*HEADER    CYTOKINE                                20-JUN-06   2HDL              
*TITLE     SOLUTION STRUCTURE OF BRAK/CXCL14                                     
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: SMALL INDUCIBLE CYTOKINE B14;                              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: CXCL14, CHEMOKINE BRAK;                                     
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: CXCL14, NJAC, SCYB14;                                          
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: SG13009[PREP4];                            
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PQE308HT                                  
*KEYWDS    CXCL14, BRAK, CHEMOKINE, NMR                                          
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    F.C.PETERSON, J.A.THORPE, A.G.HARDER, B.F.VOLKMAN,                    
*AUTHOR   2 S.R.SCHWARZE                                                         
*REVDAT   1   24-OCT-06 2HDL    0                                                


#Dihedral angle constraints
  10 PRO   PSI     141.00  159.00
  11 LYS   PHI    -134.00  -64.00
  11 LYS   PSI     106.00  158.00
  12 ILE   PHI    -144.00  -78.00
  12 ILE   PSI     118.00  146.00
  13 ARG   PHI    -112.00  -60.00
  13 ARG   PSI     123.00  165.00
  14 TYR   PHI     -70.00  -50.00
  14 TYR   PSI     -49.00  -25.00
  15 SER   PHI     -77.00  -57.00
  15 SER   PSI     -48.00  -14.00
  16 ASP   PHI    -107.00  -85.00
  17 VAL   PHI     -87.00  -59.00
  17 VAL   PSI     123.00  143.00
  18 LYS   PHI    -112.00  -90.00
  18 LYS   PSI     -43.00  -23.00
  19 LYS   PHI    -166.00 -140.00
  19 LYS   PSI     132.00  158.00
  20 LEU   PHI    -139.00  -99.00
  20 LEU   PSI     123.00  151.00
  21 GLU   PHI    -144.00 -118.00
  21 GLU   PSI     131.00  151.00
  22 MET   PHI    -106.00  -84.00
  22 MET   PSI     115.00  147.00
  23 LYS   PHI    -157.00 -103.00
  23 LYS   PSI     113.00  161.00
  26 TYR   PHI    -139.00  -95.00
  26 TYR   PSI     128.00  186.00
  27 PRO   PSI     -23.00  -11.00
  29 CYSS  PHI    -135.00 -111.00
  29 CYSS  PSI     153.00  173.00
  30 GLU   PHI     -85.00  -65.00
  30 GLU   PSI     133.00  153.00
  32 LYS   PHI     -96.00  -70.00
  32 LYS   PSI     106.00  146.00
  33 MET   PSI     154.00  174.00
  34 VAL   PHI    -113.00  -81.00
  34 VAL   PSI     111.00  131.00
  35 ILE   PHI    -120.00  -96.00
  35 ILE   PSI     110.00  138.00
  36 ILE   PHI    -124.00 -104.00
  36 ILE   PSI     114.00  134.00
  37 THR   PHI    -123.00  -97.00
  37 THR   PSI     115.00  135.00
  38 THR   PHI    -132.00  -82.00
  38 THR   PSI     162.00  184.00
  39 LYS   PHI     -75.00  -55.00
  39 LYS   PSI     -46.00  -18.00
  42 SER   PHI    -126.00  -64.00
  42 SER   PSI     118.00  174.00
  43 ARG   PHI     -80.00  -58.00
  43 ARG   PSI     -41.00   -7.00
  44 TYR   PHI    -114.00  -72.00
  44 TYR   PSI     -50.00    9.00
  46 GLY   PHI      69.00   99.00
  46 GLY   PSI       1.00   33.00
  47 GLN   PHI    -119.00  -65.00
  47 GLN   PSI     125.00  155.00
  48 GLU   PHI    -137.00  -93.00
  48 GLU   PSI     122.00  156.00
  49 HIS   PSI     132.00  156.00
  50 CYSS  PHI    -146.00 -118.00
  50 CYSS  PSI     127.00  159.00
  51 LEU   PHI    -130.00  -84.00
  51 LEU   PSI     112.00  142.00
  52 HIS   PHI    -118.00  -72.00
  54 LYS   PSI     -41.00  -15.00
  55 LEU   PHI    -119.00  -85.00
  56 GLN   PSI     -55.00  -29.00
  57 SER   PSI     -47.00  -27.00
  58 THR   PHI     -81.00  -61.00
  58 THR   PSI     -51.00  -31.00
  59 LYS   PHI     -75.00  -55.00
  59 LYS   PSI     -49.00  -29.00
  60 ARG   PHI     -77.00  -57.00
  60 ARG   PSI     -52.00  -32.00
  61 PHE   PHI     -74.00  -54.00
  61 PHE   PSI     -55.00  -35.00
  62 ILE   PHI     -73.00  -53.00
  62 ILE   PSI     -54.00  -34.00
  63 LYS   PSI     -51.00  -31.00
  64 TRP   PHI     -80.00  -60.00
  64 TRP   PSI     -49.00  -29.00
  65 TYR   PHI     -72.00  -52.00
  65 TYR   PSI     -57.00  -37.00
  66 ASN   PHI     -71.00  -51.00
  66 ASN   PSI     -47.00  -27.00
  67 ALA   PHI     -75.00  -55.00
  67 ALA   PSI     -50.00  -30.00
  68 TRP   PHI     -76.00  -56.00
  68 TRP   PSI     -51.00  -31.00
  69 ASN   PHI     -76.00  -56.00
  69 ASN   PSI     -46.00  -26.00
  70 GLU   PHI     -77.00  -57.00
  70 GLU   PSI     -47.00  -27.00
  71 LYS   PHI     -80.00  -58.00
  71 LYS   PSI     -45.00  -25.00

#Distance Constraints
  3 CYSS CB     29 CYSS SG      3.10
  3 CYSS SG     29 CYSS CB      3.10
  3 CYSS SG     29 CYSS SG      2.10
  5 CYSS CB     50 CYSS SG      3.10
  5 CYSS QB     50 CYSS QB      4.11
  5 CYSS SG     50 CYSS CB      3.10
  5 CYSS SG     50 CYSS SG      2.10
  8 LYS  HA      8 LYS  QD      4.60
  8 LYS  HA      8 LYS  QE      4.70
  8 LYS  QB      8 LYS  QD      2.95
  8 LYS  QB      8 LYS  QE      4.76
  9 GLY  HA2    10 PRO  HD2     3.66
  9 GLY  HA2    10 PRO  HD3     3.66
  9 GLY  HA3    10 PRO  HD2     3.66
  9 GLY  HA3    10 PRO  HD3     3.66
  9 GLY  QA     10 PRO  QD      2.76
  9 GLY  QA     50 CYSS H       4.14
 10 PRO  HA     11 LYS  H       3.20
 10 PRO  HB2    11 LYS  H       4.54
 10 PRO  HB3    11 LYS  H       4.54
 10 PRO  QB     11 LYS  H       3.95
 11 LYS  H      11 LYS  QB      3.58
 11 LYS  H      12 ILE  H       4.52
 11 LYS  HA     11 LYS  QG      3.93
 11 LYS  QB     12 ILE  H       4.28
 11 LYS  QG     11 LYS  QD      2.42
 12 ILE  H      12 ILE  HB      3.40
 12 ILE  H      12 ILE  HG12    3.95
 12 ILE  H      12 ILE  HG13    3.95
 12 ILE  H      12 ILE  QD1     4.40
 12 ILE  H      12 ILE  QG1     3.43
 12 ILE  H      12 ILE  QG2     4.41
 12 ILE  HA     12 ILE  HG12    4.09
 12 ILE  HA     12 ILE  HG13    4.09
 12 ILE  HA     12 ILE  QD1     4.09
 12 ILE  HA     12 ILE  QG1     3.58
 12 ILE  HA     12 ILE  QG2     3.57
 12 ILE  HA     13 ARG  H       3.20
 12 ILE  HA     61 PHE  HZ      4.42
 12 ILE  HB     12 ILE  QD1     3.70
 12 ILE  HB     13 ARG  H       4.63
 12 ILE  HB     16 ASP  QB      4.64
 12 ILE  HB     61 PHE  HZ      4.30
 12 ILE  HB     61 PHE  QE      4.53
 12 ILE  QD1    16 ASP  QB      4.45
 12 ILE  QD1    17 VAL  QQG     4.21
 12 ILE  QD1    36 ILE  HB      4.34
 12 ILE  QD1    36 ILE  QG2     3.52
 12 ILE  QD1    38 THR  QG2     3.82
 12 ILE  QD1    49 HIS  HB2     4.52
 12 ILE  QD1    49 HIS  HB3     4.52
 12 ILE  QD1    49 HIS  HD2     4.55
 12 ILE  QD1    49 HIS  QB      3.96
 12 ILE  QG2    12 ILE  HG12    3.53
 12 ILE  QG2    12 ILE  HG13    3.53
 12 ILE  QG2    12 ILE  QD1     3.25
 12 ILE  QG2    12 ILE  QG1     2.83
 12 ILE  QG2    13 ARG  H       4.08
 12 ILE  QG2    16 ASP  H       4.42
 12 ILE  QG2    16 ASP  QB      3.74
 12 ILE  QG2    17 VAL  H       4.59
 12 ILE  QG2    17 VAL  QQG     3.28
 12 ILE  QG2    38 THR  QG2     3.61
 12 ILE  QG2    49 HIS  HD2     4.54
 12 ILE  QG2    61 PHE  HZ      4.05
 12 ILE  QG2    61 PHE  QE      4.41
 13 ARG  H      13 ARG  QB      3.37
 13 ARG  H      16 ASP  QB      4.42
 13 ARG  H      17 VAL  QQG     4.58
 13 ARG  HA     13 ARG  QD      4.89
 13 ARG  HA     13 ARG  QG      3.57
 13 ARG  HA     14 TYR  H       3.46
 13 ARG  HB2    13 ARG  QD      3.35
 13 ARG  HB2    15 SER  H       4.29
 13 ARG  HB3    13 ARG  QD      3.35
 13 ARG  HB3    15 SER  H       4.29
 13 ARG  QB     13 ARG  QD      2.77
 13 ARG  QB     14 TYR  H       4.42
 13 ARG  QB     15 SER  H       3.76
 13 ARG  QB     16 ASP  H       3.84
 13 ARG  QB     61 PHE  QE      4.41
 14 TYR  H      14 TYR  QD      4.25
 14 TYR  HA     14 TYR  QD      3.40
 14 TYR  HA     17 VAL  H       4.53
 14 TYR  HA     17 VAL  QQG     3.35
 14 TYR  HA     65 TYR  QB      4.36
 14 TYR  HA     65 TYR  QD      4.28
 14 TYR  HA     65 TYR  QE      4.52
 14 TYR  HB2    15 SER  H       4.49
 14 TYR  HB3    15 SER  H       4.49
 14 TYR  QB     15 SER  H       3.83
 14 TYR  QB     17 VAL  H       4.71
 14 TYR  QB     65 TYR  QD      3.91
 14 TYR  QB     65 TYR  QE      4.56
 14 TYR  QD     61 PHE  HA      4.60
 14 TYR  QD     61 PHE  QD      3.97
 14 TYR  QD     64 TRP  HH2     4.84
 14 TYR  QD     65 TYR  HA      4.61
 14 TYR  QD     65 TYR  QD      3.99
 14 TYR  QD     68 TRP  QB      4.34
 14 TYR  QE     61 PHE  HA      4.24
 14 TYR  QE     61 PHE  QD      4.56
 14 TYR  QE     65 TYR  HA      4.57
 15 SER  H      15 SER  HB2     3.80
 15 SER  H      15 SER  HB3     3.80
 15 SER  H      15 SER  QB      3.26
 15 SER  HA     17 VAL  H       3.99
 15 SER  HA     68 TRP  HH2     3.89
 15 SER  HA     68 TRP  HZ2     4.01
 15 SER  QB     16 ASP  H       4.39
 15 SER  QB     17 VAL  H       4.54
 15 SER  QB     68 TRP  HZ2     4.41
 16 ASP  H      16 ASP  QB      3.20
 16 ASP  H      17 VAL  H       3.13
 16 ASP  QB     17 VAL  H       4.01
 16 ASP  QB     39 LYS  H       4.46
 17 VAL  H      17 VAL  HB      3.23
 17 VAL  H      17 VAL  QG1     3.89
 17 VAL  H      17 VAL  QG2     3.89
 17 VAL  H      17 VAL  QQG     3.04
 17 VAL  H      18 LYS  H       4.74
 17 VAL  HA     17 VAL  QG1     3.52
 17 VAL  HA     17 VAL  QG2     3.52
 17 VAL  HA     18 LYS  H       3.10
 17 VAL  HA     19 LYS  H       4.15
 17 VAL  HA     36 ILE  QG2     4.06
 17 VAL  HA     38 THR  HA      3.37
 17 VAL  HA     38 THR  QG2     3.94
 17 VAL  HA     39 LYS  H       4.44
 17 VAL  HB     19 LYS  H       4.36
 17 VAL  HB     65 TYR  QE      3.85
 17 VAL  QG1    18 LYS  H       4.41
 17 VAL  QG1    61 PHE  QE      4.09
 17 VAL  QG1    65 TYR  QE      3.73
 17 VAL  QG2    18 LYS  H       4.41
 17 VAL  QG2    61 PHE  QE      4.09
 17 VAL  QG2    65 TYR  QE      3.73
 17 VAL  QQG    18 LYS  H       3.56
 17 VAL  QQG    19 LYS  H       3.36
 17 VAL  QQG    20 LEU  H       4.50
 17 VAL  QQG    61 PHE  HZ      3.67
 17 VAL  QQG    61 PHE  QE      3.51
 17 VAL  QQG    65 TYR  QE      3.25
 18 LYS  H      18 LYS  HB2     3.79
 18 LYS  H      18 LYS  HB3     3.79
 18 LYS  H      18 LYS  QB      3.33
 18 LYS  H      18 LYS  QG      5.04
 18 LYS  H      19 LYS  H       3.12
 18 LYS  H      37 THR  QG2     5.04
 18 LYS  H      38 THR  HA      3.37
 18 LYS  H      38 THR  QG2     4.47
 18 LYS  H      39 LYS  H       4.27
 18 LYS  HA     18 LYS  QD      4.66
 18 LYS  HB2    18 LYS  QD      3.54
 18 LYS  HB2    18 LYS  QE      3.70
 18 LYS  HB2    19 LYS  H       3.58
 18 LYS  HB3    18 LYS  QD      3.54
 18 LYS  HB3    18 LYS  QE      3.70
 18 LYS  HB3    19 LYS  H       3.58
 18 LYS  QB     18 LYS  QD      3.01
 18 LYS  QB     18 LYS  QE      3.22
 18 LYS  QB     19 LYS  H       3.13
 18 LYS  QB     37 THR  QG2     3.31
 18 LYS  QB     38 THR  HA      4.63
 18 LYS  QE     37 THR  QG2     4.63
 18 LYS  QG     18 LYS  QE      4.01
 18 LYS  QG     19 LYS  H       4.72
 19 LYS  H      19 LYS  HG2     4.66
 19 LYS  H      19 LYS  HG3     4.66
 19 LYS  H      19 LYS  QG      4.10
 19 LYS  H      37 THR  H       3.68
 19 LYS  H      37 THR  HB      3.44
 19 LYS  H      37 THR  QG2     3.89
 19 LYS  H      65 TYR  QE      4.42
 19 LYS  HA     20 LEU  H       3.29
 19 LYS  HA     65 TYR  QE      4.01
 19 LYS  HB2    20 LEU  H       4.20
 19 LYS  HB2    37 THR  HB      4.64
 19 LYS  HB3    20 LEU  H       4.20
 19 LYS  HB3    37 THR  HB      4.64
 19 LYS  HG2    19 LYS  QE      4.13
 19 LYS  HG3    19 LYS  QE      4.13
 19 LYS  QB     19 LYS  QE      3.93
 19 LYS  QB     19 LYS  QG      2.32
 19 LYS  QB     20 LEU  H       3.59
 19 LYS  QB     37 THR  H       4.69
 19 LYS  QB     37 THR  HB      3.97
 19 LYS  QB     37 THR  QG2     3.85
 19 LYS  QD     37 THR  HB      3.86
 19 LYS  QG     19 LYS  QE      3.36
 19 LYS  QG     20 LEU  H       3.93
 19 LYS  QG     37 THR  HB      4.00
 20 LEU  H      20 LEU  HB2     3.97
 20 LEU  H      20 LEU  HB3     3.97
 20 LEU  H      21 GLU  H       4.62
 20 LEU  H      65 TYR  QE      4.63
 20 LEU  HA     20 LEU  QD1     4.84
 20 LEU  HA     20 LEU  QD2     4.84
 20 LEU  HA     21 GLU  H       3.12
 20 LEU  HA     37 THR  H       3.95
 20 LEU  HA     62 ILE  QD1     5.32
 20 LEU  HG     21 GLU  H       4.08
 20 LEU  QB     20 LEU  QQD     2.79
 20 LEU  QB     21 GLU  H       4.00
 20 LEU  QB     65 TYR  QD      4.24
 20 LEU  QB     65 TYR  QE      3.80
 20 LEU  QD1    62 ILE  HA      4.80
 20 LEU  QD1    65 TYR  QD      4.44
 20 LEU  QD2    62 ILE  HA      4.80
 20 LEU  QD2    65 TYR  QD      4.44
 20 LEU  QQD    21 GLU  H       4.17
 20 LEU  QQD    61 PHE  QD      4.23
