    H    PHE  47           H        PHE  47  -5.461   0.475  -5.850
  785    HA   PHE  47           HA       PHE  47  -4.911   1.123  -3.009
  786   1HB   PHE  47          1HB       PHE  47  -2.916   0.621  -4.655
  787   2HB   PHE  47          2HB       PHE  47  -3.277   2.212  -5.291
  788    HD1  PHE  47           1HD      PHE  47  -2.046   0.276  -2.401
  789    HD2  PHE  47           2HD      PHE  47  -2.966   4.240  -3.831
  790    HE1  PHE  47           1HE      PHE  47  -0.790   1.259  -0.502
  791    HE2  PHE  47           2HE      PHE  47  -1.714   5.213  -1.925
  792    HZ   PHE  47           HZ       PHE  47  -0.617   3.725  -0.262
  793    H    VAL  48           H        VAL  48  -5.318   3.124  -2.357
  794    HA   VAL  48           HA       VAL  48  -6.375   5.079  -4.200
  795    HB   VAL  48           HB       VAL  48  -7.971   5.626  -2.130
  796   1HG1  VAL  48          1HG1      VAL  48  -8.571   5.067  -4.529
  797   2HG1  VAL  48          2HG1      VAL  48  -8.504   3.352  -4.100
  798   3HG1  VAL  48          3HG1      VAL  48  -9.726   4.392  -3.355
  799   1HG2  VAL  48          1HG2      VAL  48  -7.303   4.023  -0.675
  800   2HG2  VAL  48          2HG2      VAL  48  -9.001   3.782  -1.129
  801   3HG2  VAL  48          3HG2      VAL  48  -7.733   2.687  -1.763
  802    H    CYS  49           H        CYS  49  -5.451   6.906  -4.064
  803    HA   CYS  49           HA       CYS  49  -3.059   7.195  -2.382
  804   1HB   CYS  49          1HB       CYS  49  -3.084   9.531  -3.497
  805   2HB   CYS  49          2HB       CYS  49  -2.808   8.121  -4.496
  806    HA   PRO  50           HA       PRO  50  -4.714   9.193   1.136
  807   1HB   PRO  50          1HB       PRO  50  -3.207  11.593   1.360
  808   2HB   PRO  50          2HB       PRO  50  -2.874   9.995   2.086
  809   1HG   PRO  50          1HG       PRO  50  -1.827  11.148  -0.504
  810   2HG   PRO  50          2HG       PRO  50  -0.942  10.200   0.733
  811   1HD   PRO  50          1HD       PRO  50  -1.723   8.984  -1.494
  812   2HD   PRO  50          2HD       PRO  50  -1.984   8.179   0.063
  813    H    TRP  51           H        TRP  51  -4.655  11.179  -1.801
  814    HA   TRP  51           HA       TRP  51  -6.401  13.254  -0.939
  815   1HB   TRP  51          1HB       TRP  51  -5.047  13.534  -2.919
  816   2HB   TRP  51          2HB       TRP  51  -5.767  12.121  -3.685
  817    HD1  TRP  51           HD       TRP  51  -8.059  14.636  -1.961
  818    HE1  TRP  51           1HE      TRP  51  -9.605  15.673  -3.636
  819    HE3  TRP  51           3HE      TRP  51  -5.772  12.948  -6.228
  820    HZ2  TRP  51           2HZ      TRP  51  -9.747  15.930  -6.563
  821    HZ3  TRP  51           3HZ      TRP  51  -6.634  13.629  -8.450
  822    HH2  TRP  51           HH       TRP  51  -8.616  15.113  -8.629
  823    H    CYS  52           H        CYS  52  -7.214  10.384  -3.070
  824    HA   CYS  52           HA       CYS  52 -10.024  10.727  -2.727
  825   1HB   CYS  52          1HB       CYS  52 -10.039   8.152  -3.180
  826   2HB   CYS  52          2HB       CYS  52  -9.642   9.238  -4.462
  827    H    ALA  53           H        ALA  53  -7.565   8.937  -0.826
  828    HA   ALA  53           HA       ALA  53  -9.357   7.470   0.713
  829   1HB   ALA  53          1HB       ALA  53  -6.873   7.213   0.776
  830   2HB   ALA  53          2HB       ALA  53  -6.752   8.765   1.639
  831   3HB   ALA  53          3HB       ALA  53  -7.566   7.415   2.414
  832    H    THR  54           H        THR  54  -8.239  10.819   1.119
  833    HA   THR  54           HA       THR  54  -9.694  11.294   3.580
  834    HB   THR  54           HB       THR  54  -8.345  13.242   1.655
  835    HG1  THR  54           1HG      THR  54  -6.795  11.845   2.236
  836   1HG2  THR  54          1HG2      THR  54  -8.047  14.636   3.683
  837   2HG2  THR  54          2HG2      THR  54  -8.954  13.448   4.642
  838   3HG2  THR  54          3HG2      THR  54  -9.770  14.367   3.358
  839    H    ASN  55           H        ASN  55 -10.122  12.296   0.126
  840    HA   ASN  55           HA       ASN  55 -12.430  13.981   0.718
  841   1HB   ASN  55          1HB       ASN  55 -11.187  12.939  -1.879
  842   2HB   ASN  55          2HB       ASN  55 -12.647  13.913  -1.850
  843   1HD2  ASN  55          1HD2      ASN  55 -10.125  14.584   0.526
  844   2HD2  ASN  55          2HD2      ASN  55  -9.612  16.083  -0.233
  845    H    GLN  56           H        GLN  56 -11.962  10.823  -0.695
  846    HA   GLN  56           HA       GLN  56 -13.242   9.366  -1.772
  847   1HB   GLN  56          2HB       GLN  56 -13.882   9.027   0.700
  848   2HB   GLN  56          3HB       GLN  56 -15.417   9.798   0.301
  849   1HG   GLN  56          2HG       GLN  56 -15.823   8.040  -1.433
  850   2HG   GLN  56          3HG       GLN  56 -14.248   7.324  -1.066
  851   1HE2  GLN  56          1HE2      GLN  56 -17.587   7.534  -0.092
  852   2HE2  GLN  56          2HE2      GLN  56 -17.435   6.445   1.303
  Start of MODEL   12
    1   1H    GLY   1          1H        GLY   1 -27.977   1.849   6.556
    2   1HA   GLY   1          1HA       GLY   1 -27.205   2.969   8.565
    3   2HA   GLY   1          2HA       GLY   1 -26.744   1.247   8.510
    4    H    SER   2           H        SER   2 -25.385   3.556   9.894
    5    HA   SER   2           HA       SER   2 -23.433   4.603  10.138
    6   1HB   SER   2          1HB       SER   2 -22.244   2.284   8.566
    7   2HB   SER   2          2HB       SER   2 -21.369   3.384   9.642
    8    HG   SER   2           HG       SER   2 -22.360   2.505  11.376
    9    H    HIS   3           H        HIS   3 -21.161   5.094   8.469
   10    HA   HIS   3           HA       HIS   3 -22.077   5.947   5.882
   11   1HB   HIS   3          1HB       HIS   3 -22.808   7.826   7.385
   12   2HB   HIS   3          2HB       HIS   3 -21.145   7.993   7.954
   13    HD1  HIS   3           1HD      HIS   3 -23.111   8.269   4.606
   14    HD2  HIS   3           2HD      HIS   3 -19.584   9.559   6.522
   15    HE1  HIS   3           1HE      HIS   3 -21.945   9.885   3.000
   16    H    MET   4           H        MET   4 -20.123   6.861   4.724
   17    HA   MET   4           HA       MET   4 -18.255   6.046   3.713
   18   1HB   MET   4          1HB       MET   4 -17.699   8.169   4.926
   19   2HB   MET   4          2HB       MET   4 -16.976   7.186   6.209
   20   1HG   MET   4          1HG       MET   4 -15.425   6.191   4.484
   21   2HG   MET   4          2HG       MET   4 -16.189   7.190   3.257
   22   1HE   MET   4          1HE       MET   4 -15.149   8.315   6.988
   23   2HE   MET   4          2HE       MET   4 -13.984   7.077   6.466
   24   3HE   MET   4          3HE       MET   4 -13.465   8.771   6.665
   25    H    ALA   5           H        ALA   5 -19.229   3.788   4.292
   26    HA   ALA   5           HA       ALA   5 -17.196   2.165   5.556
   27   1HB   ALA   5          1HB       ALA   5 -20.208   2.006   6.013
   28   2HB   ALA   5          2HB       ALA   5 -19.023   0.804   6.566
   29   3HB   ALA   5          3HB       ALA   5 -18.980   2.460   7.220
   30    H    GLU   6           H        GLU   6 -16.389   1.443   3.535
   31    HA   GLU   6           HA       GLU   6 -18.370   0.368   1.611
   32   1HB   GLU   6          1HB       GLU   6 -15.553   1.437   1.263
   33   2HB   GLU   6          2HB       GLU   6 -16.598   0.887  -0.045
   34   1HG   GLU   6          1HG       GLU   6 -17.958   2.793   0.046
   35   2HG   GLU   6          2HG       GLU   6 -17.537   3.181   1.698
   36    HA   PRO   7           HA       PRO   7 -15.671  -3.349   1.896
   37   1HB   PRO   7          1HB       PRO   7 -16.176  -4.519  -0.503
   38   2HB   PRO   7          2HB       PRO   7 -17.408  -4.528   0.797
   39   1HG   PRO   7          1HG       PRO   7 -17.222  -2.669  -1.591
   40   2HG   PRO   7          2HG       PRO   7 -18.667  -3.517  -0.952
   41   1HD   PRO   7          1HD       PRO   7 -17.986  -0.883  -0.365
   42   2HD   PRO   7          2HD       PRO   7 -18.954  -1.909   0.735
   43    H    GLN   8           H        GLN   8 -13.674  -3.971   0.530
   44    HA   GLN   8           HA       GLN   8 -11.877  -3.581  -0.550
   45   1HB   GLN   8          1HB       GLN   8 -13.986  -2.727  -2.322
   46   2HB   GLN   8          2HB       GLN   8 -12.553  -1.797  -2.642
   47   1HG   GLN   8          1HG       GLN   8 -12.650  -3.834  -4.003
   48   2HG   GLN   8          2HG       GLN   8 -11.247  -3.854  -2.938
   49   1HE2  GLN   8          1HE2      GLN   8 -10.961  -6.042  -2.714
   50   2HE2  GLN   8          2HE2      GLN   8 -12.107  -7.164  -2.028
   51    H    ARG   9           H        ARG   9 -13.169  -0.228  -0.653
   52    HA   ARG   9           HA       ARG   9 -10.775   1.105  -0.065
   53   1HB   ARG   9          1HB       ARG   9 -13.114   2.035  -0.817
   54   2HB   ARG   9          2HB       ARG   9 -13.452   2.164   0.874
   55   1HG   ARG   9          1HG       ARG   9 -10.926   3.379   0.150
   56   2HG   ARG   9          2HG       ARG   9 -12.327   4.118  -0.612
   57   1HD   ARG   9          1HD       ARG   9 -13.319   4.235   1.792
   58   2HD   ARG   9          2HD       ARG   9 -11.710   3.860   2.343
   59    HE   ARG   9           HE       ARG   9 -10.902   5.952   1.501
   60   1HH1  ARG   9          1HH1      ARG   9 -14.490   5.733   1.158
   61   2HH1  ARG   9          2HH1      ARG   9 -14.713   7.433   1.111
   62   1HH2  ARG   9          1HH2      ARG   9 -11.270   8.329   1.531
   63   2HH2  ARG   9          2HH2      ARG   9 -12.879   8.846   1.256
   64    H    HIS  10           H        HIS  10  -9.638  -0.107   1.569
   65    HA   HIS  10           HA       HIS  10 -10.679   0.266   4.347
   66   1HB   HIS  10          1HB       HIS  10  -8.975  -1.962   3.190
   67   2HB   HIS  10          2HB       HIS  10  -9.454  -1.790   4.880
   68    HD1  HIS  10           1HD      HIS  10 -10.232  -4.246   2.754
   69    HD2  HIS  10           2HD      HIS  10 -12.664  -1.050   3.878
   70    HE1  HIS  10           1HE      HIS  10 -12.537  -5.029   2.436
   71    H    LYS  11           H        LYS  11  -8.911   0.276   6.002
   72    HA   LYS  11           HA       LYS  11  -6.665   1.980   5.085
   73   1HB   LYS  11          1HB       LYS  11  -8.954   2.765   6.904
   74   2HB   LYS  11          2HB       LYS  11  -7.385   3.550   6.923
   75   1HG   LYS  11          1HG       LYS  11  -8.108   4.917   5.290
   76   2HG   LYS  11          2HG       LYS  11  -7.942   3.563   4.219
   77   1HD   LYS  11          1HD       LYS  11 -10.079   4.483   3.824
   78   2HD   LYS  11          2HD       LYS  11 -10.352   2.963   4.673
   79   1HE   LYS  11          1HE       LYS  11 -11.850   4.605   5.590
   80   2HE   LYS  11          2HE       LYS  11 -10.619   4.264   6.815
   81   1HZ   LYS  11          1HZ       LYS  11 -11.074   6.630   6.577
   82   2HZ   LYS  11          2HZ       LYS  11 -10.553   6.612   5.014
   83   3HZ   LYS  11          3HZ       LYS  11  -9.513   6.311   6.260
   84    H    ILE  12           H        ILE  12  -5.094   0.593   5.700
   85    HA   ILE  12           HA       ILE  12  -5.113  -0.569   8.435
   86    HB   ILE  12           HB       ILE  12  -2.944  -0.722   6.317
   87   1HG1  ILE  12          1HG1      ILE  12  -4.963  -2.902   6.819
   88   2HG1  ILE  12          2HG1      ILE  12  -5.060  -1.747   5.480
   89   1HG2  ILE  12          1HG2      ILE  12  -3.449  -2.384   8.823
   90   2HG2  ILE  12          2HG2      ILE  12  -2.083  -2.579   7.702
   91   3HG2  ILE  12          3HG2      ILE  12  -2.219  -1.119   8.668
   92   1HD1  ILE  12          1HD1      ILE  12  -2.741  -2.442   4.766
   93   2HD1  ILE  12          2HD1      ILE  12  -2.878  -3.795   5.921
   94   3HD1  ILE  12          3HD1      ILE  12  -4.007  -3.649   4.561
   95    H    LEU  13           H        LEU  13  -4.746   1.141   9.897
   96    HA   LEU  13           HA       LEU  13  -2.882   3.247   9.341
   97   1HB   LEU  13          1HB       LEU  13  -4.780   3.462  10.910
   98   2HB   LEU  13          2HB       LEU  13  -3.934   2.422  12.063
   99    HG   LEU  13           HG       LEU  13  -2.484   4.827  10.884
  100   1HD1  LEU  13          1HD1      LEU  13  -4.629   5.734  11.477
  101   2HD1  LEU  13          2HD1      LEU  13  -3.418   6.256  12.671
  102   3HD1  LEU  13          3HD1      LEU  13  -4.565   4.961  13.081
  103   1HD2  LEU  13          1HD2      LEU  13  -2.420   3.529  13.649
  104   2HD2  LEU  13          2HD2      LEU  13  -1.465   4.943  13.158
  105   3HD2  LEU  13          3HD2      LEU  13  -1.172   3.387  12.397
  106    H    CYS  14           H        CYS  14  -0.883   2.870   9.020
  107    HA   CYS  14           HA       CYS  14   0.667   0.950  10.657
  108   1HB   CYS  14          1HB       CYS  14   0.276   0.358   8.226
  109   2HB   CYS  14          2HB       CYS  14   1.072   1.871   7.766
  110    HG   CYS  14           HG       CYS  14   3.414   1.312   8.354
  111    H    VAL  15           H        VAL  15   3.170   1.855  10.212
  112    HA   VAL  15           HA       VAL  15   3.144   4.810  10.184
  113    HB   VAL  15           HB       VAL  15   5.356   4.799  11.267
  114   1HG1  VAL  15          1HG1      VAL  15   4.558   4.553  13.539
  115   2HG1  VAL  15          2HG1      VAL  15   3.294   5.288  12.540
  116   3HG1  VAL  15          3HG1      VAL  15   3.176   3.574  13.001
  117   1HG2  VAL  15          1HG2      VAL  15   4.807   1.881  11.971
  118   2HG2  VAL  15          2HG2      VAL  15   6.041   2.455  10.823
  119   3HG2  VAL  15          3HG2      VAL  15   6.160   2.886  12.530
  120    H    CYS  16           H        CYS  16   4.868   5.727   8.953
  121    HA   CYS  16           HA       CYS  16   5.732   4.290   6.577
  122   1HB   CYS  16          1HB       CYS  16   5.550   6.898   6.919
  123   2HB   CYS  16          2HB       CYS  16   7.065   6.745   7.802
  124    H    CYS  17           H        CYS  17   7.600   3.100   6.334
  125    HA   CYS  17           HA       CYS  17   9.116   2.016   8.412
  126   1HB   CYS  17          1HB       CYS  17   9.201   1.140   6.171
  127   2HB   CYS  17          2HB       CYS  17   9.822   2.654   5.512
  128    HG   CYS  17           HG       CYS  17  11.485   0.580   5.566
  129    H    LYS  18           H        LYS  18   9.806   5.009   6.611
  130    HA   LYS  18           HA       LYS  18  12.247   5.399   8.266
  131   1HB   LYS  18          1HB       LYS  18  13.114   6.535   6.230
  132   2HB   LYS  18          2HB       LYS  18  12.827   4.812   6.108
  133   1HG   LYS  18          1HG       LYS  18  10.631   5.341   4.865
  134   2HG   LYS  18          2HG       LYS  18  11.066   7.043   4.967
  135   1HD   LYS  18          1HD       LYS  18  11.902   6.554   2.890
  136   2HD   LYS  18          2HD       LYS  18  13.336   6.219   3.849
  137   1HE   LYS  18          1HE       LYS  18  11.286   4.220   2.795
  138   2HE   LYS  18          2HE       LYS  18  12.900   4.463   2.135
  139   1HZ   LYS  18          1HZ       LYS  18  13.845   3.410   3.985
  140   2HZ   LYS  18          2HZ       LYS  18  12.541   2.487   3.615
  141   3HZ   LYS  18          3HZ       LYS  18  12.450   3.480   4.888
  142    H    CYS  19           H        CYS  19   9.289   7.000   7.445
  143    HA   CYS  19           HA       CYS  19  10.198   9.569   8.564
  144   1HB   CYS  19          1HB       CYS  19   7.418   8.796   8.265
  145   2HB   CYS  19          2HB       CYS  19   8.121  10.380   8.254
  146    H    ASP  20           H        ASP  20   9.102   6.427   9.636
  147    HA   ASP  20           HA       ASP  20   7.950   5.624  11.351
  148   1HB   ASP  20          1HB       ASP  20  10.210   5.824  12.233
  149   2HB   ASP  20          2HB       ASP  20   9.824   7.418  12.881
  150    H    GLY  21           H        GLY  21   6.323   7.144  10.165
  151   1HA   GLY  21          1HA       GLY  21   4.918   8.834  12.160
  152   2HA   GLY  21          2HA       GLY  21   5.233   9.416  10.511
  153    H    ARG  22           H        ARG  22   2.662   9.053  11.716
  154    HA   ARG  22           HA       ARG  22   1.384   6.570  11.321
  155   1HB   ARG  22          1HB       ARG  22   0.678   8.304  12.871
  156   2HB   ARG  22          2HB       ARG  22   0.413   9.463  11.580
  157   1HG   ARG  22          1HG       ARG  22  -1.184   6.887  11.667
  158   2HG   ARG  22          2HG       ARG  22  -1.557   8.226  12.753
  159   1HD   ARG  22          1HD       ARG  22  -1.676   9.712  10.625
  160   2HD   ARG  22          2HD       ARG  22  -1.777   8.176   9.738
  161    HE   ARG  22           HE       ARG  22  -3.601   8.320  11.979
  162   1HH1  ARG  22          1HH1      ARG  22  -3.430   9.482   8.570
  163   2HH1  ARG  22          2HH1      ARG  22  -5.117   8.969   8.323
  164   1HH2  ARG  22          1HH2      ARG  22  -5.895   7.969  11.471
  165   2HH2  ARG  22          2HH2      ARG  22  -6.335   8.221   9.776
  166    H    ILE  23           H        ILE  23   0.879   5.576   9.403
  167    HA   ILE  23           HA       ILE  23  -0.136   7.374   7.308
  168    HB   ILE  23           HB       ILE  23   1.295   4.790   6.584
  169   1HG1  ILE  23          1HG1      ILE  23   2.343   7.629   6.150
  170   2HG1  ILE  23          2HG1      ILE  23   2.962   6.510   7.369
  171   1HG2  ILE  23          1HG2      ILE  23   0.888   5.648   4.274
  172   2HG2  ILE  23          2HG2      ILE  23  -0.629   5.664   5.127
  173   3HG2  ILE  23          3HG2      ILE  23   0.260   7.177   4.925
  174   1HD1  ILE  23          1HD1      ILE  23   2.974   5.928   4.383
  175   2HD1  ILE  23          2HD1      ILE  23   4.337   6.495   5.296
  176   3HD1  ILE  23          3HD1      ILE  23   3.642   4.901   5.667
  177    H    GLU  24           H        GLU  24  -2.195   6.995   7.049
  178    HA   GLU  24           HA       GLU  24  -3.568   4.528   7.841
  179   1HB   GLU  24          1HB       GLU  24  -4.430   6.670   8.355
  180   2HB   GLU  24          2HB       GLU  24  -4.378   7.210   6.661
  181   1HG   GLU  24          1HG       GLU  24  -6.095   5.477   6.154
  182   2HG   GLU  24          2HG       GLU  24  -6.114   5.043   7.876
  183    H    LEU  25           H        LEU  25  -2.671   2.949   6.486
  184    HA   LEU  25           HA       LEU  25  -2.016   3.441   3.717
  185   1HB   LEU  25          1HB       LEU  25  -2.427   0.760   5.035
  186   2HB   LEU  25          2HB       LEU  25  -1.589   1.082   3.542
  187    HG   LEU  25           HG       LEU  25  -0.655   1.841   6.344
  188   1HD1  LEU  25          1HD1      LEU  25   0.323  -0.225   4.312
  189   2HD1  LEU  25          2HD1      LEU  25  -0.462  -0.559   5.869
  190   3HD1  LEU  25          3HD1      LEU  25   1.146   0.177   5.829
  191   1HD2  LEU  25          1HD2      LEU  25   0.038   3.521   4.750
  192   2HD2  LEU  25          2HD2      LEU  25   0.619   2.282   3.635
  193   3HD2  LEU  25          3HD2      LEU  25   1.426   2.543   5.217
  194    H    THR  26           H        THR  26  -3.747   4.095   2.559
  195    HA   THR  26           HA       THR  26  -6.284   2.718   2.846
  196    HB   THR  26           HB       THR  26  -5.533   5.023   1.043
  197    HG1  THR  26           1HG      THR  26  -5.329   5.270   3.431
  198   1HG2  THR  26          1HG2      THR  26  -8.225   3.896   1.999
  199   2HG2  THR  26          2HG2      THR  26  -7.586   3.788   0.355
  200   3HG2  THR  26          3HG2      THR  26  -8.018   5.363   1.032
  201    H    VAL  27           H        VAL  27  -6.135   0.673   2.091
  202    HA   VAL  27           HA       VAL  27  -5.208   0.304  -0.739
  203    HB   VAL  27           HB       VAL  27  -4.255  -1.939  -0.149
  204   1HG1  VAL  27          1HG1      VAL  27  -3.363  -0.019   2.038
  205   2HG1  VAL  27          2HG1      VAL  27  -2.448  -1.328   1.265
  206   3HG1  VAL  27          3HG1      VAL  27  -2.892   0.120   0.337
  207   1HG2  VAL  27          1HG2      VAL  27  -5.320  -1.343   2.691
  208   2HG2  VAL  27          2HG2      VAL  27  -5.944  -2.599   1.603
  209   3HG2  VAL  27          3HG2      VAL  27  -4.295  -2.720   2.240
  210    H    GLU  28           H        GLU  28  -6.592  -1.064  -2.034
  211    HA   GLU  28           HA       GLU  28  -9.340  -0.939  -0.911
  212   1HB   GLU  28          1HB       GLU  28  -8.307   0.681  -2.714
  213   2HB   GLU  28          2HB       GLU  28  -8.684  -0.627  -3.781
  214   1HG   GLU  28          1HG       GLU  28 -11.026  -0.444  -2.456
  215   2HG   GLU  28          2HG       GLU  28 -10.480   1.190  -2.235
  216    H    SER  29           H        SER  29  -9.380  -2.984  -0.049
  217    HA   SER  29           HA       SER  29  -8.611  -5.306  -1.729
  218   1HB   SER  29          1HB       SER  29  -7.646  -4.448   1.046
  219   2HB   SER  29          2HB       SER  29  -7.114  -5.878   0.167
  220    HG   SER  29           HG       SER  29  -6.670  -3.905  -1.450
  221    H    SER  30           H        SER  30  -9.500  -7.404  -0.820
  222    HA   SER  30           HA       SER  30 -11.980  -7.030   0.604
  223   1HB   SER  30          1HB       SER  30 -10.365  -9.572   0.153
  224   2HB   SER  30          2HB       SER  30 -12.078  -9.473   0.601
  225    HG   SER  30           HG       SER  30 -11.487  -9.720  -1.734
  226    H    ALA  31           H        ALA  31 -12.431  -7.982   2.861
  227    HA   ALA  31           HA       ALA  31 -10.631  -6.857   4.714
  228   1HB   ALA  31          1HB       ALA  31 -12.727  -9.042   5.172
  229   2HB   ALA  31          2HB       ALA  31 -11.962  -8.060   6.432
  230   3HB   ALA  31          3HB       ALA  31 -13.012  -7.281   5.228
  231    H    GLU  32           H        GLU  32 -11.055 -10.344   3.889
  232    HA   GLU  32           HA       GLU  32  -8.992 -11.108   5.723
  233   1HB   GLU  32          1HB       GLU  32 -11.124 -12.348   4.590
  234   2HB   GLU  32          2HB       GLU  32  -9.827 -12.964   3.546
  235   1HG   GLU  32          1HG       GLU  32  -8.569 -13.621   5.633
  236   2HG   GLU  32          2HG       GLU  32  -9.911 -13.049   6.612
  237    H    ASP  33           H        ASP  33  -9.050 -10.196   2.359
  238    HA   ASP  33           HA       ASP  33  -6.456 -11.204   1.641
  239   1HB   ASP  33          1HB       ASP  33  -8.365 -10.643   0.085
  240   2HB   ASP  33          2HB       ASP  33  -8.033  -8.931   0.388
  241    H    LEU  34           H        LEU  34  -7.824  -8.182   2.888
  242    HA   LEU  34           HA       LEU  34  -5.407  -6.633   3.121
  243   1HB   LEU  34          1HB       LEU  34  -7.423  -5.492   3.241
  244   2HB   LEU  34          2HB       LEU  34  -8.097  -6.507   4.491
  245    HG   LEU  34           HG       LEU  34  -5.588  -4.992   5.206
  246   1HD1  LEU  34          1HD1      LEU  34  -6.919  -3.298   4.018
  247   2HD1  LEU  34          2HD1      LEU  34  -7.074  -2.996   5.758
  248   3HD1  LEU  34          3HD1      LEU  34  -8.385  -3.810   4.891
  249   1HD2  LEU  34          1HD2      LEU  34  -8.183  -5.577   6.720
  250   2HD2  LEU  34          2HD2      LEU  34  -6.766  -4.726   7.373
  251   3HD2  LEU  34          3HD2      LEU  34  -6.644  -6.427   6.938
  252    H    ARG  35           H        ARG  35  -7.038  -8.813   5.203
  253    HA   ARG  35           HA       ARG  35  -5.258  -8.723   7.464
  254   1HB   ARG  35          1HB       ARG  35  -7.491  -9.891   7.551
  255   2HB   ARG  35          2HB       ARG  35  -6.790 -11.226   6.640
  256   1HG   ARG  35          1HG       ARG  35  -5.088 -11.589   8.374
  257   2HG   ARG  35          2HG       ARG  35  -5.722 -10.223   9.308
  258   1HD   ARG  35          1HD       ARG  35  -7.848 -11.415   9.614
  259   2HD   ARG  35          2HD       ARG  35  -7.245 -12.776   8.641
  260    HE   ARG  35           HE       ARG  35  -5.312 -12.612  10.478
  261   1HH1  ARG  35          1HH1      ARG  35  -8.814 -12.731  10.915
  262   2HH1  ARG  35          2HH1      ARG  35  -8.758 -13.382  12.516
  263   1HH2  ARG  35          1HH2      ARG  35  -5.198 -13.494  12.593
  264   2HH2  ARG  35          2HH2      ARG  35  -6.636 -13.842  13.479
  265    H    THR  36           H        THR  36  -5.394 -10.970   4.731
  266    HA   THR  36           HA       THR  36  -3.036 -12.420   5.177
  267    HB   THR  36           HB       THR  36  -4.273 -11.672   2.498
  268    HG1  THR  36           1HG      THR  36  -5.798 -12.656   3.814
  269   1HG2  THR  36          1HG2      THR  36  -2.481 -14.002   3.308
  270   2HG2  THR  36          2HG2      THR  36  -2.042 -12.673   2.208
  271   3HG2  THR  36          3HG2      THR  36  -3.308 -13.820   1.746
  272    H    LEU  37           H        LEU  37  -3.382  -9.434   3.119
  273    HA   LEU  37           HA       LEU  37  -0.614  -9.293   2.692
  274   1HB   LEU  37          1HB       LEU  37  -0.990  -7.642   1.298
  275   2HB   LEU  37          2HB       LEU  37  -2.625  -8.190   1.462
  276    HG   LEU  37           HG       LEU  37  -2.588  -6.262   3.426
  277   1HD1  LEU  37          1HD1      LEU  37  -0.179  -5.622   2.883
  278   2HD1  LEU  37          2HD1      LEU  37  -1.282  -4.287   2.565
  279   3HD1  LEU  37          3HD1      LEU  37  -0.655  -5.253   1.241
  280   1HD2  LEU  37          1HD2      LEU  37  -3.829  -4.908   1.902
  281   2HD2  LEU  37          2HD2      LEU  37  -4.153  -6.584   1.430
  282   3HD2  LEU  37          3HD2      LEU  37  -3.015  -5.620   0.491
  283    H    GLN  38           H        GLN  38  -2.610  -8.077   5.381
  284    HA   GLN  38           HA       GLN  38  -0.521  -6.553   6.588
  285   1HB   GLN  38          1HB       GLN  38  -2.844  -6.158   7.047
  286   2HB   GLN  38          2HB       GLN  38  -3.017  -7.751   7.799
  287   1HG   GLN  38          1HG       GLN  38  -1.554  -7.117   9.625
  288   2HG   GLN  38          2HG       GLN  38  -1.087  -5.625   8.798
  289   1HE2  GLN  38          1HE2      GLN  38  -4.492  -6.788   8.874
  290   2HE2  GLN  38          2HE2      GLN  38  -5.026  -5.493   9.933
  291    H    GLN  39           H        GLN  39  -1.310 -10.073   6.554
  292    HA   GLN  39           HA       GLN  39   0.484 -10.825   8.643
  293   1HB   GLN  39          1HB       GLN  39  -0.228 -12.600   6.331
  294   2HB   GLN  39          2HB       GLN  39   0.408 -13.013   7.902
  295   1HG   GLN  39          1HG       GLN  39  -2.373 -12.163   7.197
  296   2HG   GLN  39          2HG       GLN  39  -1.840 -13.641   7.947
  297   1HE2  GLN  39          1HE2      GLN  39  -2.788 -10.342   8.461
  298   2HE2  GLN  39          2HE2      GLN  39  -2.761 -10.384  10.236
  299    H    LEU  40           H        LEU  40   0.817 -10.286   5.088
  300    HA   LEU  40           HA       LEU  40   3.614 -10.901   4.912
  301   1HB   LEU  40          1HB       LEU  40   2.382  -8.605   3.417
  302   2HB   LEU  40          2HB       LEU  40   3.744  -9.598   2.985
  303    HG   LEU  40           HG       LEU  40   0.919 -10.671   3.117
  304   1HD1  LEU  40          1HD1      LEU  40   2.371  -9.790   0.605
  305   2HD1  LEU  40          2HD1      LEU  40   1.184  -8.789   1.443
  306   3HD1  LEU  40          3HD1      LEU  40   0.696 -10.352   0.759
  307   1HD2  LEU  40          1HD2      LEU  40   1.711 -12.476   1.708
  308   2HD2  LEU  40          2HD2      LEU  40   2.661 -12.413   3.209
  309   3HD2  LEU  40          3HD2      LEU  40   3.342 -11.783   1.689
  310    H    PHE  41           H        PHE  41   2.017  -7.798   5.781
  311    HA   PHE  41           HA       PHE  41   4.423  -6.398   6.467
  312   1HB   PHE  41          1HB       PHE  41   1.559  -6.067   7.323
  313   2HB   PHE  41          2HB       PHE  41   2.828  -5.211   8.163
  314    HD1  PHE  41           1HD      PHE  41   3.308  -3.051   7.483
  315    HD2  PHE  41           2HD      PHE  41   1.814  -5.848   4.561
  316    HE1  PHE  41           1HE      PHE  41   3.261  -1.264   5.784
  317    HE2  PHE  41           2HE      PHE  41   1.797  -4.063   2.858
  318    HZ   PHE  41           HZ       PHE  41   2.525  -1.774   3.448
  319    H    LEU  42           H        LEU  42   2.345  -8.422   8.521
  320    HA   LEU  42           HA       LEU  42   3.851  -8.289  10.895
  321   1HB   LEU  42          1HB       LEU  42   1.618  -9.692   9.861
  322   2HB   LEU  42          2HB       LEU  42   2.675 -10.944  10.468
  323    HG   LEU  42           HG       LEU  42   1.801  -8.501  12.077
  324   1HD1  LEU  42          1HD1      LEU  42  -0.192  -9.731  11.329
  325   2HD1  LEU  42          2HD1      LEU  42   0.065  -9.971  13.065
  326   3HD1  LEU  42          3HD1      LEU  42   0.497 -11.259  11.917
  327   1HD2  LEU  42          1HD2      LEU  42   2.384  -9.917  14.020
  328   2HD2  LEU  42          2HD2      LEU  42   3.785  -9.709  12.956
  329   3HD2  LEU  42          3HD2      LEU  42   2.876 -11.234  12.930
  330    H    SER  43           H        SER  43   4.374 -10.321   7.989
  331    HA   SER  43           HA       SER  43   6.457 -11.907   9.144
  332   1HB   SER  43          1HB       SER  43   5.019 -12.466   7.135
  333   2HB   SER  43          2HB       SER  43   5.962 -11.296   6.201
  334    HG   SER  43           HG       SER  43   6.846 -13.309   5.939
  335    H    THR  44           H        THR  44   6.657  -9.258   6.679
  336    HA   THR  44           HA       THR  44   9.118  -8.308   7.866
  337    HB   THR  44           HB       THR  44  10.396  -8.452   5.748
  338    HG1  THR  44           1HG      THR  44   8.953  -8.542   4.163
  339   1HG2  THR  44          1HG2      THR  44  10.900 -10.798   5.667
  340   2HG2  THR  44          2HG2      THR  44   9.360 -11.223   6.433
  341   3HG2  THR  44          3HG2      THR  44  10.602 -10.345   7.360
  342    H    LEU  45           H        LEU  45   6.374  -7.769   5.812
  343    HA   LEU  45           HA       LEU  45   7.526  -5.731   4.213
  344   1HB   LEU  45          1HB       LEU  45   5.062  -7.229   4.377
  345   2HB   LEU  45          2HB       LEU  45   4.631  -5.558   4.255
  346    HG   LEU  45           HG       LEU  45   6.201  -5.437   2.278
  347   1HD1  LEU  45          1HD1      LEU  45   7.635  -7.363   2.732
  348   2HD1  LEU  45          2HD1      LEU  45   6.745  -7.690   1.239
  349   3HD1  LEU  45          3HD1      LEU  45   6.234  -8.450   2.752
  350   1HD2  LEU  45          1HD2      LEU  45   3.832  -7.342   2.172
  351   2HD2  LEU  45          2HD2      LEU  45   4.582  -6.621   0.756
  352   3HD2  LEU  45          3HD2      LEU  45   3.798  -5.577   1.954
  353    H    SER  46           H        SER  46   7.105  -3.518   3.969
  354    HA   SER  46           HA       SER  46   5.807  -2.089   6.176
  355   1HB   SER  46          1HB       SER  46   7.871  -0.475   5.850
  356   2HB   SER  46          2HB       SER  46   7.957  -1.864   6.939
  357    HG   SER  46           HG       SER  46   9.621  -1.301   4.905
  358    H    PHE  47           H        PHE  47   5.860   0.394   5.434
  359    HA   PHE  47           HA       PHE  47   5.231   0.550   2.557
  360   1HB   PHE  47          1HB       PHE  47   3.095   0.355   3.953
  361   2HB   PHE  47          2HB       PHE  47   3.551   1.872   4.695
  362    HD1  PHE  47           1HD      PHE  47   2.550   0.219   1.493
  363    HD2  PHE  47           2HD      PHE  47   3.291   3.954   3.491
  364    HE1  PHE  47           1HE      PHE  47   1.452   1.449  -0.372
  365    HE2  PHE  47           2HE      PHE  47   2.130   5.170   1.658
  366    HZ   PHE  47           HZ       PHE  47   1.264   3.919  -0.299
  367    H    VAL  48           H        VAL  48   5.440   2.638   1.713
  368    HA   VAL  48           HA       VAL  48   7.111   4.471   3.171
  369    HB   VAL  48           HB       VAL  48   7.904   2.606   0.960
  370   1HG1  VAL  48          1HG1      VAL  48   8.391   4.807  -0.057
  371   2HG1  VAL  48          2HG1      VAL  48   9.406   5.205   1.360
  372   3HG1  VAL  48          3HG1      VAL  48   9.820   3.841   0.310
  373   1HG2  VAL  48          1HG2      VAL  48   8.653   2.165   3.272
  374   2HG2  VAL  48          2HG2      VAL  48  10.032   2.635   2.284
  375   3HG2  VAL  48          3HG2      VAL  48   9.300   3.806   3.402
  376    H    CYS  49           H        CYS  49   5.866   6.224   3.045
  377    HA   CYS  49           HA       CYS  49   3.719   6.510   1.178
  378   1HB   CYS  49          1HB       CYS  49   3.760   8.944   2.075
  379   2HB   CYS  49          2HB       CYS  49   3.401   7.648   3.186
  380    HA   PRO  50           HA       PRO  50   5.638   8.081  -2.410
  381   1HB   PRO  50          1HB       PRO  50   3.915  10.090  -3.307
  382   2HB   PRO  50          2HB       PRO  50   3.720   8.332  -3.566
  383   1HG   PRO  50          1HG       PRO  50   2.479  10.062  -1.413
  384   2HG   PRO  50          2HG       PRO  50   1.695   8.800  -2.419
  385   1HD   PRO  50          1HD       PRO  50   2.469   8.257   0.098
  386   2HD   PRO  50          2HD       PRO  50   2.739   7.056  -1.196
  387    H    TRP  51           H        TRP  51   4.784  10.400   0.074
  388    HA   TRP  51           HA       TRP  51   6.384  12.621  -0.648
  389   1HB   TRP  51          1HB       TRP  51   4.689  12.766   1.061
  390   2HB   TRP  51          2HB       TRP  51   5.448  11.495   2.010
  391    HD1  TRP  51           HD       TRP  51   6.748  14.898   0.635
  392    HE1  TRP  51           1HE      TRP  51   7.950  16.135   2.515
  393    HE3  TRP  51           3HE      TRP  51   6.055  11.504   4.419
  394    HZ2  TRP  51           2HZ      TRP  51   8.527  15.729   5.326
  395    HZ3  TRP  51           3HZ      TRP  51   6.909  11.983   6.689
  396    HH2  TRP  51           HH       TRP  51   8.156  14.076   7.152
  397    H    CYS  52           H        CYS  52   7.237   9.908   1.686
  398    HA   CYS  52           HA       CYS  52  10.009  10.745   1.634
  399   1HB   CYS  52          1HB       CYS  52  10.491   8.795   2.926
  400   2HB   CYS  52          2HB       CYS  52   9.095   9.630   3.538
  401    H    ALA  53           H        ALA  53   8.033   8.486  -0.277
  402    HA   ALA  53           HA       ALA  53  10.220   7.075  -1.199
  403   1HB   ALA  53          1HB       ALA  53   7.802   6.445  -1.662
  404   2HB   ALA  53          2HB       ALA  53   7.732   7.768  -2.851
  405   3HB   ALA  53          3HB       ALA  53   8.807   6.403  -3.135
  406    H    THR  54           H        THR  54   8.841  10.143  -2.211
  407    HA   THR  54           HA       THR  54  10.576  10.626  -4.481
  408    HB   THR  54           HB       THR  54   8.809  12.550  -2.899
  409    HG1  THR  54           1HG      THR  54   7.487  10.965  -3.587
  410   1HG2  THR  54          1HG2      THR  54   8.673  13.776  -5.052
  411   2HG2  THR  54          2HG2      THR  54   9.848  12.648  -5.765
  412   3HG2  THR  54          3HG2      THR  54  10.333  13.724  -4.432
  413    H    ASN  55           H        ASN  55  10.386  11.923  -1.102
  414    HA   ASN  55           HA       ASN  55  12.697  13.658  -1.647
  415   1HB   ASN  55          1HB       ASN  55  10.913  13.367   0.811
  416   2HB   ASN  55          2HB       ASN  55  12.203  14.549   0.625
  417   1HD2  ASN  55          1HD2      ASN  55   9.006  13.573  -0.631
  418   2HD2  ASN  55          2HD2      ASN  55   8.715  15.123  -1.441
  419    H    GLN  56           H        GLN  56  12.090  10.700   0.075
  420    HA   GLN  56           HA       GLN  56  13.103   9.488   1.611
  421   1HB   GLN  56          2HB       GLN  56  14.278   9.120  -0.667
  422   2HB   GLN  56          3HB       GLN  56  15.652   9.960   0.063
  423   1HG   GLN  56          2HG       GLN  56  15.495   8.236   1.980
  424   2HG   GLN  56          3HG       GLN  56  14.289   7.390   1.004
  425   1HE2  GLN  56          1HE2      GLN  56  17.645   8.326   1.279
  426   2HE2  GLN  56          2HE2      GLN  56  18.318   7.311   0.009
  427   1H    GLY   1          1H        GLY   1  21.270  10.991   6.179
  428   1HA   GLY   1          1HA       GLY   1  23.587  10.334   6.003
  429   2HA   GLY   1          2HA       GLY   1  23.603  10.208   7.778
  430    H    SER   2           H        SER   2  24.192   7.907   7.252
  431    HA   SER   2           HA       SER   2  23.819   5.751   7.283
  432   1HB   SER   2          1HB       SER   2  20.888   6.336   7.787
  433   2HB   SER   2          2HB       SER   2  21.789   4.861   8.176
  434    HG   SER   2           HG       SER   2  21.617   6.210   9.989
  435    H    HIS   3           H        HIS   3  21.044   7.104   5.473
  436    HA   HIS   3           HA       HIS   3  19.989   6.514   3.589
  437   1HB   HIS   3          1HB       HIS   3  22.709   6.352   2.857
  438   2HB   HIS   3          2HB       HIS   3  22.023   4.865   2.253
  439    HD1  HIS   3           1HD      HIS   3  21.849   8.651   1.791
  440    HD2  HIS   3           2HD      HIS   3  20.269   5.104   0.158
  441    HE1  HIS   3           1HE      HIS   3  20.698   9.294  -0.399
  442    H    MET   4           H        MET   4  19.752   4.256   2.051
  443    HA   MET   4           HA       MET   4  19.935   1.866   3.625
  444   1HB   MET   4          1HB       MET   4  17.694   1.093   3.062
  445   2HB   MET   4          2HB       MET   4  17.616   2.444   4.183
  446   1HG   MET   4          1HG       MET   4  16.890   3.947   2.467
  447   2HG   MET   4          2HG       MET   4  17.289   2.817   1.175
  448   1HE   MET   4          1HE       MET   4  15.837   0.654   0.510
  449   2HE   MET   4          2HE       MET   4  16.059   0.025   2.161
  450   3HE   MET   4          3HE       MET   4  14.439   0.109   1.470
  451    H    ALA   5           H        ALA   5  19.723  -0.021   2.062
  452    HA   ALA   5           HA       ALA   5  19.579   0.503  -0.754
  453   1HB   ALA   5          1HB       ALA   5  22.279  -0.284   0.442
  454   2HB   ALA   5          2HB       ALA   5  21.870  -0.337  -1.286
  455   3HB   ALA   5          3HB       ALA   5  21.911   1.219  -0.437
  456    H    GLU   6           H        GLU   6  17.763  -0.975  -0.078
  457    HA   GLU   6           HA       GLU   6  18.661  -3.777   0.312
  458   1HB   GLU   6          1HB       GLU   6  16.465  -2.293   1.782
  459   2HB   GLU   6          2HB       GLU   6  16.769  -4.022   1.914
  460   1HG   GLU   6          1HG       GLU   6  18.771  -3.744   3.114
  461   2HG   GLU   6          2HG       GLU   6  18.992  -2.070   2.607
  462    HA   PRO   7           HA       PRO   7  15.457  -4.443  -2.791
  463   1HB   PRO   7          1HB       PRO   7  15.210  -7.135  -2.723
  464   2HB   PRO   7          2HB       PRO   7  16.732  -6.353  -3.245
  465   1HG   PRO   7          1HG       PRO   7  16.079  -7.493  -0.507
  466   2HG   PRO   7          2HG       PRO   7  17.551  -7.749  -1.493
  467   1HD   PRO   7          1HD       PRO   7  17.341  -5.850   0.523
  468   2HD   PRO   7          2HD       PRO   7  18.423  -5.662  -0.889
  469    H    GLN   8           H        GLN   8  14.197  -3.149  -1.196
  470    HA   GLN   8           HA       GLN   8  11.851  -4.710  -0.286
  471   1HB   GLN   8          1HB       GLN   8  13.675  -4.278   1.590
  472   2HB   GLN   8          2HB       GLN   8  12.995  -2.662   1.615
  473   1HG   GLN   8          1HG       GLN   8  11.979  -4.052   3.316
  474   2HG   GLN   8          2HG       GLN   8  10.773  -3.612   2.138
  475   1HE2  GLN   8          1HE2      GLN   8  12.904  -6.270   0.979
  476   2HE2  GLN   8          2HE2      GLN   8  11.764  -7.516   1.470
  477    H    ARG   9           H        ARG   9  13.025  -1.256  -0.190
  478    HA   ARG   9           HA       ARG   9  10.553  -0.126  -0.791
  479   1HB   ARG   9          1HB       ARG   9  12.661   0.905   0.183
  480   2HB   ARG   9          2HB       ARG   9  13.289   0.997  -1.454
  481   1HG   ARG   9          1HG       ARG   9  10.665   2.132  -0.945
  482   2HG   ARG   9          2HG       ARG   9  12.042   3.014  -0.279
  483   1HD   ARG   9          1HD       ARG   9  11.620   2.296  -3.207
  484   2HD   ARG   9          2HD       ARG   9  11.312   3.877  -2.494
  485    HE   ARG   9           HE       ARG   9  13.888   2.608  -3.084
  486   1HH1  ARG   9          1HH1      ARG   9  12.336   5.513  -1.668
  487   2HH1  ARG   9          2HH1      ARG   9  13.870   6.275  -1.347
  488   1HH2  ARG   9          1HH2      ARG   9  15.886   3.751  -2.643
  489   2HH2  ARG   9          2HH2      ARG   9  15.789   5.289  -1.814
  490    H    HIS  10           H        HIS  10   9.428  -1.153  -2.432
  491    HA   HIS  10           HA       HIS  10  10.589  -1.057  -5.170
  492   1HB   HIS  10          1HB       HIS  10   8.871  -3.188  -3.844
  493   2HB   HIS  10          2HB       HIS  10   9.285  -3.121  -5.561
  494    HD1  HIS  10           1HD      HIS  10  10.206  -5.458  -3.396
  495    HD2  HIS  10           2HD      HIS  10  12.444  -2.232  -4.724
  496    HE1  HIS  10           1HE      HIS  10  12.610  -6.261  -3.412
  497    H    LYS  11           H        LYS  11   8.817  -1.188  -6.898
  498    HA   LYS  11           HA       LYS  11   6.784   0.823  -6.138
  499   1HB   LYS  11          1HB       LYS  11   9.045   0.994  -8.143
  500   2HB   LYS  11          2HB       LYS  11   7.676   2.115  -8.063
  501   1HG   LYS  11          1HG       LYS  11   8.292   2.853  -5.845
  502   2HG   LYS  11          2HG       LYS  11   9.522   1.609  -5.658
  503   1HD   LYS  11          1HD       LYS  11  10.417   3.886  -6.104
  504   2HD   LYS  11          2HD       LYS  11  10.998   2.621  -7.218
  505   1HE   LYS  11          1HE       LYS  11   9.503   3.288  -8.948
  506   2HE   LYS  11          2HE       LYS  11   8.523   4.202  -7.823
  507   1HZ   LYS  11          1HZ       LYS  11   9.725   5.558  -9.256
  508   2HZ   LYS  11          2HZ       LYS  11  11.207   4.975  -8.780
  509   3HZ   LYS  11          3HZ       LYS  11  10.267   5.856  -7.717
  510    H    ILE  12           H        ILE  12   5.019  -0.454  -6.559
  511    HA   ILE  12           HA       ILE  12   4.834  -1.915  -9.134
  512    HB   ILE  12           HB       ILE  12   2.719  -1.609  -6.975
  513   1HG1  ILE  12          1HG1      ILE  12   4.528  -4.001  -7.338
  514   2HG1  ILE  12          2HG1      ILE  12   4.771  -2.750  -6.111
  515   1HG2  ILE  12          1HG2      ILE  12   2.986  -3.521  -9.343
  516   2HG2  ILE  12          2HG2      ILE  12   1.655  -3.513  -8.163
  517   3HG2  ILE  12          3HG2      ILE  12   1.869  -2.150  -9.250
  518   1HD1  ILE  12          1HD1      ILE  12   2.464  -3.187  -5.239
  519   2HD1  ILE  12          2HD1      ILE  12   2.420  -4.633  -6.291
  520   3HD1  ILE  12          3HD1      ILE  12   3.635  -4.487  -5.005
  521    H    LEU  13           H        LEU  13   4.645  -0.406 -10.775
  522    HA   LEU  13           HA       LEU  13   3.055   1.962 -10.499
  523   1HB   LEU  13          1HB       LEU  13   5.018   1.744 -12.013
  524   2HB   LEU  13          2HB       LEU  13   4.030   0.770 -13.109
  525    HG   LEU  13           HG       LEU  13   2.944   3.442 -12.135
  526   1HD1  LEU  13          1HD1      LEU  13   5.225   3.979 -12.682
  527   2HD1  LEU  13          2HD1      LEU  13   4.141   4.611 -13.940
  528   3HD1  LEU  13          3HD1      LEU  13   5.093   3.136 -14.245
  529   1HD2  LEU  13          1HD2      LEU  13   2.775   1.975 -14.808
  530   2HD2  LEU  13          2HD2      LEU  13   2.033   3.549 -14.459
  531   3HD2  LEU  13          3HD2      LEU  13   1.484   2.114 -13.599
  532    H    CYS  14           H        CYS  14   1.030   1.812 -10.142
  533    HA   CYS  14           HA       CYS  14  -0.749  -0.086 -11.579
  534   1HB   CYS  14          1HB       CYS  14  -0.305  -0.491  -9.115
  535   2HB   CYS  14          2HB       CYS  14  -0.969   1.112  -8.771
  536    HG   CYS  14           HG       CYS  14  -3.361   0.655  -9.094
  537    H    VAL  15           H        VAL  15  -3.124   1.075 -11.041
  538    HA   VAL  15           HA       VAL  15  -2.859   3.990 -11.325
  539    HB   VAL  15           HB       VAL  15  -5.057   4.083 -12.442
  540   1HG1  VAL  15          1HG1      VAL  15  -4.258   3.550 -14.680
  541   2HG1  VAL  15          2HG1      VAL  15  -2.966   4.294 -13.727
  542   3HG1  VAL  15          3HG1      VAL  15  -2.954   2.540 -14.016
  543   1HG2  VAL  15          1HG2      VAL  15  -4.750   1.079 -12.890
  544   2HG2  VAL  15          2HG2      VAL  15  -5.948   1.851 -11.823
  545   3HG2  VAL  15          3HG2      VAL  15  -6.004   2.140 -13.564
  546    H    CYS  16           H        CYS  16  -4.508   5.141 -10.224
  547    HA   CYS  16           HA       CYS  16  -5.478   4.021  -7.714
  548   1HB   CYS  16          1HB       CYS  16  -5.016   6.513  -8.139
  549   2HB   CYS  16          2HB       CYS  16  -6.413   6.507  -9.228
  550    H    CYS  17           H        CYS  17  -7.420   2.996  -7.376
  551    HA   CYS  17           HA       CYS  17  -8.943   1.948  -9.488
  552   1HB   CYS  17          1HB       CYS  17  -8.881   1.270  -7.008
  553   2HB   CYS  17          2HB       CYS  17 -10.061   2.549  -6.714
  554    HG   CYS  17           HG       CYS  17 -11.184   0.224  -6.803
  555    H    LYS  18           H        LYS  18  -9.440   5.022  -7.733
  556    HA   LYS  18           HA       LYS  18 -11.920   5.481  -9.301
  557   1HB   LYS  18          1HB       LYS  18 -12.633   6.804  -7.363
  558   2HB   LYS  18          2HB       LYS  18 -12.419   5.089  -7.056
  559   1HG   LYS  18          1HG       LYS  18 -10.202   5.626  -5.915
  560   2HG   LYS  18          2HG       LYS  18 -10.511   7.330  -6.232
  561   1HD   LYS  18          1HD       LYS  18 -11.342   7.207  -4.104
  562   2HD   LYS  18          2HD       LYS  18 -12.815   6.846  -4.974
  563   1HE   LYS  18          1HE       LYS  18 -10.866   4.806  -3.799
  564   2HE   LYS  18          2HE       LYS  18 -12.317   5.362  -2.966
  565   1HZ   LYS  18          1HZ       LYS  18 -12.325   3.158  -4.314
  566   2HZ   LYS  18          2HZ       LYS  18 -12.537   4.097  -5.601
  567   3HZ   LYS  18          3HZ       LYS  18 -13.652   4.157  -4.377
  568    H    CYS  19           H        CYS  19  -8.787   6.923  -8.672
  569    HA   CYS  19           HA       CYS  19  -9.583   9.434  -9.987
  570   1HB   CYS  19          1HB       CYS  19  -6.855   8.555  -9.512
  571   2HB   CYS  19          2HB       CYS  19  -7.457  10.163  -9.756
  572    H    ASP  20           H        ASP  20  -8.644   6.187 -10.845
  573    HA   ASP  20           HA       ASP  20  -7.589   5.207 -12.537
  574   1HB   ASP  20          1HB       ASP  20  -9.846   5.547 -13.384
  575   2HB   ASP  20          2HB       ASP  20  -9.347   7.070 -14.120
  576    H    GLY  21           H        GLY  21  -5.838   6.722 -11.451
  577   1HA   GLY  21          1HA       GLY  21  -4.322   8.065 -13.631
  578   2HA   GLY  21          2HA       GLY  21  -4.463   8.780 -12.014
  579    H    ARG  22           H        ARG  22  -2.106   7.923 -13.400
  580    HA   ARG  22           HA       ARG  22  -1.040   5.389 -12.750
  581   1HB   ARG  22          1HB       ARG  22  -0.230   6.751 -14.542
  582   2HB   ARG  22          2HB       ARG  22   0.123   8.110 -13.493
  583   1HG   ARG  22          1HG       ARG  22   1.625   5.509 -13.098
  584   2HG   ARG  22          2HG       ARG  22   2.003   6.564 -14.464
  585   1HD   ARG  22          1HD       ARG  22   2.209   8.482 -12.724
  586   2HD   ARG  22          2HD       ARG  22   2.284   7.182 -11.520
  587    HE   ARG  22           HE       ARG  22   4.116   6.886 -13.775
  588   1HH1  ARG  22          1HH1      ARG  22   3.833   8.449 -10.549
  589   2HH1  ARG  22          2HH1      ARG  22   5.508   7.987 -10.161
  590   1HH2  ARG  22          1HH2      ARG  22   6.417   6.625 -13.152
  591   2HH2  ARG  22          2HH2      ARG  22   6.831   7.139 -11.524
  592    H    ILE  23           H        ILE  23  -0.708   4.610 -10.714
  593    HA   ILE  23           HA       ILE  23   0.551   6.499  -8.827
  594    HB   ILE  23           HB       ILE  23  -0.845   4.011  -7.824
  595   1HG1  ILE  23          1HG1      ILE  23  -1.992   6.800  -7.439
  596   2HG1  ILE  23          2HG1      ILE  23  -2.575   5.705  -8.694
  597   1HG2  ILE  23          1HG2      ILE  23  -0.408   5.231  -5.629
  598   2HG2  ILE  23          2HG2      ILE  23   1.071   4.963  -6.528
  599   3HG2  ILE  23          3HG2      ILE  23   0.311   6.561  -6.542
  600   1HD1  ILE  23          1HD1      ILE  23  -2.509   4.962  -5.732
  601   2HD1  ILE  23          2HD1      ILE  23  -3.922   5.535  -6.584
  602   3HD1  ILE  23          3HD1      ILE  23  -3.174   3.995  -7.057
  603    H    GLU  24           H        GLU  24   2.603   6.084  -8.803
  604    HA   GLU  24           HA       GLU  24   3.847   3.481  -9.320
  605   1HB   GLU  24          1HB       GLU  24   4.737   5.507 -10.163
  606   2HB   GLU  24          2HB       GLU  24   4.730   6.280  -8.564
  607   1HG   GLU  24          1HG       GLU  24   6.532   4.822  -7.834
  608   2HG   GLU  24          2HG       GLU  24   6.422   3.881  -9.331
  609    H    LEU  25           H        LEU  25   2.892   2.160  -7.702
  610    HA   LEU  25           HA       LEU  25   2.450   3.063  -5.018
  611   1HB   LEU  25          1HB       LEU  25   2.613   0.250  -6.094
  612   2HB   LEU  25          2HB       LEU  25   1.922   0.720  -4.562
  613    HG   LEU  25           HG       LEU  25   0.803   1.423  -7.311
  614   1HD1  LEU  25          1HD1      LEU  25  -0.062  -0.645  -5.226
  615   2HD1  LEU  25          2HD1      LEU  25   0.524  -0.962  -6.871
  616   3HD1  LEU  25          3HD1      LEU  25  -1.036  -0.172  -6.627
  617   1HD2  LEU  25          1HD2      LEU  25   0.278   3.077  -5.495
  618   2HD2  LEU  25          2HD2      LEU  25  -0.337   1.768  -4.499
  619   3HD2  LEU  25          3HD2      LEU  25  -1.168   2.203  -6.020
  620    H    THR  26           H        THR  26   4.390   3.745  -4.085
  621    HA   THR  26           HA       THR  26   6.642   1.911  -4.002
  622    HB   THR  26           HB       THR  26   6.302   4.392  -2.313
  623    HG1  THR  26           1HG      THR  26   6.181   4.624  -4.699
  624   1HG2  THR  26          1HG2      THR  26   8.700   2.722  -3.256
  625   2HG2  THR  26          2HG2      THR  26   8.079   2.800  -1.595
  626   3HG2  THR  26          3HG2      THR  26   8.815   4.231  -2.338
  627    H    VAL  27           H        VAL  27   6.134  -0.014  -3.023
  628    HA   VAL  27           HA       VAL  27   5.131   0.071  -0.209
  629    HB   VAL  27           HB       VAL  27   4.067  -2.223  -0.547
  630   1HG1  VAL  27          1HG1      VAL  27   3.223  -0.382  -2.814
  631   2HG1  VAL  27          2HG1      VAL  27   2.287  -1.672  -2.034
  632   3HG1  VAL  27          3HG1      VAL  27   2.737  -0.232  -1.112
  633   1HG2  VAL  27          1HG2      VAL  27   5.065  -1.906  -3.462
  634   2HG2  VAL  27          2HG2      VAL  27   5.725  -3.063  -2.288
  635   3HG2  VAL  27          3HG2      VAL  27   4.053  -3.224  -2.843
  636    H    GLU  28           H        GLU  28   6.428  -1.247   1.251
  637    HA   GLU  28           HA       GLU  28   9.162  -1.487   0.098
  638   1HB   GLU  28          1HB       GLU  28   8.350   0.300   1.879
  639   2HB   GLU  28          2HB       GLU  28   8.562  -1.031   2.966
  640   1HG   GLU  28          1HG       GLU  28  10.945  -1.190   1.741
  641   2HG   GLU  28          2HG       GLU  28  10.549   0.459   1.293
  642    H    SER  29           H        SER  29   9.050  -3.620  -0.651
  643    HA   SER  29           HA       SER  29   8.163  -5.742   1.158
  644   1HB   SER  29          1HB       SER  29   7.065  -5.014  -1.586
  645   2HB   SER  29          2HB       SER  29   6.521  -6.307  -0.535
  646    HG   SER  29           HG       SER  29   6.303  -4.181   0.914
  647    H    SER  30           H        SER  30   9.298  -7.604   0.704
  648    HA   SER  30           HA       SER  30  11.504  -7.695  -1.028
  649   1HB   SER  30          1HB       SER  30   9.846 -10.091  -0.137
  650   2HB   SER  30          2HB       SER  30  11.565 -10.081  -0.558
  651    HG   SER  30           HG       SER  30  10.930  -9.967   1.779
  652    H    ALA  31           H        ALA  31  11.853  -8.766  -3.139
  653    HA   ALA  31           HA       ALA  31   9.993  -7.945  -4.991
  654   1HB   ALA  31          1HB       ALA  31  12.080 -10.133  -5.354
  655   2HB   ALA  31          2HB       ALA  31  11.263  -9.241  -6.654
  656   3HB   ALA  31          3HB       ALA  31  12.333  -8.376  -5.538
  657    H    GLU  32           H        GLU  32  10.223 -11.338  -3.711
  658    HA   GLU  32           HA       GLU  32   8.088 -12.185  -5.450
  659   1HB   GLU  32          1HB       GLU  32   9.552 -13.502  -3.162
  660   2HB   GLU  32          2HB       GLU  32   8.217 -14.269  -4.052
  661   1HG   GLU  32          1HG       GLU  32   9.489 -13.853  -6.205
  662   2HG   GLU  32          2HG       GLU  32  10.873 -13.340  -5.233
  663    H    ASP  33           H        ASP  33   8.244 -10.724  -2.278
  664    HA   ASP  33           HA       ASP  33   5.658 -11.649  -1.406
  665   1HB   ASP  33          1HB       ASP  33   7.628 -10.965   0.073
  666   2HB   ASP  33          2HB       ASP  33   7.243  -9.292  -0.352
  667    H    LEU  34           H        LEU  34   7.144  -8.888  -2.947
  668    HA   LEU  34           HA       LEU  34   4.840  -7.194  -3.416
  669   1HB   LEU  34          1HB       LEU  34   6.962  -6.250  -3.698
  670   2HB   LEU  34          2HB       LEU  34   7.534  -7.500  -4.774
  671    HG   LEU  34           HG       LEU  34   5.143  -5.909  -5.722
  672   1HD1  LEU  34          1HD1      LEU  34   6.651  -4.178  -4.792
  673   2HD1  LEU  34          2HD1      LEU  34   6.758  -4.138  -6.563
  674   3HD1  LEU  34          3HD1      LEU  34   8.034  -4.935  -5.625
  675   1HD2  LEU  34          1HD2      LEU  34   7.660  -6.952  -7.116
  676   2HD2  LEU  34          2HD2      LEU  34   6.344  -6.052  -7.900
  677   3HD2  LEU  34          3HD2      LEU  34   6.035  -7.647  -7.235
  678    H    ARG  35           H        ARG  35   6.353  -9.749  -5.188
  679    HA   ARG  35           HA       ARG  35   4.570  -9.831  -7.434
  680   1HB   ARG  35          1HB       ARG  35   6.732 -11.126  -7.366
  681   2HB   ARG  35          2HB       ARG  35   5.955 -12.295  -6.299
  682   1HG   ARG  35          1HG       ARG  35   4.231 -12.767  -7.986
  683   2HG   ARG  35          2HG       ARG  35   4.964 -11.587  -9.087
  684   1HD   ARG  35          1HD       ARG  35   6.991 -12.951  -9.230
  685   2HD   ARG  35          2HD       ARG  35   6.337 -14.094  -8.033
  686    HE   ARG  35           HE       ARG  35   4.404 -13.966  -9.990
  687   1HH1  ARG  35          1HH1      ARG  35   7.799 -14.933  -9.923
  688   2HH1  ARG  35          2HH1      ARG  35   7.691 -16.009 -11.273
  689   1HH2  ARG  35          1HH2      ARG  35   4.210 -15.407 -11.763
  690   2HH2  ARG  35          2HH2      ARG  35   5.579 -16.288 -12.335
  691    H    THR  36           H        THR  36   4.574 -11.752  -4.456
  692    HA   THR  36           HA       THR  36   2.144 -13.114  -4.745
  693    HB   THR  36           HB       THR  36   3.422 -12.106  -2.171
  694    HG1  THR  36           1HG      THR  36   4.894 -13.321  -3.330
  695   1HG2  THR  36          1HG2      THR  36   1.523 -14.435  -2.688
  696   2HG2  THR  36          2HG2      THR  36   1.141 -12.958  -1.770
  697   3HG2  THR  36          3HG2      THR  36   2.357 -14.089  -1.158
  698    H    LEU  37           H        LEU  37   2.648  -9.922  -3.069
  699    HA   LEU  37           HA       LEU  37  -0.105  -9.570  -2.684
  700   1HB   LEU  37          1HB       LEU  37   0.384  -7.806  -1.484
  701   2HB   LEU  37          2HB       LEU  37   1.979  -8.460  -1.591
  702    HG   LEU  37           HG       LEU  37   2.060  -6.774  -3.753
  703   1HD1  LEU  37          1HD1      LEU  37   0.860  -4.649  -3.139
  704   2HD1  LEU  37          2HD1      LEU  37   0.169  -5.426  -1.724
  705   3HD1  LEU  37          3HD1      LEU  37  -0.310  -5.955  -3.324
  706   1HD2  LEU  37          1HD2      LEU  37   3.333  -5.294  -2.365
  707   2HD2  LEU  37          2HD2      LEU  37   3.598  -6.925  -1.729
  708   3HD2  LEU  37          3HD2      LEU  37   2.494  -5.835  -0.895
  709    H    GLN  38           H        GLN  38   1.972  -8.776  -5.491
  710    HA   GLN  38           HA       GLN  38  -0.025  -7.313  -6.891
  711   1HB   GLN  38          1HB       GLN  38   2.322  -7.125  -7.366
  712   2HB   GLN  38          2HB       GLN  38   2.382  -8.797  -7.945
  713   1HG   GLN  38          1HG       GLN  38   0.953  -8.256  -9.831
  714   2HG   GLN  38          2HG       GLN  38   0.594  -6.658  -9.163
  715   1HE2  GLN  38          1HE2      GLN  38   3.867  -8.198  -9.249
  716   2HE2  GLN  38          2HE2      GLN  38   4.515  -6.993 -10.348
  717    H    GLN  39           H        GLN  39   0.510 -10.832  -6.345
  718    HA   GLN  39           HA       GLN  39  -1.280 -11.700  -8.407
  719   1HB   GLN  39          1HB       GLN  39  -0.697 -13.267  -5.910
  720   2HB   GLN  39          2HB       GLN  39  -1.337 -13.804  -7.443
  721   1HG   GLN  39          1HG       GLN  39   1.480 -13.032  -6.784
  722   2HG   GLN  39          2HG       GLN  39   0.875 -14.560  -7.365
  723   1HE2  GLN  39          1HE2      GLN  39   2.011 -11.403  -8.246
  724   2HE2  GLN  39          2HE2      GLN  39   1.990 -11.649 -10.006
  725    H    LEU  40           H        LEU  40  -1.589 -10.752  -4.939
  726    HA   LEU  40           HA       LEU  40  -4.433 -11.120  -4.739
  727   1HB   LEU  40          1HB       LEU  40  -3.044  -8.771  -3.494
  728   2HB   LEU  40          2HB       LEU  40  -4.472  -9.613  -2.971
  729    HG   LEU  40           HG       LEU  40  -1.719 -10.874  -2.943
  730   1HD1  LEU  40          1HD1      LEU  40  -1.871  -8.829  -1.474
  731   2HD1  LEU  40          2HD1      LEU  40  -1.532 -10.341  -0.610
  732   3HD1  LEU  40          3HD1      LEU  40  -3.159  -9.639  -0.578
  733   1HD2  LEU  40          1HD2      LEU  40  -2.650 -12.470  -1.363
  734   2HD2  LEU  40          2HD2      LEU  40  -3.535 -12.522  -2.901
  735   3HD2  LEU  40          3HD2      LEU  40  -4.240 -11.698  -1.488
  736    H    PHE  41           H        PHE  41  -2.558  -8.393  -6.096
  737    HA   PHE  41           HA       PHE  41  -4.874  -6.822  -6.841
  738   1HB   PHE  41          1HB       PHE  41  -2.011  -6.815  -7.760
  739   2HB   PHE  41          2HB       PHE  41  -3.226  -5.979  -8.697
  740    HD1  PHE  41           1HD      PHE  41  -3.547  -3.719  -8.277
  741    HD2  PHE  41           2HD      PHE  41  -2.257  -6.264  -5.042
  742    HE1  PHE  41           1HE      PHE  41  -3.429  -1.765  -6.772
  743    HE2  PHE  41           2HE      PHE  41  -2.157  -4.309  -3.540
  744    HZ   PHE  41           HZ       PHE  41  -2.757  -2.067  -4.389
  745    H    LEU  42           H        LEU  42  -2.990  -9.208  -8.716
  746    HA   LEU  42           HA       LEU  42  -4.652  -9.214 -11.023
  747   1HB   LEU  42          1HB       LEU  42  -2.801 -11.193  -9.707
  748   2HB   LEU  42          2HB       LEU  42  -3.711 -11.689 -11.115
  749    HG   LEU  42           HG       LEU  42  -2.016  -9.164 -11.185
  750   1HD1  LEU  42          1HD1      LEU  42  -0.500 -10.924 -10.476
  751   2HD1  LEU  42          2HD1      LEU  42  -0.190 -10.534 -12.173
  752   3HD1  LEU  42          3HD1      LEU  42  -1.086 -12.013 -11.752
  753   1HD2  LEU  42          1HD2      LEU  42  -1.973  -9.632 -13.608
  754   2HD2  LEU  42          2HD2      LEU  42  -3.644  -9.530 -13.035
  755   3HD2  LEU  42          3HD2      LEU  42  -2.917 -11.117 -13.358
  756    H    SER  43           H        SER  43  -5.095 -10.904  -7.888
  757    HA   SER  43           HA       SER  43  -7.311 -12.487  -8.754
  758   1HB   SER  43          1HB       SER  43  -5.900 -12.888  -6.726
  759   2HB   SER  43          2HB       SER  43  -6.645 -11.494  -5.948
  760    HG   SER  43           HG       SER  43  -7.660 -13.457  -5.397
  761    H    THR  44           H        THR  44  -7.249  -9.485  -6.769
  762    HA   THR  44           HA       THR  44  -9.680  -8.538  -8.017
  763    HB   THR  44           HB       THR  44 -10.904  -8.271  -5.827
  764    HG1  THR  44           1HG      THR  44  -8.859  -9.996  -4.886
  765   1HG2  THR  44          1HG2      THR  44 -11.408 -10.208  -7.320
  766   2HG2  THR  44          2HG2      THR  44 -11.741 -10.488  -5.594
  767   3HG2  THR  44          3HG2      THR  44 -10.296 -11.198  -6.343
  768    H    LEU  45           H        LEU  45  -6.944  -7.959  -5.997
  769    HA   LEU  45           HA       LEU  45  -7.941  -5.703  -4.661
  770   1HB   LEU  45          1HB       LEU  45  -5.551  -7.315  -4.647
  771   2HB   LEU  45          2HB       LEU  45  -5.035  -5.672  -4.703
  772    HG   LEU  45           HG       LEU  45  -6.632  -5.261  -2.759
  773   1HD1  LEU  45          1HD1      LEU  45  -8.098  -7.237  -3.073
  774   2HD1  LEU  45          2HD1      LEU  45  -7.284  -7.362  -1.500
  775   3HD1  LEU  45          3HD1      LEU  45  -6.710  -8.311  -2.873
  776   1HD2  LEU  45          1HD2      LEU  45  -5.074  -6.367  -1.099
  777   2HD2  LEU  45          2HD2      LEU  45  -4.254  -5.423  -2.356
  778   3HD2  LEU  45          3HD2      LEU  45  -4.306  -7.199  -2.446
  779    H    SER  46           H        SER  46  -7.435  -3.506  -4.593
  780    HA   SER  46           HA       SER  46  -6.141  -2.299  -6.931
  781   1HB   SER  46          1HB       SER  46  -8.111  -0.586  -6.670
  782   2HB   SER  46          2HB       SER  46  -8.334  -2.059  -7.610
  783    HG   SER  46           HG       SER  46  -9.862  -1.219  -5.580
  784    H    PHE  47           H        PHE  47  -5.992   0.215  -6.361
  785    HA   PHE  47           HA       PHE  47  -5.283   0.549  -3.525
  786   1HB   PHE  47          1HB       PHE  47  -3.249  -0.001  -5.095
  787   2HB   PHE  47          2HB       PHE  47  -3.472   1.635  -5.679
  788    HD1  PHE  47           1HD      PHE  47  -2.317  -0.492  -2.912
  789    HD2  PHE  47           2HD      PHE  47  -3.161   3.582  -4.060
  790    HE1  PHE  47           1HE      PHE  47  -0.975   0.326  -1.015
  791    HE2  PHE  47           2HE      PHE  47  -1.888   4.389  -2.097
  792    HZ   PHE  47           HZ       PHE  47  -0.802   2.764  -0.566
  793    H    VAL  48           H        VAL  48  -5.257   2.716  -2.860
  794    HA   VAL  48           HA       VAL  48  -6.752   4.588  -4.465
  795    HB   VAL  48           HB       VAL  48  -7.586   3.105  -1.988
  796   1HG1  VAL  48          1HG1      VAL  48  -7.858   5.529  -1.378
  797   2HG1  VAL  48          2HG1      VAL  48  -8.989   5.669  -2.754
  798   3HG1  VAL  48          3HG1      VAL  48  -9.336   4.549  -1.420
  799   1HG2  VAL  48          1HG2      VAL  48  -8.458   2.373  -4.185
  800   2HG2  VAL  48          2HG2      VAL  48  -9.757   3.094  -3.237