 20 LEU  QQD    61 PHE  QE      4.21
 20 LEU  QQD    62 ILE  HA      3.66
 20 LEU  QQD    62 ILE  QD1     3.40
 20 LEU  QQD    62 ILE  QG1     3.68
 20 LEU  QQD    62 ILE  QG2     3.57
 20 LEU  QQD    65 TYR  HA      4.54
 20 LEU  QQD    65 TYR  QB      4.55
 20 LEU  QQD    65 TYR  QD      3.47
 20 LEU  QQD    65 TYR  QE      4.48
 21 GLU  H      21 GLU  QG      4.12
 21 GLU  H      35 ILE  H       3.85
 21 GLU  H      35 ILE  HB      3.60
 21 GLU  H      35 ILE  QG1     4.20
 21 GLU  H      35 ILE  QG2     3.90
 21 GLU  H      36 ILE  HA      4.01
 21 GLU  H      36 ILE  QG1     4.73
 21 GLU  HA     22 MET  H       3.16
 21 GLU  QB     22 MET  H       4.35
 21 GLU  QB     35 ILE  QG1     4.22
 21 GLU  QG     22 MET  H       4.34
 21 GLU  QG     35 ILE  QG2     4.49
 22 MET  H      22 MET  HB2     3.60
 22 MET  H      22 MET  HB3     3.60
 22 MET  H      22 MET  QG      4.11
 22 MET  HA     23 LYS  H       2.85
 22 MET  HA     34 VAL  HA      3.52
 22 MET  HA     34 VAL  QQG     4.43
 22 MET  HA     35 ILE  H       4.10
 22 MET  QB     23 LYS  H       4.42
 22 MET  QG     23 LYS  H       4.79
 23 LYS  H      23 LYS  HB2     4.07
 23 LYS  H      23 LYS  HB3     4.07
 23 LYS  H      23 LYS  QD      4.03
 23 LYS  H      23 LYS  QG      3.58
 23 LYS  H      32 LYS  QB      4.23
 23 LYS  H      33 MET  H       3.71
 23 LYS  H      34 VAL  HA      4.24
 23 LYS  H      35 ILE  H       4.50
 23 LYS  HA     24 PRO  HD2     3.22
 23 LYS  HA     24 PRO  HD3     3.22
 23 LYS  HB2    24 PRO  HD2     4.46
 23 LYS  HB2    24 PRO  HD3     4.46
 23 LYS  HB3    24 PRO  HD2     4.46
 23 LYS  HB3    24 PRO  HD3     4.46
 23 LYS  QB     23 LYS  QE      5.18
 23 LYS  QB     24 PRO  QD      3.29
 23 LYS  QE     35 ILE  HB      3.97
 23 LYS  QE     35 ILE  QD1     4.37
 23 LYS  QE     35 ILE  QG2     3.83
 23 LYS  QG     23 LYS  HE2     3.59
 23 LYS  QG     23 LYS  HE3     3.59
 24 PRO  HA     25 LYS  H       3.37
 24 PRO  HA     26 TYR  H       4.36
 24 PRO  HA     33 MET  H       3.68
 24 PRO  HA     33 MET  QG      4.08
 24 PRO  HB2    25 LYS  H       4.56
 24 PRO  HB2    29 CYSS HB2     4.06
 24 PRO  HB2    29 CYSS HB3     4.06
 24 PRO  HB3    25 LYS  H       4.56
 24 PRO  HB3    29 CYSS HB2     4.06
 24 PRO  HB3    29 CYSS HB3     4.06
 24 PRO  HD2    32 LYS  QD      4.23
 24 PRO  HD2    32 LYS  QE      4.80
 24 PRO  HD3    32 LYS  QD      4.23
 24 PRO  HD3    32 LYS  QE      4.80
 24 PRO  QB     25 LYS  H       3.88
 24 PRO  QB     26 TYR  H       4.15
 24 PRO  QB     29 CYSS H       4.18
 24 PRO  QB     29 CYSS QB      3.11
 24 PRO  QD     32 LYS  QE      4.05
 24 PRO  QD     32 LYS  QG      3.59
 24 PRO  QG     26 TYR  H       4.48
 24 PRO  QG     29 CYSS QB      4.52
 25 LYS  H      25 LYS  QB      3.54
 25 LYS  H      25 LYS  QG      4.45
 25 LYS  H      26 TYR  H       3.87
 25 LYS  HA     25 LYS  HG2     3.95
 25 LYS  HA     25 LYS  HG3     3.95
 25 LYS  HA     25 LYS  QD      3.59
 25 LYS  HA     25 LYS  QE      4.95
 25 LYS  HA     25 LYS  QG      3.40
 25 LYS  HA     35 ILE  QD1     3.51
 25 LYS  HG2    25 LYS  QE      4.22
 25 LYS  HG3    25 LYS  QE      4.22
 25 LYS  QB     25 LYS  HD2     2.47
 25 LYS  QB     25 LYS  HD3     2.47
 25 LYS  QB     25 LYS  QE      3.97
 25 LYS  QB     26 TYR  H       3.89
 25 LYS  QG     25 LYS  QE      3.54
 26 TYR  H      26 TYR  HB2     4.09
 26 TYR  H      26 TYR  HB3     4.09
 26 TYR  H      26 TYR  QD      4.28
 26 TYR  H      29 CYSS HB2     4.22
 26 TYR  H      29 CYSS HB3     4.22
 26 TYR  H      29 CYSS QB      3.59
 26 TYR  HA     26 TYR  QD      3.70
 26 TYR  HA     27 PRO  QD      3.16
 26 TYR  HB2    28 HIS  HE1     3.79
 26 TYR  HB3    28 HIS  HE1     3.79
 26 TYR  QB     27 PRO  QD      3.37
 26 TYR  QB     28 HIS  HE1     3.31
 26 TYR  QB     29 CYSS H       4.57
 26 TYR  QD     27 PRO  QD      4.13
 26 TYR  QD     28 HIS  HD2     2.56
 26 TYR  QD     28 HIS  HE1     4.08
 28 HIS  H      29 CYSS H       3.74
 28 HIS  QB     28 HIS  HD2     3.40
 28 HIS  QB     28 HIS  HE1     4.40
 29 CYSS H      29 CYSS HB2     3.58
 29 CYSS H      29 CYSS HB3     3.58
 29 CYSS H      29 CYSS QB      2.97
 29 CYSS HA     30 GLU  H       3.56
 29 CYSS QB     30 GLU  H       4.32
 30 GLU  H      30 GLU  HB2     4.14
 30 GLU  H      30 GLU  HB3     4.14
 30 GLU  H      30 GLU  QB      3.60
 30 GLU  H      54 LYS  QE      4.73
 30 GLU  HA     30 GLU  HG2     3.80
 30 GLU  HA     30 GLU  HG3     3.80
 30 GLU  HB2    30 GLU  HG2     2.82
 30 GLU  HB2    30 GLU  HG3     2.82
 30 GLU  HB2    31 GLU  H       4.53
 30 GLU  HB3    30 GLU  HG2     2.82
 30 GLU  HB3    30 GLU  HG3     2.82
 30 GLU  HB3    31 GLU  H       4.53
 30 GLU  QB     30 GLU  QG      2.06
 30 GLU  QB     31 GLU  H       3.74
 31 GLU  H      31 GLU  HA      2.70
 31 GLU  H      31 GLU  QB      3.23
 31 GLU  HA     31 GLU  QG      3.59
 31 GLU  HA     32 LYS  H       2.79
 31 GLU  QB     32 LYS  H       3.40
 31 GLU  QG     32 LYS  H       3.96
 32 LYS  H      32 LYS  HB2     3.89
 32 LYS  H      32 LYS  HB3     3.89
 32 LYS  H      32 LYS  HG2     4.09
 32 LYS  H      32 LYS  HG3     4.09
 32 LYS  H      32 LYS  QB      3.17
 32 LYS  H      32 LYS  QD      3.35
 32 LYS  HA     32 LYS  QD      3.67
 32 LYS  HA     32 LYS  QE      4.62
 32 LYS  HA     32 LYS  QG      3.54
 32 LYS  HA     33 MET  H       2.98
 32 LYS  QB     32 LYS  QD      2.35
 32 LYS  QB     33 MET  H       3.83
 32 LYS  QD     33 MET  H       4.15
 32 LYS  QG     32 LYS  QE      3.26
 32 LYS  QG     33 MET  H       4.48
 33 MET  H      33 MET  HB2     3.99
 33 MET  H      33 MET  HB3     3.99
 33 MET  H      33 MET  HG2     4.55
 33 MET  H      33 MET  HG3     4.55
 33 MET  H      33 MET  QB      3.29
 33 MET  H      33 MET  QE      4.28
 33 MET  H      33 MET  QG      3.76
 33 MET  HA     33 MET  QE      3.43
 33 MET  HA     33 MET  QG      3.03
 33 MET  HA     34 VAL  H       3.52
 33 MET  HA     53 PRO  QG      4.20
 33 MET  HB2    34 VAL  H       3.67
 33 MET  HB3    34 VAL  H       3.67
 33 MET  HG2    33 MET  QE      3.62
 33 MET  HG3    33 MET  QE      3.62
 33 MET  QB     34 VAL  H       3.09
 33 MET  QB     53 PRO  QD      4.00
 33 MET  QE     53 PRO  HD2     3.91
 33 MET  QE     53 PRO  HD3     3.91
 33 MET  QG     33 MET  QE      3.00
 33 MET  QG     34 VAL  H       4.55
 34 VAL  H      34 VAL  HB      3.42
 34 VAL  H      34 VAL  QG1     3.85
 34 VAL  H      34 VAL  QG2     3.85
 34 VAL  H      34 VAL  QQG     3.28
 34 VAL  H      51 LEU  H       4.34
 34 VAL  H      51 LEU  QB      4.20
 34 VAL  H      53 PRO  HD2     4.60
 34 VAL  H      53 PRO  HD3     4.60
 34 VAL  H      53 PRO  QD      3.81
 34 VAL  H      53 PRO  QG      4.48
 34 VAL  HA     34 VAL  QG1     3.38
 34 VAL  HA     34 VAL  QG2     3.38
 34 VAL  HA     34 VAL  QQG     2.96
 34 VAL  HA     35 ILE  H       3.00
 34 VAL  HB     35 ILE  H       4.70
 34 VAL  HB     51 LEU  H       4.32
 34 VAL  HB     51 LEU  HB2     4.12
 34 VAL  HB     51 LEU  HB3     4.12
 34 VAL  HB     51 LEU  QB      3.34
 34 VAL  HB     51 LEU  QQD     4.46
 34 VAL  HB     58 THR  QG2     3.98
 34 VAL  QG1    35 ILE  H       4.49
 34 VAL  QG1    58 THR  QG2     3.75
 34 VAL  QG2    35 ILE  H       4.49
 34 VAL  QG2    58 THR  QG2     3.75
 34 VAL  QQG    35 ILE  H       3.55
 34 VAL  QQG    51 LEU  QB      3.25
 34 VAL  QQG    53 PRO  HA      3.48
 34 VAL  QQG    53 PRO  QB      3.40
 34 VAL  QQG    53 PRO  QD      3.99
 34 VAL  QQG    53 PRO  QG      3.56
 34 VAL  QQG    58 THR  QG2     3.05
 35 ILE  H      35 ILE  HB      3.55
 35 ILE  H      35 ILE  HG12    4.30
 35 ILE  H      35 ILE  HG13    4.30
 35 ILE  H      35 ILE  QD1     4.04
 35 ILE  H      35 ILE  QG1     3.58
 35 ILE  HA     35 ILE  QD1     3.63
 35 ILE  HA     35 ILE  QG2     3.58
 35 ILE  HA     36 ILE  H       3.28
 35 ILE  HB     35 ILE  QD1     3.77
 35 ILE  QD1    36 ILE  H       4.22
 35 ILE  QD1    48 GLU  QB      4.74
 35 ILE  QD1    50 CYSS HA      3.76
 35 ILE  QD1    50 CYSS HB2     4.33
 35 ILE  QD1    50 CYSS HB3     4.33
 35 ILE  QD1    50 CYSS QB      3.63
 35 ILE  QD1    51 LEU  H       4.46
 35 ILE  QG2    35 ILE  HG12    3.70
 35 ILE  QG2    35 ILE  HG13    3.70
 35 ILE  QG2    35 ILE  QD1     3.05
 35 ILE  QG2    35 ILE  QG1     3.10
 35 ILE  QG2    36 ILE  H       3.54
 35 ILE  QG2    48 GLU  HA      4.29
 35 ILE  QG2    48 GLU  HG2     4.00
 35 ILE  QG2    48 GLU  HG3     4.00
 35 ILE  QG2    48 GLU  QB      3.40
 35 ILE  QG2    48 GLU  QG      3.35
 35 ILE  QG2    49 HIS  H       4.24
 35 ILE  QG2    50 CYSS QB      4.11
 36 ILE  H      36 ILE  HB      3.51
 36 ILE  H      36 ILE  HG12    4.17
 36 ILE  H      36 ILE  HG13    4.17
 36 ILE  H      36 ILE  QD1     4.60
 36 ILE  H      36 ILE  QG1     3.56
 36 ILE  H      36 ILE  QG2     4.28
 36 ILE  H      48 GLU  HA      4.62
 36 ILE  H      48 GLU  QB      4.63
 36 ILE  H      49 HIS  H       3.83
 36 ILE  H      49 HIS  HB2     4.96
 36 ILE  H      49 HIS  HB3     4.96
 36 ILE  H      49 HIS  QB      4.31
 36 ILE  H      50 CYSS HA      4.37
 36 ILE  HA     36 ILE  QD1     5.50
 36 ILE  HA     36 ILE  QG2     3.63
 36 ILE  HA     37 THR  H       3.10
 36 ILE  HB     36 ILE  QD1     3.76
 36 ILE  HB     37 THR  H       4.39
 36 ILE  HB     49 HIS  H       4.05
 36 ILE  HB     49 HIS  HB2     4.25
 36 ILE  HB     49 HIS  HB3     4.25
 36 ILE  HB     49 HIS  QB      3.67
 36 ILE  QD1    37 THR  H       4.70
 36 ILE  QD1    49 HIS  QB      4.57
 36 ILE  QD1    61 PHE  HZ      4.79
 36 ILE  QD1    61 PHE  QD      4.11
 36 ILE  QD1    61 PHE  QE      4.06
 36 ILE  QG2    36 ILE  QD1     2.92
 36 ILE  QG2    37 THR  H       3.63
 36 ILE  QG2    38 THR  QG2     2.96
 36 ILE  QG2    49 HIS  HB2     4.73
 36 ILE  QG2    49 HIS  HB3     4.73
 36 ILE  QG2    49 HIS  HD2     4.22
 36 ILE  QG2    49 HIS  QB      4.08
 37 THR  H      37 THR  HB      3.44
 37 THR  H      37 THR  QG2     4.31
 37 THR  HA     37 THR  QG2     3.59
 37 THR  HA     48 GLU  HA      3.70
 37 THR  HA     49 HIS  H       4.37
 37 THR  HB     38 THR  H       5.50
 37 THR  QG2    38 THR  H       4.05
 37 THR  QG2    48 GLU  HG2     4.76
 37 THR  QG2    48 GLU  HG3     4.76
 37 THR  QG2    48 GLU  QG      3.91
 38 THR  H      38 THR  QG2     4.25
 38 THR  HA     38 THR  QG2     3.52
 38 THR  HA     39 LYS  H       3.06
 38 THR  HB     39 LYS  H       3.36
 38 THR  QG2    39 LYS  H       4.43
 38 THR  QG2    44 TYR  QB      3.55
 38 THR  QG2    44 TYR  QD      3.75
 38 THR  QG2    49 HIS  HD2     3.61
 41 VAL  H      41 VAL  QG1     4.36
 41 VAL  H      41 VAL  QG2     4.36
 41 VAL  H      41 VAL  QQG     3.77
 41 VAL  HA     41 VAL  QG1     3.93
 41 VAL  HA     41 VAL  QG2     3.93
 41 VAL  HA     41 VAL  QQG     3.15
 41 VAL  HB     42 SER  H       4.73
 43 ARG  HA     43 ARG  QB      3.01
 43 ARG  HA     43 ARG  QG      3.60
 43 ARG  QB     43 ARG  QD      3.24
 43 ARG  QB     44 TYR  H       4.12
 43 ARG  QG     44 TYR  H       4.23
 44 TYR  H      44 TYR  QB      3.58
 44 TYR  H      44 TYR  QD      3.87
 44 TYR  H      45 ARG  H       3.77
 44 TYR  HA     44 TYR  QB      2.65
 44 TYR  HA     44 TYR  QD      3.34
 44 TYR  QB     45 ARG  H       4.10
 44 TYR  QD     48 GLU  H       4.31
 44 TYR  QD     49 HIS  HD2     4.33
 44 TYR  QD     49 HIS  HE1     3.78
 45 ARG  H      45 ARG  QG      3.85
 45 ARG  HA     45 ARG  QD      4.20
 45 ARG  HA     45 ARG  QG      3.39
 46 GLY  H      47 GLN  H       4.29
 47 GLN  H      47 GLN  QB      3.45
 47 GLN  H      47 GLN  QG      4.09
 47 GLN  HA     47 GLN  QG      3.78
 47 GLN  HA     48 GLU  H       3.16
 47 GLN  QB     48 GLU  H       4.06
 47 GLN  QG     48 GLU  H       4.68
 48 GLU  H      48 GLU  HB2     4.19
 48 GLU  H      48 GLU  HB3     4.19
 48 GLU  H      48 GLU  HG2     4.43
 48 GLU  H      48 GLU  HG3     4.43
 48 GLU  H      48 GLU  QB      3.63
 48 GLU  HA     48 GLU  HG2     3.83
 48 GLU  HA     48 GLU  HG3     3.83
 48 GLU  HA     49 HIS  H       3.07
 48 GLU  QB     49 HIS  H       4.37
 49 HIS  H      49 HIS  HB2     3.99
 49 HIS  H      49 HIS  HB3     3.99
 49 HIS  H      49 HIS  HD2     4.26
 49 HIS  H      49 HIS  QB      3.49
 49 HIS  H      50 CYSS H       4.66
 49 HIS  HA     50 CYSS H       3.36
 49 HIS  QB     50 CYSS H       4.41
 50 CYSS H      50 CYSS HB2     3.95
 50 CYSS H      50 CYSS HB3     3.95
 50 CYSS H      50 CYSS QB      3.42
 50 CYSS H      51 LEU  H       4.51
 50 CYSS HA     51 LEU  H       3.24
 50 CYSS HA     51 LEU  QB      4.51
 51 LEU  H      51 LEU  HG      4.77
 51 LEU  H      51 LEU  QB      3.48
 51 LEU  H      51 LEU  QQD     4.41
 51 LEU  HA     51 LEU  HG      4.21
 51 LEU  HA     51 LEU  QQD     3.37
 51 LEU  HA     52 HIS  H       3.15
 51 LEU  HB2    58 THR  QG2     4.12
 51 LEU  HB3    58 THR  QG2     4.12
 51 LEU  HG     52 HIS  H       4.36
 51 LEU  QB     52 HIS  H       3.85
 51 LEU  QD1    58 THR  HA      4.36
 51 LEU  QD1    58 THR  QG2     4.13
 51 LEU  QD2    58 THR  HA      4.36
 51 LEU  QD2    58 THR  QG2     4.13
 51 LEU  QQD    52 HIS  H       4.49
 51 LEU  QQD    58 THR  HA      3.75
 51 LEU  QQD    58 THR  QG2     3.47
 51 LEU  QQD    61 PHE  QB      4.35
 51 LEU  QQD    61 PHE  QD      4.25
 52 HIS  H      52 HIS  HB2     3.45
 52 HIS  H      52 HIS  HB3     3.45
 52 HIS  H      53 PRO  QD      4.43
 52 HIS  H      55 LEU  QQD     4.09
 52 HIS  HA     52 HIS  HD2     4.68
 52 HIS  HA     53 PRO  HD2     3.21
 52 HIS  HA     53 PRO  HD3     3.21
 52 HIS  HA     53 PRO  QD      2.79
 52 HIS  HE1    54 LYS  H       4.11
 52 HIS  HE1    54 LYS  HB2     4.04
 52 HIS  HE1    54 LYS  HB3     4.04
 52 HIS  HE1    54 LYS  HG2     3.98
 52 HIS  HE1    54 LYS  HG3     3.98
 52 HIS  HE1    54 LYS  QB      3.17
 52 HIS  HE1    54 LYS  QD      4.03
 52 HIS  HE1    54 LYS  QG      3.48
 52 HIS  QB     52 HIS  HD2     3.44
 52 HIS  QB     55 LEU  QQD     3.73
 53 PRO  HA     55 LEU  H       4.09
 53 PRO  HA     58 THR  HB      3.77
 53 PRO  HA     58 THR  QG2     3.13
 53 PRO  HB2    58 THR  QG2     4.85
 53 PRO  HB3    58 THR  QG2     4.85
 53 PRO  QB     54 LYS  H       3.62
 53 PRO  QD     54 LYS  H       4.29
 53 PRO  QG     54 LYS  H       4.86
 54 LYS  H      54 LYS  HB2     4.20
 54 LYS  H      54 LYS  HB3     4.20
 54 LYS  H      54 LYS  HG2     4.50
 54 LYS  H      54 LYS  HG3     4.50
 54 LYS  H      54 LYS  QB      3.39
 54 LYS  H      54 LYS  QG      3.87
 54 LYS  H      55 LEU  H       3.36
 54 LYS  H      55 LEU  HG      4.45
 54 LYS  HA     54 LYS  HD2     3.68
 54 LYS  HA     54 LYS  HD3     3.68
 54 LYS  HA     54 LYS  HG2     3.55
 54 LYS  HA     54 LYS  HG3     3.55
 54 LYS  HA     54 LYS  QD      3.03
 54 LYS  HA     54 LYS  QE      3.46
 54 LYS  HA     54 LYS  QG      3.11
 54 LYS  QB     54 LYS  QD      2.45
 54 LYS  QB     54 LYS  QE      4.44
 54 LYS  QB     55 LEU  H       3.65
 54 LYS  QG     54 LYS  QD      2.28
 54 LYS  QG     54 LYS  QE      3.09
 55 LEU  H      55 LEU  HB2     3.97
 55 LEU  H      55 LEU  HB3     3.97
 55 LEU  H      55 LEU  HG      3.38
 55 LEU  H      55 LEU  QB      3.22
 55 LEU  H      55 LEU  QD1     4.25
 55 LEU  H      55 LEU  QD2     4.25
 55 LEU  H      58 THR  HB      4.11
 55 LEU  H      59 LYS  QE      4.43
 55 LEU  HA     55 LEU  HG      3.84
 55 LEU  HA     55 LEU  QD1     4.51
 55 LEU  HA     55 LEU  QD2     4.51
 55 LEU  HA     55 LEU  QQD     3.18
 55 LEU  HB2    55 LEU  QD1     3.85
 55 LEU  HB2    55 LEU  QD2     3.85
 55 LEU  HB2    58 THR  H       3.76
 55 LEU  HB3    55 LEU  QD1     3.85
 55 LEU  HB3    55 LEU  QD2     3.85
 55 LEU  HB3    58 THR  H       3.76
 55 LEU  QB     58 THR  H       3.26
 55 LEU  QQD    58 THR  H       4.20
 56 GLN  HA     56 GLN  QG      3.81
 56 GLN  HA     59 LYS  H       4.30
 56 GLN  HA     59 LYS  QB      3.23
 56 GLN  HA     59 LYS  QE      3.81
 57 SER  HA     57 SER  QB      2.96
 57 SER  HA     60 ARG  H       4.12
 57 SER  HA     60 ARG  QB      4.31
 57 SER  HA     60 ARG  QD      4.88
 57 SER  HA     61 PHE  H       4.42
 58 THR  H      58 THR  HB      3.46
 58 THR  H      58 THR  QG2     4.85
 58 THR  H      59 LYS  H       3.44
 58 THR  HA     58 THR  QG2     3.45
 58 THR  HA     61 PHE  H       3.94
 58 THR  HA     61 PHE  HB2     4.19
 58 THR  HA     61 PHE  HB3     4.19
 58 THR  HA     61 PHE  QB      3.55
 58 THR  HA     62 ILE  H       4.04
 58 THR  HB     59 LYS  H       3.62
 58 THR  QG2    59 LYS  H       4.72
 59 LYS  H      59 LYS  QB      3.29
 59 LYS  H      59 LYS  QD      4.51
 59 LYS  H      59 LYS  QG      3.33
 59 LYS  H      60 ARG  H       3.51
 59 LYS  HA     59 LYS  HD2     4.14
 59 LYS  HA     59 LYS  HD3     4.14
 59 LYS  HA     59 LYS  HG2     3.55
 59 LYS  HA     59 LYS  HG3     3.55
 59 LYS  HA     59 LYS  QB      2.91
 59 LYS  HA     59 LYS  QE      4.72
 59 LYS  HA     59 LYS  QG      3.11
 59 LYS  HA     62 ILE  H       3.99
 59 LYS  HA     62 ILE  HB      3.03
 59 LYS  HA     63 LYS  H       3.72
 59 LYS  QB     59 LYS  HD2     3.26
 59 LYS  QB     59 LYS  HD3     3.26
 59 LYS  QB     59 LYS  QD      2.83
 59 LYS  QB     59 LYS  QE      4.58
 59 LYS  QB     60 ARG  H       3.37
 59 LYS  QG     59 LYS  QD      2.21
 60 ARG  H      60 ARG  HB2     3.44
 60 ARG  H      60 ARG  HB3     3.44
 60 ARG  H      60 ARG  HG2     4.50
 60 ARG  H      60 ARG  HG3     4.50
 60 ARG  H      60 ARG  QB      3.00
 60 ARG  H      60 ARG  QD      4.75
 60 ARG  H      60 ARG  QG      3.90
 60 ARG  H      61 PHE  H       3.44
 60 ARG  HA     60 ARG  QD      5.50
 60 ARG  HA     60 ARG  QG      3.44
 60 ARG  HA     63 LYS  QB      3.01
 60 ARG  HB2    61 PHE  H       3.94
 60 ARG  HB3    61 PHE  H       3.94
 60 ARG  HG2    64 TRP  HD1     4.42
 60 ARG  HG3    64 TRP  HD1     4.42
 60 ARG  QB     60 ARG  QG      2.35
 60 ARG  QB     61 PHE  H       3.44
 60 ARG  QB     64 TRP  HD1     4.26
 60 ARG  QG     64 TRP  HD1     3.85
 61 PHE  H      61 PHE  HB2     3.52
 61 PHE  H      61 PHE  HB3     3.52
 61 PHE  H      61 PHE  QB      3.03
 61 PHE  H      62 ILE  H       3.23
 61 PHE  HA     61 PHE  QD      4.12
 61 PHE  HA     64 TRP  H       3.88
 61 PHE  HA     64 TRP  QB      3.87
 61 PHE  HA     65 TYR  H       4.45
 61 PHE  QB     62 ILE  H       3.83
 61 PHE  QB     63 LYS  H       4.64
 61 PHE  QD     61 PHE  HZ      4.09
 61 PHE  QD     62 ILE  H       4.65
 62 ILE  H      62 ILE  HB      3.45
 62 ILE  H      62 ILE  QD1     4.24
 62 ILE  H      62 ILE  QG1     2.89
 62 ILE  H      62 ILE  QG2     3.77
 62 ILE  H      63 LYS  H       3.23
 62 ILE  H      63 LYS  QE      4.62
 62 ILE  HA     62 ILE  QD1     3.82
 62 ILE  HA     62 ILE  QG1     3.36
 62 ILE  HA     62 ILE  QG2     3.34
 62 ILE  HA     65 TYR  H       4.15
 62 ILE  HA     65 TYR  HB2     4.29
 62 ILE  HA     65 TYR  HB3     4.29
 62 ILE  HA     65 TYR  QB      3.51
 62 ILE  HA     65 TYR  QD      4.54
 62 ILE  HA     66 ASN  H       4.67
 62 ILE  HB     62 ILE  QD1     3.53
 62 ILE  HB     63 LYS  H       3.74
 62 ILE  QD1    65 TYR  H       4.72
 62 ILE  QG1    63 LYS  H       4.78
 62 ILE  QG2    62 ILE  QD1     2.49
 62 ILE  QG2    62 ILE  QG1     2.60
 62 ILE  QG2    63 LYS  H       3.58
 62 ILE  QG2    64 TRP  H       4.74
 62 ILE  QG2    65 TYR  QD      4.58
 62 ILE  QG2    66 ASN  H       4.46
 62 ILE  QG2    66 ASN  HD21    3.82
 62 ILE  QG2    66 ASN  HD22    3.82
 63 LYS  H      63 LYS  HG2     4.46
 63 LYS  H      63 LYS  HG3     4.46
 63 LYS  H      63 LYS  QB      2.96
 63 LYS  H      63 LYS  QG      3.76
 63 LYS  H      64 TRP  H       3.40
 63 LYS  HA     63 LYS  HG2     3.86
 63 LYS  HA     63 LYS  HG3     3.86
 63 LYS  HA     63 LYS  QB      3.01
 63 LYS  HA     63 LYS  QD      3.93
 63 LYS  HA     63 LYS  QE      4.31
 63 LYS  HA     63 LYS  QG      3.20
 63 LYS  HA     66 ASN  H       4.30
 63 LYS  HA     66 ASN  HB2     4.46
 63 LYS  HA     66 ASN  HB3     4.46
 63 LYS  HA     66 ASN  QB      3.63
 63 LYS  HA     67 ALA  H       4.76
 63 LYS  QB     63 LYS  QD      3.29
 63 LYS  QB     63 LYS  QE      3.92
 63 LYS  QB     64 TRP  H       3.71
 63 LYS  QG     63 LYS  QE      3.57
 64 TRP  H      64 TRP  HB2     4.21
 64 TRP  H      64 TRP  HB3     4.21
 64 TRP  H      65 TYR  H       3.62
 64 TRP  H      66 ASN  H       4.18
 64 TRP  HA     64 TRP  HD1     3.71
 64 TRP  HA     67 ALA  H       4.02
 64 TRP  HA     67 ALA  QB      3.69
 64 TRP  HA     68 TRP  H       5.11
 64 TRP  HZ3    68 TRP  HA      4.59
 64 TRP  HZ3    68 TRP  HB2     4.26
 64 TRP  HZ3    68 TRP  HB3     4.26
 64 TRP  HZ3    68 TRP  QB      3.73
 64 TRP  QB     65 TYR  H       3.78
 65 TYR  H      65 TYR  HB2     3.60
 65 TYR  H      65 TYR  HB3     3.60
 65 TYR  H      66 ASN  H       3.64
 65 TYR  H      67 ALA  H       4.32
 65 TYR  HA     65 TYR  QD      3.52
 65 TYR  HA     67 ALA  H       4.40
 65 TYR  HA     68 TRP  H       4.45
 65 TYR  HA     68 TRP  HB2     4.47
 65 TYR  HA     68 TRP  HB3     4.47
 65 TYR  HA     68 TRP  HD1     4.37
 65 TYR  HA     68 TRP  QB      3.65
 65 TYR  HA     69 ASN  H       5.14
 65 TYR  QB     66 ASN  H       3.04
 65 TYR  QD     66 ASN  H       4.07
 65 TYR  QD     68 TRP  HD1     3.30
 65 TYR  QD     69 ASN  QB      4.33
 66 ASN  H      66 ASN  HB2     3.90
 66 ASN  H      66 ASN  HB3     3.90
 66 ASN  H      66 ASN  QB      3.31
 66 ASN  H      67 ALA  H       3.37
 66 ASN  HA     69 ASN  H       4.81
 66 ASN  HA     69 ASN  HB2     3.92
 66 ASN  HA     69 ASN  HB3     3.92
 66 ASN  HA     69 ASN  QB      3.38
 66 ASN  HA     70 GLU  H       4.70
 66 ASN  HB2    67 ALA  H       3.74
 66 ASN  HB3    67 ALA  H       3.74
 66 ASN  QB     66 ASN  QD2     3.12
 66 ASN  QB     67 ALA  H       3.25
 67 ALA  H      67 ALA  QB      3.01
 67 ALA  H      68 TRP  H       3.44
 67 ALA  HA     70 GLU  H       3.89
 67 ALA  HA     70 GLU  QB      3.55
 67 ALA  QB     68 TRP  H       3.74
 68 TRP  H      68 TRP  HB2     3.67
 68 TRP  H      68 TRP  HB3     3.67
 68 TRP  H      69 ASN  H       3.63
 68 TRP  H      70 GLU  H       4.49
 68 TRP  HA     71 LYS  H       3.31
 68 TRP  HA     71 LYS  HB2     4.53
 68 TRP  HA     71 LYS  HB3     4.53
 68 TRP  HA     71 LYS  QB      3.96
 68 TRP  HB2    69 ASN  H       4.32
 68 TRP  HB3    69 ASN  H       4.32
 68 TRP  HH2    72 ARG  QD      4.51
 68 TRP  HZ2    72 ARG  QD      4.57
 68 TRP  QB     69 ASN  H       3.60
 69 ASN  H      69 ASN  HB2     3.71
 69 ASN  H      69 ASN  HB3     3.71
 69 ASN  H      69 ASN  QB      3.16
 69 ASN  H      70 GLU  H       3.55
 69 ASN  HA     69 ASN  QD2     4.67
 69 ASN  HA     72 ARG  H       4.21
 69 ASN  HA     72 ARG  HB2     4.95
 69 ASN  HA     72 ARG  HB3     4.95
 69 ASN  HA     72 ARG  HD2     4.51
 69 ASN  HA     72 ARG  HD3     4.51
 69 ASN  HA     72 ARG  QB      4.23
 69 ASN  HA     72 ARG  QG      4.25
 69 ASN  HB2    70 GLU  H       4.08
 69 ASN  HB3    70 GLU  H       4.08
 69 ASN  QB     70 GLU  H       3.51
 70 GLU  H      70 GLU  HG2     4.49
 70 GLU  H      70 GLU  HG3     4.49
 70 GLU  H      70 GLU  QB      3.06
 70 GLU  H      71 LYS  H       3.24
 70 GLU  HA     70 GLU  HG2     3.95
 70 GLU  HA     70 GLU  HG3     3.95
 70 GLU  HA     70 GLU  QG      3.44
 70 GLU  HA     73 ARG  H       4.51
 70 GLU  HA     73 ARG  QB      4.54
 70 GLU  HA     74 VAL  H       4.00
 70 GLU  QB     70 GLU  HG2     2.67
 70 GLU  QB     70 GLU  HG3     2.67
 70 GLU  QB     71 LYS  H       3.72
 71 LYS  H      71 LYS  HG2     4.69
 71 LYS  H      71 LYS  HG3     4.69
 71 LYS  H      71 LYS  QB      3.24
 71 LYS  H      71 LYS  QE      4.73
 71 LYS  H      71 LYS  QG      3.88
 71 LYS  H      72 ARG  H       3.30
 71 LYS  HA     71 LYS  QD      3.32
 71 LYS  HA     71 LYS  QE      5.50
 71 LYS  HA     71 LYS  QG      3.63
 71 LYS  QB     71 LYS  QG      2.30
 71 LYS  QB     72 ARG  H       3.96
 71 LYS  QG     72 ARG  H       4.53
 72 ARG  H      72 ARG  HB2     3.89
 72 ARG  H      72 ARG  HB3     3.89
 72 ARG  H      72 ARG  QB      3.36
 72 ARG  H      72 ARG  QG      3.70
 72 ARG  H      73 ARG  H       3.67
 72 ARG  HA     72 ARG  QD      4.35
 72 ARG  HA     72 ARG  QG      3.68
 73 ARG  H      73 ARG  HG2     4.90
 73 ARG  H      73 ARG  HG3     4.90
 73 ARG  H      73 ARG  QB      3.58
 73 ARG  H      73 ARG  QD      4.88
 73 ARG  H      73 ARG  QG      4.06
 73 ARG  H      74 VAL  H       2.40
 73 ARG  HA     73 ARG  QD      4.21
 73 ARG  HA     73 ARG  QG      3.50
 73 ARG  QB     73 ARG  HG2     2.73
 73 ARG  QB     73 ARG  HG3     2.73
 73 ARG  QB     73 ARG  QD      2.99
 73 ARG  QB     73 ARG  QG      2.33
 73 ARG  QB     74 VAL  H       4.01
 73 ARG  QG     74 VAL  H       4.43
 74 VAL  H      74 VAL  HB      3.63
 74 VAL  H      74 VAL  QQG     3.55
 74 VAL  HA     74 VAL  QG1     4.21
 74 VAL  HA     74 VAL  QG2     4.21
 74 VAL  HA     75 TYR  H       3.10