  801   3HG2  VAL  48          3HG2      VAL  48  -8.993   4.012  -4.550
  802    H    CYS  49           H        CYS  49  -5.253   6.130  -4.612
  803    HA   CYS  49           HA       CYS  49  -2.977   6.426  -2.891
  804   1HB   CYS  49          1HB       CYS  49  -2.773   8.639  -4.171
  805   2HB   CYS  49          2HB       CYS  49  -2.744   7.162  -5.106
  806    HA   PRO  50           HA       PRO  50  -4.411   8.697   0.496
  807   1HB   PRO  50          1HB       PRO  50  -2.516  10.710   0.917
  808   2HB   PRO  50          2HB       PRO  50  -2.399   9.000   1.428
  809   1HG   PRO  50          1HG       PRO  50  -1.274  10.296  -1.065
  810   2HG   PRO  50          2HG       PRO  50  -0.476   9.133   0.043
  811   1HD   PRO  50          1HD       PRO  50  -1.539   8.296  -2.285
  812   2HD   PRO  50          2HD       PRO  50  -1.765   7.317  -0.805
  813    H    TRP  51           H        TRP  51  -3.845  10.552  -2.399
  814    HA   TRP  51           HA       TRP  51  -5.177  12.979  -1.795
  815   1HB   TRP  51          1HB       TRP  51  -3.730  12.671  -3.740
  816   2HB   TRP  51          2HB       TRP  51  -4.805  11.440  -4.390
  817    HD1  TRP  51           HD       TRP  51  -5.704  14.997  -3.110
  818    HE1  TRP  51           1HE      TRP  51  -6.916  16.262  -4.961
  819    HE3  TRP  51           3HE      TRP  51  -5.341  11.508  -6.854
  820    HZ2  TRP  51           2HZ      TRP  51  -7.625  15.844  -7.737
  821    HZ3  TRP  51           3HZ      TRP  51  -6.259  12.000  -9.100
  822    HH2  TRP  51           HH       TRP  51  -7.418  14.146  -9.547
  823    H    CYS  52           H        CYS  52  -6.521  10.081  -3.610
  824    HA   CYS  52           HA       CYS  52  -9.232  11.032  -3.160
  825   1HB   CYS  52          1HB       CYS  52  -9.913   8.824  -3.963
  826   2HB   CYS  52          2HB       CYS  52  -8.883   9.707  -5.035
  827    H    ALA  53           H        ALA  53  -6.973   8.932  -1.354
  828    HA   ALA  53           HA       ALA  53  -8.958   7.700   0.083
  829   1HB   ALA  53          1HB       ALA  53  -6.476   7.195   0.344
  830   2HB   ALA  53          2HB       ALA  53  -6.330   8.696   1.307
  831   3HB   ALA  53          3HB       ALA  53  -7.311   7.377   1.914
  832    H    THR  54           H        THR  54  -7.462  10.840   0.526
  833    HA   THR  54           HA       THR  54  -8.947  11.804   2.790
  834    HB   THR  54           HB       THR  54  -7.445  13.333   0.611
  835    HG1  THR  54           1HG      THR  54  -5.990  11.941   1.429
  836   1HG2  THR  54          1HG2      THR  54  -7.053  14.995   2.399
  837   2HG2  THR  54          2HG2      THR  54  -8.099  14.065   3.495
  838   3HG2  THR  54          3HG2      THR  54  -8.778  14.822   2.033
  839    H    ASN  55           H        ASN  55  -9.206  12.425  -0.778
  840    HA   ASN  55           HA       ASN  55 -11.446  14.252  -0.305
  841   1HB   ASN  55          1HB       ASN  55  -9.991  13.403  -2.848
  842   2HB   ASN  55          2HB       ASN  55 -11.319  14.559  -2.806
  843   1HD2  ASN  55          1HD2      ASN  55  -8.000  13.986  -1.628
  844   2HD2  ASN  55          2HD2      ASN  55  -7.755  15.656  -1.121
  845    H    GLN  56           H        GLN  56 -11.199  11.004  -1.074
  846    HA   GLN  56           HA       GLN  56 -12.581   9.317  -1.587
  847   1HB   GLN  56          2HB       GLN  56 -14.264  10.465  -0.099
  848   2HB   GLN  56          3HB       GLN  56 -14.971  11.197  -1.543
  849   1HG   GLN  56          2HG       GLN  56 -15.717   9.089  -2.375
  850   2HG   GLN  56          3HG       GLN  56 -14.620   8.188  -1.319
  851   1HE2  GLN  56          1HE2      GLN  56 -17.685   9.975  -1.444
  852   2HE2  GLN  56          2HE2      GLN  56 -18.216   9.482   0.163
  Start of MODEL   13
    1   1H    GLY   1          1H        GLY   1 -28.436   7.941  -3.904
    2   1HA   GLY   1          1HA       GLY   1 -27.342   9.155  -6.346
    3   2HA   GLY   1          2HA       GLY   1 -27.317   9.856  -4.710
    4    H    SER   2           H        SER   2 -24.918   9.925  -4.854
    5    HA   SER   2           HA       SER   2 -23.302   7.687  -5.229
    6   1HB   SER   2          1HB       SER   2 -22.727  10.157  -3.545
    7   2HB   SER   2          2HB       SER   2 -21.563   9.122  -4.398
    8    HG   SER   2           HG       SER   2 -22.003  10.957  -5.631
    9    H    HIS   3           H        HIS   3 -24.206   5.957  -4.029
   10    HA   HIS   3           HA       HIS   3 -23.783   6.039  -1.066
   11   1HB   HIS   3          1HB       HIS   3 -25.926   4.552  -2.618
   12   2HB   HIS   3          2HB       HIS   3 -25.756   4.632  -0.867
   13    HD1  HIS   3           1HD      HIS   3 -25.227   8.003  -1.169
   14    HD2  HIS   3           2HD      HIS   3 -28.418   5.566  -2.434
   15    HE1  HIS   3           1HE      HIS   3 -27.290   9.524  -1.332
   16    H    MET   4           H        MET   4 -22.444   4.699  -3.762
   17    HA   MET   4           HA       MET   4 -22.086   1.941  -2.935
   18   1HB   MET   4          1HB       MET   4 -21.889   2.588  -5.276
   19   2HB   MET   4          2HB       MET   4 -20.591   3.733  -4.903
   20   1HG   MET   4          1HG       MET   4 -19.114   1.930  -4.222
   21   2HG   MET   4          2HG       MET   4 -20.407   0.743  -4.383
   22   1HE   MET   4          1HE       MET   4 -21.826   0.945  -7.009
   23   2HE   MET   4          2HE       MET   4 -20.741   0.043  -8.091
   24   3HE   MET   4          3HE       MET   4 -21.001  -0.520  -6.424
   25    H    ALA   5           H        ALA   5 -20.992   1.426  -1.113
   26    HA   ALA   5           HA       ALA   5 -18.306   2.359  -0.800
   27   1HB   ALA   5          1HB       ALA   5 -18.528   2.752   1.635
   28   2HB   ALA   5          2HB       ALA   5 -19.437   3.962   0.695
   29   3HB   ALA   5          3HB       ALA   5 -20.299   2.618   1.496
   30    H    GLU   6           H        GLU   6 -17.104   0.577  -0.038
   31    HA   GLU   6           HA       GLU   6 -18.676  -1.941   0.102
   32   1HB   GLU   6          1HB       GLU   6 -16.364  -1.154  -1.734
   33   2HB   GLU   6          2HB       GLU   6 -17.127  -2.733  -1.710
   34   1HG   GLU   6          1HG       GLU   6 -18.403  -0.089  -2.548
   35   2HG   GLU   6          2HG       GLU   6 -17.959  -1.416  -3.579
   36    HA   PRO   7           HA       PRO   7 -15.521  -3.159   3.010
   37   1HB   PRO   7          1HB       PRO   7 -15.534  -5.869   2.875
   38   2HB   PRO   7          2HB       PRO   7 -16.975  -4.946   3.388
   39   1HG   PRO   7          1HG       PRO   7 -16.369  -6.018   0.609
   40   2HG   PRO   7          2HG       PRO   7 -17.864  -6.243   1.575
   41   1HD   PRO   7          1HD       PRO   7 -17.620  -4.289  -0.312
   42   2HD   PRO   7          2HD       PRO   7 -18.562  -4.023   1.176
   43    H    GLN   8           H        GLN   8 -14.248  -1.956   1.196
   44    HA   GLN   8           HA       GLN   8 -12.026  -3.655   0.205
   45   1HB   GLN   8          1HB       GLN   8 -14.051  -2.767  -1.437
   46   2HB   GLN   8          2HB       GLN   8 -12.965  -1.403  -1.559
   47   1HG   GLN   8          1HG       GLN   8 -12.468  -2.930  -3.341
   48   2HG   GLN   8          2HG       GLN   8 -11.122  -3.032  -2.206
   49   1HE2  GLN   8          1HE2      GLN   8 -10.569  -5.082  -1.553
   50   2HE2  GLN   8          2HE2      GLN   8 -11.623  -6.499  -1.597
   51    H    ARG   9           H        ARG   9 -12.852  -0.164   0.074
   52    HA   ARG   9           HA       ARG   9 -10.300   0.821   0.600
   53   1HB   ARG   9          1HB       ARG   9 -12.241   2.008  -0.420
   54   2HB   ARG   9          2HB       ARG   9 -12.953   2.170   1.176
   55   1HG   ARG   9          1HG       ARG   9 -10.267   3.179   0.767
   56   2HG   ARG   9          2HG       ARG   9 -11.609   4.101   0.085
   57   1HD   ARG   9          1HD       ARG   9 -12.471   3.742   2.675
   58   2HD   ARG   9          2HD       ARG   9 -10.730   3.750   2.921
   59    HE   ARG   9           HE       ARG   9 -10.671   6.016   2.432
   60   1HH1  ARG   9          1HH1      ARG   9 -13.879   4.757   1.446
   61   2HH1  ARG   9          2HH1      ARG   9 -14.495   6.386   1.166
   62   1HH2  ARG   9          1HH2      ARG   9 -11.666   8.157   2.059
   63   2HH2  ARG   9          2HH2      ARG   9 -13.341   8.150   1.503
   64    H    HIS  10           H        HIS  10  -9.268  -0.253   2.336
   65    HA   HIS  10           HA       HIS  10 -10.380   0.273   5.057
   66   1HB   HIS  10          1HB       HIS  10  -8.793  -2.059   3.943
   67   2HB   HIS  10          2HB       HIS  10  -9.196  -1.831   5.653
   68    HD1  HIS  10           1HD      HIS  10 -10.264  -4.251   3.583
   69    HD2  HIS  10           2HD      HIS  10 -12.304  -0.824   4.740
   70    HE1  HIS  10           1HE      HIS  10 -12.673  -4.853   3.490
   71    H    LYS  11           H        LYS  11  -8.557   0.121   6.770
   72    HA   LYS  11           HA       LYS  11  -6.345   1.879   5.861
   73   1HB   LYS  11          1HB       LYS  11  -8.448   2.533   7.952
   74   2HB   LYS  11          2HB       LYS  11  -6.919   3.369   7.761
   75   1HG   LYS  11          1HG       LYS  11  -7.960   4.775   6.350
   76   2HG   LYS  11          2HG       LYS  11  -7.863   3.489   5.178
   77   1HD   LYS  11          1HD       LYS  11 -10.114   4.304   5.180
   78   2HD   LYS  11          2HD       LYS  11 -10.138   2.698   5.899
   79   1HE   LYS  11          1HE       LYS  11 -11.596   4.135   7.172
   80   2HE   LYS  11          2HE       LYS  11 -10.198   3.735   8.177
   81   1HZ   LYS  11          1HZ       LYS  11 -10.798   6.082   8.289
   82   2HZ   LYS  11          2HZ       LYS  11 -10.478   6.274   6.682
   83   3HZ   LYS  11          3HZ       LYS  11  -9.279   5.906   7.745
   84    H    ILE  12           H        ILE  12  -4.704   0.508   6.364
   85    HA   ILE  12           HA       ILE  12  -4.645  -0.774   9.050
   86    HB   ILE  12           HB       ILE  12  -2.556  -0.904   6.846
   87   1HG1  ILE  12          1HG1      ILE  12  -4.626  -3.034   7.465
   88   2HG1  ILE  12          2HG1      ILE  12  -4.716  -1.912   6.101
   89   1HG2  ILE  12          1HG2      ILE  12  -2.969  -2.519   9.407
   90   2HG2  ILE  12          2HG2      ILE  12  -1.675  -2.788   8.211
   91   3HG2  ILE  12          3HG2      ILE  12  -1.712  -1.301   9.142
   92   1HD1  ILE  12          1HD1      ILE  12  -2.446  -2.720   5.343
   93   2HD1  ILE  12          2HD1      ILE  12  -2.615  -4.044   6.529
   94   3HD1  ILE  12          3HD1      ILE  12  -3.773  -3.869   5.199
   95    H    LEU  13           H        LEU  13  -4.252   0.871  10.543
   96    HA   LEU  13           HA       LEU  13  -2.506   3.068   9.965
   97   1HB   LEU  13          1HB       LEU  13  -4.387   3.157  11.588
   98   2HB   LEU  13          2HB       LEU  13  -3.447   2.161  12.707
   99    HG   LEU  13           HG       LEU  13  -2.141   4.633  11.505
  100   1HD1  LEU  13          1HD1      LEU  13  -4.316   5.446  12.092
  101   2HD1  LEU  13          2HD1      LEU  13  -3.123   6.032  13.275
  102   3HD1  LEU  13          3HD1      LEU  13  -4.218   4.695  13.705
  103   1HD2  LEU  13          1HD2      LEU  13  -2.011   3.388  14.292
  104   2HD2  LEU  13          2HD2      LEU  13  -1.097   4.811  13.744
  105   3HD2  LEU  13          3HD2      LEU  13  -0.778   3.238  13.025
  106    H    CYS  14           H        CYS  14  -0.470   2.877   9.715
  107    HA   CYS  14           HA       CYS  14   1.158   0.988  11.318
  108   1HB   CYS  14          1HB       CYS  14   0.725   0.332   8.884
  109   2HB   CYS  14          2HB       CYS  14   1.577   1.803   8.399
  110    HG   CYS  14           HG       CYS  14   3.899   1.156   8.979
  111    H    VAL  15           H        VAL  15   3.614   1.892  10.774
  112    HA   VAL  15           HA       VAL  15   3.573   4.833  10.624
  113    HB   VAL  15           HB       VAL  15   5.780   4.861  11.767
  114   1HG1  VAL  15          1HG1      VAL  15   4.868   4.780  14.027
  115   2HG1  VAL  15          2HG1      VAL  15   3.716   5.532  12.917
  116   3HG1  VAL  15          3HG1      VAL  15   3.458   3.857  13.462
  117   1HG2  VAL  15          1HG2      VAL  15   5.094   2.022  12.660
  118   2HG2  VAL  15          2HG2      VAL  15   6.392   2.464  11.522
  119   3HG2  VAL  15          3HG2      VAL  15   6.461   3.012  13.199
  120    H    CYS  16           H        CYS  16   5.294   5.694   9.398
  121    HA   CYS  16           HA       CYS  16   6.136   4.117   7.097
  122   1HB   CYS  16          1HB       CYS  16   5.775   6.695   7.167
  123   2HB   CYS  16          2HB       CYS  16   7.306   6.760   8.057
  124    H    CYS  17           H        CYS  17   7.972   2.921   6.955
  125    HA   CYS  17           HA       CYS  17   9.336   2.089   9.257
  126   1HB   CYS  17          1HB       CYS  17   9.130   1.008   6.908
  127   2HB   CYS  17          2HB       CYS  17  10.537   1.985   6.469
  128    HG   CYS  17           HG       CYS  17  11.301  -0.371   6.901
  129    H    LYS  18           H        LYS  18  10.251   4.676   6.977
  130    HA   LYS  18           HA       LYS  18  12.844   5.052   8.333
  131   1HB   LYS  18          1HB       LYS  18  13.411   6.257   6.253
  132   2HB   LYS  18          2HB       LYS  18  12.931   4.578   5.999
  133   1HG   LYS  18          1HG       LYS  18  10.594   5.411   5.382
  134   2HG   LYS  18          2HG       LYS  18  11.211   7.055   5.442
  135   1HD   LYS  18          1HD       LYS  18  12.322   4.781   3.762
  136   2HD   LYS  18          2HD       LYS  18  11.165   5.935   3.128
  137   1HE   LYS  18          1HE       LYS  18  13.878   6.701   4.257
  138   2HE   LYS  18          2HE       LYS  18  13.572   6.410   2.536
  139   1HZ   LYS  18          1HZ       LYS  18  12.096   8.286   2.483
  140   2HZ   LYS  18          2HZ       LYS  18  13.474   8.793   3.191
  141   3HZ   LYS  18          3HZ       LYS  18  12.189   8.470   4.137
  142    H    CYS  19           H        CYS  19   9.743   6.530   8.268
  143    HA   CYS  19           HA       CYS  19  10.830   9.119   9.212
  144   1HB   CYS  19          1HB       CYS  19   8.010   8.591   8.822
  145   2HB   CYS  19          2HB       CYS  19   8.885  10.078   8.748
  146    H    ASP  20           H        ASP  20   9.342   6.137  10.335
  147    HA   ASP  20           HA       ASP  20   8.163   5.490  12.047
  148   1HB   ASP  20          1HB       ASP  20  10.333   5.897  13.159
  149   2HB   ASP  20          2HB       ASP  20   9.753   7.486  13.658
  150    H    GLY  21           H        GLY  21   7.008   7.443  10.397
  151   1HA   GLY  21          1HA       GLY  21   5.382   9.169  12.235
  152   2HA   GLY  21          2HA       GLY  21   5.614   9.473  10.515
  153    H    ARG  22           H        ARG  22   3.193   9.178  12.040
  154    HA   ARG  22           HA       ARG  22   1.901   6.646  11.820
  155   1HB   ARG  22          1HB       ARG  22   1.273   8.369  13.410
  156   2HB   ARG  22          2HB       ARG  22   0.862   9.505  12.138
  157   1HG   ARG  22          1HG       ARG  22  -0.636   6.874  12.325
  158   2HG   ARG  22          2HG       ARG  22  -0.956   8.163  13.484
  159   1HD   ARG  22          1HD       ARG  22  -1.343   9.720  11.462
  160   2HD   ARG  22          2HD       ARG  22  -1.408   8.236  10.492
  161    HE   ARG  22           HE       ARG  22  -3.085   8.134  12.846
  162   1HH1  ARG  22          1HH1      ARG  22  -3.179   9.496   9.510
  163   2HH1  ARG  22          2HH1      ARG  22  -4.850   8.916   9.325
  164   1HH2  ARG  22          1HH2      ARG  22  -5.391   7.689  12.445
  165   2HH2  ARG  22          2HH2      ARG  22  -5.947   8.030  10.800
  166    H    ILE  23           H        ILE  23   1.396   5.613   9.930
  167    HA   ILE  23           HA       ILE  23   0.249   7.328   7.811
  168    HB   ILE  23           HB       ILE  23   1.449   4.625   7.178
  169   1HG1  ILE  23          1HG1      ILE  23   2.870   7.212   6.469
  170   2HG1  ILE  23          2HG1      ILE  23   3.341   6.188   7.830
  171   1HG2  ILE  23          1HG2      ILE  23   1.108   5.611   4.829
  172   2HG2  ILE  23          2HG2      ILE  23  -0.385   5.636   5.743
  173   3HG2  ILE  23          3HG2      ILE  23   0.565   7.117   5.571
  174   1HD1  ILE  23          1HD1      ILE  23   3.156   5.138   4.967
  175   2HD1  ILE  23          2HD1      ILE  23   4.629   5.667   5.727
  176   3HD1  ILE  23          3HD1      ILE  23   3.755   4.275   6.394
  177    H    GLU  24           H        GLU  24  -1.865   7.016   7.750
  178    HA   GLU  24           HA       GLU  24  -3.171   4.532   8.640
  179   1HB   GLU  24          1HB       GLU  24  -4.055   6.650   9.211
  180   2HB   GLU  24          2HB       GLU  24  -4.130   7.193   7.521
  181   1HG   GLU  24          1HG       GLU  24  -5.830   5.440   7.101
  182   2HG   GLU  24          2HG       GLU  24  -5.686   4.917   8.793
  183    H    LEU  25           H        LEU  25  -2.320   2.950   7.215
  184    HA   LEU  25           HA       LEU  25  -1.780   3.525   4.453
  185   1HB   LEU  25          1HB       LEU  25  -2.093   0.793   5.720
  186   2HB   LEU  25          2HB       LEU  25  -1.331   1.160   4.197
  187    HG   LEU  25           HG       LEU  25  -0.273   1.968   6.945
  188   1HD1  LEU  25          1HD1      LEU  25   0.604  -0.194   4.961
  189   2HD1  LEU  25          2HD1      LEU  25  -0.124  -0.461   6.559
  190   3HD1  LEU  25          3HD1      LEU  25   1.485   0.261   6.431
  191   1HD2  LEU  25          1HD2      LEU  25   0.341   3.539   5.165
  192   2HD2  LEU  25          2HD2      LEU  25   0.887   2.224   4.141
  193   3HD2  LEU  25          3HD2      LEU  25   1.755   2.606   5.661
  194    H    THR  26           H        THR  26  -3.622   4.203   3.373
  195    HA   THR  26           HA       THR  26  -6.024   2.602   3.625
  196    HB   THR  26           HB       THR  26  -5.604   4.900   1.726
  197    HG1  THR  26           1HG      THR  26  -5.383   5.216   4.119
  198   1HG2  THR  26          1HG2      THR  26  -8.069   3.434   2.840
  199   2HG2  THR  26          2HG2      THR  26  -7.494   3.366   1.167
  200   3HG2  THR  26          3HG2      THR  26  -8.137   4.876   1.827
  201    H    VAL  27           H        VAL  27  -5.911   0.613   2.805
  202    HA   VAL  27           HA       VAL  27  -4.910   0.279   0.023
  203    HB   VAL  27           HB       VAL  27  -3.929  -1.950   0.612
  204   1HG1  VAL  27          1HG1      VAL  27  -3.052  -0.066   2.839
  205   2HG1  VAL  27          2HG1      VAL  27  -2.113  -1.292   1.971
  206   3HG1  VAL  27          3HG1      VAL  27  -2.640   0.190   1.145
  207   1HG2  VAL  27          1HG2      VAL  27  -4.943  -1.402   3.481
  208   2HG2  VAL  27          2HG2      VAL  27  -5.599  -2.628   2.386
  209   3HG2  VAL  27          3HG2      VAL  27  -3.935  -2.763   2.960
  210    H    GLU  28           H        GLU  28  -6.343  -0.947  -1.307
  211    HA   GLU  28           HA       GLU  28  -9.067  -0.843  -0.133
  212   1HB   GLU  28          1HB       GLU  28  -8.132   0.694  -2.058
  213   2HB   GLU  28          2HB       GLU  28  -8.387  -0.706  -3.042
  214   1HG   GLU  28          1HG       GLU  28 -10.803  -0.586  -1.802
  215   2HG   GLU  28          2HG       GLU  28 -10.331   1.093  -1.658
  216    H    SER  29           H        SER  29  -9.064  -2.896   0.836
  217    HA   SER  29           HA       SER  29  -8.291  -5.235  -0.809
  218   1HB   SER  29          1HB       SER  29  -7.216  -4.311   1.882
  219   2HB   SER  29          2HB       SER  29  -6.760  -5.771   1.010
  220    HG   SER  29           HG       SER  29  -6.373  -3.805  -0.668
  221    H    SER  30           H        SER  30  -9.519  -6.993  -0.279
  222    HA   SER  30           HA       SER  30 -11.868  -6.685   1.283
  223   1HB   SER  30          1HB       SER  30 -10.504  -9.302   0.536
  224   2HB   SER  30          2HB       SER  30 -12.220  -9.042   0.859
  225    HG   SER  30           HG       SER  30 -11.716  -9.076  -1.418
  226    H    ALA  31           H        ALA  31 -12.350  -7.447   3.452
  227    HA   ALA  31           HA       ALA  31 -10.448  -6.708   5.203
  228   1HB   ALA  31          1HB       ALA  31 -12.645  -8.739   5.822
  229   2HB   ALA  31          2HB       ALA  31 -11.804  -7.726   7.006
  230   3HB   ALA  31          3HB       ALA  31 -12.849  -6.966   5.786
  231    H    GLU  32           H        GLU  32 -10.752 -10.129   4.147
  232    HA   GLU  32           HA       GLU  32  -8.706 -10.736   6.097
  233   1HB   GLU  32          1HB       GLU  32 -10.986 -12.054   5.697
  234   2HB   GLU  32          2HB       GLU  32  -9.891 -12.999   4.640
  235   1HG   GLU  32          1HG       GLU  32  -8.279 -13.173   6.529
  236   2HG   GLU  32          2HG       GLU  32  -9.321 -12.174   7.536
  237    H    ASP  33           H        ASP  33  -8.934 -10.066   2.843
  238    HA   ASP  33           HA       ASP  33  -6.500 -11.345   1.981
  239   1HB   ASP  33          1HB       ASP  33  -8.587 -10.592   0.612
  240   2HB   ASP  33          2HB       ASP  33  -7.913  -8.969   0.739
  241    H    LEU  34           H        LEU  34  -7.735  -8.317   3.325
  242    HA   LEU  34           HA       LEU  34  -5.271  -6.828   3.558
  243   1HB   LEU  34          1HB       LEU  34  -7.282  -5.650   3.667
  244   2HB   LEU  34          2HB       LEU  34  -7.970  -6.658   4.906
  245    HG   LEU  34           HG       LEU  34  -5.427  -5.192   5.606
  246   1HD1  LEU  34          1HD1      LEU  34  -6.760  -3.485   4.433
  247   2HD1  LEU  34          2HD1      LEU  34  -6.788  -3.162   6.175
  248   3HD1  LEU  34          3HD1      LEU  34  -8.188  -3.932   5.399
  249   1HD2  LEU  34          1HD2      LEU  34  -7.999  -5.795   7.147
  250   2HD2  LEU  34          2HD2      LEU  34  -6.610  -4.894   7.792
  251   3HD2  LEU  34          3HD2      LEU  34  -6.431  -6.590   7.370
  252    H    ARG  35           H        ARG  35  -7.033  -8.887   5.692
  253    HA   ARG  35           HA       ARG  35  -5.248  -8.966   7.914
  254   1HB   ARG  35          1HB       ARG  35  -7.515 -10.095   7.890
  255   2HB   ARG  35          2HB       ARG  35  -6.785 -11.410   6.962
  256   1HG   ARG  35          1HG       ARG  35  -5.155 -11.787   8.813
  257   2HG   ARG  35          2HG       ARG  35  -6.033 -10.583   9.780
  258   1HD   ARG  35          1HD       ARG  35  -8.080 -12.004   9.623
  259   2HD   ARG  35          2HD       ARG  35  -7.183 -13.165   8.622
  260    HE   ARG  35           HE       ARG  35  -5.829 -12.653  11.087
  261   1HH1  ARG  35          1HH1      ARG  35  -8.571 -14.624   9.738
  262   2HH1  ARG  35          2HH1      ARG  35  -8.453 -15.784  10.989
  263   1HH2  ARG  35          1HH2      ARG  35  -5.725 -14.276  12.696
  264   2HH2  ARG  35          2HH2      ARG  35  -6.834 -15.599  12.680
  265    H    THR  36           H        THR  36  -5.374 -11.143   5.091
  266    HA   THR  36           HA       THR  36  -3.059 -12.647   5.633
  267    HB   THR  36           HB       THR  36  -4.189 -11.873   2.906
  268    HG1  THR  36           1HG      THR  36  -5.782 -12.842   4.156
  269   1HG2  THR  36          1HG2      THR  36  -2.476 -14.243   3.772
  270   2HG2  THR  36          2HG2      THR  36  -1.964 -12.919   2.698
  271   3HG2  THR  36          3HG2      THR  36  -3.234 -14.036   2.178
  272    H    LEU  37           H        LEU  37  -3.297  -9.641   3.591
  273    HA   LEU  37           HA       LEU  37  -0.501  -9.500   3.258
  274   1HB   LEU  37          1HB       LEU  37  -0.865  -7.834   1.889
  275   2HB   LEU  37          2HB       LEU  37  -2.509  -8.328   2.046
  276    HG   LEU  37           HG       LEU  37  -2.414  -6.476   4.082
  277   1HD1  LEU  37          1HD1      LEU  37  -1.062  -4.516   3.296
  278   2HD1  LEU  37          2HD1      LEU  37  -0.486  -5.440   1.911
  279   3HD1  LEU  37          3HD1      LEU  37   0.011  -5.903   3.528
  280   1HD2  LEU  37          1HD2      LEU  37  -3.676  -5.073   2.687
  281   2HD2  LEU  37          2HD2      LEU  37  -3.946  -6.688   1.997
  282   3HD2  LEU  37          3HD2      LEU  37  -2.814  -5.583   1.223
  283    H    GLN  38           H        GLN  38  -2.555  -8.382   5.962
  284    HA   GLN  38           HA       GLN  38  -0.510  -6.902   7.283
  285   1HB   GLN  38          1HB       GLN  38  -2.871  -6.572   7.651
  286   2HB   GLN  38          2HB       GLN  38  -3.054  -8.195   8.304
  287   1HG   GLN  38          1HG       GLN  38  -1.592  -7.640  10.204
  288   2HG   GLN  38          2HG       GLN  38  -1.380  -6.002   9.563
  289   1HE2  GLN  38          1HE2      GLN  38  -3.641  -4.884   9.004
  290   2HE2  GLN  38          2HE2      GLN  38  -4.925  -5.208  10.162
  291    H    GLN  39           H        GLN  39  -1.303 -10.414   7.093
  292    HA   GLN  39           HA       GLN  39   0.408 -11.153   9.268
  293   1HB   GLN  39          1HB       GLN  39  -0.253 -12.916   6.908
  294   2HB   GLN  39          2HB       GLN  39   0.356 -13.373   8.485
  295   1HG   GLN  39          1HG       GLN  39  -2.407 -12.497   7.733
  296   2HG   GLN  39          2HG       GLN  39  -1.899 -13.967   8.518
  297   1HE2  GLN  39          1HE2      GLN  39  -2.919 -10.701   8.956
  298   2HE2  GLN  39          2HE2      GLN  39  -2.906 -10.686  10.729
  299    H    LEU  40           H        LEU  40   0.848 -10.634   5.716
  300    HA   LEU  40           HA       LEU  40   3.668 -11.163   5.676
  301   1HB   LEU  40          1HB       LEU  40   2.502  -8.858   4.159
  302   2HB   LEU  40          2HB       LEU  40   3.879  -9.852   3.792
  303    HG   LEU  40           HG       LEU  40   1.012 -10.822   3.678
  304   1HD1  LEU  40          1HD1      LEU  40   2.869  -9.966   1.426
  305   2HD1  LEU  40          2HD1      LEU  40   1.494  -9.022   2.033
  306   3HD1  LEU  40          3HD1      LEU  40   1.213 -10.585   1.243
  307   1HD2  LEU  40          1HD2      LEU  40   1.849 -12.686   2.359
  308   2HD2  LEU  40          2HD2      LEU  40   2.542 -12.690   3.993
  309   3HD2  LEU  40          3HD2      LEU  40   3.515 -12.138   2.606
  310    H    PHE  41           H        PHE  41   1.919  -8.163   6.646
  311    HA   PHE  41           HA       PHE  41   4.335  -6.677   7.233
  312   1HB   PHE  41          1HB       PHE  41   1.456  -6.350   8.003
  313   2HB   PHE  41          2HB       PHE  41   2.667  -5.524   8.953
  314    HD1  PHE  41           1HD      PHE  41   3.426  -3.417   8.311
  315    HD2  PHE  41           2HD      PHE  41   1.743  -6.034   5.326
  316    HE1  PHE  41           1HE      PHE  41   3.622  -1.627   6.623
  317    HE2  PHE  41           2HE      PHE  41   1.968  -4.247   3.631
  318    HZ   PHE  41           HZ       PHE  41   2.942  -2.060   4.262
  319    H    LEU  42           H        LEU  42   2.324  -8.748   9.297
  320    HA   LEU  42           HA       LEU  42   3.913  -8.475  11.659
  321   1HB   LEU  42          1HB       LEU  42   1.969 -10.517  10.567
  322   2HB   LEU  42          2HB       LEU  42   2.764 -10.802  12.104
  323    HG   LEU  42           HG       LEU  42   1.197  -8.243  11.564
  324   1HD1  LEU  42          1HD1      LEU  42  -0.337 -10.110  11.219
  325   2HD1  LEU  42          2HD1      LEU  42  -0.708  -9.296  12.743
  326   3HD1  LEU  42          3HD1      LEU  42   0.159 -10.851  12.754
  327   1HD2  LEU  42          1HD2      LEU  42   1.045  -8.155  14.029
  328   2HD2  LEU  42          2HD2      LEU  42   2.733  -8.182  13.511
  329   3HD2  LEU  42          3HD2      LEU  42   1.986  -9.658  14.154
  330    H    SER  43           H        SER  43   4.345 -10.559   8.782
  331    HA   SER  43           HA       SER  43   6.347 -12.202  10.027
  332   1HB   SER  43          1HB       SER  43   4.777 -12.939   8.243
  333   2HB   SER  43          2HB       SER  43   5.535 -11.814   7.113
  334    HG   SER  43           HG       SER  43   6.798 -13.394   6.707
  335    H    THR  44           H        THR  44   6.465  -9.834   7.332
  336    HA   THR  44           HA       THR  44   9.311  -9.432   7.669
  337    HB   THR  44           HB       THR  44   9.030  -9.661   5.001
  338    HG1  THR  44           1HG      THR  44   7.285 -10.821   4.333
  339   1HG2  THR  44          1HG2      THR  44   9.474 -12.052   5.151
  340   2HG2  THR  44          2HG2      THR  44   8.913 -12.080   6.839
  341   3HG2  THR  44          3HG2      THR  44  10.376 -11.167   6.410
  342    H    LEU  45           H        LEU  45   6.293  -8.054   6.741
  343    HA   LEU  45           HA       LEU  45   7.563  -6.111   4.975
  344   1HB   LEU  45          1HB       LEU  45   5.051  -7.505   5.120
  345   2HB   LEU  45          2HB       LEU  45   4.683  -5.811   5.103
  346    HG   LEU  45           HG       LEU  45   6.211  -5.606   3.104
  347   1HD1  LEU  45          1HD1      LEU  45   7.619  -7.595   3.402
  348   2HD1  LEU  45          2HD1      LEU  45   6.659  -7.850   1.932
  349   3HD1  LEU  45          3HD1      LEU  45   6.188  -8.625   3.449
  350   1HD2  LEU  45          1HD2      LEU  45   4.585  -6.642   1.528
  351   2HD2  LEU  45          2HD2      LEU  45   3.754  -5.792   2.837
  352   3HD2  LEU  45          3HD2      LEU  45   3.880  -7.566   2.853
  353    H    SER  46           H        SER  46   7.338  -3.901   4.774
  354    HA   SER  46           HA       SER  46   6.092  -2.394   6.956
  355   1HB   SER  46          1HB       SER  46   8.223  -0.875   6.578
  356   2HB   SER  46          2HB       SER  46   8.263  -2.240   7.694
  357    HG   SER  46           HG       SER  46   9.952  -1.792   5.685
  358    H    PHE  47           H        PHE  47   6.204   0.087   6.135
  359    HA   PHE  47           HA       PHE  47   5.514   0.181   3.272
  360   1HB   PHE  47          1HB       PHE  47   3.435   0.082   4.896
  361   2HB   PHE  47          2HB       PHE  47   3.890   1.723   5.295
  362    HD1  PHE  47           1HD      PHE  47   2.463  -0.520   2.749
  363    HD2  PHE  47           2HD      PHE  47   3.804   3.514   3.489
  364    HE1  PHE  47           1HE      PHE  47   1.314   0.241   0.713
  365    HE2  PHE  47           2HE      PHE  47   2.730   4.247   1.383
  366    HZ   PHE  47           HZ       PHE  47   1.495   2.614  -0.020
  367    H    VAL  48           H        VAL  48   5.765   2.244   2.363
  368    HA   VAL  48           HA       VAL  48   7.273   4.177   3.869
  369    HB   VAL  48           HB       VAL  48   8.256   2.347   1.753
  370   1HG1  VAL  48          1HG1      VAL  48   8.415   4.349   0.458
  371   2HG1  VAL  48          2HG1      VAL  48   9.264   5.184   1.792
  372   3HG1  VAL  48          3HG1      VAL  48  10.008   3.798   0.985
  373   1HG2  VAL  48          1HG2      VAL  48   9.088   2.237   4.071
  374   2HG2  VAL  48          2HG2      VAL  48  10.393   2.752   3.007
  375   3HG2  VAL  48          3HG2      VAL  48   9.550   3.943   4.011
  376    H    CYS  49           H        CYS  49   5.998   5.931   3.780
  377    HA   CYS  49           HA       CYS  49   3.822   6.263   1.981
  378   1HB   CYS  49          1HB       CYS  49   3.826   8.612   2.926
  379   2HB   CYS  49          2HB       CYS  49   3.699   7.303   4.078
  380    HA   PRO  50           HA       PRO  50   5.693   7.635  -1.668
  381   1HB   PRO  50          1HB       PRO  50   3.881   9.429  -2.775
  382   2HB   PRO  50          2HB       PRO  50   3.723   7.647  -2.779
  383   1HG   PRO  50          1HG       PRO  50   2.507   9.623  -0.825