 74 VAL  HB     75 TYR  H       3.96
 74 VAL  QQG    75 TYR  H       4.28
 75 TYR  H      75 TYR  HB2     3.84
 75 TYR  H      75 TYR  HB3     3.84
 75 TYR  H      75 TYR  QB      3.30
 75 TYR  H      75 TYR  QD      4.22
 75 TYR  HA     75 TYR  QD      3.32
 75 TYR  HA     76 GLU  H       3.33
 76 GLU  H      76 GLU  QB      3.59
 76 GLU  H      76 GLU  QG      4.33
 76 GLU  HA     76 GLU  QG      3.82
 76 GLU  HA     77 GLU  H       3.24
 76 GLU  HB2    76 GLU  QG      2.76
 76 GLU  HB2    77 GLU  H       4.27
 76 GLU  HB3    76 GLU  QG      2.76
 76 GLU  HB3    77 GLU  H       4.27
 76 GLU  QB     76 GLU  QG      2.26
 76 GLU  QB     77 GLU  H       3.63
 76 GLU  QG     77 GLU  H       4.26

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    SER   1           H        SER   1  16.414 -10.035  -5.848
    2    HA   SER   1           HA       SER   1  18.278  -7.786  -5.700
    3   1HB   SER   1          2HB       SER   1  16.501  -8.527  -8.021
    4   2HB   SER   1          1HB       SER   1  17.565  -7.128  -7.923
    5    HG   SER   1           HG       SER   1  18.923  -9.376  -7.370
    6    H    LYS   2           H        LYS   2  17.272  -6.384  -4.335
    7    HA   LYS   2           HA       LYS   2  14.369  -6.202  -4.611
    8   1HB   LYS   2          2HB       LYS   2  14.270  -5.281  -2.338
    9   2HB   LYS   2          1HB       LYS   2  14.983  -6.880  -2.368
   10   1HG   LYS   2          2HG       LYS   2  17.194  -5.943  -2.082
   11   2HG   LYS   2          1HG       LYS   2  16.537  -4.308  -2.188
   12   1HD   LYS   2          2HD       LYS   2  15.195  -4.734  -0.179
   13   2HD   LYS   2          1HD       LYS   2  15.888  -6.349  -0.062
   14   1HE   LYS   2          2HE       LYS   2  18.102  -5.411   0.242
   15   2HE   LYS   2          1HE       LYS   2  17.468  -3.785   0.006
   16   1HZ   LYS   2          1HZ       LYS   2  16.751  -5.598   2.259
   17   2HZ   LYS   2          2HZ       LYS   2  16.179  -4.021   2.026
   18   3HZ   LYS   2          3HZ       LYS   2  17.804  -4.281   2.324
   19    H    CYS   3           H        CYS   3  13.428  -4.412  -5.204
   20    HA   CYS   3           HA       CYS   3  15.045  -2.123  -5.746
   21   1HB   CYS   3          2HB       CYS   3  12.631  -1.341  -6.561
   22   2HB   CYS   3          1HB       CYS   3  13.650  -2.388  -7.542
   23    H    LYS   4           H        LYS   4  14.762  -0.127  -4.821
   24    HA   LYS   4           HA       LYS   4  14.009  -0.410  -2.090
   25   1HB   LYS   4          2HB       LYS   4  15.010   1.788  -1.735
   26   2HB   LYS   4          1HB       LYS   4  16.097   0.688  -2.560
   27   1HG   LYS   4          2HG       LYS   4  15.663   1.803  -4.674
   28   2HG   LYS   4          1HG       LYS   4  14.483   2.859  -3.891
   29   1HD   LYS   4          2HD       LYS   4  16.278   3.738  -2.451
   30   2HD   LYS   4          1HD       LYS   4  17.432   2.706  -3.289
   31   1HE   LYS   4          2HE       LYS   4  15.762   4.874  -4.569
   32   2HE   LYS   4          1HE       LYS   4  17.453   5.036  -4.112
   33   1HZ   LYS   4          1HZ       LYS   4  17.973   3.254  -5.703
   34   2HZ   LYS   4          2HZ       LYS   4  17.295   4.581  -6.429
   35   3HZ   LYS   4          3HZ       LYS   4  16.358   3.204  -6.198
   36    H    CYS   5           H        CYS   5  12.208  -0.017  -1.297
   37    HA   CYS   5           HA       CYS   5  10.698   2.358  -2.109
   38   1HB   CYS   5          2HB       CYS   5   9.668  -0.353  -1.225
   39   2HB   CYS   5          1HB       CYS   5   8.662   1.087  -1.277
   40    H    SER   6           H        SER   6  12.811   1.395  -0.185
   41    HA   SER   6           HA       SER   6  13.569   1.657   1.851
   42   1HB   SER   6          2HB       SER   6  12.697   4.017   1.579
   43   2HB   SER   6          1HB       SER   6  11.203   3.509   2.357
   44    HG   SER   6           HG       SER   6  13.805   3.571   3.405
   45    H    ARG   7           H        ARG   7  10.209   1.949   2.851
   46    HA   ARG   7           HA       ARG   7  10.137  -0.864   3.596
   47   1HB   ARG   7          2HB       ARG   7   9.478   1.338   5.597
   48   2HB   ARG   7          1HB       ARG   7   9.191  -0.367   5.827
   49   1HG   ARG   7          2HG       ARG   7  11.619  -0.767   5.781
   50   2HG   ARG   7          1HG       ARG   7  11.880   0.972   5.606
   51   1HD   ARG   7          2HD       ARG   7  10.491  -0.399   7.910
   52   2HD   ARG   7          1HD       ARG   7  12.113   0.288   7.942
   53    HE   ARG   7           HE       ARG   7  10.745   2.408   7.235
   54   1HH1  ARG   7          1HH1      ARG   7   9.940   0.043   9.800
   55   2HH1  ARG   7          2HH1      ARG   7   9.100   1.170  10.739
   56   1HH2  ARG   7          1HH2      ARG   7   9.565   3.928   8.572
   57   2HH2  ARG   7          2HH2      ARG   7   8.889   3.420  10.045
   58    H    LYS   8           H        LYS   8   8.405   2.147   4.013
   59    HA   LYS   8           HA       LYS   8   6.048   1.086   2.631
   60   1HB   LYS   8          2HB       LYS   8   5.710   0.761   5.026
   61   2HB   LYS   8          1HB       LYS   8   6.195   2.412   5.340
   62   1HG   LYS   8          2HG       LYS   8   4.138   3.226   4.322
   63   2HG   LYS   8          1HG       LYS   8   3.671   1.577   3.900
   64   1HD   LYS   8          2HD       LYS   8   2.518   2.326   5.937
   65   2HD   LYS   8          1HD       LYS   8   3.598   0.977   6.279
   66   1HE   LYS   8          2HE       LYS   8   5.294   2.588   7.119
   67   2HE   LYS   8          1HE       LYS   8   4.164   3.905   6.812
   68   1HZ   LYS   8          1HZ       LYS   8   4.136   3.234   9.142
   69   2HZ   LYS   8          2HZ       LYS   8   3.797   1.666   8.729
   70   3HZ   LYS   8          3HZ       LYS   8   2.649   2.846   8.461
   71    H    GLY   9           H        GLY   9   8.373   3.466   3.000
   72   1HA   GLY   9          2HA       GLY   9   8.654   5.474   1.950
   73   2HA   GLY   9          1HA       GLY   9   7.010   5.322   1.312
   74    HA   PRO  10           HA       PRO  10   6.662   8.621   4.585
   75   1HB   PRO  10          2HB       PRO  10   4.441   9.264   2.695
   76   2HB   PRO  10          1HB       PRO  10   5.590  10.358   3.474
   77   1HG   PRO  10          2HG       PRO  10   5.834   9.782   0.890
   78   2HG   PRO  10          1HG       PRO  10   7.261   9.933   1.926
   79   1HD   PRO  10          2HD       PRO  10   5.934   7.472   0.882
   80   2HD   PRO  10          1HD       PRO  10   7.661   7.810   1.095
   81    H    LYS  11           H        LYS  11   5.051   8.534   6.175
   82    HA   LYS  11           HA       LYS  11   3.795   6.039   6.383
   83   1HB   LYS  11          2HB       LYS  11   4.551   7.277   8.356
   84   2HB   LYS  11          1HB       LYS  11   3.324   8.504   8.064
   85   1HG   LYS  11          2HG       LYS  11   1.563   6.855   8.441
   86   2HG   LYS  11          1HG       LYS  11   2.785   5.610   8.707
   87   1HD   LYS  11          2HD       LYS  11   3.626   6.855  10.637
   88   2HD   LYS  11          1HD       LYS  11   2.412   8.104  10.350
   89   1HE   LYS  11          2HE       LYS  11   0.636   6.477  10.737
   90   2HE   LYS  11          1HE       LYS  11   1.828   5.210  10.995
   91   1HZ   LYS  11          1HZ       LYS  11   2.650   6.458  12.913
   92   2HZ   LYS  11          2HZ       LYS  11   1.025   6.066  13.082
   93   3HZ   LYS  11          3HZ       LYS  11   1.461   7.633  12.674
   94    H    ILE  12           H        ILE  12   2.093   5.352   5.513
   95    HA   ILE  12           HA       ILE  12   0.110   7.106   4.302
   96    HB   ILE  12           HB       ILE  12   0.173   4.089   4.328
   97   1HG1  ILE  12          2HG1      ILE  12   1.534   5.873   2.304
   98   2HG1  ILE  12          1HG1      ILE  12   2.370   4.925   3.529
   99   1HG2  ILE  12          1HG2      ILE  12  -0.937   6.101   2.362
  100   2HG2  ILE  12          2HG2      ILE  12  -1.872   5.165   3.527
  101   3HG2  ILE  12          3HG2      ILE  12  -1.038   4.345   2.208
  102   1HD1  ILE  12          1HD1      ILE  12   2.430   3.811   1.388
  103   2HD1  ILE  12          2HD1      ILE  12   0.673   3.871   1.298
  104   3HD1  ILE  12          3HD1      ILE  12   1.457   2.873   2.531
  105    H    ARG  13           H        ARG  13  -2.001   7.160   5.114
  106    HA   ARG  13           HA       ARG  13  -2.538   5.423   7.388
  107   1HB   ARG  13          2HB       ARG  13  -3.961   7.907   6.406
  108   2HB   ARG  13          1HB       ARG  13  -4.540   6.836   7.668
  109   1HG   ARG  13          2HG       ARG  13  -3.596   8.859   8.640
  110   2HG   ARG  13          1HG       ARG  13  -2.642   7.452   9.081
  111   1HD   ARG  13          2HD       ARG  13  -0.934   8.074   7.485
  112   2HD   ARG  13          1HD       ARG  13  -1.940   9.388   6.866
  113    HE   ARG  13           HE       ARG  13  -1.746   9.858   9.525
  114   1HH1  ARG  13          1HH1      ARG  13   0.736   9.518   6.976
  115   2HH1  ARG  13          2HH1      ARG  13   1.775  10.648   7.697
  116   1HH2  ARG  13          1HH2      ARG  13  -0.275  11.423  10.446
  117   2HH2  ARG  13          2HH2      ARG  13   1.214  11.750   9.696
  118    H    TYR  14           H        TYR  14  -4.720   4.423   7.311
  119    HA   TYR  14           HA       TYR  14  -5.110   3.095   4.837
  120   1HB   TYR  14          2HB       TYR  14  -7.096   3.331   7.111
  121   2HB   TYR  14          1HB       TYR  14  -7.090   2.096   5.857
  122    HD1  TYR  14           1HD      TYR  14  -6.030   2.933   9.117
  123    HD2  TYR  14           2HD      TYR  14  -4.919   0.606   5.725
  124    HE1  TYR  14           1HE      TYR  14  -4.567   1.569  10.525
  125    HE2  TYR  14           2HE      TYR  14  -3.487  -0.748   7.122
  126    HH   TYR  14           HH       TYR  14  -2.283  -0.483   9.205
  127    H    SER  15           H        SER  15  -6.448   5.937   6.238
  128    HA   SER  15           HA       SER  15  -8.705   6.327   4.658
  129   1HB   SER  15          2HB       SER  15  -6.907   8.290   6.012
  130   2HB   SER  15          1HB       SER  15  -8.590   8.561   5.528
  131    HG   SER  15           HG       SER  15  -9.200   7.628   7.273
  132    H    ASP  16           H        ASP  16  -5.300   6.671   3.968
  133    HA   ASP  16           HA       ASP  16  -5.575   8.663   1.874
  134   1HB   ASP  16          2HB       ASP  16  -3.220   6.978   2.771
  135   2HB   ASP  16          1HB       ASP  16  -3.167   8.010   1.358
  136    H    VAL  17           H        VAL  17  -5.817   5.284   2.183
  137    HA   VAL  17           HA       VAL  17  -4.787   4.805  -0.504
  138    HB   VAL  17           HB       VAL  17  -5.990   2.726   1.280
  139   1HG1  VAL  17          1HG1      VAL  17  -5.799   1.957  -0.907
  140   2HG1  VAL  17          2HG1      VAL  17  -4.503   1.186   0.021
  141   3HG1  VAL  17          3HG1      VAL  17  -4.147   2.527  -1.065
  142   1HG2  VAL  17          1HG2      VAL  17  -3.707   2.206   2.069
  143   2HG2  VAL  17          2HG2      VAL  17  -4.234   3.813   2.566
  144   3HG2  VAL  17          3HG2      VAL  17  -3.110   3.633   1.223
  145    H    LYS  18           H        LYS  18  -5.964   4.855  -2.192
  146    HA   LYS  18           HA       LYS  18  -8.874   4.510  -2.141
  147   1HB   LYS  18          2HB       LYS  18  -6.889   5.412  -4.173
  148   2HB   LYS  18          1HB       LYS  18  -8.520   4.994  -4.648
  149   1HG   LYS  18          2HG       LYS  18  -7.824   7.052  -2.575
  150   2HG   LYS  18          1HG       LYS  18  -8.090   7.410  -4.292
  151   1HD   LYS  18          2HD       LYS  18 -10.129   6.136  -2.447
  152   2HD   LYS  18          1HD       LYS  18 -10.099   7.837  -2.899
  153   1HE   LYS  18          2HE       LYS  18 -10.318   7.188  -5.274
  154   2HE   LYS  18          1HE       LYS  18 -10.418   5.504  -4.795
  155   1HZ   LYS  18          1HZ       LYS  18 -12.327   7.620  -3.992
  156   2HZ   LYS  18          2HZ       LYS  18 -12.481   5.955  -3.646
  157   3HZ   LYS  18          3HZ       LYS  18 -12.555   6.517  -5.232
  158    H    LYS  19           H        LYS  19  -5.959   2.939  -3.151