  384   2HG   PRO  50          2HG       PRO  50   1.705   8.256  -1.665
  385   1HD   PRO  50          1HD       PRO  50   2.544   7.981   0.867
  386   2HD   PRO  50          2HD       PRO  50   2.803   6.658  -0.305
  387    H    TRP  51           H        TRP  51   4.771  10.180   0.586
  388    HA   TRP  51           HA       TRP  51   6.302  12.349  -0.453
  389   1HB   TRP  51          1HB       TRP  51   4.722  12.810   1.269
  390   2HB   TRP  51          2HB       TRP  51   5.353  11.541   2.313
  391    HD1  TRP  51           HD       TRP  51   6.665  14.877   0.830
  392    HE1  TRP  51           1HE      TRP  51   8.239  15.978   2.528
  393    HE3  TRP  51           3HE      TRP  51   6.445  11.365   4.563
  394    HZ2  TRP  51           2HZ      TRP  51   9.268  15.419   5.167
  395    HZ3  TRP  51           3HZ      TRP  51   7.723  11.690   6.655
  396    HH2  TRP  51           HH       TRP  51   9.143  13.700   6.965
  397    H    CYS  52           H        CYS  52   7.174   9.956   2.138
  398    HA   CYS  52           HA       CYS  52   9.899  10.888   2.246
  399   1HB   CYS  52          1HB       CYS  52  10.186   9.314   3.907
  400   2HB   CYS  52          2HB       CYS  52   8.469   9.643   3.983
  401    H    ALA  53           H        ALA  53   8.187   8.456   0.345
  402    HA   ALA  53           HA       ALA  53  10.473   7.055  -0.428
  403   1HB   ALA  53          1HB       ALA  53   8.136   6.226  -0.797
  404   2HB   ALA  53          2HB       ALA  53   7.880   7.497  -2.006
  405   3HB   ALA  53          3HB       ALA  53   9.054   6.226  -2.326
  406    H    THR  54           H        THR  54   8.694   9.773  -1.921
  407    HA   THR  54           HA       THR  54  10.340  10.191  -4.198
  408    HB   THR  54           HB       THR  54   8.654  12.215  -2.650
  409    HG1  THR  54           1HG      THR  54   7.318  10.555  -3.166
  410   1HG2  THR  54          1HG2      THR  54   8.380  13.301  -4.860
  411   2HG2  THR  54          2HG2      THR  54   9.498  12.125  -5.582
  412   3HG2  THR  54          3HG2      THR  54  10.080  13.285  -4.366
  413    H    ASN  55           H        ASN  55  10.433  11.571  -0.892
  414    HA   ASN  55           HA       ASN  55  12.629  13.367  -1.452
  415   1HB   ASN  55          1HB       ASN  55  11.389  12.348   1.139
  416   2HB   ASN  55          2HB       ASN  55  12.818  13.378   1.126
  417   1HD2  ASN  55          1HD2      ASN  55   9.381  13.272   0.015
  418   2HD2  ASN  55          2HD2      ASN  55   9.289  15.025  -0.115
  419    H    GLN  56           H        GLN  56  12.451  10.190   0.044
  420    HA   GLN  56           HA       GLN  56  13.915   8.704   0.856
  421   1HB   GLN  56          2HB       GLN  56  15.014   8.645  -1.340
  422   2HB   GLN  56          3HB       GLN  56  16.058   9.970  -0.837
  423   1HG   GLN  56          2HG       GLN  56  16.795   8.461   1.127
  424   2HG   GLN  56          3HG       GLN  56  15.982   7.148   0.281
  425   1HE2  GLN  56          1HE2      GLN  56  17.589   5.864  -0.799
  426   2HE2  GLN  56          2HE2      GLN  56  18.984   6.609  -1.577
  427   1H    GLY   1          1H        GLY   1  17.043  13.669  -0.512
  428   1HA   GLY   1          1HA       GLY   1  19.091  12.359  -0.857
  429   2HA   GLY   1          2HA       GLY   1  18.095  10.946  -0.448
  430    H    SER   2           H        SER   2  17.768   9.883  -2.390
  431    HA   SER   2           HA       SER   2  16.257  11.175  -4.505
  432   1HB   SER   2          1HB       SER   2  18.675  11.811  -4.951
  433   2HB   SER   2          2HB       SER   2  19.043  10.086  -5.129
  434    HG   SER   2           HG       SER   2  18.574  11.278  -7.103
  435    H    HIS   3           H        HIS   3  16.762   9.273  -6.431
  436    HA   HIS   3           HA       HIS   3  15.570   6.733  -5.592
  437   1HB   HIS   3          1HB       HIS   3  16.637   7.966  -8.103
  438   2HB   HIS   3          2HB       HIS   3  17.010   6.265  -7.932
  439    HD1  HIS   3           1HD      HIS   3  15.421   5.553  -9.888
  440    HD2  HIS   3           2HD      HIS   3  13.571   7.559  -6.678
  441    HE1  HIS   3           1HE      HIS   3  12.907   5.243 -10.189
  442    H    MET   4           H        MET   4  16.633   4.844  -5.039
  443    HA   MET   4           HA       MET   4  19.408   4.451  -5.609
  444   1HB   MET   4          1HB       MET   4  19.588   5.605  -3.439
  445   2HB   MET   4          2HB       MET   4  18.398   4.515  -2.729
  446   1HG   MET   4          1HG       MET   4  19.932   2.614  -3.041
  447   2HG   MET   4          2HG       MET   4  21.125   3.680  -3.791
  448   1HE   MET   4          1HE       MET   4  21.223   6.296  -1.953
  449   2HE   MET   4          2HE       MET   4  22.464   5.777  -0.796
  450   3HE   MET   4          3HE       MET   4  22.633   5.366  -2.517
  451    H    ALA   5           H        ALA   5  19.754   2.122  -5.632
  452    HA   ALA   5           HA       ALA   5  17.383   0.506  -5.875
  453   1HB   ALA   5          1HB       ALA   5  19.027  -1.228  -6.531
  454   2HB   ALA   5          2HB       ALA   5  19.236   0.275  -7.461
  455   3HB   ALA   5          3HB       ALA   5  20.353  -0.118  -6.128
  456    H    GLU   6           H        GLU   6  16.711   0.886  -3.502
  457    HA   GLU   6           HA       GLU   6  18.478  -0.269  -1.497
  458   1HB   GLU   6          1HB       GLU   6  15.668   0.848  -1.349
  459   2HB   GLU   6          2HB       GLU   6  16.708   0.492   0.041
  460   1HG   GLU   6          1HG       GLU   6  18.257   2.264  -0.573
  461   2HG   GLU   6          2HG       GLU   6  17.457   2.519  -2.108
  462    HA   PRO   7           HA       PRO   7  15.910  -4.118  -1.353
  463   1HB   PRO   7          1HB       PRO   7  16.587  -5.028   1.097
  464   2HB   PRO   7          2HB       PRO   7  17.781  -5.050  -0.237
  465   1HG   PRO   7          1HG       PRO   7  17.522  -3.034   2.010
  466   2HG   PRO   7          2HG       PRO   7  19.008  -3.814   1.383
  467   1HD   PRO   7          1HD       PRO   7  18.074  -1.291   0.624
  468   2HD   PRO   7          2HD       PRO   7  19.131  -2.303  -0.406
  469    H    GLN   8           H        GLN   8  13.928  -4.583  -0.313
  470    HA   GLN   8           HA       GLN   8  12.205  -4.528   1.027
  471   1HB   GLN   8          1HB       GLN   8  14.066  -3.715   2.795
  472   2HB   GLN   8          2HB       GLN   8  13.155  -2.224   2.715
  473   1HG   GLN   8          1HG       GLN   8  12.390  -3.626   4.560
  474   2HG   GLN   8          2HG       GLN   8  11.100  -3.523   3.368
  475   1HE2  GLN   8          1HE2      GLN   8  10.126  -5.508   3.061
  476   2HE2  GLN   8          2HE2      GLN   8  11.017  -7.062   3.036
  477    H    ARG   9           H        ARG   9  13.313  -1.129   0.692
  478    HA   ARG   9           HA       ARG   9  10.865   0.009   0.059
  479   1HB   ARG   9          1HB       ARG   9  13.255   0.994   0.748
  480   2HB   ARG   9          2HB       ARG   9  13.492   1.131  -0.960
  481   1HG   ARG   9          1HG       ARG   9  10.902   2.123  -0.159
  482   2HG   ARG   9          2HG       ARG   9  12.216   2.993   0.631
  483   1HD   ARG   9          1HD       ARG   9  12.174   2.523  -2.373
  484   2HD   ARG   9          2HD       ARG   9  11.242   3.824  -1.618
  485    HE   ARG   9           HE       ARG   9  14.095   3.644  -0.912
  486   1HH1  ARG   9          1HH1      ARG   9  11.603   5.352  -2.736
  487   2HH1  ARG   9          2HH1      ARG   9  12.414   6.881  -2.739
  488   1HH2  ARG   9          1HH2      ARG   9  15.426   5.404  -1.416
  489   2HH2  ARG   9          2HH2      ARG   9  14.851   6.793  -2.317
  490    H    HIS  10           H        HIS  10   9.783  -1.369  -1.550
  491    HA   HIS  10           HA       HIS  10  10.912  -1.088  -4.304
  492   1HB   HIS  10          1HB       HIS  10   9.200  -3.272  -3.122
  493   2HB   HIS  10          2HB       HIS  10   9.819  -3.204  -4.781
  494    HD1  HIS  10           1HD      HIS  10  10.414  -5.433  -2.409
  495    HD2  HIS  10           2HD      HIS  10  12.888  -2.280  -3.526
  496    HE1  HIS  10           1HE      HIS  10  12.727  -6.108  -1.718
  497    H    LYS  11           H        LYS  11   9.053  -1.340  -6.013
  498    HA   LYS  11           HA       LYS  11   7.032   0.733  -5.292
  499   1HB   LYS  11          1HB       LYS  11   9.263   0.812  -7.324
  500   2HB   LYS  11          2HB       LYS  11   7.853   1.868  -7.415
  501   1HG   LYS  11          1HG       LYS  11   8.465   3.132  -5.557
  502   2HG   LYS  11          2HG       LYS  11   9.377   1.820  -4.824
  503   1HD   LYS  11          1HD       LYS  11  10.868   3.619  -5.565
  504   2HD   LYS  11          2HD       LYS  11  11.201   2.057  -6.303
  505   1HE   LYS  11          1HE       LYS  11  11.261   3.123  -8.251
  506   2HE   LYS  11          2HE       LYS  11   9.499   3.128  -8.170
  507   1HZ   LYS  11          1HZ       LYS  11   9.922   5.312  -8.523
  508   2HZ   LYS  11          2HZ       LYS  11  11.330   5.381  -7.650
  509   3HZ   LYS  11          3HZ       LYS  11   9.795   5.338  -6.955
  510    H    ILE  12           H        ILE  12   5.261  -0.602  -5.618
  511    HA   ILE  12           HA       ILE  12   5.030  -2.045  -8.212
  512    HB   ILE  12           HB       ILE  12   2.925  -1.855  -6.030
  513   1HG1  ILE  12          1HG1      ILE  12   4.884  -4.148  -6.405
  514   2HG1  ILE  12          2HG1      ILE  12   5.019  -2.925  -5.137
  515   1HG2  ILE  12          1HG2      ILE  12   3.294  -3.782  -8.364
  516   2HG2  ILE  12          2HG2      ILE  12   1.935  -3.764  -7.215
  517   3HG2  ILE  12          3HG2      ILE  12   2.155  -2.423  -8.328
  518   1HD1  ILE  12          1HD1      ILE  12   2.720  -3.530  -4.339
  519   2HD1  ILE  12          2HD1      ILE  12   2.787  -4.940  -5.437
  520   3HD1  ILE  12          3HD1      ILE  12   3.957  -4.769  -4.119
  521    H    LEU  13           H        LEU  13   4.757  -0.459  -9.797
  522    HA   LEU  13           HA       LEU  13   3.167   1.887  -9.375
  523   1HB   LEU  13          1HB       LEU  13   4.965   1.725 -11.066
  524   2HB   LEU  13          2HB       LEU  13   3.964   0.632 -12.029
  525    HG   LEU  13           HG       LEU  13   2.767   3.273 -11.115
  526   1HD1  LEU  13          1HD1      LEU  13   4.944   3.943 -11.849
  527   2HD1  LEU  13          2HD1      LEU  13   3.746   4.401 -13.093
  528   3HD1  LEU  13          3HD1      LEU  13   4.795   2.990 -13.345
  529   1HD2  LEU  13          1HD2      LEU  13   2.528   1.715 -13.732
  530   2HD2  LEU  13          2HD2      LEU  13   1.665   3.216 -13.329
  531   3HD2  LEU  13          3HD2      LEU  13   1.324   1.746 -12.432
  532    H    CYS  14           H        CYS  14   1.121   1.830  -9.040
  533    HA   CYS  14           HA       CYS  14  -0.652  -0.064 -10.488
  534   1HB   CYS  14          1HB       CYS  14  -0.366  -0.493  -7.998
  535   2HB   CYS  14          2HB       CYS  14  -1.055   1.110  -7.693
  536    HG   CYS  14           HG       CYS  14  -3.420   0.667  -8.297
  537    H    VAL  15           H        VAL  15  -3.023   1.124 -10.166
  538    HA   VAL  15           HA       VAL  15  -2.692   4.045 -10.393
  539    HB   VAL  15           HB       VAL  15  -4.869   4.132 -11.581
  540   1HG1  VAL  15          1HG1      VAL  15  -3.959   3.638 -13.788
  541   2HG1  VAL  15          2HG1      VAL  15  -2.734   4.410 -12.770
  542   3HG1  VAL  15          3HG1      VAL  15  -2.660   2.657 -13.071
  543   1HG2  VAL  15          1HG2      VAL  15  -4.483   1.140 -12.055
  544   2HG2  VAL  15          2HG2      VAL  15  -5.735   1.870 -11.017
  545   3HG2  VAL  15          3HG2      VAL  15  -5.734   2.183 -12.756
  546    H    CYS  16           H        CYS  16  -4.351   5.227  -9.319
  547    HA   CYS  16           HA       CYS  16  -5.363   4.046  -6.862
  548   1HB   CYS  16          1HB       CYS  16  -4.870   6.567  -7.241
  549   2HB   CYS  16          2HB       CYS  16  -6.357   6.592  -8.206
  550    H    CYS  17           H        CYS  17  -7.182   2.907  -6.653
  551    HA   CYS  17           HA       CYS  17  -8.576   1.826  -8.784
  552   1HB   CYS  17          1HB       CYS  17  -8.503   1.130  -6.289
  553   2HB   CYS  17          2HB       CYS  17  -9.869   2.231  -6.058
  554    HG   CYS  17           HG       CYS  17 -10.770  -0.127  -6.181
  555    H    LYS  18           H        LYS  18  -9.391   4.837  -7.062
  556    HA   LYS  18           HA       LYS  18 -11.894   5.075  -8.644
  557   1HB   LYS  18          1HB       LYS  18 -12.569   6.668  -6.967
  558   2HB   LYS  18          2HB       LYS  18 -12.158   5.122  -6.221
  559   1HG   LYS  18          1HG       LYS  18 -10.059   5.997  -5.357
  560   2HG   LYS  18          2HG       LYS  18 -10.181   7.443  -6.342
  561   1HD   LYS  18          1HD       LYS  18 -11.105   8.489  -4.666
  562   2HD   LYS  18          2HD       LYS  18 -12.568   7.552  -4.895
  563   1HE   LYS  18          1HE       LYS  18 -11.786   5.863  -3.277
  564   2HE   LYS  18          2HE       LYS  18 -10.222   6.688  -3.157
  565   1HZ   LYS  18          1HZ       LYS  18 -12.823   7.693  -2.244
  566   2HZ   LYS  18          2HZ       LYS  18 -11.572   8.703  -2.482
  567   3HZ   LYS  18          3HZ       LYS  18 -11.422   7.516  -1.355
  568    H    CYS  19           H        CYS  19  -8.694   6.543  -8.404
  569    HA   CYS  19           HA       CYS  19  -9.605   9.003  -9.747
  570   1HB   CYS  19          1HB       CYS  19  -6.832   8.431  -9.142
  571   2HB   CYS  19          2HB       CYS  19  -7.645   9.952  -9.272
  572    H    ASP  20           H        ASP  20  -8.296   5.851 -10.451
  573    HA   ASP  20           HA       ASP  20  -7.117   4.913 -12.038
  574   1HB   ASP  20          1HB       ASP  20  -9.251   5.292 -13.205
  575   2HB   ASP  20          2HB       ASP  20  -8.602   6.788 -13.874
  576    H    GLY  21           H        GLY  21  -5.791   6.855 -10.627
  577   1HA   GLY  21          1HA       GLY  21  -4.027   8.254 -12.612
  578   2HA   GLY  21          2HA       GLY  21  -4.298   8.809 -10.959
  579    H    ARG  22           H        ARG  22  -1.838   8.133 -12.288
  580    HA   ARG  22           HA       ARG  22  -0.808   5.541 -11.699
  581   1HB   ARG  22          1HB       ARG  22   0.093   7.005 -13.419
  582   2HB   ARG  22          2HB       ARG  22   0.541   8.235 -12.247
  583   1HG   ARG  22          1HG       ARG  22   1.737   5.452 -12.076
  584   2HG   ARG  22          2HG       ARG  22   2.309   6.608 -13.279
  585   1HD   ARG  22          1HD       ARG  22   2.750   8.255 -11.382
  586   2HD   ARG  22          2HD       ARG  22   2.452   6.913 -10.262
  587    HE   ARG  22           HE       ARG  22   4.305   6.055 -12.204
  588   1HH1  ARG  22          1HH1      ARG  22   4.275   8.412  -9.554
  589   2HH1  ARG  22          2HH1      ARG  22   5.918   8.074  -9.080
  590   1HH2  ARG  22          1HH2      ARG  22   6.513   5.682 -11.586
  591   2HH2  ARG  22          2HH2      ARG  22   7.061   6.281 -10.051
  592    H    ILE  23           H        ILE  23  -0.422   4.685  -9.698
  593    HA   ILE  23           HA       ILE  23   0.758   6.550  -7.732
  594    HB   ILE  23           HB       ILE  23  -0.691   4.045  -6.861
  595   1HG1  ILE  23          1HG1      ILE  23  -1.872   6.834  -6.562
  596   2HG1  ILE  23          2HG1      ILE  23  -2.407   5.660  -7.769
  597   1HG2  ILE  23          1HG2      ILE  23  -0.321   5.158  -4.620
  598   2HG2  ILE  23          2HG2      ILE  23   1.195   5.077  -5.477
  599   3HG2  ILE  23          3HG2      ILE  23   0.303   6.600  -5.444
  600   1HD1  ILE  23          1HD1      ILE  23  -2.426   5.126  -4.766
  601   2HD1  ILE  23          2HD1      ILE  23  -3.815   5.574  -5.707
  602   3HD1  ILE  23          3HD1      ILE  23  -3.005   4.031  -6.039
  603    H    GLU  24           H        GLU  24   2.800   6.066  -7.418
  604    HA   GLU  24           HA       GLU  24   3.998   3.454  -8.037
  605   1HB   GLU  24          1HB       GLU  24   5.121   5.511  -8.563
  606   2HB   GLU  24          2HB       GLU  24   5.009   6.101  -6.905
  607   1HG   GLU  24          1HG       GLU  24   6.470   4.178  -6.215
  608   2HG   GLU  24          2HG       GLU  24   6.557   3.682  -7.917
  609    H    LEU  25           H        LEU  25   3.027   1.949  -6.577
  610    HA   LEU  25           HA       LEU  25   2.493   2.733  -3.827
  611   1HB   LEU  25          1HB       LEU  25   2.549  -0.097  -4.901
  612   2HB   LEU  25          2HB       LEU  25   1.806   0.485  -3.432
  613    HG   LEU  25           HG       LEU  25   0.876   1.091  -6.275
  614   1HD1  LEU  25          1HD1      LEU  25  -0.312  -0.601  -4.024
  615   2HD1  LEU  25          2HD1      LEU  25   0.414  -1.216  -5.523
  616   3HD1  LEU  25          3HD1      LEU  25  -1.084  -0.278  -5.587
  617   1HD2  LEU  25          1HD2      LEU  25   0.460   2.996  -4.862
  618   2HD2  LEU  25          2HD2      LEU  25  -0.211   1.983  -3.586
  619   3HD2  LEU  25          3HD2      LEU  25  -1.065   2.159  -5.150
  620    H    THR  26           H        THR  26   4.412   3.375  -2.910
  621    HA   THR  26           HA       THR  26   6.747   1.663  -3.171
  622    HB   THR  26           HB       THR  26   6.574   4.101  -1.410
  623    HG1  THR  26           1HG      THR  26   6.058   4.357  -3.771
  624   1HG2  THR  26          1HG2      THR  26   8.851   2.609  -2.831
  625   2HG2  THR  26          2HG2      THR  26   8.514   2.520  -1.099
  626   3HG2  THR  26          3HG2      THR  26   9.036   4.049  -1.833
  627    H    VAL  27           H        VAL  27   6.408  -0.267  -2.201
  628    HA   VAL  27           HA       VAL  27   5.373  -0.325   0.595
  629    HB   VAL  27           HB       VAL  27   4.288  -2.523   0.134
  630   1HG1  VAL  27          1HG1      VAL  27   3.580  -0.726  -2.214
  631   2HG1  VAL  27          2HG1      VAL  27   2.555  -1.851  -1.312
  632   3HG1  VAL  27          3HG1      VAL  27   3.142  -0.360  -0.545
  633   1HG2  VAL  27          1HG2      VAL  27   5.419  -2.201  -2.732
  634   2HG2  VAL  27          2HG2      VAL  27   5.945  -3.418  -1.560
  635   3HG2  VAL  27          3HG2      VAL  27   4.295  -3.453  -2.184
  636    H    GLU  28           H        GLU  28   6.756  -1.334   2.069
  637    HA   GLU  28           HA       GLU  28   9.501  -1.606   0.964
  638   1HB   GLU  28          1HB       GLU  28   8.607   0.201   2.686
  639   2HB   GLU  28          2HB       GLU  28   8.807  -1.087   3.815
  640   1HG   GLU  28          1HG       GLU  28  11.211  -1.208   2.589
  641   2HG   GLU  28          2HG       GLU  28  10.828   0.469   2.282
  642    H    SER  29           H        SER  29   9.065  -3.647   0.141
  643    HA   SER  29           HA       SER  29   8.280  -5.831   1.980
  644   1HB   SER  29          1HB       SER  29   7.114  -5.090  -0.717
  645   2HB   SER  29          2HB       SER  29   6.584  -6.361   0.376
  646    HG   SER  29           HG       SER  29   6.405  -4.241   1.820
  647    H    SER  30           H        SER  30   9.474  -7.580   1.535
  648    HA   SER  30           HA       SER  30  11.777  -7.488  -0.103
  649   1HB   SER  30          1HB       SER  30  10.356 -10.030   0.799
  650   2HB   SER  30          2HB       SER  30  12.086  -9.780   0.583
  651    HG   SER  30           HG       SER  30  11.423  -9.660   2.821
  652    H    ALA  31           H        ALA  31  12.232  -8.603  -2.181
  653    HA   ALA  31           HA       ALA  31  10.408  -7.910  -4.015
  654   1HB   ALA  31          1HB       ALA  31  12.424 -10.191  -4.342
  655   2HB   ALA  31          2HB       ALA  31  11.672  -9.282  -5.667
  656   3HB   ALA  31          3HB       ALA  31  12.774  -8.452  -4.544
  657    H    GLU  32           H        GLU  32  10.383 -11.219  -2.594
  658    HA   GLU  32           HA       GLU  32   8.288 -11.798  -4.502
  659   1HB   GLU  32          1HB       GLU  32  10.422 -13.299  -3.969
  660   2HB   GLU  32          2HB       GLU  32   9.225 -14.041  -2.865
  661   1HG   GLU  32          1HG       GLU  32   7.631 -14.242  -4.760
  662   2HG   GLU  32          2HG       GLU  32   8.746 -13.387  -5.819
  663    H    ASP  33           H        ASP  33   8.596 -10.843  -1.364
  664    HA   ASP  33           HA       ASP  33   6.076 -11.790  -0.337
  665   1HB   ASP  33          1HB       ASP  33   8.351 -11.007   0.813
  666   2HB   ASP  33          2HB       ASP  33   7.648  -9.402   0.645
  667    H    LEU  34           H        LEU  34   7.561  -9.050  -1.991
  668    HA   LEU  34           HA       LEU  34   5.252  -7.327  -2.344
  669   1HB   LEU  34          1HB       LEU  34   7.295  -6.310  -2.608
  670   2HB   LEU  34          2HB       LEU  34   7.975  -7.557  -3.613
  671    HG   LEU  34           HG       LEU  34   5.620  -6.017  -4.716
  672   1HD1  LEU  34          1HD1      LEU  34   7.079  -4.281  -3.750
  673   2HD1  LEU  34          2HD1      LEU  34   7.176  -4.246  -5.519
  674   3HD1  LEU  34          3HD1      LEU  34   8.476  -5.015  -4.582
  675   1HD2  LEU  34          1HD2      LEU  34   8.180  -7.114  -5.974
  676   2HD2  LEU  34          2HD2      LEU  34   6.944  -6.178  -6.839
  677   3HD2  LEU  34          3HD2      LEU  34   6.544  -7.757  -6.191
  678    H    ARG  35           H        ARG  35   6.791  -9.761  -4.250
  679    HA   ARG  35           HA       ARG  35   4.992  -9.854  -6.462
  680   1HB   ARG  35          1HB       ARG  35   7.196 -11.108  -6.317
  681   2HB   ARG  35          2HB       ARG  35   6.360 -12.329  -5.350
  682   1HG   ARG  35          1HG       ARG  35   4.762 -12.708  -7.214
  683   2HG   ARG  35          2HG       ARG  35   5.664 -11.539  -8.201
  684   1HD   ARG  35          1HD       ARG  35   7.698 -12.999  -7.982
  685   2HD   ARG  35          2HD       ARG  35   6.730 -14.151  -7.027
  686    HE   ARG  35           HE       ARG  35   5.493 -13.556  -9.531
  687   1HH1  ARG  35          1HH1      ARG  35   8.084 -15.657  -8.064
  688   2HH1  ARG  35          2HH1      ARG  35   8.017 -16.772  -9.360
  689   1HH2  ARG  35          1HH2      ARG  35   5.438 -15.101 -11.161
  690   2HH2  ARG  35          2HH2      ARG  35   6.485 -16.479 -11.138
  691    H    THR  36           H        THR  36   4.981 -11.830  -3.474
  692    HA   THR  36           HA       THR  36   2.560 -13.170  -3.956
  693    HB   THR  36           HB       THR  36   3.703 -12.283  -1.261
  694    HG1  THR  36           1HG      THR  36   5.214 -13.493  -2.394
  695   1HG2  THR  36          1HG2      THR  36   1.804 -14.570  -1.952
  696   2HG2  THR  36          2HG2      THR  36   1.381 -13.111  -1.023
  697   3HG2  THR  36          3HG2      THR  36   2.544 -14.273  -0.364
  698    H    LEU  37           H        LEU  37   3.001 -10.023  -2.163
  699    HA   LEU  37           HA       LEU  37   0.207  -9.682  -1.939
  700   1HB   LEU  37          1HB       LEU  37   0.625  -7.957  -0.660
  701   2HB   LEU  37          2HB       LEU  37   2.221  -8.606  -0.688
  702    HG   LEU  37           HG       LEU  37   2.390  -6.871  -2.837
  703   1HD1  LEU  37          1HD1      LEU  37   1.241  -4.744  -2.178
  704   2HD1  LEU  37          2HD1      LEU  37   0.518  -5.542  -0.782
  705   3HD1  LEU  37          3HD1      LEU  37   0.034  -6.017  -2.403
  706   1HD2  LEU  37          1HD2      LEU  37   3.707  -5.498  -1.407
  707   2HD2  LEU  37          2HD2      LEU  37   3.874  -7.146  -0.770
  708   3HD2  LEU  37          3HD2      LEU  37   2.804  -5.994   0.034
  709    H    GLN  38           H        GLN  38   2.382  -8.925  -4.663
  710    HA   GLN  38           HA       GLN  38   0.517  -7.336  -6.158
  711   1HB   GLN  38          1HB       GLN  38   2.832  -7.242  -6.708
  712   2HB   GLN  38          2HB       GLN  38   2.955  -8.973  -6.833
  713   1HG   GLN  38          1HG       GLN  38   1.275  -8.706  -8.871
  714   2HG   GLN  38          2HG       GLN  38   1.883  -7.049  -8.857
  715   1HE2  GLN  38          1HE2      GLN  38   4.420  -6.916  -8.763
  716   2HE2  GLN  38          2HE2      GLN  38   5.285  -8.200  -9.596
  717    H    GLN  39           H        GLN  39   1.006 -10.903  -5.688
  718    HA   GLN  39           HA       GLN  39  -0.842 -11.627  -7.749
  719   1HB   GLN  39          1HB       GLN  39  -0.254 -13.300  -5.316
  720   2HB   GLN  39          2HB       GLN  39  -0.923 -13.790  -6.860
  721   1HG   GLN  39          1HG       GLN  39   1.904 -13.134  -6.160
  722   2HG   GLN  39          2HG       GLN  39   1.264 -14.544  -6.959
  723   1HE2  GLN  39          1HE2      GLN  39   2.610 -11.444  -7.348
  724   2HE2  GLN  39          2HE2      GLN  39   2.619 -11.299  -9.097
  725    H    LEU  40           H        LEU  40  -1.162 -10.854  -4.233
  726    HA   LEU  40           HA       LEU  40  -3.994 -11.210  -4.085
  727   1HB   LEU  40          1HB       LEU  40  -2.563  -8.933  -2.724
  728   2HB   LEU  40          2HB       LEU  40  -4.061  -9.703  -2.295
  729    HG   LEU  40           HG       LEU  40  -1.354 -11.061  -2.148
  730   1HD1  LEU  40          1HD1      LEU  40  -3.046  -9.912   0.099
  731   2HD1  LEU  40          2HD1      LEU  40  -1.588  -9.153  -0.559
  732   3HD1  LEU  40          3HD1      LEU  40  -1.475 -10.722   0.262
  733   1HD2  LEU  40          1HD2      LEU  40  -2.455 -12.757  -0.785
  734   2HD2  LEU  40          2HD2      LEU  40  -3.150 -12.698  -2.416
  735   3HD2  LEU  40          3HD2      LEU  40  -4.023 -11.972  -1.045
  736    H    PHE  41           H        PHE  41  -2.103  -8.406  -5.332
  737    HA   PHE  41           HA       PHE  41  -4.442  -6.802  -5.928
  738   1HB   PHE  41          1HB       PHE  41  -1.561  -6.708  -6.759
  739   2HB   PHE  41          2HB       PHE  41  -2.734  -5.873  -7.752
  740    HD1  PHE  41           1HD      PHE  41  -3.273  -3.664  -7.264
  741    HD2  PHE  41           2HD      PHE  41  -1.845  -6.215  -4.094
  742    HE1  PHE  41           1HE      PHE  41  -3.300  -1.756  -5.707
  743    HE2  PHE  41           2HE      PHE  41  -1.891  -4.302  -2.529
  744    HZ   PHE  41           HZ       PHE  41  -2.651  -2.084  -3.313
  745    H    LEU  42           H        LEU  42  -2.594  -9.108  -7.908
  746    HA   LEU  42           HA       LEU  42  -4.225  -8.868 -10.252
  747   1HB   LEU  42          1HB       LEU  42  -2.390 -10.984  -9.104
  748   2HB   LEU  42          2HB       LEU  42  -3.220 -11.258 -10.626
  749    HG   LEU  42           HG       LEU  42  -1.454  -8.813 -10.170
  750   1HD1  LEU  42          1HD1      LEU  42  -0.071 -10.798  -9.814
  751   2HD1  LEU  42          2HD1      LEU  42   0.341 -10.040 -11.355
  752   3HD1  LEU  42          3HD1      LEU  42  -0.652 -11.516 -11.329
  753   1HD2  LEU  42          1HD2      LEU  42  -1.330  -8.797 -12.643
  754   2HD2  LEU  42          2HD2      LEU  42  -3.002  -8.647 -12.093
  755   3HD2  LEU  42          3HD2      LEU  42  -2.414 -10.203 -12.715
  756    H    SER  43           H        SER  43  -4.678 -10.740  -7.266
  757    HA   SER  43           HA       SER  43  -6.835 -12.356  -8.261
  758   1HB   SER  43          1HB       SER  43  -5.439 -13.218  -6.537
  759   2HB   SER  43          2HB       SER  43  -5.564 -11.754  -5.571
  760    HG   SER  43           HG       SER  43  -7.444 -12.257  -4.825
  761    H    THR  44           H        THR  44  -6.731  -9.892  -5.699
  762    HA   THR  44           HA       THR  44  -9.551  -9.330  -6.025
  763    HB   THR  44           HB       THR  44  -9.030  -9.474  -3.276
  764    HG1  THR  44           1HG      THR  44  -7.521 -10.871  -2.810
  765   1HG2  THR  44          1HG2      THR  44 -10.899 -10.455  -4.479
  766   2HG2  THR  44          2HG2      THR  44 -10.115 -11.666  -3.425
  767   3HG2  THR  44          3HG2      THR  44  -9.822 -11.687  -5.189
  768    H    LEU  45           H        LEU  45  -6.545  -8.061  -5.316
  769    HA   LEU  45           HA       LEU  45  -7.599  -5.858  -3.667
  770   1HB   LEU  45          1HB       LEU  45  -5.194  -7.456  -3.701
  771   2HB   LEU  45          2HB       LEU  45  -4.717  -5.790  -3.839
  772    HG   LEU  45           HG       LEU  45  -6.174  -5.297  -1.860
  773   1HD1  LEU  45          1HD1      LEU  45  -7.762  -7.146  -1.920
  774   2HD1  LEU  45          2HD1      LEU  45  -6.758  -7.404  -0.473
  775   3HD1  LEU  45          3HD1      LEU  45  -6.443  -8.312  -1.961
  776   1HD2  LEU  45          1HD2      LEU  45  -4.628  -6.304  -0.210
  777   2HD2  LEU  45          2HD2      LEU  45  -3.742  -5.662  -1.598
  778   3HD2  LEU  45          3HD2      LEU  45  -4.013  -7.416  -1.439
  779    H    SER  46           H        SER  46  -7.093  -3.668  -3.676
  780    HA   SER  46           HA       SER  46  -5.842  -2.508  -6.056
  781   1HB   SER  46          1HB       SER  46  -7.879  -0.840  -5.843
  782   2HB   SER  46          2HB       SER  46  -8.027  -2.338  -6.764
  783    HG   SER  46           HG       SER  46  -9.627  -1.525  -4.804
  784    H    PHE  47           H        PHE  47  -5.834   0.077  -5.517
  785    HA   PHE  47           HA       PHE  47  -5.137   0.458  -2.682
  786   1HB   PHE  47          1HB       PHE  47  -3.061  -0.045  -4.165
  787   2HB   PHE  47          2HB       PHE  47  -3.345   1.533  -4.867
  788    HD1  PHE  47           1HD      PHE  47  -2.095  -0.348  -1.978
  789    HD2  PHE  47           2HD      PHE  47  -3.175   3.592  -3.356
  790    HE1  PHE  47           1HE      PHE  47  -0.818   0.660  -0.127
  791    HE2  PHE  47           2HE      PHE  47  -1.959   4.586  -1.438
  792    HZ   PHE  47           HZ       PHE  47  -0.793   3.128   0.186
  793    H    VAL  48           H        VAL  48  -5.183   2.634  -2.045
  794    HA   VAL  48           HA       VAL  48  -6.607   4.477  -3.733
  795    HB   VAL  48           HB       VAL  48  -7.655   2.939  -1.413
  796   1HG1  VAL  48          1HG1      VAL  48  -7.724   5.187  -0.442
  797   2HG1  VAL  48          2HG1      VAL  48  -8.710   5.725  -1.832
  798   3HG1  VAL  48          3HG1      VAL  48  -9.309   4.465  -0.747
  799   1HG2  VAL  48          1HG2      VAL  48  -8.508   2.563  -3.696
  800   2HG2  VAL  48          2HG2      VAL  48  -9.785   3.257  -2.700
  801   3HG2  VAL  48          3HG2      VAL  48  -8.917   4.280  -3.858
  802    H    CYS  49           H        CYS  49  -5.251   6.163  -3.783
  803    HA   CYS  49           HA       CYS  49  -2.969   6.452  -2.082
  804   1HB   CYS  49          1HB       CYS  49  -2.853   8.732  -3.193
  805   2HB   CYS  49          2HB       CYS  49  -2.827   7.341  -4.248
  806    HA   PRO  50           HA       PRO  50  -4.604   8.221   1.513
  807   1HB   PRO  50          1HB       PRO  50  -2.693  10.071   2.359
  808   2HB   PRO  50          2HB       PRO  50  -2.634   8.298   2.583
  809   1HG   PRO  50          1HG       PRO  50  -1.353   9.951   0.392
  810   2HG   PRO  50          2HG       PRO  50  -0.624   8.626   1.356
  811   1HD   PRO  50          1HD       PRO  50  -1.540   8.148  -1.117
  812   2HD   PRO  50          2HD       PRO  50  -1.864   6.976   0.191
  813    H    TRP  51           H        TRP  51  -3.689  10.536  -0.969
  814    HA   TRP  51           HA       TRP  51  -5.116  12.836  -0.097
  815   1HB   TRP  51          1HB       TRP  51  -3.557  13.086  -1.877
  816   2HB   TRP  51          2HB       TRP  51  -4.259  11.757  -2.797
  817    HD1  TRP  51           HD       TRP  51  -6.169  14.777  -1.331
  818    HE1  TRP  51           1HE      TRP  51  -7.588  15.805  -3.133
  819    HE3  TRP  51           3HE      TRP  51  -4.415  12.068  -5.316
  820    HZ2  TRP  51           2HZ      TRP  51  -7.807  15.640  -6.056
  821    HZ3  TRP  51           3HZ      TRP  51  -5.258  12.529  -7.598
  822    HH2  TRP  51           HH       TRP  51  -6.950  14.305  -7.980
  823    H    CYS  52           H        CYS  52  -6.182  10.324  -2.532
  824    HA   CYS  52           HA       CYS  52  -8.896  11.268  -2.441
  825   1HB   CYS  52          1HB       CYS  52  -9.402   9.570  -3.920
  826   2HB   CYS  52          2HB       CYS  52  -7.731   9.954  -4.259
  827    H    ALA  53           H        ALA  53  -7.050   8.866  -0.578
  828    HA   ALA  53           HA       ALA  53  -9.224   7.551   0.453
  829   1HB   ALA  53          1HB       ALA  53  -6.833   6.878   0.892
  830   2HB   ALA  53          2HB       ALA  53  -6.677   8.268   1.996
  831   3HB   ALA  53          3HB       ALA  53  -7.779   6.972   2.407
  832    H    THR  54           H        THR  54  -7.666  10.559   1.454
  833    HA   THR  54           HA       THR  54  -9.405  11.190   3.671
  834    HB   THR  54           HB       THR  54  -7.520  12.974   2.059
  835    HG1  THR  54           1HG      THR  54  -6.281  11.314   2.760
  836   1HG2  THR  54          1HG2      THR  54  -7.308  14.229   4.174
  837   2HG2  THR  54          2HG2      THR  54  -8.493  13.156   4.945
  838   3HG2  THR  54          3HG2      THR  54  -8.990  14.227   3.616
  839    H    ASN  55           H        ASN  55  -9.189  12.279   0.227
  840    HA   ASN  55           HA       ASN  55 -11.230  14.331   0.578
  841   1HB   ASN  55          1HB       ASN  55  -9.776  13.233  -1.875
  842   2HB   ASN  55          2HB       ASN  55 -11.020  14.469  -1.978
  843   1HD2  ASN  55          1HD2      ASN  55  -8.760  14.295   0.717
  844   2HD2  ASN  55          2HD2      ASN  55  -7.956  15.800   0.355
  845    H    GLN  56           H        GLN  56 -11.320  11.120  -0.211
  846    HA   GLN  56           HA       GLN  56 -12.881   9.561  -0.733
  847   1HB   GLN  56          2HB       GLN  56 -14.600  10.849   0.549
  848   2HB   GLN  56          3HB       GLN  56 -15.002  11.692  -0.950
  849   1HG   GLN  56          2HG       GLN  56 -16.488  10.060  -1.350
  850   2HG   GLN  56          3HG       GLN  56 -15.131   9.016  -1.743
  851   1HE2  GLN  56          1HE2      GLN  56 -17.906   9.083   0.040
  852   2HE2  GLN  56          2HE2      GLN  56 -17.458   7.961   1.310
  Start of MODEL   14
    1   1H    GLY   1          1H        GLY   1 -19.922  14.588  10.992
    2   1HA   GLY   1          1HA       GLY   1 -17.519  14.503  11.105
    3   2HA   GLY   1          2HA       GLY   1 -17.690  12.876  11.813
    4    H    SER   2           H        SER   2 -16.636  11.852   9.968
    5    HA   SER   2           HA       SER   2 -17.884  11.963   7.348
    6   1HB   SER   2          1HB       SER   2 -15.517  11.230   7.735
    7   2HB   SER   2          2HB       SER   2 -16.134   9.787   8.572
    8    HG   SER   2           HG       SER   2 -15.671   9.508   6.287
    9    H    HIS   3           H        HIS   3 -18.871   9.961   6.483
   10    HA   HIS   3           HA       HIS   3 -20.487   8.269   8.229
   11   1HB   HIS   3          1HB       HIS   3 -22.641   9.094   7.274
   12   2HB   HIS   3          2HB       HIS   3 -21.837  10.272   8.302
   13    HD1  HIS   3           1HD      HIS   3 -22.040   9.525   4.536
   14    HD2  HIS   3           2HD      HIS   3 -21.523  12.674   7.268
   15    HE1  HIS   3           1HE      HIS   3 -21.997  11.727   3.146
   16    H    MET   4           H        MET   4 -18.402   7.634   6.505
   17    HA   MET   4           HA       MET   4 -19.711   6.365   4.170
   18   1HB   MET   4          1HB       MET   4 -18.528   8.511   3.555
   19   2HB   MET   4          2HB       MET   4 -17.008   7.796   4.133
   20   1HG   MET   4          1HG       MET   4 -17.203   6.001   2.495
   21   2HG   MET   4          2HG       MET   4 -18.824   6.549   2.051
   22   1HE   MET   4          1HE       MET   4 -17.383   7.206  -1.279
   23   2HE   MET   4          2HE       MET   4 -17.019   5.823  -0.222
   24   3HE   MET   4          3HE       MET   4 -18.656   6.500  -0.267
   25    H    ALA   5           H        ALA   5 -19.142   4.262   3.950
   26    HA   ALA   5           HA       ALA   5 -16.961   2.930   5.240
   27   1HB   ALA   5          1HB       ALA   5 -19.725   2.823   6.519
   28   2HB   ALA   5          2HB       ALA   5 -18.404   1.689   6.872
   29   3HB   ALA   5          3HB       ALA   5 -18.230   3.425   7.282
   30    H    GLU   6           H        GLU   6 -16.755   1.658   3.285
   31    HA   GLU   6           HA       GLU   6 -19.063  -0.077   2.662
   32   1HB   GLU   6          1HB       GLU   6 -17.430   1.529   0.636
   33   2HB   GLU   6          2HB       GLU   6 -18.718   0.404   0.272
   34   1HG   GLU   6          1HG       GLU   6 -19.893   2.384   0.172
   35   2HG   GLU   6          2HG       GLU   6 -20.249   1.881   1.781
   36    HA   PRO   7           HA       PRO   7 -15.817  -3.089   2.325
   37   1HB   PRO   7          1HB       PRO   7 -16.560  -4.740   0.259
   38   2HB   PRO   7          2HB       PRO   7 -17.373  -4.708   1.848
   39   1HG   PRO   7          1HG       PRO   7 -18.186  -3.234  -0.677
   40   2HG   PRO   7          2HG       PRO   7 -19.208  -4.269   0.375
   41   1HD   PRO   7          1HD       PRO   7 -19.211  -1.590   0.649
   42   2HD   PRO   7          2HD       PRO   7 -19.246  -2.631   2.094
   43    H    GLN   8           H        GLN   8 -14.259  -4.098   0.492
   44    HA   GLN   8           HA       GLN   8 -12.489  -3.778  -0.601
   45   1HB   GLN   8          1HB       GLN   8 -14.542  -2.455  -2.253
   46   2HB   GLN   8          2HB       GLN   8 -12.856  -2.092  -2.638
   47   1HG   GLN   8          1HG       GLN   8 -13.757  -3.956  -3.967
   48   2HG   GLN   8          2HG       GLN   8 -12.335  -4.384  -3.025
   49   1HE2  GLN   8          1HE2      GLN   8 -12.576  -6.531  -2.484
   50   2HE2  GLN   8          2HE2      GLN   8 -13.984  -7.231  -1.752
   51    H    ARG   9           H        ARG   9 -13.654  -0.415  -0.677
   52    HA   ARG   9           HA       ARG   9 -11.193   0.844  -0.234
   53   1HB   ARG   9          1HB       ARG   9 -13.449   1.775  -1.068
   54   2HB   ARG   9          2HB       ARG   9 -13.887   1.950   0.611
   55   1HG   ARG   9          1HG       ARG   9 -11.307   3.142   0.092
   56   2HG   ARG   9          2HG       ARG   9 -12.548   3.798  -0.980
   57   1HD   ARG   9          1HD       ARG   9 -13.945   4.108   1.223
   58   2HD   ARG   9          2HD       ARG   9 -12.414   3.848   2.055
   59    HE   ARG   9           HE       ARG   9 -11.747   5.978   1.471
   60   1HH1  ARG   9          1HH1      ARG   9 -14.554   5.157  -0.515
   61   2HH1  ARG   9          2HH1      ARG   9 -14.650   6.699  -1.317
   62   1HH2  ARG   9          1HH2      ARG   9 -11.981   8.120   0.614
   63   2HH2  ARG   9          2HH2      ARG   9 -13.159   8.405  -0.617
   64    H    HIS  10           H        HIS  10 -10.058  -0.308   1.451
   65    HA   HIS  10           HA       HIS  10 -11.013   0.206   4.224
   66   1HB   HIS  10          1HB       HIS  10  -9.399  -2.073   3.037
   67   2HB   HIS  10          2HB       HIS  10  -9.811  -1.876   4.747
   68    HD1  HIS  10           1HD      HIS  10 -10.733  -4.383   2.753
   69    HD2  HIS  10           2HD      HIS  10 -13.027  -1.059   3.796
   70    HE1  HIS  10           1HE      HIS  10 -13.094  -5.167   2.772
   71    H    LYS  11           H        LYS  11  -9.087   0.075   5.825
   72    HA   LYS  11           HA       LYS  11  -6.822   1.678   4.787
   73   1HB   LYS  11          1HB       LYS  11  -8.840   2.585   6.871
   74   2HB   LYS  11          2HB       LYS  11  -7.238   3.268   6.661
   75   1HG   LYS  11          1HG       LYS  11  -8.200   4.725   5.232
   76   2HG   LYS  11          2HG       LYS  11  -8.075   3.422   4.092
   77   1HD   LYS  11          1HD       LYS  11 -10.275   4.329   3.912
   78   2HD   LYS  11          2HD       LYS  11 -10.436   2.744   4.657
   79   1HE   LYS  11          1HE       LYS  11 -11.900   4.303   5.783
   80   2HE   LYS  11          2HE       LYS  11 -10.620   3.810   6.899
   81   1HZ   LYS  11          1HZ       LYS  11 -11.045   6.196   6.958
   82   2HZ   LYS  11          2HZ       LYS  11 -10.594   6.349   5.379
   83   3HZ   LYS  11          3HZ       LYS  11  -9.505   5.905   6.526
   84    H    ILE  12           H        ILE  12  -5.192   0.383   5.342
   85    HA   ILE  12           HA       ILE  12  -5.136  -0.869   8.044
   86    HB   ILE  12           HB       ILE  12  -3.120  -1.075   5.786
   87   1HG1  ILE  12          1HG1      ILE  12  -5.129  -3.226   6.449
   88   2HG1  ILE  12          2HG1      ILE  12  -5.329  -2.060   5.132
   89   1HG2  ILE  12          1HG2      ILE  12  -3.489  -2.651   8.378
   90   2HG2  ILE  12          2HG2      ILE  12  -2.235  -2.970   7.154
   91   3HG2  ILE  12          3HG2      ILE  12  -2.213  -1.466   8.063
   92   1HD1  ILE  12          1HD1      ILE  12  -3.076  -2.752   4.223
   93   2HD1  ILE  12          2HD1      ILE  12  -3.129  -4.122   5.366
   94   3HD1  ILE  12          3HD1      ILE  12  -4.360  -3.946   4.103
   95    H    LEU  13           H        LEU  13  -4.682   0.856   9.468
   96    HA   LEU  13           HA       LEU  13  -2.804   2.914   8.799
   97   1HB   LEU  13          1HB       LEU  13  -4.672   3.189  10.409
   98   2HB   LEU  13          2HB       LEU  13  -3.806   2.174  11.568
   99    HG   LEU  13           HG       LEU  13  -2.312   4.493  10.293
  100   1HD1  LEU  13          1HD1      LEU  13  -4.442   5.476  10.790
  101   2HD1  LEU  13          2HD1      LEU  13  -3.231   6.041  11.967
  102   3HD1  LEU  13          3HD1      LEU  13  -4.422   4.800  12.439
  103   1HD2  LEU  13          1HD2      LEU  13  -2.341   3.406  13.148
  104   2HD2  LEU  13          2HD2      LEU  13  -1.291   4.700  12.529
  105   3HD2  LEU  13          3HD2      LEU  13  -1.104   3.058  11.925
  106    H    CYS  14           H        CYS  14  -0.771   2.567   8.548
  107    HA   CYS  14           HA       CYS  14   0.696   0.811  10.433
  108   1HB   CYS  14          1HB       CYS  14   0.313  -0.069   7.978
  109   2HB   CYS  14          2HB       CYS  14   1.523   1.145   7.532
  110    HG   CYS  14           HG       CYS  14   1.713  -1.370   9.690
  111    H    VAL  15           H        VAL  15   3.279   1.479   9.616
  112    HA   VAL  15           HA       VAL  15   3.403   4.411   9.605
  113    HB   VAL  15           HB       VAL  15   5.360   4.374  11.110
  114   1HG1  VAL  15          1HG1      VAL  15   4.110   4.279  13.185
  115   2HG1  VAL  15          2HG1      VAL  15   3.118   5.017  11.919
  116   3HG1  VAL  15          3HG1      VAL  15   2.812   3.335  12.417
  117   1HG2  VAL  15          1HG2      VAL  15   4.519   1.525  11.821
  118   2HG2  VAL  15          2HG2      VAL  15   5.991   1.975  10.927
  119   3HG2  VAL  15          3HG2      VAL  15   5.785   2.498  12.601
  120    H    CYS  16           H        CYS  16   5.286   5.241   8.712
  121    HA   CYS  16           HA       CYS  16   6.236   3.763   6.407
  122   1HB   CYS  16          1HB       CYS  16   5.729   6.327   6.646
  123   2HB   CYS  16          2HB       CYS  16   7.288   6.426   7.484
  124    H    CYS  17           H        CYS  17   8.147   2.496   6.385
  125    HA   CYS  17           HA       CYS  17   9.488   2.104   8.892
  126   1HB   CYS  17          1HB       CYS  17   9.178   0.465   6.918
  127   2HB   CYS  17          2HB       CYS  17  10.649   1.203   6.250
  128    HG   CYS  17           HG       CYS  17  11.130  -1.097   7.399
  129    H    LYS  18           H        LYS  18  10.282   4.328   6.165
  130    HA   LYS  18           HA       LYS  18  13.048   4.494   7.100
  131   1HB   LYS  18          1HB       LYS  18  13.470   5.585   5.041
  132   2HB   LYS  18          2HB       LYS  18  12.376   4.256   4.702
  133   1HG   LYS  18          1HG       LYS  18  11.302   5.869   3.478
  134   2HG   LYS  18          2HG       LYS  18  10.490   6.140   5.009
  135   1HD   LYS  18          1HD       LYS  18  11.138   8.304   4.725
  136   2HD   LYS  18          2HD       LYS  18  12.703   7.779   5.308
  137   1HE   LYS  18          1HE       LYS  18  13.325   7.240   2.930
  138   2HE   LYS  18          2HE       LYS  18  11.826   8.034   2.422
  139   1HZ   LYS  18          1HZ       LYS  18  13.938   9.354   4.045
  140   2HZ   LYS  18          2HZ       LYS  18  12.586  10.075   3.442
  141   3HZ   LYS  18          3HZ       LYS  18  13.788   9.595   2.454
  142    H    CYS  19           H        CYS  19  10.039   6.204   7.672
  143    HA   CYS  19           HA       CYS  19  11.519   8.399   8.955
  144   1HB   CYS  19          1HB       CYS  19   9.865   9.879   7.927
  145   2HB   CYS  19          2HB       CYS  19  11.020   9.163   6.810
  146    H    ASP  20           H        ASP  20   9.359   5.932   9.602
  147    HA   ASP  20           HA       ASP  20   7.800   5.485  11.029
  148   1HB   ASP  20          1HB       ASP  20   9.740   6.015  12.504
  149   2HB   ASP  20          2HB       ASP  20   9.012   7.594  12.818
  150    H    GLY  21           H        GLY  21   7.096   7.506   9.058
  151   1HA   GLY  21          1HA       GLY  21   5.253   9.359  10.392
  152   2HA   GLY  21          2HA       GLY  21   5.372   9.122   8.647
  153    H    ARG  22           H        ARG  22   3.080   9.228  10.388
  154    HA   ARG  22           HA       ARG  22   1.776   6.647  10.629
  155   1HB   ARG  22          1HB       ARG  22   1.183   8.568  11.998
  156   2HB   ARG  22          2HB       ARG  22   0.749   9.531  10.595
  157   1HG   ARG  22          1HG       ARG  22  -0.750   6.953  11.150
  158   2HG   ARG  22          2HG       ARG  22  -1.044   8.380  12.144
  159   1HD   ARG  22          1HD       ARG  22  -1.475   9.685   9.976
  160   2HD   ARG  22          2HD       ARG  22  -1.527   8.106   9.163
  161    HE   ARG  22           HE       ARG  22  -3.187   8.172  11.512
  162   1HH1  ARG  22          1HH1      ARG  22  -3.314   9.371   8.111
  163   2HH1  ARG  22          2HH1      ARG  22  -4.999   8.813   7.985
  164   1HH2  ARG  22          1HH2      ARG  22  -5.505   7.748  11.168
  165   2HH2  ARG  22          2HH2      ARG  22  -6.083   8.020   9.518
  166    H    ILE  23           H        ILE  23   1.043   5.388   8.890
  167    HA   ILE  23           HA       ILE  23   0.077   6.905   6.527
  168    HB   ILE  23           HB       ILE  23   1.258   4.157   6.172
  169   1HG1  ILE  23          1HG1      ILE  23   2.849   6.735   5.855
  170   2HG1  ILE  23          2HG1      ILE  23   3.124   5.486   7.075
  171   1HG2  ILE  23          1HG2      ILE  23   1.241   4.930   3.815
  172   2HG2  ILE  23          2HG2      ILE  23  -0.336   5.220   4.525
  173   3HG2  ILE  23          3HG2      ILE  23   0.802   6.569   4.336
  174   1HD1  ILE  23          1HD1      ILE  23   3.353   4.998   4.085
  175   2HD1  ILE  23          2HD1      ILE  23   4.682   5.221   5.177
  176   3HD1  ILE  23          3HD1      ILE  23   3.635   3.813   5.387
  177    H    GLU  24           H        GLU  24  -2.030   6.723   6.484
  178    HA   GLU  24           HA       GLU  24  -3.464   4.339   7.437
  179   1HB   GLU  24          1HB       GLU  24  -4.231   6.533   7.944
  180   2HB   GLU  24          2HB       GLU  24  -4.335   6.990   6.227
  181   1HG   GLU  24          1HG       GLU  24  -6.088   5.271   5.937
  182   2HG   GLU  24          2HG       GLU  24  -5.917   4.814   7.643
  183    H    LEU  25           H        LEU  25  -2.654   2.707   6.064
  184    HA   LEU  25           HA       LEU  25  -2.143   3.167   3.286
  185   1HB   LEU  25          1HB       LEU  25  -2.514   0.492   4.628
  186   2HB   LEU  25          2HB       LEU  25  -1.714   0.796   3.115
  187    HG   LEU  25           HG       LEU  25  -0.694   1.771   5.830
  188   1HD1  LEU  25          1HD1      LEU  25   0.079  -0.672   4.160
  189   2HD1  LEU  25          2HD1      LEU  25  -0.689  -0.678   5.761
  190   3HD1  LEU  25          3HD1      LEU  25   0.965  -0.078   5.576
  191   1HD2  LEU  25          1HD2      LEU  25   0.040   3.029   3.761
  192   2HD2  LEU  25          2HD2      LEU  25   0.682   1.517   3.130
  193   3HD2  LEU  25          3HD2      LEU  25   1.360   2.221   4.623
  194    H    THR  26           H        THR  26  -3.978   3.825   2.185
  195    HA   THR  26           HA       THR  26  -6.460   2.375   2.624
  196    HB   THR  26           HB       THR  26  -5.935   4.647   0.715
  197    HG1  THR  26           1HG      THR  26  -5.589   4.958   3.075
  198   1HG2  THR  26          1HG2      THR  26  -8.495   3.408   1.878
  199   2HG2  THR  26          2HG2      THR  26  -7.960   3.272   0.200
  200   3HG2  THR  26          3HG2      THR  26  -8.443   4.839   0.851
  201    H    VAL  27           H        VAL  27  -6.585   0.410   1.814
  202    HA   VAL  27           HA       VAL  27  -5.711  -0.039  -1.007
  203    HB   VAL  27           HB       VAL  27  -4.841  -2.242  -0.487
  204   1HG1  VAL  27          1HG1      VAL  27  -3.869  -0.622   1.892
  205   2HG1  VAL  27          2HG1      VAL  27  -2.998  -1.821   0.915
  206   3HG1  VAL  27          3HG1      VAL  27  -3.419  -0.241   0.226
  207   1HG2  VAL  27          1HG2      VAL  27  -6.003  -1.831   2.327
  208   2HG2  VAL  27          2HG2      VAL  27  -6.577  -3.001   1.115
  209   3HG2  VAL  27          3HG2      VAL  27  -4.988  -3.193   1.846
  210    H    GLU  28           H        GLU  28  -7.201  -1.488  -2.197
  211    HA   GLU  28           HA       GLU  28  -9.904  -1.132  -1.007
  212   1HB   GLU  28          1HB       GLU  28  -8.768   0.479  -2.765
  213   2HB   GLU  28          2HB       GLU  28  -9.216  -0.765  -3.878
  214   1HG   GLU  28          1HG       GLU  28 -11.597  -0.411  -2.620
  215   2HG   GLU  28          2HG       GLU  28 -10.876   1.151  -2.325
  216    H    SER  29           H        SER  29 -10.043  -3.295  -0.222
  217    HA   SER  29           HA       SER  29 -10.312  -5.387  -2.235
  218   1HB   SER  29          1HB       SER  29  -7.772  -5.146  -1.701
  219   2HB   SER  29          2HB       SER  29  -8.172  -5.896  -0.149
  220    HG   SER  29           HG       SER  29  -7.674  -7.582  -1.587
  221    H    SER  30           H        SER  30 -10.635  -7.580  -1.092
  222    HA   SER  30           HA       SER  30 -12.733  -7.323   0.883
  223   1HB   SER  30          1HB       SER  30 -11.165  -9.754  -0.082
  224   2HB   SER  30          2HB       SER  30 -12.639  -9.807   0.906
  225    HG   SER  30           HG       SER  30 -12.949 -10.002  -1.438
  226    H    ALA  31           H        ALA  31 -12.671  -8.043   3.096
  227    HA   ALA  31           HA       ALA  31 -10.549  -6.927   4.489
  228   1HB   ALA  31          1HB       ALA  31 -12.584  -8.973   5.492
  229   2HB   ALA  31          2HB       ALA  31 -11.595  -7.905   6.508
  230   3HB   ALA  31          3HB       ALA  31 -12.812  -7.207   5.425
  231    H    GLU  32           H        GLU  32 -11.072 -10.444   3.864
  232    HA   GLU  32           HA       GLU  32  -8.826 -11.285   5.420
  233   1HB   GLU  32          1HB       GLU  32 -10.790 -12.443   3.526
  234   2HB   GLU  32          2HB       GLU  32  -9.229 -13.272   3.559
  235   1HG   GLU  32          1HG       GLU  32  -9.337 -13.587   5.971
  236   2HG   GLU  32          2HG       GLU  32 -10.794 -12.600   6.091
  237    H    ASP  33           H        ASP  33  -9.132 -10.235   2.068
  238    HA   ASP  33           HA       ASP  33  -6.590 -11.216   1.154
  239   1HB   ASP  33          1HB       ASP  33  -8.482 -10.854  -0.324
  240   2HB   ASP  33          2HB       ASP  33  -8.578  -9.159   0.128
  241    H    LEU  34           H        LEU  34  -7.890  -8.123   2.274
  242    HA   LEU  34           HA       LEU  34  -5.586  -6.515   2.413
  243   1HB   LEU  34          1HB       LEU  34  -7.528  -5.366   2.670
  244   2HB   LEU  34          2HB       LEU  34  -8.288  -6.554   3.691
  245    HG   LEU  34           HG       LEU  34  -5.994  -5.050   4.935
  246   1HD1  LEU  34          1HD1      LEU  34  -7.264  -3.293   3.738
  247   2HD1  LEU  34          2HD1      LEU  34  -7.512  -3.166   5.486
  248   3HD1  LEU  34          3HD1      LEU  34  -8.765  -3.908   4.467
  249   1HD2  LEU  34          1HD2      LEU  34  -8.746  -5.863   5.980
  250   2HD2  LEU  34          2HD2      LEU  34  -7.466  -5.064   6.915
  251   3HD2  LEU  34          3HD2      LEU  34  -7.231  -6.702   6.327
  252    H    ARG  35           H        ARG  35  -6.903  -8.691   4.550
  253    HA   ARG  35           HA       ARG  35  -5.215  -8.294   6.851
  254   1HB   ARG  35          1HB       ARG  35  -7.499  -9.376   6.986
  255   2HB   ARG  35          2HB       ARG  35  -6.783 -10.868   6.375
  256   1HG   ARG  35          1HG       ARG  35  -5.245 -10.973   8.257
  257   2HG   ARG  35          2HG       ARG  35  -5.747  -9.366   8.817
  258   1HD   ARG  35          1HD       ARG  35  -8.011 -10.266   9.288
  259   2HD   ARG  35          2HD       ARG  35  -7.450 -11.883   8.793
  260    HE   ARG  35           HE       ARG  35  -5.623 -10.897  10.678
  261   1HH1  ARG  35          1HH1      ARG  35  -9.010 -11.881  10.655
  262   2HH1  ARG  35          2HH1      ARG  35  -9.075 -12.312  12.330
  263   1HH2  ARG  35          1HH2      ARG  35  -5.656 -11.479  12.902
  264   2HH2  ARG  35          2HH2      ARG  35  -7.098 -12.077  13.637
  265    H    THR  36           H        THR  36  -5.348 -10.805   4.362
  266    HA   THR  36           HA       THR  36  -3.000 -12.212   5.101
  267    HB   THR  36           HB       THR  36  -4.044 -11.699   2.265
  268    HG1  THR  36           1HG      THR  36  -5.678 -12.569   3.542
  269   1HG2  THR  36          1HG2      THR  36  -2.365 -13.985   3.390
  270   2HG2  THR  36          2HG2      THR  36  -1.799 -12.733   2.258
  271   3HG2  THR  36          3HG2      THR  36  -3.035 -13.894   1.747
  272    H    LEU  37           H        LEU  37  -3.363  -9.407   2.868
  273    HA   LEU  37           HA       LEU  37  -0.643  -8.790   2.514
  274   1HB   LEU  37          1HB       LEU  37  -1.794  -7.555   1.070
  275   2HB   LEU  37          2HB       LEU  37  -3.248  -7.611   2.037
  276    HG   LEU  37           HG       LEU  37  -2.387  -5.761   3.446
  277   1HD1  LEU  37          1HD1      LEU  37  -0.596  -4.248   2.373
  278   2HD1  LEU  37          2HD1      LEU  37  -0.439  -5.343   1.017
  279   3HD1  LEU  37          3HD1      LEU  37   0.140  -5.831   2.591
  280   1HD2  LEU  37          1HD2      LEU  37  -2.972  -4.064   1.766
  281   2HD2  LEU  37          2HD2      LEU  37  -4.078  -5.441   1.734
  282   3HD2  LEU  37          3HD2      LEU  37  -2.819  -5.278   0.494
  283    H    GLN  38           H        GLN  38  -2.801  -7.912   5.293
  284    HA   GLN  38           HA       GLN  38  -0.900  -6.226   6.557
  285   1HB   GLN  38          1HB       GLN  38  -3.202  -6.064   7.137
  286   2HB   GLN  38          2HB       GLN  38  -3.299  -7.764   7.508
  287   1HG   GLN  38          1HG       GLN  38  -1.656  -7.280   9.465
  288   2HG   GLN  38          2HG       GLN  38  -2.160  -5.599   9.227
  289   1HE2  GLN  38          1HE2      GLN  38  -4.668  -5.295   9.132
  290   2HE2  GLN  38          2HE2      GLN  38  -5.628  -6.406  10.093
  291    H    GLN  39           H        GLN  39  -1.413  -9.811   6.581
  292    HA   GLN  39           HA       GLN  39   0.464 -10.314   8.669
  293   1HB   GLN  39          1HB       GLN  39  -0.249 -12.294   6.516
  294   2HB   GLN  39          2HB       GLN  39   0.415 -12.581   8.115
  295   1HG   GLN  39          1HG       GLN  39  -2.378 -11.902   7.320
  296   2HG   GLN  39          2HG       GLN  39  -1.801 -13.194   8.335
  297   1HE2  GLN  39          1HE2      GLN  39  -3.042 -10.049   8.220
  298   2HE2  GLN  39          2HE2      GLN  39  -3.040  -9.625   9.928
  299    H    LEU  40           H        LEU  40   0.760  -9.952   5.100
  300    HA   LEU  40           HA       LEU  40   3.565 -10.573   4.917
  301   1HB   LEU  40          1HB       LEU  40   2.261  -8.342   3.359
  302   2HB   LEU  40          2HB       LEU  40   3.666  -9.306   2.968
  303    HG   LEU  40           HG       LEU  40   0.828 -10.351   3.054
  304   1HD1  LEU  40          1HD1      LEU  40   2.510  -9.739   0.616
  305   2HD1  LEU  40          2HD1      LEU  40   1.222  -8.701   1.238
  306   3HD1  LEU  40          3HD1      LEU  40   0.843 -10.332   0.650
  307   1HD2  LEU  40          1HD2      LEU  40   1.701 -12.338   1.907
  308   2HD2  LEU  40          2HD2      LEU  40   2.429 -12.147   3.512
  309   3HD2  LEU  40          3HD2      LEU  40   3.349 -11.701   2.056
  310    H    PHE  41           H        PHE  41   1.911  -7.479   5.635
  311    HA   PHE  41           HA       PHE  41   4.298  -6.006   6.159
  312   1HB   PHE  41          1HB       PHE  41   1.398  -5.625   6.859
  313   2HB   PHE  41          2HB       PHE  41   2.608  -4.652   7.670
  314    HD1  PHE  41           1HD      PHE  41   2.984  -2.556   6.790
  315    HD2  PHE  41           2HD      PHE  41   1.956  -5.751   4.086
  316    HE1  PHE  41           1HE      PHE  41   3.092  -0.991   4.896
  317    HE2  PHE  41           2HE      PHE  41   2.113  -4.185   2.180
  318    HZ   PHE  41           HZ       PHE  41   2.691  -1.802   2.566
  319    H    LEU  42           H        LEU  42   2.227  -7.867   8.357
  320    HA   LEU  42           HA       LEU  42   3.666  -7.442  10.747
  321   1HB   LEU  42          1HB       LEU  42   1.374  -8.452  10.315
  322   2HB   LEU  42          2HB       LEU  42   2.174  -9.972   9.934
  323    HG   LEU  42           HG       LEU  42   2.619  -8.592  12.600
  324   1HD1  LEU  42          1HD1      LEU  42   0.174  -8.738  12.257
  325   2HD1  LEU  42          2HD1      LEU  42   0.705  -9.883  13.495
  326   3HD1  LEU  42          3HD1      LEU  42   0.321 -10.464  11.860
  327   1HD2  LEU  42          1HD2      LEU  42   2.877 -10.955  13.389
  328   2HD2  LEU  42          2HD2      LEU  42   4.066 -10.550  12.159
  329   3HD2  LEU  42          3HD2      LEU  42   2.650 -11.529  11.722
  330    H    SER  43           H        SER  43   4.198  -9.847   8.097
  331    HA   SER  43           HA       SER  43   6.283 -11.272   9.417
  332   1HB   SER  43          1HB       SER  43   4.902 -12.040   7.453
  333   2HB   SER  43          2HB       SER  43   5.801 -10.919   6.422
  334    HG   SER  43           HG       SER  43   6.758 -12.897   6.297
  335    H    THR  44           H        THR  44   6.495  -8.828   6.766
  336    HA   THR  44           HA       THR  44   9.081  -7.931   7.704
  337    HB   THR  44           HB       THR  44  10.012  -8.370   5.352
  338    HG1  THR  44           1HG      THR  44   8.854 -10.089   4.249
  339   1HG2  THR  44          1HG2      THR  44  10.638 -10.654   5.709
  340   2HG2  THR  44          2HG2      THR  44   9.267 -10.937   6.799
  341   3HG2  THR  44          3HG2      THR  44  10.587  -9.854   7.292
  342    H    LEU  45           H        LEU  45   6.307  -7.486   5.608
  343    HA   LEU  45           HA       LEU  45   7.539  -5.536   3.949
  344   1HB   LEU  45          1HB       LEU  45   5.008  -7.007   4.121
  345   2HB   LEU  45          2HB       LEU  45   4.698  -5.349   3.720
  346    HG   LEU  45           HG       LEU  45   6.399  -5.544   1.922
  347   1HD1  LEU  45          1HD1      LEU  45   7.768  -7.391   2.684
  348   2HD1  LEU  45          2HD1      LEU  45   6.989  -7.884   1.166
  349   3HD1  LEU  45          3HD1      LEU  45   6.365  -8.466   2.722
  350   1HD2  LEU  45          1HD2      LEU  45   4.910  -6.882   0.393
  351   2HD2  LEU  45          2HD2      LEU  45   4.043  -5.686   1.373
  352   3HD2  LEU  45          3HD2      LEU  45   4.005  -7.409   1.806
  353    H    SER  46           H        SER  46   7.210  -3.255   3.652
  354    HA   SER  46           HA       SER  46   5.368  -1.945   5.470
  355   1HB   SER  46          1HB       SER  46   7.121  -0.274   6.047
  356   2HB   SER  46          2HB       SER  46   7.327  -1.900   6.744
  357    HG   SER  46           HG       SER  46   8.921  -0.490   4.878
  358    H    PHE  47           H        PHE  47   5.490   0.563   4.826
  359    HA   PHE  47           HA       PHE  47   5.284   0.698   1.873
  360   1HB   PHE  47          1HB       PHE  47   3.070   0.577   3.276
  361   2HB   PHE  47          2HB       PHE  47   3.499   2.170   3.818
  362    HD1  PHE  47           1HD      PHE  47   2.057   0.202   1.119
  363    HD2  PHE  47           2HD      PHE  47   3.651   4.067   2.117
  364    HE1  PHE  47           1HE      PHE  47   0.984   1.178  -0.893
  365    HE2  PHE  47           2HE      PHE  47   2.602   5.032   0.094
  366    HZ   PHE  47           HZ       PHE  47   1.242   3.588  -1.408
  367    H    VAL  48           H        VAL  48   5.900   2.763   1.077
  368    HA   VAL  48           HA       VAL  48   6.919   4.605   3.051
  369    HB   VAL  48           HB       VAL  48   8.484   5.247   1.067
  370   1HG1  VAL  48          1HG1      VAL  48  10.280   3.810   2.145
  371   2HG1  VAL  48          2HG1      VAL  48   9.295   4.657   3.340
  372   3HG1  VAL  48          3HG1      VAL  48   8.959   2.978   3.003
  373   1HG2  VAL  48          1HG2      VAL  48   7.794   3.951  -0.467
  374   2HG2  VAL  48          2HG2      VAL  48   9.526   3.827  -0.120
  375   3HG2  VAL  48          3HG2      VAL  48   8.408   2.498   0.398
  376    H    CYS  49           H        CYS  49   5.686   6.205   3.208
  377    HA   CYS  49           HA       CYS  49   3.393   6.674   1.639
  378   1HB   CYS  49          1HB       CYS  49   3.534   8.963   2.885
  379   2HB   CYS  49          2HB       CYS  49   3.321   7.484   3.799
  380    HA   PRO  50           HA       PRO  50   4.922   8.671  -1.936
  381   1HB   PRO  50          1HB       PRO  50   3.019  10.629  -2.518
  382   2HB   PRO  50          2HB       PRO  50   2.896   8.887  -2.902
  383   1HG   PRO  50          1HG       PRO  50   1.769  10.359  -0.505
  384   2HG   PRO  50          2HG       PRO  50   0.954   9.150  -1.551
  385   1HD   PRO  50          1HD       PRO  50   1.973   8.409   0.818
  386   2HD   PRO  50          2HD       PRO  50   2.207   7.365  -0.614
  387    H    TRP  51           H        TRP  51   4.103  10.785   0.778
  388    HA   TRP  51           HA       TRP  51   5.704  13.051   0.185
  389   1HB   TRP  51          1HB       TRP  51   4.284  13.196   2.068
  390   2HB   TRP  51          2HB       TRP  51   4.819  11.648   2.713
  391    HD1  TRP  51           HD       TRP  51   7.231  14.481   1.741
  392    HE1  TRP  51           1HE      TRP  51   8.736  14.971   3.698
  393    HE3  TRP  51           3HE      TRP  51   4.832  11.650   5.277
  394    HZ2  TRP  51           2HZ      TRP  51   8.753  14.428   6.583
  395    HZ3  TRP  51           3HZ      TRP  51   5.623  11.661   7.624
  396    HH2  TRP  51           HH       TRP  51   7.576  13.041   8.288
  397    H    CYS  52           H        CYS  52   6.644   9.990   1.967
  398    HA   CYS  52           HA       CYS  52   9.358  10.931   2.196
  399   1HB   CYS  52          1HB       CYS  52   9.727   9.121   3.482
  400   2HB   CYS  52          2HB       CYS  52   7.957   9.148   3.598