  159    HA   LYS  19           HA       LYS  19  -7.365   0.591  -3.913
  160   1HB   LYS  19          2HB       LYS  19  -7.609   2.052  -5.888
  161   2HB   LYS  19          1HB       LYS  19  -5.864   2.207  -5.973
  162   1HG   LYS  19          2HG       LYS  19  -5.654  -0.141  -6.432
  163   2HG   LYS  19          1HG       LYS  19  -7.406  -0.323  -6.239
  164   1HD   LYS  19          2HD       LYS  19  -7.778   1.204  -8.106
  165   2HD   LYS  19          1HD       LYS  19  -6.035   1.396  -8.295
  166   1HE   LYS  19          2HE       LYS  19  -6.931  -0.175  -9.936
  167   2HE   LYS  19          1HE       LYS  19  -5.824  -0.975  -8.821
  168   1HZ   LYS  19          1HZ       LYS  19  -7.771  -1.815  -7.614
  169   2HZ   LYS  19          2HZ       LYS  19  -7.755  -2.318  -9.212
  170   3HZ   LYS  19          3HZ       LYS  19  -8.804  -1.098  -8.734
  171    H    LEU  20           H        LEU  20  -5.999  -1.126  -3.865
  172    HA   LEU  20           HA       LEU  20  -3.163  -0.635  -3.299
  173   1HB   LEU  20          2HB       LEU  20  -4.643  -1.034  -1.287
  174   2HB   LEU  20          1HB       LEU  20  -5.080  -2.569  -1.970
  175    HG   LEU  20           HG       LEU  20  -2.288  -1.841  -1.031
  176   1HD1  LEU  20          1HD1      LEU  20  -2.847  -3.164   0.966
  177   2HD1  LEU  20          2HD1      LEU  20  -4.459  -3.435   0.334
  178   3HD1  LEU  20          3HD1      LEU  20  -3.964  -1.818   0.791
  179   1HD2  LEU  20          1HD2      LEU  20  -1.908  -4.266  -1.086
  180   2HD2  LEU  20          2HD2      LEU  20  -2.358  -3.681  -2.690
  181   3HD2  LEU  20          3HD2      LEU  20  -3.544  -4.520  -1.694
  182    H    GLU  21           H        GLU  21  -1.949  -1.774  -4.791
  183    HA   GLU  21           HA       GLU  21  -3.137  -4.165  -6.031
  184   1HB   GLU  21          2HB       GLU  21  -1.558  -1.984  -7.393
  185   2HB   GLU  21          1HB       GLU  21  -1.994  -3.513  -8.129
  186   1HG   GLU  21          2HG       GLU  21  -4.361  -2.903  -7.919
  187   2HG   GLU  21          1HG       GLU  21  -3.882  -1.360  -7.212
  188    H    MET  22           H        MET  22  -1.616  -5.799  -6.495
  189    HA   MET  22           HA       MET  22   1.007  -5.213  -5.379
  190   1HB   MET  22          2HB       MET  22  -0.404  -7.843  -5.782
  191   2HB   MET  22          1HB       MET  22   1.241  -7.663  -5.190
  192   1HG   MET  22          2HG       MET  22   0.434  -6.431  -3.258
  193   2HG   MET  22          1HG       MET  22  -1.216  -6.548  -3.856
  194   1HE   MET  22          1HE       MET  22  -0.408  -7.353  -0.917
  195   2HE   MET  22          2HE       MET  22  -1.306  -8.861  -0.735
  196   3HE   MET  22          3HE       MET  22  -2.041  -7.491  -1.567
  197    H    LYS  23           H        LYS  23   2.363  -4.666  -6.832
  198    HA   LYS  23           HA       LYS  23   3.131  -6.431  -8.822
  199   1HB   LYS  23          2HB       LYS  23   2.941  -4.855 -10.803
  200   2HB   LYS  23          1HB       LYS  23   1.429  -5.506 -10.247
  201   1HG   LYS  23          2HG       LYS  23   0.931  -3.300 -10.780
  202   2HG   LYS  23          1HG       LYS  23   1.140  -3.249  -9.037
  203   1HD   LYS  23          2HD       LYS  23   3.361  -2.294  -9.303
  204   2HD   LYS  23          1HD       LYS  23   3.256  -2.489 -11.056
  205   1HE   LYS  23          2HE       LYS  23   1.316  -0.968 -11.105
  206   2HE   LYS  23          1HE       LYS  23   1.452  -0.709  -9.379
  207   1HZ   LYS  23          1HZ       LYS  23   3.677   0.274  -9.794
  208   2HZ   LYS  23          2HZ       LYS  23   2.454   1.079 -10.634
  209   3HZ   LYS  23          3HZ       LYS  23   3.452   0.003 -11.441
  210    HA   PRO  24           HA       PRO  24   6.773  -4.818  -7.392
  211   1HB   PRO  24          2HB       PRO  24   8.599  -5.556  -9.225
  212   2HB   PRO  24          1HB       PRO  24   7.771  -6.721  -8.198
  213   1HG   PRO  24          2HG       PRO  24   7.183  -5.970 -11.035
  214   2HG   PRO  24          1HG       PRO  24   7.198  -7.579 -10.286
  215   1HD   PRO  24          2HD       PRO  24   4.899  -6.161 -10.747
  216   2HD   PRO  24          1HD       PRO  24   5.089  -7.338  -9.433
  217    H    LYS  25           H        LYS  25   8.204  -3.129  -7.443
  218    HA   LYS  25           HA       LYS  25   7.581  -0.898  -9.059
  219   1HB   LYS  25          2HB       LYS  25   8.464  -0.678  -6.832
  220   2HB   LYS  25          1HB       LYS  25  10.017  -1.425  -7.276
  221   1HG   LYS  25          2HG       LYS  25  10.328   0.914  -7.108
  222   2HG   LYS  25          1HG       LYS  25  10.227   0.584  -8.840
  223   1HD   LYS  25          2HD       LYS  25   7.806   1.100  -8.710
  224   2HD   LYS  25          1HD       LYS  25   8.037   1.576  -7.050
  225   1HE   LYS  25          2HE       LYS  25   9.634   3.308  -7.681
  226   2HE   LYS  25          1HE       LYS  25   9.462   2.867  -9.380
  227   1HZ   LYS  25          1HZ       LYS  25   7.129   3.511  -9.256
  228   2HZ   LYS  25          2HZ       LYS  25   8.139   4.786  -8.869
  229   3HZ   LYS  25          3HZ       LYS  25   7.319   3.968  -7.641
  230    H    TYR  26           H        TYR  26  10.032  -3.422  -9.099
  231    HA   TYR  26           HA       TYR  26  10.522  -2.799 -11.872
  232   1HB   TYR  26          2HB       TYR  26  12.628  -3.300  -9.744
  233   2HB   TYR  26          1HB       TYR  26  12.955  -3.586 -11.434
  234    HD1  TYR  26           1HD      TYR  26  13.265  -1.831 -12.936
  235    HD2  TYR  26           2HD      TYR  26  12.258  -1.005  -8.909
  236    HE1  TYR  26           1HE      TYR  26  13.864   0.574 -13.276
  237    HE2  TYR  26           2HE      TYR  26  12.857   1.362  -9.215
  238    HH   TYR  26           HH       TYR  26  14.257   2.680 -10.660
  239    HA   PRO  27           HA       PRO  27   9.377  -7.093 -12.227
  240   1HB   PRO  27          2HB       PRO  27  11.111  -7.179 -14.624
  241   2HB   PRO  27          1HB       PRO  27   9.383  -7.495 -14.487
  242   1HG   PRO  27          2HG       PRO  27  10.272  -5.259 -15.644
  243   2HG   PRO  27          1HG       PRO  27   8.818  -5.268 -14.633
  244   1HD   PRO  27          2HD       PRO  27  11.579  -4.317 -13.958
  245   2HD   PRO  27          1HD       PRO  27   9.998  -3.607 -13.565
  246    H    HIS  28           H        HIS  28  12.598  -6.022 -12.262
  247    HA   HIS  28           HA       HIS  28  13.774  -8.652 -11.928
  248   1HB   HIS  28          2HB       HIS  28  15.968  -7.457 -11.781
  249   2HB   HIS  28          1HB       HIS  28  15.077  -7.064 -13.239
  250    HD1  HIS  28           1HD      HIS  28  16.363  -5.598 -10.044
  251    HD2  HIS  28           2HD      HIS  28  14.347  -4.242 -13.438
  252    HE1  HIS  28           1HE      HIS  28  16.417  -3.092  -9.999
  253    HE2  HIS  28           2HE      HIS  28  15.725  -2.486 -12.281
  254    H    CYS  29           H        CYS  29  11.887  -7.646  -9.923
  255    HA   CYS  29           HA       CYS  29  13.530  -7.743  -7.494
  256   1HB   CYS  29          2HB       CYS  29  10.824  -6.550  -8.097
  257   2HB   CYS  29          1HB       CYS  29  11.471  -6.528  -6.486
  258    H    GLU  30           H        GLU  30  12.653  -9.230  -5.790
  259    HA   GLU  30           HA       GLU  30  11.241 -11.435  -6.989
  260   1HB   GLU  30          2HB       GLU  30  12.253 -11.079  -4.165
  261   2HB   GLU  30          1HB       GLU  30  11.375 -12.502  -4.700
  262   1HG   GLU  30          2HG       GLU  30  13.605 -13.122  -4.684
  263   2HG   GLU  30          1HG       GLU  30  13.246 -12.738  -6.361
  264    H    GLU  31           H        GLU  31   9.226 -11.973  -6.787
  265    HA   GLU  31           HA       GLU  31   7.057 -11.909  -6.414
  266   1HB   GLU  31          2HB       GLU  31   7.988 -10.925  -3.748
  267   2HB   GLU  31          1HB       GLU  31   6.270 -11.095  -4.090
  268   1HG   GLU  31          2HG       GLU  31   7.054 -13.029  -2.876
  269   2HG   GLU  31          1HG       GLU  31   6.646 -13.505  -4.510
  270    H    LYS  32           H        LYS  32   5.180 -10.353  -5.603
  271    HA   LYS  32           HA       LYS  32   5.510  -7.968  -7.227
  272   1HB   LYS  32          2HB       LYS  32   3.073  -8.884  -5.695
  273   2HB   LYS  32          1HB       LYS  32   3.137  -7.666  -6.952
  274   1HG   LYS  32          2HG       LYS  32   3.623 -10.598  -7.288
  275   2HG   LYS  32          1HG       LYS  32   2.153  -9.714  -7.739
  276   1HD   LYS  32          2HD       LYS  32   3.456  -8.435  -9.344
  277   2HD   LYS  32          1HD       LYS  32   4.914  -9.347  -8.897
  278   1HE   LYS  32          2HE       LYS  32   2.391 -10.449 -10.146
  279   2HE   LYS  32          1HE       LYS  32   3.932 -10.209 -10.963
  280   1HZ   LYS  32          1HZ       LYS  32   4.918 -11.868  -9.465
  281   2HZ   LYS  32          2HZ       LYS  32   3.611 -12.501 -10.327
  282   3HZ   LYS  32          3HZ       LYS  32   3.419 -12.092  -8.718
  283    H    MET  33           H        MET  33   5.532  -5.966  -6.438
  284    HA   MET  33           HA       MET  33   5.919  -5.656  -3.560
  285   1HB   MET  33          2HB       MET  33   6.034  -3.531  -5.720
  286   2HB   MET  33          1HB       MET  33   6.395  -3.265  -4.030
  287   1HG   MET  33          2HG       MET  33   7.987  -4.965  -5.957
  288   2HG   MET  33          1HG       MET  33   8.435  -3.365  -5.370
  289   1HE   MET  33          1HE       MET  33   7.340  -6.950  -4.009
  290   2HE   MET  33          2HE       MET  33   8.858  -7.430  -3.278
  291   3HE   MET  33          3HE       MET  33   8.773  -7.146  -5.016
  292    H    VAL  34           H        VAL  34   4.705  -3.826  -2.451
  293    HA   VAL  34           HA       VAL  34   1.936  -4.122  -3.307
  294    HB   VAL  34           HB       VAL  34   2.998  -3.138  -0.662
  295   1HG1  VAL  34          1HG1      VAL  34   0.805  -2.255  -1.194
  296   2HG1  VAL  34          2HG1      VAL  34   0.690  -3.485   0.076
  297   3HG1  VAL  34          3HG1      VAL  34   0.232  -3.882  -1.579
  298   1HG2  VAL  34          1HG2      VAL  34   2.291  -5.315   0.223
  299   2HG2  VAL  34          2HG2      VAL  34   3.537  -5.498  -1.013
  300   3HG2  VAL  34          3HG2      VAL  34   1.852  -5.834  -1.405
  301    H    ILE  35           H        ILE  35   1.016  -2.531  -4.343
  302    HA   ILE  35           HA       ILE  35   2.269   0.110  -4.335
  303    HB   ILE  35           HB       ILE  35   0.305  -1.153  -6.247
  304   1HG1  ILE  35          2HG1      ILE  35   2.411  -2.297  -6.235
  305   2HG1  ILE  35          1HG1      ILE  35   2.188  -1.445  -7.751
  306   1HG2  ILE  35          1HG2      ILE  35   0.887   0.698  -7.748
  307   2HG2  ILE  35          2HG2      ILE  35   1.908   1.389  -6.489
  308   3HG2  ILE  35          3HG2      ILE  35   0.167   1.278  -6.242
  309   1HD1  ILE  35          1HD1      ILE  35   3.712   0.337  -6.929
  310   2HD1  ILE  35          2HD1      ILE  35   4.495  -1.241  -7.003
  311   3HD1  ILE  35          3HD1      ILE  35   3.962  -0.595  -5.452
  312    H    ILE  36           H        ILE  36   1.238   1.713  -3.469
  313    HA   ILE  36           HA       ILE  36  -1.620   1.444  -2.966
  314    HB   ILE  36           HB       ILE  36   0.497   2.463  -1.139
  315   1HG1  ILE  36          2HG1      ILE  36  -1.815   0.550  -0.869
  316   2HG1  ILE  36          1HG1      ILE  36  -0.104   0.159  -0.925
  317   1HG2  ILE  36          1HG2      ILE  36  -1.045   4.301  -1.178
  318   2HG2  ILE  36          2HG2      ILE  36  -1.216   3.424   0.347
  319   3HG2  ILE  36          3HG2      ILE  36  -2.410   3.215  -0.935
  320   1HD1  ILE  36          1HD1      ILE  36  -0.971  -0.018   1.320
  321   2HD1  ILE  36          2HD1      ILE  36  -1.536   1.655   1.209
  322   3HD1  ILE  36          3HD1      ILE  36   0.198   1.316   1.211
  323    H    THR  37           H        THR  37  -2.847   2.764  -3.805
  324    HA   THR  37           HA       THR  37  -1.852   5.216  -5.053
  325    HB   THR  37           HB       THR  37  -4.448   3.680  -5.352
  326    HG1  THR  37           1HG      THR  37  -2.012   3.282  -6.283