  401    H    ALA  53           H        ALA  53   7.558   8.868  -0.054
  402    HA   ALA  53           HA       ALA  53   9.814   7.832  -1.386
  403   1HB   ALA  53          1HB       ALA  53   7.486   6.949  -1.607
  404   2HB   ALA  53          2HB       ALA  53   7.034   8.413  -2.511
  405   3HB   ALA  53          3HB       ALA  53   8.212   7.289  -3.196
  406    H    THR  54           H        THR  54   8.031  10.896  -1.743
  407    HA   THR  54           HA       THR  54   9.477  11.783  -4.096
  408    HB   THR  54           HB       THR  54   7.832  13.395  -2.094
  409    HG1  THR  54           1HG      THR  54   6.518  11.820  -2.894
  410   1HG2  THR  54          1HG2      THR  54   7.432  14.898  -4.023
  411   2HG2  THR  54          2HG2      THR  54   8.538  13.925  -5.015
  412   3HG2  THR  54          3HG2      THR  54   9.154  14.831  -3.614
  413    H    ASN  55           H        ASN  55   9.730  12.421  -0.554
  414    HA   ASN  55           HA       ASN  55  11.903  14.338  -0.802
  415   1HB   ASN  55          1HB       ASN  55  10.921  12.621   1.531
  416   2HB   ASN  55          2HB       ASN  55  12.263  13.753   1.658
  417   1HD2  ASN  55          1HD2      ASN  55   9.706  14.790  -0.468
  418   2HD2  ASN  55          2HD2      ASN  55   9.027  15.953   0.655
  419    H    GLN  56           H        GLN  56  11.726  10.926  -0.273
  420    HA   GLN  56           HA       GLN  56  13.154   9.258   0.070
  421   1HB   GLN  56          2HB       GLN  56  12.882   9.551  -2.425
  422   2HB   GLN  56          3HB       GLN  56  14.474  10.299  -2.453
  423   1HG   GLN  56          2HG       GLN  56  14.682   7.836  -0.928
  424   2HG   GLN  56          3HG       GLN  56  13.704   7.490  -2.338
  425   1HE2  GLN  56          1HE2      GLN  56  16.589   9.504  -1.643
  426   2HE2  GLN  56          2HE2      GLN  56  17.614   8.851  -2.946
  427   1H    GLY   1          1H        GLY   1  20.654   3.802  14.145
  428   1HA   GLY   1          1HA       GLY   1  22.151   4.113  12.320
  429   2HA   GLY   1          2HA       GLY   1  22.791   2.480  12.625
  430    H    SER   2           H        SER   2  21.874   2.780  10.089
  431    HA   SER   2           HA       SER   2  19.774   0.885  10.000
  432   1HB   SER   2          1HB       SER   2  18.469   3.067  10.135
  433   2HB   SER   2          2HB       SER   2  19.245   3.550   8.610
  434    HG   SER   2           HG       SER   2  17.201   2.509   8.304
  435    H    HIS   3           H        HIS   3  19.341   0.855   7.327
  436    HA   HIS   3           HA       HIS   3  21.818   1.188   5.842
  437   1HB   HIS   3          1HB       HIS   3  22.057  -1.037   6.988
  438   2HB   HIS   3          2HB       HIS   3  20.580  -1.575   6.183
  439    HD1  HIS   3           1HD      HIS   3  20.916  -2.642   3.896
  440    HD2  HIS   3           2HD      HIS   3  24.143  -0.233   5.164
  441    HE1  HIS   3           1HE      HIS   3  22.749  -2.811   2.076
  442    H    MET   4           H        MET   4  21.150   0.109   3.411
  443    HA   MET   4           HA       MET   4  18.438   0.792   2.700
  444   1HB   MET   4          1HB       MET   4  18.915   2.846   1.490
  445   2HB   MET   4          2HB       MET   4  19.439   3.059   3.156
  446   1HG   MET   4          1HG       MET   4  21.782   2.512   2.451
  447   2HG   MET   4          2HG       MET   4  21.227   2.397   0.779
  448   1HE   MET   4          1HE       MET   4  23.122   4.051   0.054
  449   2HE   MET   4          2HE       MET   4  23.376   5.654   0.783
  450   3HE   MET   4          3HE       MET   4  23.657   4.186   1.747
  451    H    ALA   5           H        ALA   5  18.500   1.194   0.148
  452    HA   ALA   5           HA       ALA   5  18.710   0.335  -1.886
  453   1HB   ALA   5          1HB       ALA   5  20.961   0.212  -2.823
  454   2HB   ALA   5          2HB       ALA   5  20.842   1.599  -1.723
  455   3HB   ALA   5          3HB       ALA   5  21.664   0.108  -1.199
  456    H    GLU   6           H        GLU   6  18.235  -1.518   0.262
  457    HA   GLU   6           HA       GLU   6  19.183  -4.139  -0.718
  458   1HB   GLU   6          1HB       GLU   6  17.443  -3.155   1.572
  459   2HB   GLU   6          2HB       GLU   6  17.432  -4.866   1.135
  460   1HG   GLU   6          1HG       GLU   6  19.832  -5.062   1.451
  461   2HG   GLU   6          2HG       GLU   6  20.002  -3.323   1.681
  462    HA   PRO   7           HA       PRO   7  15.606  -4.832  -3.334
  463   1HB   PRO   7          1HB       PRO   7  15.223  -7.518  -3.247
  464   2HB   PRO   7          2HB       PRO   7  16.707  -6.795  -3.925
  465   1HG   PRO   7          1HG       PRO   7  16.304  -7.856  -1.105
  466   2HG   PRO   7          2HG       PRO   7  17.610  -8.274  -2.262
  467   1HD   PRO   7          1HD       PRO   7  17.952  -6.376  -0.354
  468   2HD   PRO   7          2HD       PRO   7  18.657  -6.174  -1.982
  469    H    GLN   8           H        GLN   8  14.706  -3.511  -1.446
  470    HA   GLN   8           HA       GLN   8  12.349  -4.896  -0.279
  471   1HB   GLN   8          1HB       GLN   8  14.444  -4.325   1.271
  472   2HB   GLN   8          2HB       GLN   8  13.774  -2.704   1.261
  473   1HG   GLN   8          1HG       GLN   8  12.922  -3.865   3.184
  474   2HG   GLN   8          2HG       GLN   8  11.574  -3.708   2.053
  475   1HE2  GLN   8          1HE2      GLN   8  10.482  -5.589   1.494
  476   2HE2  GLN   8          2HE2      GLN   8  11.181  -7.211   1.673
  477    H    ARG   9           H        ARG   9  13.472  -1.474  -0.283
  478    HA   ARG   9           HA       ARG   9  11.031  -0.264  -0.758
  479   1HB   ARG   9          1HB       ARG   9  13.226   0.670   0.116
  480   2HB   ARG   9          2HB       ARG   9  13.747   0.773  -1.557
  481   1HG   ARG   9          1HG       ARG   9  11.145   1.967  -1.155
  482   2HG   ARG   9          2HG       ARG   9  12.377   2.743  -0.161
  483   1HD   ARG   9          1HD       ARG   9  12.532   2.326  -3.181
  484   2HD   ARG   9          2HD       ARG   9  12.028   3.820  -2.369
  485    HE   ARG   9           HE       ARG   9  14.636   2.784  -1.567
  486   1HH1  ARG   9          1HH1      ARG   9  12.998   5.009  -3.837
  487   2HH1  ARG   9          2HH1      ARG   9  14.444   5.999  -4.012
  488   1HH2  ARG   9          1HH2      ARG   9  16.518   4.168  -1.948
  489   2HH2  ARG   9          2HH2      ARG   9  16.295   5.544  -3.007
  490    H    HIS  10           H        HIS  10   9.772  -1.238  -2.456
  491    HA   HIS  10           HA       HIS  10  10.864  -0.920  -5.203
  492   1HB   HIS  10          1HB       HIS  10   9.007  -3.018  -4.033
  493   2HB   HIS  10          2HB       HIS  10   9.412  -2.867  -5.742
  494    HD1  HIS  10           1HD      HIS  10  10.187  -5.332  -3.594
  495    HD2  HIS  10           2HD      HIS  10  12.666  -2.307  -5.067
  496    HE1  HIS  10           1HE      HIS  10  12.517  -6.257  -3.533
  497    H    LYS  11           H        LYS  11   9.014  -0.918  -6.837
  498    HA   LYS  11           HA       LYS  11   7.079   1.201  -6.041
  499   1HB   LYS  11          1HB       LYS  11   9.182   1.268  -8.231
  500   2HB   LYS  11          2HB       LYS  11   7.879   2.428  -8.062
  501   1HG   LYS  11          1HG       LYS  11   9.068   3.662  -6.606
  502   2HG   LYS  11          2HG       LYS  11   9.196   2.309  -5.513
  503   1HD   LYS  11          1HD       LYS  11  11.423   3.038  -5.988
  504   2HD   LYS  11          2HD       LYS  11  11.184   1.471  -6.750
  505   1HE   LYS  11          1HE       LYS  11  12.382   2.815  -8.314
  506   2HE   LYS  11          2HE       LYS  11  10.733   2.664  -8.938
  507   1HZ   LYS  11          1HZ       LYS  11  11.608   4.928  -9.069
  508   2HZ   LYS  11          2HZ       LYS  11  11.686   5.017  -7.422
  509   3HZ   LYS  11          3HZ       LYS  11  10.239   4.852  -8.201
  510    H    ILE  12           H        ILE  12   5.319  -0.233  -6.312
  511    HA   ILE  12           HA       ILE  12   5.062  -1.641  -8.914
  512    HB   ILE  12           HB       ILE  12   2.992  -1.559  -6.701
  513   1HG1  ILE  12          1HG1      ILE  12   5.042  -3.740  -7.139
  514   2HG1  ILE  12          2HG1      ILE  12   5.102  -2.558  -5.827
  515   1HG2  ILE  12          1HG2      ILE  12   3.417  -3.471  -9.043
  516   2HG2  ILE  12          2HG2      ILE  12   2.039  -3.458  -7.913
  517   3HG2  ILE  12          3HG2      ILE  12   2.261  -2.131  -9.041
  518   1HD1  ILE  12          1HD1      ILE  12   2.776  -3.336  -5.123
  519   2HD1  ILE  12          2HD1      ILE  12   3.010  -4.718  -6.223
  520   3HD1  ILE  12          3HD1      ILE  12   4.106  -4.462  -4.856
  521    H    LEU  13           H        LEU  13   4.727  -0.104 -10.463
  522    HA   LEU  13           HA       LEU  13   3.076   2.206 -10.086
  523   1HB   LEU  13          1HB       LEU  13   4.959   2.101 -11.681
  524   2HB   LEU  13          2HB       LEU  13   4.032   1.008 -12.711
  525    HG   LEU  13           HG       LEU  13   2.742   3.615 -11.827
  526   1HD1  LEU  13          1HD1      LEU  13   4.941   4.326 -12.429
  527   2HD1  LEU  13          2HD1      LEU  13   3.814   4.776 -13.735
  528   3HD1  LEU  13          3HD1      LEU  13   4.898   3.381 -13.940
  529   1HD2  LEU  13          1HD2      LEU  13   2.666   2.071 -14.464
  530   2HD2  LEU  13          2HD2      LEU  13   1.783   3.574 -14.120
  531   3HD2  LEU  13          3HD2      LEU  13   1.385   2.106 -13.238
  532    H    CYS  14           H        CYS  14   1.013   1.999  -9.713
  533    HA   CYS  14           HA       CYS  14  -0.622   0.277 -11.517
  534   1HB   CYS  14          1HB       CYS  14  -0.957   0.870  -8.543
  535   2HB   CYS  14          2HB       CYS  14  -2.266   0.216  -9.528
  536    HG   CYS  14           HG       CYS  14  -0.909  -1.865 -10.440
  537    H    VAL  15           H        VAL  15  -3.109   1.333 -11.041
  538    HA   VAL  15           HA       VAL  15  -2.823   4.258 -11.151
  539    HB   VAL  15           HB       VAL  15  -4.917   4.353 -12.470
  540   1HG1  VAL  15          1HG1      VAL  15  -3.864   3.974 -14.637
  541   2HG1  VAL  15          2HG1      VAL  15  -2.721   4.721 -13.512
  542   3HG1  VAL  15          3HG1      VAL  15  -2.591   2.986 -13.884
  543   1HG2  VAL  15          1HG2      VAL  15  -4.440   1.396 -13.069
  544   2HG2  VAL  15          2HG2      VAL  15  -5.770   2.048 -12.079
  545   3HG2  VAL  15          3HG2      VAL  15  -5.666   2.455 -13.794
  546    H    CYS  16           H        CYS  16  -4.414   5.374 -10.033
  547    HA   CYS  16           HA       CYS  16  -5.546   4.100  -7.698
  548   1HB   CYS  16          1HB       CYS  16  -4.971   6.582  -7.873
  549   2HB   CYS  16          2HB       CYS  16  -6.337   6.747  -8.994
  550    H    CYS  17           H        CYS  17  -7.432   3.045  -7.541
  551    HA   CYS  17           HA       CYS  17  -8.908   2.108  -9.687
  552   1HB   CYS  17          1HB       CYS  17  -8.880   1.362  -7.233
  553   2HB   CYS  17          2HB       CYS  17 -10.097   2.599  -6.922
  554    HG   CYS  17           HG       CYS  17 -11.251   0.329  -7.057
  555    H    LYS  18           H        LYS  18  -9.470   5.154  -7.956
  556    HA   LYS  18           HA       LYS  18 -11.919   5.641  -9.574
  557   1HB   LYS  18          1HB       LYS  18 -12.610   7.032  -7.641
  558   2HB   LYS  18          2HB       LYS  18 -12.510   5.305  -7.354
  559   1HG   LYS  18          1HG       LYS  18 -10.258   5.701  -6.186
  560   2HG   LYS  18          2HG       LYS  18 -10.490   7.425  -6.476
  561   1HD   LYS  18          1HD       LYS  18 -11.303   7.268  -4.335
  562   2HD   LYS  18          2HD       LYS  18 -12.791   7.035  -5.240
  563   1HE   LYS  18          1HE       LYS  18 -11.009   4.864  -4.039
  564   2HE   LYS  18          2HE       LYS  18 -12.503   5.450  -3.308
  565   1HZ   LYS  18          1HZ       LYS  18 -12.430   4.171  -5.961
  566   2HZ   LYS  18          2HZ       LYS  18 -13.752   4.419  -4.998
  567   3HZ   LYS  18          3HZ       LYS  18 -12.580   3.300  -4.620
  568    H    CYS  19           H        CYS  19  -8.752   6.974  -8.936
  569    HA   CYS  19           HA       CYS  19  -9.485   9.527 -10.209
  570   1HB   CYS  19          1HB       CYS  19  -6.766   8.714  -9.632
  571   2HB   CYS  19          2HB       CYS  19  -7.435  10.301  -9.769
  572    H    ASP  20           H        ASP  20  -8.374   6.297 -11.030
  573    HA   ASP  20           HA       ASP  20  -7.229   5.366 -12.644
  574   1HB   ASP  20          1HB       ASP  20  -9.361   5.823 -13.766
  575   2HB   ASP  20          2HB       ASP  20  -8.691   7.322 -14.403
  576    H    GLY  21           H        GLY  21  -5.813   7.181 -11.210
  577   1HA   GLY  21          1HA       GLY  21  -4.006   8.570 -13.151
  578   2HA   GLY  21          2HA       GLY  21  -4.290   9.108 -11.492
  579    H    ARG  22           H        ARG  22  -1.836   8.401 -12.800
  580    HA   ARG  22           HA       ARG  22  -0.833   5.801 -12.308
  581   1HB   ARG  22          1HB       ARG  22  -0.003   7.366 -13.969
  582   2HB   ARG  22          2HB       ARG  22   0.474   8.529 -12.739
  583   1HG   ARG  22          1HG       ARG  22   1.728   5.783 -12.680
  584   2HG   ARG  22          2HG       ARG  22   2.176   6.903 -13.970
  585   1HD   ARG  22          1HD       ARG  22   2.660   8.646 -12.138
  586   2HD   ARG  22          2HD       ARG  22   2.556   7.297 -10.990
  587    HE   ARG  22           HE       ARG  22   4.289   6.709 -13.216
  588   1HH1  ARG  22          1HH1      ARG  22   4.352   8.571 -10.130
  589   2HH1  ARG  22          2HH1      ARG  22   5.969   7.917  -9.779
  590   1HH2  ARG  22          1HH2      ARG  22   6.555   6.219 -12.665
  591   2HH2  ARG  22          2HH2      ARG  22   7.063   6.769 -11.061
  592    H    ILE  23           H        ILE  23  -0.585   4.880 -10.305
  593    HA   ILE  23           HA       ILE  23   0.565   6.627  -8.211
  594    HB   ILE  23           HB       ILE  23  -0.831   3.984  -7.631
  595   1HG1  ILE  23          1HG1      ILE  23  -1.995   6.725  -6.992
  596   2HG1  ILE  23          2HG1      ILE  23  -2.525   5.732  -8.350
  597   1HG2  ILE  23          1HG2      ILE  23  -0.550   4.881  -5.267
  598   2HG2  ILE  23          2HG2      ILE  23   0.979   4.672  -6.095
  599   3HG2  ILE  23          3HG2      ILE  23   0.275   6.292  -5.941
  600   1HD1  ILE  23          1HD1      ILE  23  -3.197   3.906  -6.856
  601   2HD1  ILE  23          2HD1      ILE  23  -2.658   4.818  -5.432
  602   3HD1  ILE  23          3HD1      ILE  23  -3.996   5.414  -6.376
  603    H    GLU  24           H        GLU  24   2.699   6.262  -8.064
  604    HA   GLU  24           HA       GLU  24   3.934   3.679  -8.768
  605   1HB   GLU  24          1HB       GLU  24   4.933   5.731  -9.439
  606   2HB   GLU  24          2HB       GLU  24   5.005   6.353  -7.781
  607   1HG   GLU  24          1HG       GLU  24   6.622   4.525  -7.237
  608   2HG   GLU  24          2HG       GLU  24   6.466   3.932  -8.901
  609    H    LEU  25           H        LEU  25   2.945   2.250  -7.249
  610    HA   LEU  25           HA       LEU  25   2.505   2.989  -4.538
  611   1HB   LEU  25          1HB       LEU  25   2.722   0.178  -5.614
  612   2HB   LEU  25          2HB       LEU  25   1.986   0.655  -4.108
  613    HG   LEU  25           HG       LEU  25   0.925   1.497  -6.843
  614   1HD1  LEU  25          1HD1      LEU  25   0.084  -0.787  -4.993
  615   2HD1  LEU  25          2HD1      LEU  25   0.751  -0.924  -6.634
  616   3HD1  LEU  25          3HD1      LEU  25  -0.848  -0.207  -6.392
  617   1HD2  LEU  25          1HD2      LEU  25   0.321   2.899  -4.772
  618   2HD2  LEU  25          2HD2      LEU  25  -0.368   1.450  -4.064
  619   3HD2  LEU  25          3HD2      LEU  25  -1.077   2.129  -5.550
  620    H    THR  26           H        THR  26   4.278   3.610  -3.394
  621    HA   THR  26           HA       THR  26   6.847   2.241  -3.727
  622    HB   THR  26           HB       THR  26   6.446   4.586  -1.967
  623    HG1  THR  26           1HG      THR  26   5.590   4.704  -4.471
  624   1HG2  THR  26          1HG2      THR  26   8.570   4.000  -4.078
  625   2HG2  THR  26          2HG2      THR  26   8.682   3.248  -2.486
  626   3HG2  THR  26          3HG2      THR  26   8.719   5.018  -2.639
  627    H    VAL  27           H        VAL  27   6.528   0.221  -2.936
  628    HA   VAL  27           HA       VAL  27   5.737  -0.069  -0.081
  629    HB   VAL  27           HB       VAL  27   4.508  -2.150  -0.551
  630   1HG1  VAL  27          1HG1      VAL  27   3.695  -0.129  -2.672
  631   2HG1  VAL  27          2HG1      VAL  27   2.692  -1.278  -1.765
  632   3HG1  VAL  27          3HG1      VAL  27   3.459   0.100  -0.943
  633   1HG2  VAL  27          1HG2      VAL  27   5.337  -1.674  -3.508
  634   2HG2  VAL  27          2HG2      VAL  27   5.920  -3.003  -2.500
  635   3HG2  VAL  27          3HG2      VAL  27   4.210  -2.912  -2.914
  636    H    GLU  28           H        GLU  28   7.391  -0.555   1.080
  637    HA   GLU  28           HA       GLU  28   9.879  -1.697   0.029
  638   1HB   GLU  28          1HB       GLU  28   9.005  -1.394   2.877
  639   2HB   GLU  28          2HB       GLU  28  10.644  -1.709   2.336
  640   1HG   GLU  28          1HG       GLU  28  10.882   0.510   1.449
  641   2HG   GLU  28          2HG       GLU  28   9.155   0.847   1.653
  642    H    SER  29           H        SER  29   9.472  -3.733  -0.855
  643    HA   SER  29           HA       SER  29   8.216  -5.784   0.823
  644   1HB   SER  29          1HB       SER  29   7.239  -4.591  -1.770
  645   2HB   SER  29          2HB       SER  29   6.554  -5.989  -0.904
  646    HG   SER  29           HG       SER  29   6.680  -3.939   0.780
  647    H    SER  30           H        SER  30   9.146  -7.564   0.410
  648    HA   SER  30           HA       SER  30  11.485  -7.762  -1.277
  649   1HB   SER  30          1HB       SER  30   9.957 -10.104  -0.055
  650   2HB   SER  30          2HB       SER  30  11.668 -10.036  -0.487
  651    HG   SER  30           HG       SER  30  11.521  -9.686   1.717
  652    H    ALA  31           H        ALA  31  11.690  -8.799  -3.347
  653    HA   ALA  31           HA       ALA  31   9.696  -8.311  -5.064
  654   1HB   ALA  31          1HB       ALA  31  11.707 -10.584  -5.408
  655   2HB   ALA  31          2HB       ALA  31  10.823  -9.772  -6.711
  656   3HB   ALA  31          3HB       ALA  31  12.014  -8.861  -5.754
  657    H    GLU  32           H        GLU  32  10.051 -11.532  -3.508
  658    HA   GLU  32           HA       GLU  32   8.010 -12.623  -5.224
  659   1HB   GLU  32          1HB       GLU  32  10.164 -13.688  -3.991
  660   2HB   GLU  32          2HB       GLU  32   8.923 -14.097  -2.790
  661   1HG   GLU  32          1HG       GLU  32   7.562 -15.108  -4.647
  662   2HG   GLU  32          2HG       GLU  32   8.829 -14.698  -5.794
  663    H    ASP  33           H        ASP  33   8.163 -11.187  -2.065
  664    HA   ASP  33           HA       ASP  33   5.592 -12.060  -1.109
  665   1HB   ASP  33          1HB       ASP  33   7.601 -11.484   0.309
  666   2HB   ASP  33          2HB       ASP  33   7.382  -9.795  -0.158
  667    H    LEU  34           H        LEU  34   7.082  -9.226  -2.658
  668    HA   LEU  34           HA       LEU  34   4.801  -7.557  -2.926
  669   1HB   LEU  34          1HB       LEU  34   6.789  -6.494  -3.315
  670   2HB   LEU  34          2HB       LEU  34   7.491  -7.794  -4.238
  671    HG   LEU  34           HG       LEU  34   5.208  -6.276  -5.527
  672   1HD1  LEU  34          1HD1      LEU  34   6.663  -4.501  -4.618
  673   2HD1  LEU  34          2HD1      LEU  34   6.951  -4.633  -6.363
  674   3HD1  LEU  34          3HD1      LEU  34   8.111  -5.335  -5.227
  675   1HD2  LEU  34          1HD2      LEU  34   7.825  -7.454  -6.596
  676   2HD2  LEU  34          2HD2      LEU  34   6.594  -6.619  -7.564
  677   3HD2  LEU  34          3HD2      LEU  34   6.216  -8.157  -6.804
  678    H    ARG  35           H        ARG  35   6.050 -10.028  -4.787
  679    HA   ARG  35           HA       ARG  35   4.239 -10.025  -7.031
  680   1HB   ARG  35          1HB       ARG  35   6.454 -11.249  -7.017
  681   2HB   ARG  35          2HB       ARG  35   5.689 -12.536  -6.090
  682   1HG   ARG  35          1HG       ARG  35   4.026 -12.887  -7.855
  683   2HG   ARG  35          2HG       ARG  35   4.664 -11.507  -8.771
  684   1HD   ARG  35          1HD       ARG  35   6.809 -12.707  -9.062
  685   2HD   ARG  35          2HD       ARG  35   6.143 -14.095  -8.166
  686    HE   ARG  35           HE       ARG  35   4.347 -13.424 -10.233
  687   1HH1  ARG  35          1HH1      ARG  35   7.588 -14.778  -9.922
  688   2HH1  ARG  35          2HH1      ARG  35   7.547 -15.672 -11.402
  689   1HH2  ARG  35          1HH2      ARG  35   4.233 -14.622 -12.198
  690   2HH2  ARG  35          2HH2      ARG  35   5.571 -15.575 -12.727
  691    H    THR  36           H        THR  36   4.382 -11.958  -4.058
  692    HA   THR  36           HA       THR  36   1.891 -13.300  -4.367
  693    HB   THR  36           HB       THR  36   3.177 -12.397  -1.748
  694    HG1  THR  36           1HG      THR  36   4.652 -13.613  -3.007
  695   1HG2  THR  36          1HG2      THR  36   1.278 -14.694  -2.382
  696   2HG2  THR  36          2HG2      THR  36   0.871 -13.233  -1.451
  697   3HG2  THR  36          3HG2      THR  36   2.057 -14.385  -0.815
  698    H    LEU  37           H        LEU  37   2.573 -10.143  -2.774
  699    HA   LEU  37           HA       LEU  37  -0.068  -9.284  -2.378
  700   1HB   LEU  37          1HB       LEU  37   1.223  -7.805  -1.329
  701   2HB   LEU  37          2HB       LEU  37   2.617  -8.200  -2.291
  702    HG   LEU  37           HG       LEU  37   1.800  -6.620  -4.079
  703   1HD1  LEU  37          1HD1      LEU  37  -0.643  -6.347  -3.176
  704   2HD1  LEU  37          2HD1      LEU  37   0.200  -4.808  -3.304
  705   3HD1  LEU  37          3HD1      LEU  37   0.028  -5.597  -1.737
  706   1HD2  LEU  37          1HD2      LEU  37   2.520  -4.590  -2.740
  707   2HD2  LEU  37          2HD2      LEU  37   3.629  -5.944  -2.712
  708   3HD2  LEU  37          3HD2      LEU  37   2.583  -5.636  -1.312
  709    H    GLN  38           H        GLN  38   1.919  -9.128  -5.373
  710    HA   GLN  38           HA       GLN  38   0.069  -7.611  -6.897
  711   1HB   GLN  38          1HB       GLN  38   2.308  -7.715  -7.581
  712   2HB   GLN  38          2HB       GLN  38   2.315  -9.456  -7.582
  713   1HG   GLN  38          1HG       GLN  38   0.652  -9.349  -9.551
  714   2HG   GLN  38          2HG       GLN  38   1.170  -7.660  -9.685
  715   1HE2  GLN  38          1HE2      GLN  38   3.673  -7.383  -9.638
  716   2HE2  GLN  38          2HE2      GLN  38   4.645  -8.626 -10.394
  717    H    GLN  39           H        GLN  39   0.298 -11.125  -6.086
  718    HA   GLN  39           HA       GLN  39  -1.749 -11.898  -7.945
  719   1HB   GLN  39          1HB       GLN  39  -0.982 -13.458  -5.491
  720   2HB   GLN  39          2HB       GLN  39  -1.795 -14.003  -6.948
  721   1HG   GLN  39          1HG       GLN  39   1.097 -13.395  -6.519
  722   2HG   GLN  39          2HG       GLN  39   0.360 -14.820  -7.191
  723   1HE2  GLN  39          1HE2      GLN  39   1.833 -11.845  -7.866
  724   2HE2  GLN  39          2HE2      GLN  39   1.705 -11.812  -9.622
  725    H    LEU  40           H        LEU  40  -1.716 -10.816  -4.499
  726    HA   LEU  40           HA       LEU  40  -4.549 -11.082  -4.060
  727   1HB   LEU  40          1HB       LEU  40  -2.771  -8.884  -2.954
  728   2HB   LEU  40          2HB       LEU  40  -4.318  -9.393  -2.352
  729    HG   LEU  40           HG       LEU  40  -1.765 -11.042  -2.284
  730   1HD1  LEU  40          1HD1      LEU  40  -3.312  -9.663  -0.063
  731   2HD1  LEU  40          2HD1      LEU  40  -1.763  -9.129  -0.744
  732   3HD1  LEU  40          3HD1      LEU  40  -1.854 -10.661   0.141
  733   1HD2  LEU  40          1HD2      LEU  40  -2.973 -12.626  -0.849
  734   2HD2  LEU  40          2HD2      LEU  40  -3.721 -12.543  -2.449
  735   3HD2  LEU  40          3HD2      LEU  40  -4.477 -11.709  -1.076
  736    H    PHE  41           H        PHE  41  -2.600  -8.641  -5.731
  737    HA   PHE  41           HA       PHE  41  -4.647  -6.712  -6.234
  738   1HB   PHE  41          1HB       PHE  41  -1.974  -6.783  -6.620
  739   2HB   PHE  41          2HB       PHE  41  -2.494  -7.112  -8.267
  740    HD1  PHE  41           1HD      PHE  41  -4.355  -5.450  -9.224
  741    HD2  PHE  41           2HD      PHE  41  -1.723  -4.595  -5.913
  742    HE1  PHE  41           1HE      PHE  41  -4.716  -3.027  -9.555
  743    HE2  PHE  41           2HE      PHE  41  -2.061  -2.182  -6.267
  744    HZ   PHE  41           HZ       PHE  41  -3.595  -1.376  -8.064
  745    H    LEU  42           H        LEU  42  -3.424  -9.407  -8.195
  746    HA   LEU  42           HA       LEU  42  -5.429  -9.247 -10.242
  747   1HB   LEU  42          1HB       LEU  42  -3.571 -11.427  -9.237
  748   2HB   LEU  42          2HB       LEU  42  -4.655 -11.701 -10.595
  749    HG   LEU  42           HG       LEU  42  -2.630  -9.417 -10.554
  750   1HD1  LEU  42          1HD1      LEU  42  -1.418 -11.537 -10.351
  751   2HD1  LEU  42          2HD1      LEU  42  -1.189 -10.841 -11.960
  752   3HD1  LEU  42          3HD1      LEU  42  -2.307 -12.208 -11.734
  753   1HD2  LEU  42          1HD2      LEU  42  -2.934  -9.480 -13.014
  754   2HD2  LEU  42          2HD2      LEU  42  -4.458  -9.132 -12.196
  755   3HD2  LEU  42          3HD2      LEU  42  -4.154 -10.760 -12.836
  756    H    SER  43           H        SER  43  -5.398 -10.931  -7.112
  757    HA   SER  43           HA       SER  43  -7.736 -12.479  -7.419
  758   1HB   SER  43          1HB       SER  43  -5.999 -12.583  -5.556
  759   2HB   SER  43          2HB       SER  43  -6.752 -11.149  -4.852
  760    HG   SER  43           HG       SER  43  -7.697 -12.776  -3.865
  761    H    THR  44           H        THR  44  -7.342  -9.202  -5.992
  762    HA   THR  44           HA       THR  44  -9.927  -8.300  -6.872
  763    HB   THR  44           HB       THR  44  -9.564  -9.191  -3.983
  764    HG1  THR  44           1HG      THR  44 -10.579 -10.394  -5.946
  765   1HG2  THR  44          1HG2      THR  44 -11.801  -8.269  -3.468
  766   2HG2  THR  44          2HG2      THR  44 -11.806  -7.412  -5.028
  767   3HG2  THR  44          3HG2      THR  44 -10.611  -6.992  -3.778
  768    H    LEU  45           H        LEU  45  -6.969  -7.736  -4.927
  769    HA   LEU  45           HA       LEU  45  -7.825  -5.319  -3.823
  770   1HB   LEU  45          1HB       LEU  45  -6.047  -6.808  -2.994
  771   2HB   LEU  45          2HB       LEU  45  -4.972  -6.319  -4.262
  772    HG   LEU  45           HG       LEU  45  -6.124  -4.105  -2.591
  773   1HD1  LEU  45          1HD1      LEU  45  -5.605  -5.872  -0.918
  774   2HD1  LEU  45          2HD1      LEU  45  -4.520  -4.484  -0.796
  775   3HD1  LEU  45          3HD1      LEU  45  -3.965  -5.993  -1.567
  776   1HD2  LEU  45          1HD2      LEU  45  -3.307  -4.684  -3.619
  777   2HD2  LEU  45          2HD2      LEU  45  -3.835  -3.219  -2.756
  778   3HD2  LEU  45          3HD2      LEU  45  -4.476  -3.575  -4.362
  779    H    SER  46           H        SER  46  -8.443  -3.487  -4.922
  780    HA   SER  46           HA       SER  46  -6.638  -2.428  -6.979
  781   1HB   SER  46          1HB       SER  46  -8.506  -0.585  -6.832
  782   2HB   SER  46          2HB       SER  46  -8.758  -2.060  -7.759
  783    HG   SER  46           HG       SER  46 -10.290  -1.086  -5.758
  784    H    PHE  47           H        PHE  47  -6.379   0.049  -6.486
  785    HA   PHE  47           HA       PHE  47  -5.549   0.418  -3.678
  786   1HB   PHE  47          1HB       PHE  47  -3.706  -0.164  -5.733
  787   2HB   PHE  47          2HB       PHE  47  -3.605   1.573  -5.534
  788    HD1  PHE  47           1HD      PHE  47  -2.691  -1.641  -4.188
  789    HD2  PHE  47           2HD      PHE  47  -3.253   2.495  -3.085
  790    HE1  PHE  47           1HE      PHE  47  -1.299  -1.987  -2.174
  791    HE2  PHE  47           2HE      PHE  47  -1.899   2.129  -1.054
  792    HZ   PHE  47           HZ       PHE  47  -0.905  -0.111  -0.598
  793    H    VAL  48           H        VAL  48  -5.482   2.504  -2.984
  794    HA   VAL  48           HA       VAL  48  -6.833   4.510  -4.557
  795    HB   VAL  48           HB       VAL  48  -7.796   2.931  -2.186
  796   1HG1  VAL  48          1HG1      VAL  48  -8.027   5.333  -1.455
  797   2HG1  VAL  48          2HG1      VAL  48  -9.123   5.566  -2.844
  798   3HG1  VAL  48          3HG1      VAL  48  -9.525   4.395  -1.581
  799   1HG2  VAL  48          1HG2      VAL  48  -8.633   2.318  -4.410
  800   2HG2  VAL  48          2HG2      VAL  48  -9.938   3.074  -3.500
  801   3HG2  VAL  48          3HG2      VAL  48  -9.079   4.000  -4.748
  802    H    CYS  49           H        CYS  49  -5.414   6.153  -4.508
  803    HA   CYS  49           HA       CYS  49  -3.219   6.365  -2.664
  804   1HB   CYS  49          1HB       CYS  49  -3.004   8.646  -3.770
  805   2HB   CYS  49          2HB       CYS  49  -2.950   7.251  -4.829
  806    HA   PRO  50           HA       PRO  50  -4.979   8.221   0.830
  807   1HB   PRO  50          1HB       PRO  50  -3.157  10.159   1.655
  808   2HB   PRO  50          2HB       PRO  50  -3.009   8.395   1.906
  809   1HG   PRO  50          1HG       PRO  50  -1.802  10.076  -0.307
  810   2HG   PRO  50          2HG       PRO  50  -1.008   8.811   0.686
  811   1HD   PRO  50          1HD       PRO  50  -1.899   8.244  -1.787
  812   2HD   PRO  50          2HD       PRO  50  -2.154   7.072  -0.461
  813    H    TRP  51           H        TRP  51  -4.148  10.420  -1.748
  814    HA   TRP  51           HA       TRP  51  -5.543  12.769  -1.007
  815   1HB   TRP  51          1HB       TRP  51  -3.945  12.751  -2.814
  816   2HB   TRP  51          2HB       TRP  51  -4.833  11.501  -3.673
  817    HD1  TRP  51           HD       TRP  51  -6.293  14.819  -2.282
  818    HE1  TRP  51           1HE      TRP  51  -7.341  16.119  -4.205
  819    HE3  TRP  51           3HE      TRP  51  -4.949  11.753  -6.173
  820    HZ2  TRP  51           2HZ      TRP  51  -7.520  15.918  -7.088
  821    HZ3  TRP  51           3HZ      TRP  51  -5.556  12.355  -8.496
  822    HH2  TRP  51           HH       TRP  51  -6.836  14.430  -8.964
  823    H    CYS  52           H        CYS  52  -6.678  10.130  -3.285
  824    HA   CYS  52           HA       CYS  52  -9.401  11.068  -3.079
  825   1HB   CYS  52          1HB       CYS  52  -9.999   9.102  -4.328
  826   2HB   CYS  52          2HB       CYS  52  -8.587   9.846  -5.013
  827    H    ALA  53           H        ALA  53  -7.417   8.731  -1.255
  828    HA   ALA  53           HA       ALA  53  -9.526   7.320  -0.225
  829   1HB   ALA  53          1HB       ALA  53  -7.108   6.788   0.270
  830   2HB   ALA  53          2HB       ALA  53  -7.041   8.201   1.351
  831   3HB   ALA  53          3HB       ALA  53  -8.076   6.854   1.770
  832    H    THR  54           H        THR  54  -8.071  10.333   0.858
  833    HA   THR  54           HA       THR  54  -9.812  10.955   3.049
  834    HB   THR  54           HB       THR  54  -7.960  12.729   1.397
  835    HG1  THR  54           1HG      THR  54  -6.672  11.171   2.071