  327   1HG2  THR  37          1HG2      THR  37  -3.335   5.987  -6.969
  328   2HG2  THR  37          2HG2      THR  37  -4.731   6.044  -5.877
  329   3HG2  THR  37          3HG2      THR  37  -4.799   5.069  -7.345
  330    H    THR  38           H        THR  38  -2.395   7.217  -4.166
  331    HA   THR  38           HA       THR  38  -4.034   7.109  -1.817
  332    HB   THR  38           HB       THR  38  -3.132   9.456  -1.395
  333    HG1  THR  38           1HG      THR  38  -2.409   9.712  -3.700
  334   1HG2  THR  38          1HG2      THR  38  -0.973   8.599  -0.607
  335   2HG2  THR  38          2HG2      THR  38  -1.141   7.200  -1.655
  336   3HG2  THR  38          3HG2      THR  38  -2.240   7.407  -0.304
  337    H    LYS  39           H        LYS  39  -5.414   8.993  -1.275
  338    HA   LYS  39           HA       LYS  39  -7.555   8.980  -3.167
  339   1HB   LYS  39          2HB       LYS  39  -7.894   8.801  -0.755
  340   2HB   LYS  39          1HB       LYS  39  -7.261  10.418  -0.536
  341   1HG   LYS  39          2HG       LYS  39  -9.163  11.327  -1.770
  342   2HG   LYS  39          1HG       LYS  39  -9.802   9.696  -1.994
  343   1HD   LYS  39          2HD       LYS  39  -9.898   9.420   0.452
  344   2HD   LYS  39          1HD       LYS  39  -9.327  11.077   0.651
  345   1HE   LYS  39          2HE       LYS  39 -11.346  11.876  -0.532
  346   2HE   LYS  39          1HE       LYS  39 -11.890  10.206  -0.678
  347   1HZ   LYS  39          1HZ       LYS  39 -11.953  10.062   1.743
  348   2HZ   LYS  39          2HZ       LYS  39 -12.955  11.295   1.204
  349   3HZ   LYS  39          3HZ       LYS  39 -11.474  11.661   1.891
  350    H    SER  40           H        SER  40  -5.582  11.644  -1.852
  351    HA   SER  40           HA       SER  40  -5.342  13.053  -4.210
  352   1HB   SER  40          2HB       SER  40  -6.943  14.983  -3.806
  353   2HB   SER  40          1HB       SER  40  -7.721  13.473  -4.265
  354    HG   SER  40           HG       SER  40  -8.711  13.433  -2.434
  355    H    VAL  41           H        VAL  41  -6.309  14.226  -1.017
  356    HA   VAL  41           HA       VAL  41  -3.982  15.905  -0.940
  357    HB   VAL  41           HB       VAL  41  -6.055  15.504   1.242
  358   1HG1  VAL  41          1HG1      VAL  41  -4.031  17.709   0.862
  359   2HG1  VAL  41          2HG1      VAL  41  -3.973  16.451   2.095
  360   3HG1  VAL  41          3HG1      VAL  41  -5.260  17.656   2.127
  361   1HG2  VAL  41          1HG2      VAL  41  -5.898  17.627  -0.898
  362   2HG2  VAL  41          2HG2      VAL  41  -7.056  17.600   0.433
  363   3HG2  VAL  41          3HG2      VAL  41  -7.094  16.335  -0.796
  364    H    SER  42           H        SER  42  -2.574  14.110  -1.116
  365    HA   SER  42           HA       SER  42  -1.738  13.295   1.552
  366   1HB   SER  42          2HB       SER  42  -2.678  11.376   0.116
  367   2HB   SER  42          1HB       SER  42  -1.295  11.629  -0.942
  368    HG   SER  42           HG       SER  42  -1.534  10.531   1.521
  369    H    ARG  43           H        ARG  43   0.477  13.474   1.827
  370    HA   ARG  43           HA       ARG  43   1.899  15.430   0.421
  371   1HB   ARG  43          2HB       ARG  43   3.847  14.814   1.730
  372   2HB   ARG  43          1HB       ARG  43   2.422  14.772   2.749
  373   1HG   ARG  43          2HG       ARG  43   3.781  12.341   1.553
  374   2HG   ARG  43          1HG       ARG  43   4.032  12.927   3.191
  375   1HD   ARG  43          2HD       ARG  43   1.410  11.934   2.042
  376   2HD   ARG  43          1HD       ARG  43   2.482  11.005   3.081
  377    HE   ARG  43           HE       ARG  43   1.973  13.250   4.514
  378   1HH1  ARG  43          1HH1      ARG  43  -0.194  10.881   2.986
  379   2HH1  ARG  43          2HH1      ARG  43  -1.391  10.990   4.168
  380   1HH2  ARG  43          1HH2      ARG  43   0.373  13.395   6.131
  381   2HH2  ARG  43          2HH2      ARG  43  -1.062  12.487   6.054
  382    H    TYR  44           H        TYR  44   1.298  12.311  -0.621
  383    HA   TYR  44           HA       TYR  44   3.725  12.112  -2.228
  384   1HB   TYR  44          2HB       TYR  44   2.841  10.386  -0.452
  385   2HB   TYR  44          1HB       TYR  44   1.800   9.901  -1.784
  386    HD1  TYR  44           1HD      TYR  44   2.600   8.326  -3.287
  387    HD2  TYR  44           2HD      TYR  44   5.231  10.618  -0.987
  388    HE1  TYR  44           1HE      TYR  44   4.468   6.950  -4.132
  389    HE2  TYR  44           2HE      TYR  44   7.186   9.263  -1.812
  390    HH   TYR  44           HH       TYR  44   6.922   7.115  -4.424
  391    H    ARG  45           H        ARG  45   0.916  13.497  -2.538
  392    HA   ARG  45           HA       ARG  45  -0.900  12.548  -4.214
  393   1HB   ARG  45          2HB       ARG  45  -0.740  14.841  -3.210
  394   2HB   ARG  45          1HB       ARG  45   0.385  15.283  -4.459
  395   1HG   ARG  45          2HG       ARG  45  -2.504  14.525  -4.891
  396   2HG   ARG  45          1HG       ARG  45  -1.889  16.166  -4.788
  397   1HD   ARG  45          2HD       ARG  45  -1.244  14.113  -6.913
  398   2HD   ARG  45          1HD       ARG  45  -2.268  15.529  -7.118
  399    HE   ARG  45           HE       ARG  45   0.127  16.536  -6.325
  400   1HH1  ARG  45          1HH1      ARG  45  -0.951  14.452  -8.980
  401   2HH1  ARG  45          2HH1      ARG  45   0.262  14.893 -10.067
  402   1HH2  ARG  45          1HH2      ARG  45   1.843  17.166  -7.807
  403   2HH2  ARG  45          2HH2      ARG  45   1.920  16.510  -9.380
  404    H    GLY  46           H        GLY  46  -0.860  11.527  -6.049
  405   1HA   GLY  46          2HA       GLY  46  -0.709  11.380  -8.371
  406   2HA   GLY  46          1HA       GLY  46   0.572  12.579  -8.349
  407    H    GLN  47           H        GLN  47   1.441  10.458  -6.039
  408    HA   GLN  47           HA       GLN  47   2.741   8.669  -7.952
  409   1HB   GLN  47          2HB       GLN  47   3.837   9.695  -5.326
  410   2HB   GLN  47          1HB       GLN  47   4.611   8.490  -6.339
  411   1HG   GLN  47          2HG       GLN  47   4.077  11.356  -7.075
  412   2HG   GLN  47          1HG       GLN  47   5.637  10.669  -6.621
  413   1HE2  GLN  47          1HE2      GLN  47   4.775  11.989  -9.062
  414   2HE2  GLN  47          2HE2      GLN  47   5.098  10.913 -10.358
  415    H    GLU  48           H        GLU  48   3.017   6.508  -7.231
  416    HA   GLU  48           HA       GLU  48   1.033   5.801  -5.218
  417   1HB   GLU  48          2HB       GLU  48   2.490   3.913  -7.079
  418   2HB   GLU  48          1HB       GLU  48   1.152   3.521  -6.025
  419   1HG   GLU  48          2HG       GLU  48   0.164   3.597  -8.109
  420   2HG   GLU  48          1HG       GLU  48  -0.172   5.203  -7.479
  421    H    HIS  49           H        HIS  49   1.602   4.695  -3.450
  422    HA   HIS  49           HA       HIS  49   4.422   4.812  -2.683
  423   1HB   HIS  49          2HB       HIS  49   2.041   3.774  -1.137
  424   2HB   HIS  49          1HB       HIS  49   3.671   3.889  -0.516
  425    HD1  HIS  49           1HD      HIS  49   4.202   5.958   0.701
  426    HD2  HIS  49           2HD      HIS  49   0.834   6.345  -1.693
  427    HE1  HIS  49           1HE      HIS  49   3.157   8.158   1.360
  428    HE2  HIS  49           2HE      HIS  49   0.992   8.230   0.050
  429    H    CYS  50           H        CYS  50   5.562   2.918  -1.968
  430    HA   CYS  50           HA       CYS  50   4.244   0.455  -2.636
  431   1HB   CYS  50          2HB       CYS  50   6.370  -0.412  -3.689
  432   2HB   CYS  50          1HB       CYS  50   5.517   0.802  -4.625
  433    H    LEU  51           H        LEU  51   4.367  -0.941  -1.122
  434    HA   LEU  51           HA       LEU  51   6.356  -0.522   0.988
  435   1HB   LEU  51          2HB       LEU  51   3.957  -2.384   1.009
  436   2HB   LEU  51          1HB       LEU  51   5.113  -2.230   2.302
  437    HG   LEU  51           HG       LEU  51   4.322   0.184   2.509
  438   1HD1  LEU  51          1HD1      LEU  51   2.121   0.675   1.730
  439   2HD1  LEU  51          2HD1      LEU  51   2.056  -0.895   0.933
  440   3HD1  LEU  51          3HD1      LEU  51   3.197   0.342   0.353
  441   1HD2  LEU  51          1HD2      LEU  51   3.746  -1.542   4.109
  442   2HD2  LEU  51          2HD2      LEU  51   2.379  -2.034   3.105
  443   3HD2  LEU  51          3HD2      LEU  51   2.395  -0.440   3.857
  444    H    HIS  52           H        HIS  52   7.789  -2.050   1.474
  445    HA   HIS  52           HA       HIS  52   8.195  -3.990  -0.641
  446   1HB   HIS  52          2HB       HIS  52  10.089  -2.559   0.260
  447   2HB   HIS  52          1HB       HIS  52   9.974  -3.470   1.763
  448    HD1  HIS  52           1HD      HIS  52  11.488  -5.445   1.882
  449    HD2  HIS  52           2HD      HIS  52  10.638  -4.345  -2.032
  450    HE1  HIS  52           1HE      HIS  52  12.722  -7.049   0.469
  451    HE2  HIS  52           2HE      HIS  52  11.899  -6.569  -1.849
  452    HA   PRO  53           HA       PRO  53   5.575  -6.635   1.881
  453   1HB   PRO  53          2HB       PRO  53   5.573  -8.759   0.249
  454   2HB   PRO  53          1HB       PRO  53   4.621  -7.293  -0.069
  455   1HG   PRO  53          2HG       PRO  53   7.277  -8.123  -1.179
  456   2HG   PRO  53          1HG       PRO  53   5.879  -7.445  -2.030
  457   1HD   PRO  53          2HD       PRO  53   7.974  -5.935  -1.368
  458   2HD   PRO  53          1HD       PRO  53   6.320  -5.289  -1.303
  459    H    LYS  54           H        LYS  54   8.747  -6.999   1.700
  460    HA   LYS  54           HA       LYS  54   8.856  -9.675   2.671
  461   1HB   LYS  54          2HB       LYS  54  10.997  -7.593   2.404
  462   2HB   LYS  54          1HB       LYS  54  11.286  -9.255   2.931
  463   1HG   LYS  54          2HG       LYS  54  10.049  -8.476   0.301
  464   2HG   LYS  54          1HG       LYS  54  11.738  -8.918   0.573
  465   1HD   LYS  54          2HD       LYS  54  11.216 -11.078   1.144
  466   2HD   LYS  54          1HD       LYS  54   9.488 -10.762   1.322
  467   1HE   LYS  54          2HE       LYS  54   9.319 -10.317  -0.980
  468   2HE   LYS  54          1HE       LYS  54  11.044 -10.626  -1.255
  469   1HZ   LYS  54          1HZ       LYS  54  10.665 -12.891  -0.439
  470   2HZ   LYS  54          2HZ       LYS  54   9.736 -12.590  -1.808
  471   3HZ   LYS  54          3HZ       LYS  54   9.011 -12.593  -0.292
  472    H    LEU  55           H        LEU  55   8.312  -6.583   3.913
  473    HA   LEU  55           HA       LEU  55   9.356  -7.087   6.572
  474   1HB   LEU  55          2HB       LEU  55   7.953  -4.713   5.383
  475   2HB   LEU  55          1HB       LEU  55   8.582  -4.795   7.015
  476    HG   LEU  55           HG       LEU  55  10.249  -4.990   4.512
  477   1HD1  LEU  55          1HD1      LEU  55  11.011  -2.772   5.116
  478   2HD1  LEU  55          2HD1      LEU  55   9.879  -2.749   6.472
  479   3HD1  LEU  55          3HD1      LEU  55   9.272  -2.791   4.816
  480   1HD2  LEU  55          1HD2      LEU  55  11.026  -4.786   7.421
  481   2HD2  LEU  55          2HD2      LEU  55  12.133  -4.718   6.053
  482   3HD2  LEU  55          3HD2      LEU  55  11.236  -6.199   6.387
  483    H    GLN  56           H        GLN  56   8.100  -6.935   8.405
  484    HA   GLN  56           HA       GLN  56   5.657  -8.398   8.231
  485   1HB   GLN  56          2HB       GLN  56   5.760  -8.561  10.601
  486   2HB   GLN  56          1HB       GLN  56   7.381  -8.770  10.000
  487   1HG   GLN  56          2HG       GLN  56   6.297  -6.262  11.322
  488   2HG   GLN  56          1HG       GLN  56   7.255  -7.484  12.119
  489   1HE2  GLN  56          1HE2      GLN  56   8.816  -6.061  12.740
  490   2HE2  GLN  56          2HE2      GLN  56   9.923  -5.292  11.676
  491    H    SER  57           H        SER  57   6.493  -5.057   8.830
  492    HA   SER  57           HA       SER  57   4.029  -4.246   9.912
  493   1HB   SER  57          2HB       SER  57   6.059  -2.627   8.368
  494   2HB   SER  57          1HB       SER  57   4.812  -1.978   9.438
  495    HG   SER  57           HG       SER  57   5.836  -3.474  11.043
  496    H    THR  58           H        THR  58   5.077  -4.742   6.616
  497    HA   THR  58           HA       THR  58   3.080  -3.401   5.168
  498    HB   THR  58           HB       THR  58   4.453  -6.035   4.560
  499    HG1  THR  58           1HG      THR  58   5.305  -3.335   4.162
  500   1HG2  THR  58          1HG2      THR  58   2.601  -5.480   3.039
  501   2HG2  THR  58          2HG2      THR  58   4.142  -5.317   2.198
  502   3HG2  THR  58          3HG2      THR  58   3.293  -3.887   2.764
  503    H    LYS  59           H        LYS  59   3.208  -6.702   6.576
  504    HA   LYS  59           HA       LYS  59   0.868  -7.681   5.426
  505   1HB   LYS  59          2HB       LYS  59   2.353  -8.485   7.893
  506   2HB   LYS  59          1HB       LYS  59   0.860  -9.289   7.423
  507   1HG   LYS  59          2HG       LYS  59   2.715 -10.579   6.681
  508   2HG   LYS  59          1HG       LYS  59   1.932  -9.882   5.279
  509   1HD   LYS  59          2HD       LYS  59   3.647  -8.197   5.098
  510   2HD   LYS  59          1HD       LYS  59   4.416  -8.771   6.579
  511   1HE   LYS  59          2HE       LYS  59   5.621  -9.583   4.625
  512   2HE   LYS  59          1HE       LYS  59   4.879 -10.919   5.494
  513   1HZ   LYS  59          1HZ       LYS  59   3.820  -9.677   3.002
  514   2HZ   LYS  59          2HZ       LYS  59   3.112 -10.975   3.820
  515   3HZ   LYS  59          3HZ       LYS  59   4.610 -11.151   3.120
  516    H    ARG  60           H        ARG  60   1.104  -6.107   8.658
  517    HA   ARG  60           HA       ARG  60  -1.662  -6.452   8.956
  518   1HB   ARG  60          2HB       ARG  60   0.337  -4.921  10.459
  519   2HB   ARG  60          1HB       ARG  60  -1.343  -4.461  10.635
  520   1HG   ARG  60          2HG       ARG  60  -0.951  -5.945  12.378
  521   2HG   ARG  60          1HG       ARG  60  -1.797  -6.856  11.174
  522   1HD   ARG  60          2HD       ARG  60   0.059  -8.215  12.002
  523   2HD   ARG  60          1HD       ARG  60   0.284  -7.806  10.301
  524    HE   ARG  60           HE       ARG  60   1.603  -5.842  11.618
  525   1HH1  ARG  60          1HH1      ARG  60   1.827  -9.366  11.634
  526   2HH1  ARG  60          2HH1      ARG  60   3.478  -9.383  12.085
  527   1HH2  ARG  60          1HH2      ARG  60   3.836  -5.873  12.212
  528   2HH2  ARG  60          2HH2      ARG  60   4.622  -7.377  12.439
  529    H    PHE  61           H        PHE  61   0.229  -3.786   7.686
  530    HA   PHE  61           HA       PHE  61  -1.953  -1.985   7.737
  531   1HB   PHE  61          2HB       PHE  61   0.474  -1.328   7.394
  532   2HB   PHE  61          1HB       PHE  61   0.300  -1.978   5.760
  533    HD1  PHE  61           1HD      PHE  61  -0.966  -0.771   4.055
  534    HD2  PHE  61           2HD      PHE  61  -0.645   0.805   8.000
  535    HE1  PHE  61           1HE      PHE  61  -1.812   1.402   3.265
  536    HE2  PHE  61           2HE      PHE  61  -1.514   2.996   7.175
  537    HZ   PHE  61           HZ       PHE  61  -2.075   3.268   4.838
  538    H    ILE  62           H        ILE  62  -0.849  -4.405   5.393
  539    HA   ILE  62           HA       ILE  62  -2.624  -3.526   3.360
  540    HB   ILE  62           HB       ILE  62  -1.080  -6.097   3.696
  541   1HG1  ILE  62          2HG1      ILE  62   0.482  -4.331   3.538
  542   2HG1  ILE  62          1HG1      ILE  62   0.407  -5.046   1.938
  543   1HG2  ILE  62          1HG2      ILE  62  -2.959  -6.421   2.254
  544   2HG2  ILE  62          2HG2      ILE  62  -1.457  -6.490   1.322
  545   3HG2  ILE  62          3HG2      ILE  62  -2.489  -5.057   1.243
  546   1HD1  ILE  62          1HD1      ILE  62  -0.985  -2.515   2.788
  547   2HD1  ILE  62          2HD1      ILE  62  -0.957  -3.199   1.155
  548   3HD1  ILE  62          3HD1      ILE  62   0.525  -2.610   1.901
  549    H    LYS  63           H        LYS  63  -2.570  -6.069   5.787
  550    HA   LYS  63           HA       LYS  63  -4.901  -7.386   4.960
  551   1HB   LYS  63          2HB       LYS  63  -2.969  -7.862   6.749
  552   2HB   LYS  63          1HB       LYS  63  -4.173  -7.169   7.805
  553   1HG   LYS  63          2HG       LYS  63  -4.331  -9.527   7.787
  554   2HG   LYS  63          1HG       LYS  63  -5.792  -8.777   7.085
  555   1HD   LYS  63          2HD       LYS  63  -4.997 -10.756   5.782
  556   2HD   LYS  63          1HD       LYS  63  -4.993  -9.288   4.825
  557   1HE   LYS  63          2HE       LYS  63  -2.938 -10.544   4.454
  558   2HE   LYS  63          1HE       LYS  63  -2.570  -9.025   5.263
  559   1HZ   LYS  63          1HZ       LYS  63  -2.365 -10.211   7.350
  560   2HZ   LYS  63          2HZ       LYS  63  -1.384 -10.971   6.206
  561   3HZ   LYS  63          3HZ       LYS  63  -2.841 -11.655   6.634
  562    H    TRP  64           H        TRP  64  -4.218  -4.745   7.063
  563    HA   TRP  64           HA       TRP  64  -6.775  -4.503   8.279
  564   1HB   TRP  64          2HB       TRP  64  -4.312  -3.547   8.823
  565   2HB   TRP  64          1HB       TRP  64  -4.990  -2.148   8.013
  566    HD1  TRP  64           HD       TRP  64  -4.830  -3.883  11.291
  567    HE1  TRP  64           1HE      TRP  64  -6.356  -2.691  13.000
  568    HE3  TRP  64           3HE      TRP  64  -7.444  -0.816   8.110
  569    HZ2  TRP  64           2HZ      TRP  64  -8.370  -0.724  13.002
  570    HZ3  TRP  64           3HZ      TRP  64  -9.145   0.688   9.060
  571    HH2  TRP  64           HH       TRP  64  -9.597   0.729  11.451
  572    H    TYR  65           H        TYR  65  -5.098  -2.996   5.498
  573    HA   TYR  65           HA       TYR  65  -7.183  -1.230   4.894
  574   1HB   TYR  65          2HB       TYR  65  -4.967  -0.854   3.890
  575   2HB   TYR  65          1HB       TYR  65  -5.153  -2.325   2.925
  576    HD1  TYR  65           1HD      TYR  65  -6.177  -2.187   0.790
  577    HD2  TYR  65           2HD      TYR  65  -6.833   0.909   3.622
  578    HE1  TYR  65           1HE      TYR  65  -7.481  -0.916  -0.891
  579    HE2  TYR  65           2HE      TYR  65  -8.128   2.166   1.945
  580    HH   TYR  65           HH       TYR  65  -8.317   2.307  -0.406
  581    H    ASN  66           H        ASN  66  -6.597  -4.534   3.925
  582    HA   ASN  66           HA       ASN  66  -8.695  -4.678   2.065
  583   1HB   ASN  66          2HB       ASN  66  -7.379  -6.802   3.728
  584   2HB   ASN  66          1HB       ASN  66  -8.774  -7.196   2.735
  585   1HD2  ASN  66          1HD2      ASN  66  -5.414  -6.187   2.692
  586   2HD2  ASN  66          2HD2      ASN  66  -5.153  -6.552   1.033
  587    H    ALA  67           H        ALA  67  -8.780  -4.884   5.532
  588    HA   ALA  67           HA       ALA  67 -11.557  -5.566   5.651
  589   1HB   ALA  67          1HB       ALA  67  -9.772  -4.320   7.749
  590   2HB   ALA  67          2HB       ALA  67 -10.038  -6.048   7.521
  591   3HB   ALA  67          3HB       ALA  67 -11.367  -5.011   8.035
  592    H    TRP  68           H        TRP  68  -9.717  -2.589   6.129
  593    HA   TRP  68           HA       TRP  68 -11.839  -0.761   6.490
  594   1HB   TRP  68          2HB       TRP  68  -9.647  -0.123   7.110
  595   2HB   TRP  68          1HB       TRP  68  -8.996  -0.560   5.549
  596    HD1  TRP  68           HD       TRP  68  -9.002   1.230   3.695
  597    HE1  TRP  68           1HE      TRP  68  -9.396   3.748   3.674
  598    HE3  TRP  68           3HE      TRP  68 -11.213   1.757   8.276
  599    HZ2  TRP  68           2HZ      TRP  68 -10.503   5.699   5.312
  600    HZ3  TRP  68           3HZ      TRP  68 -11.910   4.030   8.958
  601    HH2  TRP  68           HH       TRP  68 -11.524   5.970   7.436
  602    H    ASN  69           H        ASN  69 -10.304  -1.846   3.519
  603    HA   ASN  69           HA       ASN  69 -11.575  -0.109   1.723
  604   1HB   ASN  69          2HB       ASN  69  -9.640  -1.490   1.080
  605   2HB   ASN  69          1HB       ASN  69 -10.599  -2.949   1.269
  606   1HD2  ASN  69          1HD2      ASN  69  -9.913  -0.186  -0.755
  607   2HD2  ASN  69          2HD2      ASN  69 -10.783  -0.739  -2.127
  608    H    GLU  70           H        GLU  70 -12.590  -3.121   3.194
  609    HA   GLU  70           HA       GLU  70 -14.895  -3.618   1.627
  610   1HB   GLU  70          2HB       GLU  70 -13.833  -5.298   3.098
  611   2HB   GLU  70          1HB       GLU  70 -14.255  -4.341   4.501
  612   1HG   GLU  70          2HG       GLU  70 -16.591  -4.756   4.129
  613   2HG   GLU  70          1HG       GLU  70 -16.233  -5.628   2.628
  614    H    LYS  71           H        LYS  71 -14.278  -1.554   4.358
  615    HA   LYS  71           HA       LYS  71 -17.043  -0.906   4.683
  616   1HB   LYS  71          2HB       LYS  71 -14.538   0.215   5.898
  617   2HB   LYS  71          1HB       LYS  71 -16.077   0.975   6.203
  618   1HG   LYS  71          2HG       LYS  71 -15.597  -0.439   8.047
  619   2HG   LYS  71          1HG       LYS  71 -16.869  -1.220   7.104
  620   1HD   LYS  71          2HD       LYS  71 -15.195  -2.679   6.081
  621   2HD   LYS  71          1HD       LYS  71 -13.932  -1.893   7.024
  622   1HE   LYS  71          2HE       LYS  71 -16.246  -3.513   8.102
  623   2HE   LYS  71          1HE       LYS  71 -14.558  -4.005   8.039
  624   1HZ   LYS  71          1HZ       LYS  71 -14.054  -2.126   9.575
  625   2HZ   LYS  71          2HZ       LYS  71 -15.083  -3.280  10.208
  626   3HZ   LYS  71          3HZ       LYS  71 -15.724  -1.830   9.681
  627    H    ARG  72           H        ARG  72 -14.334   0.468   3.029
  628    HA   ARG  72           HA       ARG  72 -15.778   2.875   2.341
  629   1HB   ARG  72          2HB       ARG  72 -13.232   1.848   1.109
  630   2HB   ARG  72          1HB       ARG  72 -13.924   3.438   0.840
  631   1HG   ARG  72          2HG       ARG  72 -13.695   3.815   3.319
  632   2HG   ARG  72          1HG       ARG  72 -12.721   2.337   3.353
  633   1HD   ARG  72          2HD       ARG  72 -11.258   4.200   3.154
  634   2HD   ARG  72          1HD       ARG  72 -11.256   3.332   1.625
  635    HE   ARG  72           HE       ARG  72 -13.135   5.514   1.850
  636   1HH1  ARG  72          1HH1      ARG  72  -9.969   4.516   0.658
  637   2HH1  ARG  72          2HH1      ARG  72  -9.789   5.793  -0.429
  638   1HH2  ARG  72          1HH2      ARG  72 -12.937   7.262   0.370
  639   2HH2  ARG  72          2HH2      ARG  72 -11.577   7.436  -0.634
  640    H    ARG  73           H        ARG  73 -15.108  -0.156   0.687
  641    HA   ARG  73           HA       ARG  73 -16.408   0.639  -1.740
  642   1HB   ARG  73          2HB       ARG  73 -14.753  -1.222  -1.652
  643   2HB   ARG  73          1HB       ARG  73 -15.855  -2.147  -0.645
  644   1HG   ARG  73          2HG       ARG  73 -15.912  -2.939  -2.937
  645   2HG   ARG  73          1HG       ARG  73 -17.465  -2.228  -2.496
  646   1HD   ARG  73          2HD       ARG  73 -16.836  -1.505  -4.732
  647   2HD   ARG  73          1HD       ARG  73 -16.785  -0.137  -3.627
  648    HE   ARG  73           HE       ARG  73 -14.240  -1.293  -3.763
  649   1HH1  ARG  73          1HH1      ARG  73 -16.460   0.536  -5.831
  650   2HH1  ARG  73          2HH1      ARG  73 -15.221   1.242  -6.760
  651   1HH2  ARG  73          1HH2      ARG  73 -12.553  -0.322  -5.058
  652   2HH2  ARG  73          2HH2      ARG  73 -12.976   0.757  -6.313
  653    H    VAL  74           H        VAL  74 -17.301  -0.384   1.293
  654    HA   VAL  74           HA       VAL  74 -19.162  -0.260   2.438
  655    HB   VAL  74           HB       VAL  74 -20.592   0.331  -0.065
  656   1HG1  VAL  74          1HG1      VAL  74 -21.474   0.703   2.816
  657   2HG1  VAL  74          2HG1      VAL  74 -22.147  -0.438   1.648
  658   3HG1  VAL  74          3HG1      VAL  74 -22.394   1.295   1.431
  659   1HG2  VAL  74          1HG2      VAL  74 -18.973   2.074   0.333
  660   2HG2  VAL  74          2HG2      VAL  74 -19.521   2.265   1.995
  661   3HG2  VAL  74          3HG2      VAL  74 -20.574   2.735   0.659
  662    H    TYR  75           H        TYR  75 -18.799  -2.172   2.752