  836   1HG2  THR  54          1HG2      THR  54  -7.713  14.024   3.486
  837   2HG2  THR  54          2HG2      THR  54  -8.901  12.974   4.288
  838   3HG2  THR  54          3HG2      THR  54  -9.399  14.025   2.941
  839    H    ASN  55           H        ASN  55  -9.575  12.211  -0.349
  840    HA   ASN  55           HA       ASN  55 -11.853  14.018   0.218
  841   1HB   ASN  55          1HB       ASN  55  -9.908  13.928  -2.131
  842   2HB   ASN  55          2HB       ASN  55 -11.113  15.171  -1.826
  843   1HD2  ASN  55          1HD2      ASN  55  -8.059  13.797  -0.677
  844   2HD2  ASN  55          2HD2      ASN  55  -7.654  15.186   0.350
  845    H    GLN  56           H        GLN  56 -11.319  11.111  -1.461
  846    HA   GLN  56           HA       GLN  56 -12.109  10.008  -3.185
  847   1HB   GLN  56          2HB       GLN  56 -14.218  10.082  -1.822
  848   2HB   GLN  56          3HB       GLN  56 -14.787  11.394  -2.864
  849   1HG   GLN  56          2HG       GLN  56 -14.979   9.977  -4.740
  850   2HG   GLN  56          3HG       GLN  56 -13.750   8.858  -4.148
  851   1HE2  GLN  56          1HE2      GLN  56 -17.162   9.706  -3.975
  852   2HE2  GLN  56          2HE2      GLN  56 -17.648   8.281  -3.071
  Start of MODEL   15
    1   1H    GLY   1          1H        GLY   1 -26.510  11.463   4.261
    2   1HA   GLY   1          1HA       GLY   1 -24.387  11.981   3.230
    3   2HA   GLY   1          2HA       GLY   1 -23.628  10.956   4.475
    4    H    SER   2           H        SER   2 -22.880   9.619   2.439
    5    HA   SER   2           HA       SER   2 -24.914   8.093   1.078
    6   1HB   SER   2          1HB       SER   2 -23.090   6.725   0.277
    7   2HB   SER   2          2HB       SER   2 -22.622   8.426   0.162
    8    HG   SER   2           HG       SER   2 -21.470   6.373   1.550
    9    H    HIS   3           H        HIS   3 -22.742   7.500   3.769
   10    HA   HIS   3           HA       HIS   3 -22.570   6.116   5.488
   11   1HB   HIS   3          1HB       HIS   3 -25.489   5.387   5.136
   12   2HB   HIS   3          2HB       HIS   3 -24.460   4.994   6.515
   13    HD1  HIS   3           1HD      HIS   3 -23.633   7.163   8.029
   14    HD2  HIS   3           2HD      HIS   3 -26.448   7.871   4.981
   15    HE1  HIS   3           1HE      HIS   3 -24.512   9.535   8.392
   16    H    MET   4           H        MET   4 -24.209   4.685   2.678
   17    HA   MET   4           HA       MET   4 -22.771   2.186   2.709
   18   1HB   MET   4          1HB       MET   4 -24.677   2.549   1.218
   19   2HB   MET   4          2HB       MET   4 -23.867   3.920   0.444
   20   1HG   MET   4          1HG       MET   4 -22.131   2.434  -0.450
   21   2HG   MET   4          2HG       MET   4 -22.853   1.049   0.379
   22   1HE   MET   4          1HE       MET   4 -22.491  -0.020  -2.113
   23   2HE   MET   4          2HE       MET   4 -23.338   0.583  -3.557
   24   3HE   MET   4          3HE       MET   4 -22.048   1.553  -2.812
   25    H    ALA   5           H        ALA   5 -20.748   1.755   2.162
   26    HA   ALA   5           HA       ALA   5 -19.269   3.135   0.227
   27   1HB   ALA   5          1HB       ALA   5 -17.185   3.325   1.537
   28   2HB   ALA   5          2HB       ALA   5 -18.421   4.429   2.182
   29   3HB   ALA   5          3HB       ALA   5 -18.056   2.898   3.029
   30    H    GLU   6           H        GLU   6 -17.436   1.655  -0.311
   31    HA   GLU   6           HA       GLU   6 -18.554  -0.957  -0.364
   32   1HB   GLU   6          1HB       GLU   6 -16.038   0.223  -1.619
   33   2HB   GLU   6          2HB       GLU   6 -16.726  -1.344  -2.025
   34   1HG   GLU   6          1HG       GLU   6 -17.364   0.306  -3.687
   35   2HG   GLU   6          2HG       GLU   6 -18.779  -0.324  -2.849
   36    HA   PRO   7           HA       PRO   7 -15.760  -2.976   2.556
   37   1HB   PRO   7          1HB       PRO   7 -16.190  -5.578   1.992
   38   2HB   PRO   7          2HB       PRO   7 -17.521  -4.539   2.574
   39   1HG   PRO   7          1HG       PRO   7 -16.885  -5.287  -0.301
   40   2HG   PRO   7          2HG       PRO   7 -18.463  -5.384   0.542
   41   1HD   PRO   7          1HD       PRO   7 -17.688  -3.241  -1.026
   42   2HD   PRO   7          2HD       PRO   7 -18.799  -3.065   0.360
   43    H    GLN   8           H        GLN   8 -14.258  -1.684   0.940
   44    HA   GLN   8           HA       GLN   8 -12.159  -3.519   0.017
   45   1HB   GLN   8          1HB       GLN   8 -14.019  -3.069  -1.835
   46   2HB   GLN   8          2HB       GLN   8 -13.176  -1.550  -2.035
   47   1HG   GLN   8          1HG       GLN   8 -12.388  -3.188  -3.628
   48   2HG   GLN   8          2HG       GLN   8 -11.085  -2.797  -2.535
   49   1HE2  GLN   8          1HE2      GLN   8 -13.473  -5.111  -1.119
   50   2HE2  GLN   8          2HE2      GLN   8 -12.487  -6.503  -1.560
   51    H    ARG   9           H        ARG   9 -12.999   0.034  -0.415
   52    HA   ARG   9           HA       ARG   9 -10.433   1.011  -0.013
   53   1HB   ARG   9          1HB       ARG   9 -12.402   2.113  -1.059
   54   2HB   ARG   9          2HB       ARG   9 -13.131   2.291   0.517
   55   1HG   ARG   9          1HG       ARG   9 -10.505   3.411   0.007
   56   2HG   ARG   9          2HG       ARG   9 -11.917   4.273  -0.594
   57   1HD   ARG   9          1HD       ARG   9 -11.154   3.712   2.283
   58   2HD   ARG   9          2HD       ARG   9 -11.230   5.279   1.474
   59    HE   ARG   9           HE       ARG   9 -13.485   3.529   2.255
   60   1HH1  ARG   9          1HH1      ARG   9 -12.516   7.034   1.511
   61   2HH1  ARG   9          2HH1      ARG   9 -14.190   7.466   1.662
   62   1HH2  ARG   9          1HH2      ARG   9 -15.621   4.460   2.398
   63   2HH2  ARG   9          2HH2      ARG   9 -15.793   6.183   2.120
   64    H    HIS  10           H        HIS  10  -9.343   0.050   1.712
   65    HA   HIS  10           HA       HIS  10 -10.453   0.491   4.450
   66   1HB   HIS  10          1HB       HIS  10  -8.960  -1.855   3.241
   67   2HB   HIS  10          2HB       HIS  10  -9.264  -1.654   4.969
   68    HD1  HIS  10           1HD      HIS  10 -10.540  -4.055   3.040
   69    HD2  HIS  10           2HD      HIS  10 -12.391  -0.513   4.198
   70    HE1  HIS  10           1HE      HIS  10 -12.997  -4.577   3.171
   71    H    LYS  11           H        LYS  11  -9.025   1.016   6.119
   72    HA   LYS  11           HA       LYS  11  -6.642   2.436   5.096
   73   1HB   LYS  11          1HB       LYS  11  -8.849   3.198   7.019
   74   2HB   LYS  11          2HB       LYS  11  -7.428   4.176   6.670
   75   1HG   LYS  11          1HG       LYS  11  -8.048   4.488   4.363
   76   2HG   LYS  11          2HG       LYS  11  -9.260   3.239   4.402
   77   1HD   LYS  11          1HD       LYS  11 -10.277   5.441   4.348
   78   2HD   LYS  11          2HD       LYS  11 -10.712   4.471   5.747
   79   1HE   LYS  11          1HE       LYS  11 -10.319   6.286   6.920
   80   2HE   LYS  11          2HE       LYS  11  -8.628   5.837   6.834
   81   1HZ   LYS  11          1HZ       LYS  11  -9.168   8.195   6.174
   82   2HZ   LYS  11          2HZ       LYS  11  -9.752   7.591   4.750
   83   3HZ   LYS  11          3HZ       LYS  11  -8.170   7.376   5.213
   84    H    ILE  12           H        ILE  12  -5.082   1.040   5.756
   85    HA   ILE  12           HA       ILE  12  -5.015   0.011   8.531
   86    HB   ILE  12           HB       ILE  12  -2.944  -0.290   6.326
   87   1HG1  ILE  12          1HG1      ILE  12  -5.017  -2.411   6.953
   88   2HG1  ILE  12          2HG1      ILE  12  -5.238  -1.227   5.660
   89   1HG2  ILE  12          1HG2      ILE  12  -3.443  -1.884   8.879
   90   2HG2  ILE  12          2HG2      ILE  12  -2.165  -2.206   7.683
   91   3HG2  ILE  12          3HG2      ILE  12  -2.132  -0.719   8.621
   92   1HD1  ILE  12          1HD1      ILE  12  -3.049  -1.897   4.675
   93   2HD1  ILE  12          2HD1      ILE  12  -3.035  -3.273   5.818
   94   3HD1  ILE  12          3HD1      ILE  12  -4.334  -3.099   4.620
   95    H    LEU  13           H        LEU  13  -4.477   1.711   9.952
   96    HA   LEU  13           HA       LEU  13  -2.554   3.721   9.254
   97   1HB   LEU  13          1HB       LEU  13  -4.282   4.052  10.978
   98   2HB   LEU  13          2HB       LEU  13  -3.443   2.917  12.043
   99    HG   LEU  13           HG       LEU  13  -1.849   5.199  10.821
  100   1HD1  LEU  13          1HD1      LEU  13  -3.859   6.323  11.504
  101   2HD1  LEU  13          2HD1      LEU  13  -2.555   6.696  12.665
  102   3HD1  LEU  13          3HD1      LEU  13  -3.820   5.528  13.096
  103   1HD2  LEU  13          1HD2      LEU  13  -1.810   3.910  13.591
  104   2HD2  LEU  13          2HD2      LEU  13  -0.721   5.198  13.033
  105   3HD2  LEU  13          3HD2      LEU  13  -0.646   3.609  12.289
  106    H    CYS  14           H        CYS  14  -0.562   3.296   8.847
  107    HA   CYS  14           HA       CYS  14   0.953   1.333  10.488
  108   1HB   CYS  14          1HB       CYS  14   0.554   0.726   8.055
  109   2HB   CYS  14          2HB       CYS  14   1.491   2.157   7.597
  110    HG   CYS  14           HG       CYS  14   3.772   1.386   8.264
  111    H    VAL  15           H        VAL  15   3.466   2.067  10.026
  112    HA   VAL  15           HA       VAL  15   3.689   5.002   9.959
  113    HB   VAL  15           HB       VAL  15   5.732   4.849  11.358
  114   1HG1  VAL  15          1HG1      VAL  15   4.566   4.728  13.506
  115   2HG1  VAL  15          2HG1      VAL  15   3.599   5.602  12.315
  116   3HG1  VAL  15          3HG1      VAL  15   3.175   3.928  12.745
  117   1HG2  VAL  15          1HG2      VAL  15   4.782   2.034  12.074
  118   2HG2  VAL  15          2HG2      VAL  15   6.206   2.411  11.075
  119   3HG2  VAL  15          3HG2      VAL  15   6.156   2.915  12.767
  120    H    CYS  16           H        CYS  16   5.708   5.685   9.056
  121    HA   CYS  16           HA       CYS  16   6.389   4.113   6.686
  122   1HB   CYS  16          1HB       CYS  16   5.936   6.669   6.754
  123   2HB   CYS  16          2HB       CYS  16   7.501   6.834   7.572
  124    H    CYS  17           H        CYS  17   8.135   2.666   6.781
  125    HA   CYS  17           HA       CYS  17   9.791   2.741   9.180
  126   1HB   CYS  17          1HB       CYS  17   8.791   0.675   7.850
  127   2HB   CYS  17          2HB       CYS  17  10.366   0.755   7.028
  128    HG   CYS  17           HG       CYS  17  10.373  -1.052   8.898
  129    H    LYS  18           H        LYS  18  10.201   4.556   6.353
  130    HA   LYS  18           HA       LYS  18  13.125   4.522   6.769
  131   1HB   LYS  18          1HB       LYS  18  13.346   5.281   4.674
  132   2HB   LYS  18          2HB       LYS  18  12.027   4.144   4.493
  133   1HG   LYS  18          1HG       LYS  18  11.000   5.806   3.346
  134   2HG   LYS  18          2HG       LYS  18  10.645   6.529   4.906
  135   1HD   LYS  18          1HD       LYS  18  11.734   8.262   3.579
  136   2HD   LYS  18          2HD       LYS  18  12.960   7.702   4.711
  137   1HE   LYS  18          1HE       LYS  18  13.432   5.926   2.789
  138   2HE   LYS  18          2HE       LYS  18  12.633   7.144   1.779
  139   1HZ   LYS  18          1HZ       LYS  18  14.310   8.756   2.576
  140   2HZ   LYS  18          2HZ       LYS  18  14.975   7.601   1.774
  141   3HZ   LYS  18          3HZ       LYS  18  15.088   7.475   3.423
  142    H    CYS  19           H        CYS  19  10.264   6.546   7.408
  143    HA   CYS  19           HA       CYS  19  12.074   8.672   8.352
  144   1HB   CYS  19          1HB       CYS  19  10.421  10.230   7.421
  145   2HB   CYS  19          2HB       CYS  19  11.373   9.365   6.227
  146    H    ASP  20           H        ASP  20   9.889   6.438   9.428
  147    HA   ASP  20           HA       ASP  20   8.482   6.198  11.061
  148   1HB   ASP  20          1HB       ASP  20  10.686   6.489  12.200
  149   2HB   ASP  20          2HB       ASP  20  10.216   8.149  12.589
  150    H    GLY  21           H        GLY  21   7.379   7.824   9.269
  151   1HA   GLY  21          1HA       GLY  21   5.873   9.882  10.850
  152   2HA   GLY  21          2HA       GLY  21   5.823   9.732   9.094
  153    H    ARG  22           H        ARG  22   3.679   9.677  11.014
  154    HA   ARG  22           HA       ARG  22   2.440   7.024  11.044
  155   1HB   ARG  22          1HB       ARG  22   1.734   8.691  12.640
  156   2HB   ARG  22          2HB       ARG  22   1.373   9.866  11.386
  157   1HG   ARG  22          1HG       ARG  22  -0.149   7.232  11.606
  158   2HG   ARG  22          2HG       ARG  22  -0.563   8.663  12.556
  159   1HD   ARG  22          1HD       ARG  22  -0.679   9.943  10.317
  160   2HD   ARG  22          2HD       ARG  22  -0.718   8.349   9.543
  161    HE   ARG  22           HE       ARG  22  -2.656   8.289  11.529
  162   1HH1  ARG  22          1HH1      ARG  22  -2.050  10.139   8.589
  163   2HH1  ARG  22          2HH1      ARG  22  -3.717  10.413   8.208
  164   1HH2  ARG  22          1HH2      ARG  22  -4.898   8.709  11.104
  165   2HH2  ARG  22          2HH2      ARG  22  -5.365   9.584   9.692
  166    H    ILE  23           H        ILE  23   1.410   6.008   9.325
  167    HA   ILE  23           HA       ILE  23   0.537   7.764   7.103
  168    HB   ILE  23           HB       ILE  23   1.446   4.951   6.559
  169   1HG1  ILE  23          1HG1      ILE  23   3.350   7.261   6.107
  170   2HG1  ILE  23          2HG1      ILE  23   3.501   6.094   7.423
  171   1HG2  ILE  23          1HG2      ILE  23   1.412   5.925   4.218
  172   2HG2  ILE  23          2HG2      ILE  23  -0.081   6.338   5.034
  173   3HG2  ILE  23          3HG2      ILE  23   1.197   7.547   4.903
  174   1HD1  ILE  23          1HD1      ILE  23   3.382   5.217   4.505
  175   2HD1  ILE  23          2HD1      ILE  23   4.861   5.465   5.382
  176   3HD1  ILE  23          3HD1      ILE  23   3.729   4.225   5.934
  177    H    GLU  24           H        GLU  24  -1.630   7.595   6.923
  178    HA   GLU  24           HA       GLU  24  -3.002   5.123   7.782
  179   1HB   GLU  24          1HB       GLU  24  -4.111   7.166   8.331
  180   2HB   GLU  24          2HB       GLU  24  -4.040   7.749   6.662
  181   1HG   GLU  24          1HG       GLU  24  -5.267   5.034   7.178
  182   2HG   GLU  24          2HG       GLU  24  -6.163   6.441   7.745
  183    H    LEU  25           H        LEU  25  -2.657   3.448   6.421
  184    HA   LEU  25           HA       LEU  25  -2.030   3.930   3.611
  185   1HB   LEU  25          1HB       LEU  25  -2.305   1.273   5.040
  186   2HB   LEU  25          2HB       LEU  25  -1.569   1.590   3.484
  187    HG   LEU  25           HG       LEU  25  -0.526   2.425   6.226
  188   1HD1  LEU  25          1HD1      LEU  25   0.436   0.388   4.156
  189   2HD1  LEU  25          2HD1      LEU  25  -0.283   0.028   5.739
  190   3HD1  LEU  25          3HD1      LEU  25   1.296   0.825   5.645
  191   1HD2  LEU  25          1HD2      LEU  25   0.004   4.113   4.531
  192   2HD2  LEU  25          2HD2      LEU  25   0.613   2.878   3.434
  193   3HD2  LEU  25          3HD2      LEU  25   1.458   3.223   4.975
  194    H    THR  26           H        THR  26  -4.056   4.642   2.714
  195    HA   THR  26           HA       THR  26  -6.311   2.834   2.940
  196    HB   THR  26           HB       THR  26  -5.937   4.886   0.772
  197    HG1  THR  26           1HG      THR  26  -6.299   5.430   3.434
  198   1HG2  THR  26          1HG2      THR  26  -8.299   3.372   2.020
  199   2HG2  THR  26          2HG2      THR  26  -7.636   3.121   0.391
  200   3HG2  THR  26          3HG2      THR  26  -8.471   4.614   0.790
  201    H    VAL  27           H        VAL  27  -6.159   0.862   2.065
  202    HA   VAL  27           HA       VAL  27  -5.017   0.545  -0.655
  203    HB   VAL  27           HB       VAL  27  -3.915  -1.649  -0.070
  204   1HG1  VAL  27          1HG1      VAL  27  -3.262   0.164   2.294
  205   2HG1  VAL  27          2HG1      VAL  27  -2.229  -0.997   1.443
  206   3HG1  VAL  27          3HG1      VAL  27  -2.726   0.512   0.653
  207   1HG2  VAL  27          1HG2      VAL  27  -5.170  -1.225   2.727
  208   2HG2  VAL  27          2HG2      VAL  27  -5.652  -2.467   1.568
  209   3HG2  VAL  27          3HG2      VAL  27  -4.033  -2.507   2.271
  210    H    GLU  28           H        GLU  28  -6.478  -0.832  -2.006
  211    HA   GLU  28           HA       GLU  28  -9.169  -0.693  -0.747
  212   1HB   GLU  28          1HB       GLU  28  -8.322   0.740  -2.815
  213   2HB   GLU  28          2HB       GLU  28  -8.661  -0.734  -3.665
  214   1HG   GLU  28          1HG       GLU  28 -11.006  -0.575  -2.449
  215   2HG   GLU  28          2HG       GLU  28 -10.522   1.095  -2.184
  216    H    SER  29           H        SER  29  -9.357  -2.749   0.218
  217    HA   SER  29           HA       SER  29  -8.642  -5.124  -1.378
  218   1HB   SER  29          1HB       SER  29  -7.566  -4.218   1.318
  219   2HB   SER  29          2HB       SER  29  -7.141  -5.691   0.445
  220    HG   SER  29           HG       SER  29  -6.697  -3.739  -1.220
  221    H    SER  30           H        SER  30  -9.932  -6.796  -0.893
  222    HA   SER  30           HA       SER  30 -12.118  -6.713   0.928
  223   1HB   SER  30          1HB       SER  30 -10.613  -9.165  -0.110
  224   2HB   SER  30          2HB       SER  30 -12.248  -9.160   0.568
  225    HG   SER  30           HG       SER  30 -12.048  -9.049  -1.821
  226    H    ALA  31           H        ALA  31 -12.354  -7.509   3.070
  227    HA   ALA  31           HA       ALA  31 -10.352  -6.728   4.688
  228   1HB   ALA  31          1HB       ALA  31 -12.484  -8.789   5.418
  229   2HB   ALA  31          2HB       ALA  31 -11.593  -7.762   6.558
  230   3HB   ALA  31          3HB       ALA  31 -12.712  -7.019   5.395
  231    H    GLU  32           H        GLU  32 -10.658 -10.160   3.631
  232    HA   GLU  32           HA       GLU  32  -8.497 -10.716   5.467
  233   1HB   GLU  32          1HB       GLU  32 -10.773 -12.055   5.256
  234   2HB   GLU  32          2HB       GLU  32  -9.754 -13.024   4.150
  235   1HG   GLU  32          1HG       GLU  32  -8.013 -13.148   5.938
  236   2HG   GLU  32          2HG       GLU  32  -8.996 -12.121   6.979
  237    H    ASP  33           H        ASP  33  -8.928 -10.176   2.196
  238    HA   ASP  33           HA       ASP  33  -6.454 -11.328   1.270
  239   1HB   ASP  33          1HB       ASP  33  -8.540 -10.743  -0.082
  240   2HB   ASP  33          2HB       ASP  33  -8.108  -9.047   0.127
  241    H    LEU  34           H        LEU  34  -7.750  -8.314   2.638
  242    HA   LEU  34           HA       LEU  34  -5.321  -6.768   2.733
  243   1HB   LEU  34          1HB       LEU  34  -7.407  -5.684   2.918
  244   2HB   LEU  34          2HB       LEU  34  -7.917  -6.622   4.288
  245    HG   LEU  34           HG       LEU  34  -5.393  -4.995   4.596
  246   1HD1  LEU  34          1HD1      LEU  34  -6.951  -3.433   3.493
  247   2HD1  LEU  34          2HD1      LEU  34  -6.830  -3.005   5.202
  248   3HD1  LEU  34          3HD1      LEU  34  -8.248  -3.895   4.618
  249   1HD2  LEU  34          1HD2      LEU  34  -7.726  -5.629   6.472
  250   2HD2  LEU  34          2HD2      LEU  34  -6.337  -4.603   6.884
  251   3HD2  LEU  34          3HD2      LEU  34  -6.090  -6.311   6.554
  252    H    ARG  35           H        ARG  35  -6.900  -8.802   4.962
  253    HA   ARG  35           HA       ARG  35  -5.079  -8.792   7.153
  254   1HB   ARG  35          1HB       ARG  35  -7.317  -9.979   7.175
  255   2HB   ARG  35          2HB       ARG  35  -6.551 -11.300   6.283
  256   1HG   ARG  35          1HG       ARG  35  -4.887 -11.535   8.138
  257   2HG   ARG  35          2HG       ARG  35  -5.807 -10.334   9.062
  258   1HD   ARG  35          1HD       ARG  35  -7.780 -11.846   9.013
  259   2HD   ARG  35          2HD       ARG  35  -6.866 -13.006   8.022
  260    HE   ARG  35           HE       ARG  35  -5.407 -12.393  10.370
  261   1HH1  ARG  35          1HH1      ARG  35  -8.260 -14.386   9.336
  262   2HH1  ARG  35          2HH1      ARG  35  -8.106 -15.443  10.677
  263   1HH2  ARG  35          1HH2      ARG  35  -5.234 -13.873  12.083
  264   2HH2  ARG  35          2HH2      ARG  35  -6.359 -15.173  12.245
  265    H    THR  36           H        THR  36  -5.191 -10.997   4.353
  266    HA   THR  36           HA       THR  36  -2.807 -12.413   4.898
  267    HB   THR  36           HB       THR  36  -3.967 -11.736   2.156
  268    HG1  THR  36           1HG      THR  36  -5.547 -12.723   3.443
  269   1HG2  THR  36          1HG2      THR  36  -2.230 -14.067   3.079
  270   2HG2  THR  36          2HG2      THR  36  -1.702 -12.736   2.021
  271   3HG2  THR  36          3HG2      THR  36  -2.947 -13.866   1.465
  272    H    LEU  37           H        LEU  37  -3.200  -9.461   2.809
  273    HA   LEU  37           HA       LEU  37  -0.442  -9.128   2.443
  274   1HB   LEU  37          1HB       LEU  37  -0.971  -7.470   1.128
  275   2HB   LEU  37          2HB       LEU  37  -2.609  -7.955   1.418
  276    HG   LEU  37           HG       LEU  37  -2.374  -6.158   3.453
  277   1HD1  LEU  37          1HD1      LEU  37   0.056  -5.625   2.890
  278   2HD1  LEU  37          2HD1      LEU  37  -0.979  -4.208   2.700
  279   3HD1  LEU  37          3HD1      LEU  37  -0.438  -5.116   1.292
  280   1HD2  LEU  37          1HD2      LEU  37  -3.627  -4.683   2.163
  281   2HD2  LEU  37          2HD2      LEU  37  -3.944  -6.236   1.371
  282   3HD2  LEU  37          3HD2      LEU  37  -2.802  -5.122   0.651
  283    H    GLN  38           H        GLN  38  -2.500  -8.182   5.215
  284    HA   GLN  38           HA       GLN  38  -0.533  -6.607   6.532
  285   1HB   GLN  38          1HB       GLN  38  -2.890  -6.370   6.904
  286   2HB   GLN  38          2HB       GLN  38  -3.022  -8.011   7.516
  287   1HG   GLN  38          1HG       GLN  38  -1.611  -7.442   9.454
  288   2HG   GLN  38          2HG       GLN  38  -1.501  -5.773   8.870
  289   1HE2  GLN  38          1HE2      GLN  38  -3.778  -4.724   8.389
  290   2HE2  GLN  38          2HE2      GLN  38  -5.089  -5.230   9.446
  291    H    GLN  39           H        GLN  39  -1.102 -10.156   6.326
  292    HA   GLN  39           HA       GLN  39   0.639 -10.786   8.505
  293   1HB   GLN  39          1HB       GLN  39   0.015 -12.607   6.174
  294   2HB   GLN  39          2HB       GLN  39   0.667 -13.026   7.748
  295   1HG   GLN  39          1HG       GLN  39  -2.137 -12.271   7.020
  296   2HG   GLN  39          2HG       GLN  39  -1.563 -13.694   7.841
  297   1HE2  GLN  39          1HE2      GLN  39  -2.700 -10.461   8.199
  298   2HE2  GLN  39          2HE2      GLN  39  -2.650 -10.376   9.968
  299    H    LEU  40           H        LEU  40   1.006 -10.230   4.972
  300    HA   LEU  40           HA       LEU  40   3.883 -10.555   4.876
  301   1HB   LEU  40          1HB       LEU  40   2.559  -8.318   3.427
  302   2HB   LEU  40          2HB       LEU  40   3.966  -9.260   3.031
  303    HG   LEU  40           HG       LEU  40   1.182 -10.422   2.950
  304   1HD1  LEU  40          1HD1      LEU  40   2.835  -9.327   0.651
  305   2HD1  LEU  40          2HD1      LEU  40   1.448  -8.499   1.369
  306   3HD1  LEU  40          3HD1      LEU  40   1.221 -10.057   0.546
  307   1HD2  LEU  40          1HD2      LEU  40   2.187 -12.135   1.522
  308   2HD2  LEU  40          2HD2      LEU  40   2.962 -12.115   3.119
  309   3HD2  LEU  40          3HD2      LEU  40   3.782 -11.383   1.711
  310    H    PHE  41           H        PHE  41   1.990  -7.652   5.824
  311    HA   PHE  41           HA       PHE  41   4.267  -6.114   6.630
  312   1HB   PHE  41          1HB       PHE  41   1.367  -5.958   7.375
  313   2HB   PHE  41          2HB       PHE  41   2.563  -5.027   8.242
  314    HD1  PHE  41           1HD      PHE  41   2.644  -2.806   7.613
  315    HD2  PHE  41           2HD      PHE  41   2.018  -5.776   4.543
  316    HE1  PHE  41           1HE      PHE  41   2.638  -1.043   5.889
  317    HE2  PHE  41           2HE      PHE  41   2.035  -4.007   2.830
  318    HZ   PHE  41           HZ       PHE  41   2.347  -1.632   3.488
  319    H    LEU  42           H        LEU  42   2.320  -8.361   8.553
  320    HA   LEU  42           HA       LEU  42   3.772  -8.159  10.960
  321   1HB   LEU  42          1HB       LEU  42   1.565  -9.157  10.642
  322   2HB   LEU  42          2HB       LEU  42   2.262 -10.482   9.725
  323    HG   LEU  42           HG       LEU  42   3.250 -10.109  12.532
  324   1HD1  LEU  42          1HD1      LEU  42   0.813  -9.832  12.757
  325   2HD1  LEU  42          2HD1      LEU  42   1.312 -11.408  13.385
  326   3HD1  LEU  42          3HD1      LEU  42   0.533 -11.299  11.790
  327   1HD2  LEU  42          1HD2      LEU  42   3.250 -12.594  12.458
  328   2HD2  LEU  42          2HD2      LEU  42   4.157 -11.953  11.089
  329   3HD2  LEU  42          3HD2      LEU  42   2.510 -12.565  10.843
  330    H    SER  43           H        SER  43   4.568 -10.001   7.977
  331    HA   SER  43           HA       SER  43   6.710 -11.476   9.178
  332   1HB   SER  43          1HB       SER  43   5.468 -12.081   7.076
  333   2HB   SER  43          2HB       SER  43   6.328 -10.779   6.238
  334    HG   SER  43           HG       SER  43   7.388 -12.760   5.998
  335    H    THR  44           H        THR  44   6.952  -8.781   6.770
  336    HA   THR  44           HA       THR  44   9.030  -7.541   8.351
  337    HB   THR  44           HB       THR  44  10.683  -7.388   6.571
  338    HG1  THR  44           1HG      THR  44  10.114  -7.608   4.595
  339   1HG2  THR  44          1HG2      THR  44  11.449  -9.659   6.347
  340   2HG2  THR  44          2HG2      THR  44   9.841 -10.300   6.741
  341   3HG2  THR  44          3HG2      THR  44  10.781  -9.431   7.982
  342    H    LEU  45           H        LEU  45   6.449  -7.278   6.207
  343    HA   LEU  45           HA       LEU  45   7.455  -5.156   4.622
  344   1HB   LEU  45          1HB       LEU  45   4.946  -6.740   4.779
  345   2HB   LEU  45          2HB       LEU  45   4.719  -5.179   4.131
  346    HG   LEU  45           HG       LEU  45   6.723  -5.723   2.644
  347   1HD1  LEU  45          1HD1      LEU  45   7.349  -7.756   4.129
  348   2HD1  LEU  45          2HD1      LEU  45   7.471  -7.937   2.429
  349   3HD1  LEU  45          3HD1      LEU  45   6.063  -8.607   3.283
  350   1HD2  LEU  45          1HD2      LEU  45   5.283  -6.820   1.003
  351   2HD2  LEU  45          2HD2      LEU  45   4.440  -5.517   1.842
  352   3HD2  LEU  45          3HD2      LEU  45   4.115  -7.202   2.263
  353    H    SER  46           H        SER  46   6.991  -3.004   4.389
  354    HA   SER  46           HA       SER  46   5.087  -1.739   6.175
  355   1HB   SER  46          1HB       SER  46   6.829  -0.011   6.733
  356   2HB   SER  46          2HB       SER  46   7.010  -1.612   7.492
  357    HG   SER  46           HG       SER  46   8.665  -0.283   5.614
  358    H    PHE  47           H        PHE  47   5.281   0.830   5.437
  359    HA   PHE  47           HA       PHE  47   5.075   0.778   2.483
  360   1HB   PHE  47          1HB       PHE  47   2.900   0.871   3.975
  361   2HB   PHE  47          2HB       PHE  47   3.407   2.504   4.297
  362    HD1  PHE  47           1HD      PHE  47   2.015   0.212   1.774
  363    HD2  PHE  47           2HD      PHE  47   3.454   4.209   2.466
  364    HE1  PHE  47           1HE      PHE  47   1.038   0.946  -0.379
  365    HE2  PHE  47           2HE      PHE  47   2.520   4.930   0.290
  366    HZ   PHE  47           HZ       PHE  47   1.305   3.297  -1.141
  367    H    VAL  48           H        VAL  48   5.625   2.801   1.546
  368    HA   VAL  48           HA       VAL  48   6.826   4.746   3.308
  369    HB   VAL  48           HB       VAL  48   8.502   5.042   1.297
  370   1HG1  VAL  48          1HG1      VAL  48   9.201   4.479   3.616
  371   2HG1  VAL  48          2HG1      VAL  48   8.690   2.827   3.350
  372   3HG1  VAL  48          3HG1      VAL  48  10.086   3.479   2.460
  373   1HG2  VAL  48          1HG2      VAL  48   7.499   3.604  -0.091
  374   2HG2  VAL  48          2HG2      VAL  48   9.233   3.329   0.185
  375   3HG2  VAL  48          3HG2      VAL  48   8.020   2.215   0.923
  376    H    CYS  49           H        CYS  49   5.565   6.293   3.341
  377    HA   CYS  49           HA       CYS  49   3.273   6.827   1.814
  378   1HB   CYS  49          1HB       CYS  49   3.638   9.160   2.935
  379   2HB   CYS  49          2HB       CYS  49   3.401   7.746   3.942
  380    HA   PRO  50           HA       PRO  50   4.656   8.508  -1.945
  381   1HB   PRO  50          1HB       PRO  50   2.894  10.620  -2.477
  382   2HB   PRO  50          2HB       PRO  50   2.601   8.880  -2.763
  383   1HG   PRO  50          1HG       PRO  50   1.800  10.542  -0.361
  384   2HG   PRO  50          2HG       PRO  50   0.808   9.359  -1.275
  385   1HD   PRO  50          1HD       PRO  50   1.954   8.636   1.035
  386   2HD   PRO  50          2HD       PRO  50   2.012   7.519  -0.361
  387    H    TRP  51           H        TRP  51   4.360  10.858   0.663
  388    HA   TRP  51           HA       TRP  51   6.068  12.931  -0.262
  389   1HB   TRP  51          1HB       TRP  51   4.920  13.350   1.751
  390   2HB   TRP  51          2HB       TRP  51   5.320  11.775   2.429
  391    HD1  TRP  51           HD       TRP  51   7.769  14.451   1.107
  392    HE1  TRP  51           1HE      TRP  51   9.622  14.770   2.787
  393    HE3  TRP  51           3HE      TRP  51   5.864  11.572   4.896
  394    HZ2  TRP  51           2HZ      TRP  51  10.161  13.997   5.561
  395    HZ3  TRP  51           3HZ      TRP  51   7.080  11.382   7.045
  396    HH2  TRP  51           HH       TRP  51   9.223  12.582   7.389
  397    H    CYS  52           H        CYS  52   6.898   9.907   1.585
  398    HA   CYS  52           HA       CYS  52   9.738  10.525   1.428
  399   1HB   CYS  52          1HB       CYS  52   9.893   9.039   3.123
  400   2HB   CYS  52          2HB       CYS  52   8.132   9.242   3.187
  401    H    ALA  53           H        ALA  53   7.358   8.661  -0.341
  402    HA   ALA  53           HA       ALA  53   9.093   7.010  -1.737
  403   1HB   ALA  53          1HB       ALA  53   6.619   6.871  -1.929
  404   2HB   ALA  53          2HB       ALA  53   6.624   8.378  -2.883
  405   3HB   ALA  53          3HB       ALA  53   7.416   6.945  -3.520
  406    H    THR  54           H        THR  54   7.923  10.289  -2.396
  407    HA   THR  54           HA       THR  54   9.481  10.856  -4.711
  408    HB   THR  54           HB       THR  54   8.110  12.787  -2.782
  409    HG1  THR  54           1HG      THR  54   6.540  11.380  -3.337
  410   1HG2  THR  54          1HG2      THR  54   7.768  14.162  -4.804
  411   2HG2  THR  54          2HG2      THR  54   8.676  12.981  -5.773
  412   3HG2  THR  54          3HG2      THR  54   9.496  13.913  -4.500
  413    H    ASN  55           H        ASN  55   9.878  11.832  -1.244
  414    HA   ASN  55           HA       ASN  55  12.248  13.443  -1.734
  415   1HB   ASN  55          1HB       ASN  55  11.116  12.180   0.812
  416   2HB   ASN  55          2HB       ASN  55  12.591  13.130   0.781
  417   1HD2  ASN  55          1HD2      ASN  55   9.899  14.006  -1.328
  418   2HD2  ASN  55          2HD2      ASN  55   9.496  15.466  -0.448
  419    H    GLN  56           H        GLN  56  11.674  10.121  -0.841
  420    HA   GLN  56           HA       GLN  56  12.937   8.269  -0.727
  421   1HB   GLN  56          2HB       GLN  56  13.373   8.947  -3.102
  422   2HB   GLN  56          3HB       GLN  56  14.892   9.679  -2.588
  423   1HG   GLN  56          2HG       GLN  56  15.870   7.569  -2.101
  424   2HG   GLN  56          3HG       GLN  56  14.306   6.758  -2.019
  425   1HE2  GLN  56          1HE2      GLN  56  16.753   8.116  -4.213
  426   2HE2  GLN  56          2HE2      GLN  56  16.116   7.357  -5.664
  427   1H    GLY   1          1H        GLY   1  14.129   0.526   4.669
  428   1HA   GLY   1          1HA       GLY   1  14.331   2.649   6.690
  429   2HA   GLY   1          2HA       GLY   1  15.534   1.370   6.399
  430    H    SER   2           H        SER   2  17.333   2.541   5.506
  431    HA   SER   2           HA       SER   2  17.109   3.775   2.937
  432   1HB   SER   2          1HB       SER   2  17.292   5.575   5.407
  433   2HB   SER   2          2HB       SER   2  17.771   6.112   3.786
  434    HG   SER   2           HG       SER   2  15.315   4.845   3.983
  435    H    HIS   3           H        HIS   3  19.196   5.069   2.529
  436    HA   HIS   3           HA       HIS   3  21.367   5.332   2.330
  437   1HB   HIS   3          1HB       HIS   3  21.736   4.177   5.108
  438   2HB   HIS   3          2HB       HIS   3  22.871   5.167   4.197
  439    HD1  HIS   3           1HD      HIS   3  21.987   7.814   3.753
  440    HD2  HIS   3           2HD      HIS   3  19.917   5.432   6.546
  441    HE1  HIS   3           1HE      HIS   3  20.526   9.395   5.132
  442    H    MET   4           H        MET   4  20.714   2.146   3.789
  443    HA   MET   4           HA       MET   4  22.581   0.745   2.015
  444   1HB   MET   4          1HB       MET   4  21.878  -0.246   4.166
  445   2HB   MET   4          2HB       MET   4  20.185  -0.182   3.674
  446   1HG   MET   4          1HG       MET   4  21.197  -2.445   3.468
  447   2HG   MET   4          2HG       MET   4  20.520  -1.833   1.969
  448   1HE   MET   4          1HE       MET   4  24.090  -0.890   3.559
  449   2HE   MET   4          2HE       MET   4  23.804  -2.597   3.982
  450   3HE   MET   4          3HE       MET   4  25.077  -2.166   2.818
  451    H    ALA   5           H        ALA   5  22.014  -0.163   0.007
  452    HA   ALA   5           HA       ALA   5  19.621   0.699  -1.350
  453   1HB   ALA   5          1HB       ALA   5  20.541  -0.691  -3.193
  454   2HB   ALA   5          2HB       ALA   5  21.710   0.513  -2.604
  455   3HB   ALA   5          3HB       ALA   5  21.872  -1.198  -2.131
  456    H    GLU   6           H        GLU   6  18.185  -0.198   0.337
  457    HA   GLU   6           HA       GLU   6  18.374  -2.815   1.225
  458   1HB   GLU   6          1HB       GLU   6  15.765  -1.281   1.037
  459   2HB   GLU   6          2HB       GLU   6  16.151  -2.613   2.137
  460   1HG   GLU   6          1HG       GLU   6  17.941  -1.184   3.164
  461   2HG   GLU   6          2HG       GLU   6  17.401   0.157   2.150
  462    HA   PRO   7           HA       PRO   7  16.137  -5.167  -1.997
  463   1HB   PRO   7          1HB       PRO   7  16.125  -7.604  -0.840
  464   2HB   PRO   7          2HB       PRO   7  17.672  -6.834  -1.289
  465   1HG   PRO   7          1HG       PRO   7  16.344  -6.862   1.446
  466   2HG   PRO   7          2HG       PRO   7  18.041  -7.278   1.037
  467   1HD   PRO   7          1HD       PRO   7  17.189  -4.764   1.895
  468   2HD   PRO   7          2HD       PRO   7  18.634  -5.006   0.872
  469    H    GLN   8           H        GLN   8  14.662  -3.336  -0.437
  470    HA   GLN   8           HA       GLN   8  12.238  -4.813   0.354
  471   1HB   GLN   8          1HB       GLN   8  14.025  -4.583   2.326
  472   2HB   GLN   8          2HB       GLN   8  13.358  -2.965   2.446
  473   1HG   GLN   8          1HG       GLN   8  12.174  -4.300   3.981
  474   2HG   GLN   8          2HG       GLN   8  11.060  -4.034   2.665
  475   1HE2  GLN   8          1HE2      GLN   8  13.021  -6.470   1.278
  476   2HE2  GLN   8          2HE2      GLN   8  12.109  -7.804   1.951
  477    H    ARG   9           H        ARG   9  13.400  -1.400   0.919
  478    HA   ARG   9           HA       ARG   9  11.021  -0.168   0.230
  479   1HB   ARG   9          1HB       ARG   9  13.110   0.743   1.351
  480   2HB   ARG   9          2HB       ARG   9  13.726   1.061  -0.256
  481   1HG   ARG   9          1HG       ARG   9  11.160   2.097   0.620
  482   2HG   ARG   9          2HG       ARG   9  12.654   2.954   0.968
  483   1HD   ARG   9          1HD       ARG   9  13.105   2.890  -1.542
  484   2HD   ARG   9          2HD       ARG   9  11.412   2.399  -1.754
  485    HE   ARG   9           HE       ARG   9  11.227   4.651  -0.199
  486   1HH1  ARG   9          1HH1      ARG   9  12.755   3.932  -3.272
  487   2HH1  ARG   9          2HH1      ARG   9  12.857   5.583  -3.808
  488   1HH2  ARG   9          1HH2      ARG   9  11.147   6.927  -0.998
  489   2HH2  ARG   9          2HH2      ARG   9  11.466   7.192  -2.652
  490    H    HIS  10           H        HIS  10   9.950  -1.074  -1.550
  491    HA   HIS  10           HA       HIS  10  11.162  -0.716  -4.238
  492   1HB   HIS  10          1HB       HIS  10   9.439  -2.948  -3.104
  493   2HB   HIS  10          2HB       HIS  10   9.880  -2.785  -4.798
  494    HD1  HIS  10           1HD      HIS  10  10.846  -5.223  -2.742
  495    HD2  HIS  10           2HD      HIS  10  13.016  -1.886  -3.934
  496    HE1  HIS  10           1HE      HIS  10  13.253  -5.981  -2.852
  497    H    LYS  11           H        LYS  11   9.202  -1.180  -5.920
  498    HA   LYS  11           HA       LYS  11   7.097   0.807  -5.331
  499   1HB   LYS  11          1HB       LYS  11   9.247   1.095  -7.473
  500   2HB   LYS  11          2HB       LYS  11   7.764   2.028  -7.382
  501   1HG   LYS  11          1HG       LYS  11   8.918   3.535  -6.163
  502   2HG   LYS  11          2HG       LYS  11   8.713   2.418  -4.852
  503   1HD   LYS  11          1HD       LYS  11  11.011   3.040  -4.876
  504   2HD   LYS  11          2HD       LYS  11  10.942   1.379  -5.448
  505   1HE   LYS  11          1HE       LYS  11  12.518   2.594  -6.806
  506   2HE   LYS  11          2HE       LYS  11  11.116   2.185  -7.803
  507   1HZ   LYS  11          1HZ       LYS  11  11.870   4.470  -8.122
  508   2HZ   LYS  11          2HZ       LYS  11  11.521   4.837  -6.551
  509   3HZ   LYS  11          3HZ       LYS  11  10.327   4.426  -7.609
  510    H    ILE  12           H        ILE  12   5.377  -0.434  -5.763
  511    HA   ILE  12           HA       ILE  12   5.234  -1.942  -8.337
  512    HB   ILE  12           HB       ILE  12   3.170  -1.693  -6.114
  513   1HG1  ILE  12          1HG1      ILE  12   4.981  -4.047  -6.662
  514   2HG1  ILE  12          2HG1      ILE  12   5.191  -2.887  -5.345
  515   1HG2  ILE  12          1HG2      ILE  12   3.305  -3.520  -8.562
  516   2HG2  ILE  12          2HG2      ILE  12   2.020  -3.530  -7.330
  517   3HG2  ILE  12          3HG2      ILE  12   2.215  -2.135  -8.374
  518   1HD1  ILE  12          1HD1      ILE  12   2.888  -3.444  -4.514
  519   2HD1  ILE  12          2HD1      ILE  12   2.887  -4.822  -5.652
  520   3HD1  ILE  12          3HD1      ILE  12   4.092  -4.722  -4.357
  521    H    LEU  13           H        LEU  13   4.973  -0.356  -9.983
  522    HA   LEU  13           HA       LEU  13   3.396   1.996  -9.540
  523   1HB   LEU  13          1HB       LEU  13   5.286   1.867 -11.145
  524   2HB   LEU  13          2HB       LEU  13   4.304   0.845 -12.201
  525    HG   LEU  13           HG       LEU  13   3.107   3.457 -11.213
  526   1HD1  LEU  13          1HD1      LEU  13   5.336   4.134 -11.783
  527   2HD1  LEU  13          2HD1      LEU  13   4.214   4.683 -13.050
  528   3HD1  LEU  13          3HD1      LEU  13   5.256   3.270 -13.340
  529   1HD2  LEU  13          1HD2      LEU  13   3.010   2.059 -13.927
  530   2HD2  LEU  13          2HD2      LEU  13   2.130   3.537 -13.478
  531   3HD2  LEU  13          3HD2      LEU  13   1.735   2.013 -12.695
  532    H    CYS  14           H        CYS  14   1.355   2.035  -9.407
  533    HA   CYS  14           HA       CYS  14  -0.386   0.178 -10.928
  534   1HB   CYS  14          1HB       CYS  14  -0.190  -0.293  -8.433
  535   2HB   CYS  14          2HB       CYS  14  -0.890   1.303  -8.129
  536    HG   CYS  14           HG       CYS  14  -3.237   0.869  -8.852
  537    H    VAL  15           H        VAL  15  -2.757   1.363 -10.699
  538    HA   VAL  15           HA       VAL  15  -2.436   4.288 -10.793
  539    HB   VAL  15           HB       VAL  15  -4.498   4.414 -12.180
  540   1HG1  VAL  15          1HG1      VAL  15  -3.375   4.043 -14.312
  541   2HG1  VAL  15          2HG1      VAL  15  -2.277   4.792 -13.147
  542   3HG1  VAL  15          3HG1      VAL  15  -2.123   3.058 -13.519
  543   1HG2  VAL  15          1HG2      VAL  15  -4.008   1.459 -12.774
  544   2HG2  VAL  15          2HG2      VAL  15  -5.363   2.107 -11.815
  545   3HG2  VAL  15          3HG2      VAL  15  -5.213   2.519 -13.526
  546    H    CYS  16           H        CYS  16  -4.243   5.415  -9.892
  547    HA   CYS  16           HA       CYS  16  -5.389   4.181  -7.529
  548   1HB   CYS  16          1HB       CYS  16  -4.879   6.694  -7.823
  549   2HB   CYS  16          2HB       CYS  16  -6.290   6.750  -8.894
  550    H    CYS  17           H        CYS  17  -7.286   3.157  -7.358
  551    HA   CYS  17           HA       CYS  17  -8.690   2.088  -9.517
  552   1HB   CYS  17          1HB       CYS  17  -8.647   1.376  -7.043
  553   2HB   CYS  17          2HB       CYS  17  -9.911   2.584  -6.766
  554    HG   CYS  17           HG       CYS  17 -10.958   0.269  -6.847
  555    H    LYS  18           H        LYS  18  -9.404   5.120  -7.736
  556    HA   LYS  18           HA       LYS  18 -11.827   5.497  -9.403
  557   1HB   LYS  18          1HB       LYS  18 -12.562   6.995  -7.677
  558   2HB   LYS  18          2HB       LYS  18 -12.197   5.410  -6.996
  559   1HG   LYS  18          1HG       LYS  18 -10.118   6.233  -6.022
  560   2HG   LYS  18          2HG       LYS  18 -10.234   7.740  -6.915
  561   1HD   LYS  18          1HD       LYS  18 -10.973   8.427  -4.857
  562   2HD   LYS  18          2HD       LYS  18 -12.509   8.087  -5.632
  563   1HE   LYS  18          1HE       LYS  18 -12.649   5.927  -4.492
  564   2HE   LYS  18          2HE       LYS  18 -10.990   6.098  -3.880
  565   1HZ   LYS  18          1HZ       LYS  18 -11.733   8.067  -2.648
  566   2HZ   LYS  18          2HZ       LYS  18 -12.644   6.733  -2.215
  567   3HZ   LYS  18          3HZ       LYS  18 -13.245   7.899  -3.218
  568    H    CYS  19           H        CYS  19  -8.582   6.808  -9.082
  569    HA   CYS  19           HA       CYS  19  -9.390   9.315 -10.409
  570   1HB   CYS  19          1HB       CYS  19  -6.674   8.699  -9.618
  571   2HB   CYS  19          2HB       CYS  19  -7.455  10.230  -9.797
  572    H    ASP  20           H        ASP  20  -8.058   6.145 -11.108
  573    HA   ASP  20           HA       ASP  20  -6.758   5.257 -12.627
  574   1HB   ASP  20          1HB       ASP  20  -8.738   5.794 -13.998
  575   2HB   ASP  20          2HB       ASP  20  -7.957   7.291 -14.502
  576    H    GLY  21           H        GLY  21  -5.646   7.332 -10.994
  577   1HA   GLY  21          1HA       GLY  21  -3.692   8.754 -12.748
  578   2HA   GLY  21          2HA       GLY  21  -3.997   9.130 -11.053
  579    H    ARG  22           H        ARG  22  -1.542   8.530 -12.429
  580    HA   ARG  22           HA       ARG  22  -0.528   5.892 -11.989
  581   1HB   ARG  22          1HB       ARG  22   0.341   7.447 -13.639
  582   2HB   ARG  22          2HB       ARG  22   0.803   8.613 -12.410
  583   1HG   ARG  22          1HG       ARG  22   2.030   5.840 -12.385
  584   2HG   ARG  22          2HG       ARG  22   2.542   7.033 -13.580
  585   1HD   ARG  22          1HD       ARG  22   2.970   8.645 -11.613
  586   2HD   ARG  22          2HD       ARG  22   2.818   7.219 -10.570
  587    HE   ARG  22           HE       ARG  22   4.618   6.793 -12.788
  588   1HH1  ARG  22          1HH1      ARG  22   4.619   8.390  -9.557
  589   2HH1  ARG  22          2HH1      ARG  22   6.212   7.675  -9.211
  590   1HH2  ARG  22          1HH2      ARG  22   6.846   6.184 -12.198
  591   2HH2  ARG  22          2HH2      ARG  22   7.324   6.604 -10.547
  592    H    ILE  23           H        ILE  23  -0.235   4.942  -9.998
  593    HA   ILE  23           HA       ILE  23   0.923   6.685  -7.907
  594    HB   ILE  23           HB       ILE  23  -0.657   4.221  -7.178
  595   1HG1  ILE  23          1HG1      ILE  23  -1.792   7.042  -7.017
  596   2HG1  ILE  23          2HG1      ILE  23  -2.298   5.802  -8.172
  597   1HG2  ILE  23          1HG2      ILE  23  -0.396   5.231  -4.916
  598   2HG2  ILE  23          2HG2      ILE  23   1.175   5.247  -5.687
  599   3HG2  ILE  23          3HG2      ILE  23   0.222   6.735  -5.633
  600   1HD1  ILE  23          1HD1      ILE  23  -2.999   4.300  -6.366
  601   2HD1  ILE  23          2HD1      ILE  23  -2.508   5.498  -5.146
  602   3HD1  ILE  23          3HD1      ILE  23  -3.825   5.861  -6.227
  603    H    GLU  24           H        GLU  24   2.979   6.174  -7.734
  604    HA   GLU  24           HA       GLU  24   4.073   3.518  -8.322
  605   1HB   GLU  24          1HB       GLU  24   5.169   5.516  -8.979
  606   2HB   GLU  24          2HB       GLU  24   5.234   6.146  -7.323
  607   1HG   GLU  24          1HG       GLU  24   6.780   4.310  -6.737
  608   2HG   GLU  24          2HG       GLU  24   6.583   3.629  -8.362
  609    H    LEU  25           H        LEU  25   3.109   2.071  -6.851
  610    HA   LEU  25           HA       LEU  25   2.498   2.882  -4.139
  611   1HB   LEU  25          1HB       LEU  25   2.582   0.050  -5.178
  612   2HB   LEU  25          2HB       LEU  25   1.777   0.641  -3.751
  613    HG   LEU  25           HG       LEU  25   0.976   1.245  -6.638
  614   1HD1  LEU  25          1HD1      LEU  25  -0.260  -0.505  -4.471
  615   2HD1  LEU  25          2HD1      LEU  25   0.506  -1.065  -5.972
  616   3HD1  LEU  25          3HD1      LEU  25  -1.008  -0.151  -6.039
  617   1HD2  LEU  25          1HD2      LEU  25   0.482   3.124  -5.213
  618   2HD2  LEU  25          2HD2      LEU  25  -0.265   2.083  -4.000
  619   3HD2  LEU  25          3HD2      LEU  25  -1.020   2.285  -5.609
  620    H    THR  26           H        THR  26   4.262   3.444  -3.038
  621    HA   THR  26           HA       THR  26   6.738   1.943  -3.373
  622    HB   THR  26           HB       THR  26   6.276   4.510  -1.886
  623    HG1  THR  26           1HG      THR  26   5.615   4.494  -4.246
  624   1HG2  THR  26          1HG2      THR  26   8.785   4.108  -3.445
  625   2HG2  THR  26          2HG2      THR  26   8.619   2.974  -2.102
  626   3HG2  THR  26          3HG2      THR  26   8.555   4.735  -1.823
  627    H    VAL  27           H        VAL  27   6.701   0.076  -2.328
  628    HA   VAL  27           HA       VAL  27   5.681  -0.112   0.460
  629    HB   VAL  27           HB       VAL  27   4.618  -2.301  -0.057
  630   1HG1  VAL  27          1HG1      VAL  27   3.746  -0.234  -2.095
  631   2HG1  VAL  27          2HG1      VAL  27   2.804  -1.538  -1.350
  632   3HG1  VAL  27          3HG1      VAL  27   3.391  -0.193  -0.361
  633   1HG2  VAL  27          1HG2      VAL  27   5.479  -1.749  -2.977
  634   2HG2  VAL  27          2HG2      VAL  27   6.140  -3.037  -1.957
  635   3HG2  VAL  27          3HG2      VAL  27   4.438  -3.068  -2.405
  636    H    GLU  28           H        GLU  28   7.251  -0.691   1.808
  637    HA   GLU  28           HA       GLU  28   9.853  -1.673   0.901
  638   1HB   GLU  28          1HB       GLU  28   8.640  -1.245   3.613
  639   2HB   GLU  28          2HB       GLU  28  10.273  -1.861   3.385
  640   1HG   GLU  28          1HG       GLU  28  11.043   0.186   2.455
  641   2HG   GLU  28          2HG       GLU  28   9.408   0.821   2.254
  642    H    SER  29           H        SER  29   9.687  -3.736   0.003
  643    HA   SER  29           HA       SER  29   8.320  -5.901   1.435
  644   1HB   SER  29          1HB       SER  29   7.606  -4.526  -1.199
  645   2HB   SER  29          2HB       SER  29   6.872  -6.029  -0.626
  646    HG   SER  29           HG       SER  29   6.767  -4.123   1.274
  647    H    SER  30           H        SER  30   8.957  -7.955   0.561
  648    HA   SER  30           HA       SER  30  11.699  -7.852  -0.586
  649   1HB   SER  30          1HB       SER  30  10.022 -10.264   0.239
  650   2HB   SER  30          2HB       SER  30  11.728 -10.240  -0.176
  651    HG   SER  30           HG       SER  30  10.438  -9.318   2.147
  652    H    ALA  31           H        ALA  31  12.122  -8.716  -2.707
  653    HA   ALA  31           HA       ALA  31  10.397  -7.831  -4.563
  654   1HB   ALA  31          1HB       ALA  31  12.328 -10.154  -4.986
  655   2HB   ALA  31          2HB       ALA  31  11.678  -9.093  -6.250
  656   3HB   ALA  31          3HB       ALA  31  12.759  -8.423  -5.008
  657    H    GLU  32           H        GLU  32  10.270 -11.248  -3.406
  658    HA   GLU  32           HA       GLU  32   8.217 -11.657  -5.398
  659   1HB   GLU  32          1HB       GLU  32  10.311 -13.206  -4.965
  660   2HB   GLU  32          2HB       GLU  32   9.148 -13.996  -3.859
  661   1HG   GLU  32          1HG       GLU  32   7.485 -14.049  -5.729
  662   2HG   GLU  32          2HG       GLU  32   8.622 -13.218  -6.779
  663    H    ASP  33           H        ASP  33   8.377 -10.926  -2.148
  664    HA   ASP  33           HA       ASP  33   5.731 -11.866  -1.479
  665   1HB   ASP  33          1HB       ASP  33   6.585 -11.521   0.544
  666   2HB   ASP  33          2HB       ASP  33   8.008 -10.726  -0.112
  667    H    LEU  34           H        LEU  34   7.460  -9.068  -2.750
  668    HA   LEU  34           HA       LEU  34   5.206  -7.279  -3.088
  669   1HB   LEU  34          1HB       LEU  34   7.259  -6.269  -3.121
  670   2HB   LEU  34          2HB       LEU  34   8.001  -7.422  -4.195
  671    HG   LEU  34           HG       LEU  34   5.732  -5.801  -5.340
  672   1HD1  LEU  34          1HD1      LEU  34   7.050  -4.115  -4.085
  673   2HD1  LEU  34          2HD1      LEU  34   7.347  -3.930  -5.823
  674   3HD1  LEU  34          3HD1      LEU  34   8.551  -4.742  -4.802
  675   1HD2  LEU  34          1HD2      LEU  34   8.446  -6.668  -6.444
  676   2HD2  LEU  34          2HD2      LEU  34   7.193  -5.785  -7.343
  677   3HD2  LEU  34          3HD2      LEU  34   6.891  -7.433  -6.799
  678    H    ARG  35           H        ARG  35   6.709  -9.612  -5.052
  679    HA   ARG  35           HA       ARG  35   4.967  -9.595  -7.356
  680   1HB   ARG  35          1HB       ARG  35   7.110 -10.980  -7.190
  681   2HB   ARG  35          2HB       ARG  35   6.180 -12.150  -6.249
  682   1HG   ARG  35          1HG       ARG  35   4.569 -12.367  -8.149
  683   2HG   ARG  35          2HG       ARG  35   5.631 -11.321  -9.112
  684   1HD   ARG  35          1HD       ARG  35   7.479 -13.006  -8.782
  685   2HD   ARG  35          2HD       ARG  35   6.339 -14.022  -7.873
  686    HE   ARG  35           HE       ARG  35   5.355 -13.275 -10.473
  687   1HH1  ARG  35          1HH1      ARG  35   7.578 -15.670  -8.899
  688   2HH1  ARG  35          2HH1      ARG  35   7.226 -16.886 -10.056
  689   1HH2  ARG  35          1HH2      ARG  35   4.975 -14.929 -11.996
  690   2HH2  ARG  35          2HH2      ARG  35   5.791 -16.448 -11.870
  691    H    THR  36           H        THR  36   4.837 -11.590  -4.368
  692    HA   THR  36           HA       THR  36   2.366 -12.801  -4.942
  693    HB   THR  36           HB       THR  36   3.537 -12.136  -2.201
  694    HG1  THR  36           1HG      THR  36   4.995 -13.350  -3.449
  695   1HG2  THR  36          1HG2      THR  36   1.525 -14.265  -3.049
  696   2HG2  THR  36          2HG2      THR  36   1.189 -12.861  -2.009
  697   3HG2  THR  36          3HG2      THR  36   2.283 -14.134  -1.447
  698    H    LEU  37           H        LEU  37   2.921  -9.744  -3.031
  699    HA   LEU  37           HA       LEU  37   0.141  -9.332  -2.744
  700   1HB   LEU  37          1HB       LEU  37   0.582  -7.660  -1.419
  701   2HB   LEU  37          2HB       LEU  37   2.142  -8.410  -1.419
  702    HG   LEU  37           HG       LEU  37   2.451  -6.572  -3.479
  703   1HD1  LEU  37          1HD1      LEU  37   1.424  -4.410  -2.615
  704   2HD1  LEU  37          2HD1      LEU  37   0.650  -5.288  -1.309
  705   3HD1  LEU  37          3HD1      LEU  37   0.142  -5.584  -2.956
  706   1HD2  LEU  37          1HD2      LEU  37   3.846  -5.367  -1.933
  707   2HD2  LEU  37          2HD2      LEU  37   3.936  -7.079  -1.468
  708   3HD2  LEU  37          3HD2      LEU  37   2.935  -5.976  -0.539
  709    H    GLN  38           H        GLN  38   2.327  -8.606  -5.419
  710    HA   GLN  38           HA       GLN  38   0.577  -6.877  -6.867
  711   1HB   GLN  38          1HB       GLN  38   2.853  -6.843  -7.421
  712   2HB   GLN  38          2HB       GLN  38   2.933  -8.572  -7.596
  713   1HG   GLN  38          1HG       GLN  38   1.270  -8.234  -9.613
  714   2HG   GLN  38          2HG       GLN  38   1.860  -6.567  -9.547
  715   1HE2  GLN  38          1HE2      GLN  38   4.420  -6.453  -9.353
  716   2HE2  GLN  38          2HE2      GLN  38   5.300  -7.665 -10.268
  717    H    GLN  39           H        GLN  39   0.984 -10.471  -6.591
  718    HA   GLN  39           HA       GLN  39  -0.990 -11.080  -8.544
  719   1HB   GLN  39          1HB       GLN  39  -0.290 -12.875  -6.224
  720   2HB   GLN  39          2HB       GLN  39  -1.054 -13.282  -7.748
  721   1HG   GLN  39          1HG       GLN  39   1.815 -12.726  -7.172
  722   2HG   GLN  39          2HG       GLN  39   1.095 -14.050  -8.039
  723   1HE2  GLN  39          1HE2      GLN  39   2.558 -11.002  -8.275
  724   2HE2  GLN  39          2HE2      GLN  39   2.499 -10.740 -10.009
  725    H    LEU  40           H        LEU  40  -1.201 -10.285  -5.031
  726    HA   LEU  40           HA       LEU  40  -4.018 -10.768  -4.810
  727   1HB   LEU  40          1HB       LEU  40  -2.571  -8.522  -3.411
  728   2HB   LEU  40          2HB       LEU  40  -4.086  -9.283  -2.993
  729    HG   LEU  40           HG       LEU  40  -1.396 -10.668  -2.868
  730   1HD1  LEU  40          1HD1      LEU  40  -3.113  -9.577  -0.610
  731   2HD1  LEU  40          2HD1      LEU  40  -1.646  -8.802  -1.230
  732   3HD1  LEU  40          3HD1      LEU  40  -1.544 -10.390  -0.446
  733   1HD2  LEU  40          1HD2      LEU  40  -2.508 -12.379  -1.520
  734   2HD2  LEU  40          2HD2      LEU  40  -3.116 -12.327  -3.185
  735   3HD2  LEU  40          3HD2      LEU  40  -4.077 -11.627  -1.861
  736    H    PHE  41           H        PHE  41  -2.260  -7.745  -5.851
  737    HA   PHE  41           HA       PHE  41  -4.637  -6.339  -6.578
  738   1HB   PHE  41          1HB       PHE  41  -1.900  -6.149  -7.891
  739   2HB   PHE  41          2HB       PHE  41  -3.242  -5.069  -8.202
  740    HD1  PHE  41           1HD      PHE  41  -4.334  -4.099  -5.848
  741    HD2  PHE  41           2HD      PHE  41  -0.223  -5.039  -6.642
  742    HE1  PHE  41           1HE      PHE  41  -3.646  -2.723  -3.903
  743    HE2  PHE  41           2HE      PHE  41   0.475  -3.618  -4.755
  744    HZ   PHE  41           HZ       PHE  41  -1.228  -2.510  -3.330
  745    H    LEU  42           H        LEU  42  -2.717  -8.651  -8.496
  746    HA   LEU  42           HA       LEU  42  -4.240  -8.460 -10.885
  747   1HB   LEU  42          1HB       LEU  42  -1.977  -9.416 -10.585
  748   2HB   LEU  42          2HB       LEU  42  -2.665 -10.805  -9.753
  749    HG   LEU  42           HG       LEU  42  -3.664 -10.230 -12.529
  750   1HD1  LEU  42          1HD1      LEU  42  -1.230  -9.933 -12.743
  751   2HD1  LEU  42          2HD1      LEU  42  -1.732 -11.454 -13.493
  752   3HD1  LEU  42          3HD1      LEU  42  -0.946 -11.471 -11.898
  753   1HD2  LEU  42          1HD2      LEU  42  -3.659 -12.712 -12.653
  754   2HD2  LEU  42          2HD2      LEU  42  -4.574 -12.176 -11.245
  755   3HD2  LEU  42          3HD2      LEU  42  -2.928 -12.806 -11.037
  756    H    SER  43           H        SER  43  -4.685 -10.498  -8.007
  757    HA   SER  43           HA       SER  43  -6.791 -12.155  -8.999
  758   1HB   SER  43          1HB       SER  43  -5.400 -12.937  -7.228
  759   2HB   SER  43          2HB       SER  43  -5.578 -11.458  -6.299
  760    HG   SER  43           HG       SER  43  -7.456 -12.022  -5.551
  761    H    THR  44           H        THR  44  -6.816  -9.626  -6.512
  762    HA   THR  44           HA       THR  44  -9.666  -9.241  -6.852
  763    HB   THR  44           HB       THR  44  -9.179  -9.256  -4.084
  764    HG1  THR  44           1HG      THR  44  -7.633 -10.636  -3.573
  765   1HG2  THR  44          1HG2      THR  44 -10.289 -11.441  -4.129
  766   2HG2  THR  44          2HG2      THR  44  -9.984 -11.573  -5.881
  767   3HG2  THR  44          3HG2      THR  44 -11.059 -10.298  -5.255
  768    H    LEU  45           H        LEU  45  -6.672  -7.892  -5.761
  769    HA   LEU  45           HA       LEU  45  -7.978  -5.730  -4.310
  770   1HB   LEU  45          1HB       LEU  45  -5.412  -7.140  -4.313
  771   2HB   LEU  45          2HB       LEU  45  -5.118  -5.431  -4.326
  772    HG   LEU  45           HG       LEU  45  -6.594  -5.159  -2.400
  773   1HD1  LEU  45          1HD1      LEU  45  -8.152  -6.993  -2.575
  774   2HD1  LEU  45          2HD1      LEU  45  -7.164  -7.351  -1.144
  775   3HD1  LEU  45          3HD1      LEU  45  -6.825  -8.146  -2.699
  776   1HD2  LEU  45          1HD2      LEU  45  -4.385  -7.236  -2.036
  777   2HD2  LEU  45          2HD2      LEU  45  -5.052  -6.226  -0.753
  778   3HD2  LEU  45          3HD2      LEU  45  -4.160  -5.471  -2.085
  779    H    SER  46           H        SER  46  -7.437  -3.462  -4.358
  780    HA   SER  46           HA       SER  46  -6.201  -2.437  -6.812
  781   1HB   SER  46          1HB       SER  46  -8.163  -0.678  -6.612
  782   2HB   SER  46          2HB       SER  46  -8.377  -2.187  -7.500
  783    HG   SER  46           HG       SER  46  -9.880  -1.244  -5.502
  784    H    PHE  47           H        PHE  47  -6.059   0.143  -6.389
  785    HA   PHE  47           HA       PHE  47  -5.310   0.563  -3.568
  786   1HB   PHE  47          1HB       PHE  47  -3.303   0.031  -5.192
  787   2HB   PHE  47          2HB       PHE  47  -3.548   1.688  -5.732
  788    HD1  PHE  47           1HD      PHE  47  -2.410  -0.514  -3.051
  789    HD2  PHE  47           2HD      PHE  47  -3.338   3.586  -4.000
  790    HE1  PHE  47           1HE      PHE  47  -1.177   0.232  -1.044
  791    HE2  PHE  47           2HE      PHE  47  -2.190   4.322  -1.932
  792    HZ   PHE  47           HZ       PHE  47  -1.111   2.653  -0.448
  793    H    VAL  48           H        VAL  48  -5.462   2.651  -2.870
  794    HA   VAL  48           HA       VAL  48  -6.755   4.611  -4.531
  795    HB   VAL  48           HB       VAL  48  -8.009   2.980  -2.358
  796   1HG1  VAL  48          1HG1      VAL  48  -9.649   4.549  -1.728
  797   2HG1  VAL  48          2HG1      VAL  48  -8.052   5.185  -1.317
  798   3HG1  VAL  48          3HG1      VAL  48  -8.932   5.822  -2.725
  799   1HG2  VAL  48          1HG2      VAL  48  -8.743   2.668  -4.659
  800   2HG2  VAL  48          2HG2      VAL  48 -10.046   3.465  -3.776
  801   3HG2  VAL  48          3HG2      VAL  48  -9.018   4.412  -4.863
  802    H    CYS  49           H        CYS  49  -5.405   6.301  -4.308
  803    HA   CYS  49           HA       CYS  49  -3.378   6.521  -2.302
  804   1HB   CYS  49          1HB       CYS  49  -3.347   8.943  -3.224
  805   2HB   CYS  49          2HB       CYS  49  -2.923   7.617  -4.286
  806    HA   PRO  50           HA       PRO  50  -5.803   7.781   1.072
  807   1HB   PRO  50          1HB       PRO  50  -4.129   9.349   2.626
  808   2HB   PRO  50          2HB       PRO  50  -4.086   7.565   2.510
  809   1HG   PRO  50          1HG       PRO  50  -2.399   9.578   0.998
  810   2HG   PRO  50          2HG       PRO  50  -1.865   8.082   1.832
  811   1HD   PRO  50          1HD       PRO  50  -2.235   8.127  -0.837
  812   2HD   PRO  50          2HD       PRO  50  -2.736   6.707   0.123
  813    H    TRP  51           H        TRP  51  -4.369  10.346  -0.828
  814    HA   TRP  51           HA       TRP  51  -5.912  12.599  -0.032
  815   1HB   TRP  51          1HB       TRP  51  -4.177  13.123  -1.504
  816   2HB   TRP  51          2HB       TRP  51  -4.470  11.719  -2.526
  817    HD1  TRP  51           HD       TRP  51  -6.721  14.737  -1.611
  818    HE1  TRP  51           1HE      TRP  51  -8.066  15.398  -3.638
  819    HE3  TRP  51           3HE      TRP  51  -4.575  11.572  -5.020
  820    HZ2  TRP  51           2HZ      TRP  51  -8.138  14.724  -6.487
  821    HZ3  TRP  51           3HZ      TRP  51  -5.344  11.568  -7.372
  822    HH2  TRP  51           HH       TRP  51  -7.125  13.131  -8.115
  823    H    CYS  52           H        CYS  52  -6.538  10.354  -2.822
  824    HA   CYS  52           HA       CYS  52  -9.202  11.340  -3.167
  825   1HB   CYS  52          1HB       CYS  52  -9.368   9.854  -4.913
  826   2HB   CYS  52          2HB       CYS  52  -7.643  10.088  -4.807
  827    H    ALA  53           H        ALA  53  -7.792   8.833  -1.143
  828    HA   ALA  53           HA       ALA  53 -10.132   7.432  -0.691
  829   1HB   ALA  53          1HB       ALA  53  -7.793   6.777   0.117
  830   2HB   ALA  53          2HB       ALA  53  -7.970   7.962   1.417
  831   3HB   ALA  53          3HB       ALA  53  -9.067   6.599   1.363
  832    H    THR  54           H        THR  54  -8.750  10.278   0.862
  833    HA   THR  54           HA       THR  54 -10.784  10.558   2.923
  834    HB   THR  54           HB       THR  54  -8.448  12.366   2.159
  835    HG1  THR  54           1HG      THR  54  -7.519  10.480   2.579
  836   1HG2  THR  54          1HG2      THR  54  -8.490  13.013   4.546
  837   2HG2  THR  54          2HG2      THR  54  -9.927  12.000   4.805
  838   3HG2  THR  54          3HG2      THR  54 -10.016  13.429   3.752
  839    H    ASN  55           H        ASN  55  -9.896  12.232  -0.134
  840    HA   ASN  55           HA       ASN  55 -11.950  14.294   0.025
  841   1HB   ASN  55          1HB       ASN  55 -10.488  12.992  -2.324
  842   2HB   ASN  55          2HB       ASN  55 -11.736  14.209  -2.528
  843   1HD2  ASN  55          1HD2      ASN  55  -9.563  14.480   0.238
  844   2HD2  ASN  55          2HD2      ASN  55  -8.703  15.876  -0.398
  845    H    GLN  56           H        GLN  56 -11.755  11.047  -1.262
  846    HA   GLN  56           HA       GLN  56 -13.146   9.348  -1.230
  847   1HB   GLN  56          2HB       GLN  56 -14.437  10.397   0.596
  848   2HB   GLN  56          3HB       GLN  56 -15.521  11.116  -0.614
  849   1HG   GLN  56          2HG       GLN  56 -16.325   8.992  -1.319
  850   2HG   GLN  56          3HG       GLN  56 -14.953   8.135  -0.611
  851   1HE2  GLN  56          1HE2      GLN  56 -17.853  10.072   0.331
  852   2HE2  GLN  56          2HE2      GLN  56 -18.065   9.237   1.864