  663    HA   TYR  75           HA       TYR  75 -21.018  -3.944   2.035
  664   1HB   TYR  75          2HB       TYR  75 -18.259  -4.768   2.970
  665   2HB   TYR  75          1HB       TYR  75 -19.616  -5.873   2.900
  666    HD1  TYR  75           1HD      TYR  75 -17.278  -3.851   0.875
  667    HD2  TYR  75           2HD      TYR  75 -20.266  -6.876   0.851
  668    HE1  TYR  75           1HE      TYR  75 -16.680  -4.426  -1.440
  669    HE2  TYR  75           2HE      TYR  75 -19.675  -7.452  -1.461
  670    HH   TYR  75           HH       TYR  75 -16.852  -6.297  -2.965
  671    H    GLU  76           H        GLU  76 -22.094  -2.590   3.575
  672    HA   GLU  76           HA       GLU  76 -21.502  -3.469   6.282
  673   1HB   GLU  76          2HB       GLU  76 -20.746  -1.166   5.906
  674   2HB   GLU  76          1HB       GLU  76 -22.419  -0.736   5.499
  675   1HG   GLU  76          2HG       GLU  76 -21.853  -0.093   7.795
  676   2HG   GLU  76          1HG       GLU  76 -23.120  -1.322   7.742
  677    H    GLU  77           H        GLU  77 -22.910  -4.834   6.332
  678    HA   GLU  77           HA       GLU  77 -25.711  -4.208   6.465
  679   1HB   GLU  77          2HB       GLU  77 -25.233  -4.405   4.024
  680   2HB   GLU  77          1HB       GLU  77 -24.619  -6.015   4.299
  681   1HG   GLU  77          2HG       GLU  77 -26.869  -6.723   4.985
  682   2HG   GLU  77          1HG       GLU  77 -27.454  -5.085   4.662
  Start of MODEL    2
    1    H    SER   1           H        SER   1  15.451  -9.594  -3.112
    2    HA   SER   1           HA       SER   1  14.470  -8.218  -4.524
    3   1HB   SER   1          2HB       SER   1  13.189  -7.357  -2.558
    4   2HB   SER   1          1HB       SER   1  14.436  -6.138  -2.306
    5    HG   SER   1           HG       SER   1  12.972  -5.116  -3.478
    6    H    LYS   2           H        LYS   2  14.721  -6.121  -5.726
    7    HA   LYS   2           HA       LYS   2  17.449  -5.132  -5.671
    8   1HB   LYS   2          2HB       LYS   2  17.384  -7.264  -7.050
    9   2HB   LYS   2          1HB       LYS   2  16.280  -6.449  -8.141
   10   1HG   LYS   2          2HG       LYS   2  18.543  -6.453  -9.028
   11   2HG   LYS   2          1HG       LYS   2  18.024  -4.805  -8.669
   12   1HD   LYS   2          2HD       LYS   2  19.261  -4.872  -6.553
   13   2HD   LYS   2          1HD       LYS   2  19.752  -6.530  -6.898
   14   1HE   LYS   2          2HE       LYS   2  20.946  -5.770  -8.866
   15   2HE   LYS   2          1HE       LYS   2  20.429  -4.113  -8.563
   16   1HZ   LYS   2          1HZ       LYS   2  22.673  -4.508  -7.759
   17   2HZ   LYS   2          2HZ       LYS   2  22.121  -5.745  -6.755
   18   3HZ   LYS   2          3HZ       LYS   2  21.639  -4.160  -6.474
   19    H    CYS   3           H        CYS   3  14.671  -4.127  -5.279
   20    HA   CYS   3           HA       CYS   3  14.668  -2.127  -7.413
   21   1HB   CYS   3          2HB       CYS   3  12.317  -3.197  -5.863
   22   2HB   CYS   3          1HB       CYS   3  12.233  -1.818  -6.961
   23    H    LYS   4           H        LYS   4  14.336   0.018  -6.917
   24    HA   LYS   4           HA       LYS   4  15.193   0.655  -4.202
   25   1HB   LYS   4          2HB       LYS   4  15.418   2.230  -6.757
   26   2HB   LYS   4          1HB       LYS   4  16.023   2.736  -5.192
   27   1HG   LYS   4          2HG       LYS   4  17.599   0.907  -5.161
   28   2HG   LYS   4          1HG       LYS   4  16.944   0.288  -6.682
   29   1HD   LYS   4          2HD       LYS   4  17.603   2.355  -7.804
   30   2HD   LYS   4          1HD       LYS   4  18.270   2.968  -6.291
   31   1HE   LYS   4          2HE       LYS   4  19.893   1.169  -6.250
   32   2HE   LYS   4          1HE       LYS   4  19.188   0.470  -7.708
   33   1HZ   LYS   4          1HZ       LYS   4  19.784   2.460  -8.906
   34   2HZ   LYS   4          2HZ       LYS   4  21.154   1.761  -8.252
   35   3HZ   LYS   4          3HZ       LYS   4  20.480   3.141  -7.536
   36    H    CYS   5           H        CYS   5  13.496   1.131  -3.024
   37    HA   CYS   5           HA       CYS   5  11.802   3.343  -3.931
   38   1HB   CYS   5          2HB       CYS   5  10.912   0.925  -2.323
   39   2HB   CYS   5          1HB       CYS   5   9.970   2.403  -2.422
   40    H    SER   6           H        SER   6  12.474   1.499  -0.982
   41    HA   SER   6           HA       SER   6  14.035   3.382   0.277
   42   1HB   SER   6          2HB       SER   6  11.159   3.104   1.293
   43   2HB   SER   6          1HB       SER   6  12.470   3.866   2.187
   44    HG   SER   6           HG       SER   6  12.127   4.822  -0.329
   45    H    ARG   7           H        ARG   7  14.137   2.426   2.701
   46    HA   ARG   7           HA       ARG   7  14.539  -0.379   2.349
   47   1HB   ARG   7          2HB       ARG   7  14.573   1.271   4.889
   48   2HB   ARG   7          1HB       ARG   7  15.173  -0.375   4.740
   49   1HG   ARG   7          2HG       ARG   7  16.877   0.387   3.153
   50   2HG   ARG   7          1HG       ARG   7  16.270   2.034   3.301
   51   1HD   ARG   7          2HD       ARG   7  18.209   1.793   4.704
   52   2HD   ARG   7          1HD       ARG   7  16.769   1.951   5.707
   53    HE   ARG   7           HE       ARG   7  17.550  -0.756   5.158
   54   1HH1  ARG   7          1HH1      ARG   7  17.846   1.973   7.399
   55   2HH1  ARG   7          2HH1      ARG   7  18.444   1.054   8.691
   56   1HH2  ARG   7          1HH2      ARG   7  18.367  -2.034   6.901
   57   2HH2  ARG   7          2HH2      ARG   7  18.767  -1.326   8.408
   58    H    LYS   8           H        LYS   8  12.158   1.670   3.796
   59    HA   LYS   8           HA       LYS   8  10.428  -0.651   4.303
   60   1HB   LYS   8          2HB       LYS   8  10.214   2.154   5.435
   61   2HB   LYS   8          1HB       LYS   8   9.202   0.780   5.841
   62   1HG   LYS   8          2HG       LYS   8  11.081  -0.353   6.875
   63   2HG   LYS   8          1HG       LYS   8  12.163   0.950   6.390
   64   1HD   LYS   8          2HD       LYS   8  11.558   1.209   8.734
   65   2HD   LYS   8          1HD       LYS   8  10.872   2.522   7.785
   66   1HE   LYS   8          2HE       LYS   8   8.707   1.364   7.759
   67   2HE   LYS   8          1HE       LYS   8   9.405   0.050   8.703
   68   1HZ   LYS   8          1HZ       LYS   8   8.168   1.584  10.089
   69   2HZ   LYS   8          2HZ       LYS   8   9.115   2.874   9.598
   70   3HZ   LYS   8          3HZ       LYS   8   9.794   1.637  10.514
   71    H    GLY   9           H        GLY   9  10.034   2.814   3.601
   72   1HA   GLY   9          2HA       GLY   9   9.066   3.236   1.199
   73   2HA   GLY   9          1HA       GLY   9   7.778   2.238   1.775
   74    HA   PRO  10           HA       PRO  10   7.730   6.887   3.437
   75   1HB   PRO  10          2HB       PRO  10   5.856   7.110   1.115
   76   2HB   PRO  10          1HB       PRO  10   6.914   8.345   1.811
   77   1HG   PRO  10          2HG       PRO  10   7.604   7.173  -0.450
   78   2HG   PRO  10          1HG       PRO  10   8.825   7.461   0.801
   79   1HD   PRO  10          2HD       PRO  10   7.462   4.907   0.045
   80   2HD   PRO  10          1HD       PRO  10   9.141   5.196   0.554
   81    H    LYS  11           H        LYS  11   6.082   7.361   4.847
   82    HA   LYS  11           HA       LYS  11   4.455   5.216   5.559
   83   1HB   LYS  11          2HB       LYS  11   4.485   8.047   6.589
   84   2HB   LYS  11          1HB       LYS  11   3.554   6.739   7.299
   85   1HG   LYS  11          2HG       LYS  11   5.579   5.511   7.795
   86   2HG   LYS  11          1HG       LYS  11   6.551   6.754   7.008
   87   1HD   LYS  11          2HD       LYS  11   5.815   8.384   8.674
   88   2HD   LYS  11          1HD       LYS  11   4.802   7.158   9.433
   89   1HE   LYS  11          2HE       LYS  11   7.803   6.983   9.155
   90   2HE   LYS  11          1HE       LYS  11   6.972   7.512  10.612
   91   1HZ   LYS  11          1HZ       LYS  11   7.595   5.214  10.757
   92   2HZ   LYS  11          2HZ       LYS  11   6.750   4.813   9.364
   93   3HZ   LYS  11          3HZ       LYS  11   5.926   5.324  10.750
   94    H    ILE  12           H        ILE  12   2.324   4.983   5.742
   95    HA   ILE  12           HA       ILE  12   0.548   6.566   4.026
   96    HB   ILE  12           HB       ILE  12   0.716   3.542   3.954
   97   1HG1  ILE  12          2HG1      ILE  12   1.799   5.456   1.877
   98   2HG1  ILE  12          1HG1      ILE  12   2.787   4.527   2.991
   99   1HG2  ILE  12          1HG2      ILE  12  -0.641   5.518   2.116
  100   2HG2  ILE  12          2HG2      ILE  12  -1.438   4.576   3.386
  101   3HG2  ILE  12          3HG2      ILE  12  -0.702   3.753   2.022
  102   1HD1  ILE  12          1HD1      ILE  12   2.738   3.499   0.811
  103   2HD1  ILE  12          2HD1      ILE  12   0.982   3.441   0.858
  104   3HD1  ILE  12          3HD1      ILE  12   1.926   2.458   1.987
  105    H    ARG  13           H        ARG  13  -1.487   6.648   5.025
  106    HA   ARG  13           HA       ARG  13  -1.956   4.679   7.102
  107   1HB   ARG  13          2HB       ARG  13  -3.200   7.412   6.725
  108   2HB   ARG  13          1HB       ARG  13  -3.617   6.252   7.986
  109   1HG   ARG  13          2HG       ARG  13  -1.380   6.417   8.912
  110   2HG   ARG  13          1HG       ARG  13  -0.918   7.546   7.642
  111   1HD   ARG  13          2HD       ARG  13  -2.613   9.123   8.433
  112   2HD   ARG  13          1HD       ARG  13  -3.072   7.977   9.691
  113    HE   ARG  13           HE       ARG  13  -0.316   8.561   9.777
  114   1HH1  ARG  13          1HH1      ARG  13  -3.471   9.860  10.631
  115   2HH1  ARG  13          2HH1      ARG  13  -2.950  10.801  11.937
  116   1HH2  ARG  13          1HH2      ARG  13   0.490   9.884  11.584
  117   2HH2  ARG  13          2HH2      ARG  13  -0.611  10.815  12.482
  118    H    TYR  14           H        TYR  14  -4.369   4.160   7.199
  119    HA   TYR  14           HA       TYR  14  -4.968   2.988   4.699
  120   1HB   TYR  14          2HB       TYR  14  -6.812   3.294   7.055
  121   2HB   TYR  14          1HB       TYR  14  -6.907   2.092   5.767
  122    HD1  TYR  14           1HD      TYR  14  -5.558   2.847   8.995
  123    HD2  TYR  14           2HD      TYR  14  -4.936   0.403   5.549
  124    HE1  TYR  14           1HE      TYR  14  -4.101   1.369  10.300
  125    HE2  TYR  14           2HE      TYR  14  -3.506  -1.056   6.843
  126    HH   TYR  14           HH       TYR  14  -2.113  -0.910   8.819
  127    H    SER  15           H        SER  15  -5.933   5.936   6.201
  128    HA   SER  15           HA       SER  15  -8.179   6.506   4.606
  129   1HB   SER  15          2HB       SER  15  -6.324   8.278   6.123
  130   2HB   SER  15          1HB       SER  15  -7.907   8.767   5.503
  131    HG   SER  15           HG       SER  15  -8.354   8.151   7.531
  132    H    ASP  16           H        ASP  16  -4.790   6.575   3.990
  133    HA   ASP  16           HA       ASP  16  -4.681   8.771   2.091
  134   1HB   ASP  16          2HB       ASP  16  -2.733   6.541   2.738
  135   2HB   ASP  16          1HB       ASP  16  -2.418   7.796   1.570
  136    H    VAL  17           H        VAL  17  -5.207   5.396   2.153
  137    HA   VAL  17           HA       VAL  17  -4.255   4.924  -0.554
  138    HB   VAL  17           HB       VAL  17  -5.753   2.960   1.131
  139   1HG1  VAL  17          1HG1      VAL  17  -5.548   2.228  -1.068
  140   2HG1  VAL  17          2HG1      VAL  17  -4.419   1.292  -0.082
  141   3HG1  VAL  17          3HG1      VAL  17  -3.831   2.587  -1.119
  142   1HG2  VAL  17          1HG2      VAL  17  -3.588   2.147   1.985
  143   2HG2  VAL  17          2HG2      VAL  17  -3.956   3.789   2.516
  144   3HG2  VAL  17          3HG2      VAL  17  -2.801   3.528   1.217
  145    H    LYS  18           H        LYS  18  -5.410   4.923  -2.339
  146    HA   LYS  18           HA       LYS  18  -8.363   4.843  -2.176
  147   1HB   LYS  18          2HB       LYS  18  -6.746   6.657  -3.468
  148   2HB   LYS  18          1HB       LYS  18  -7.052   5.506  -4.753
  149   1HG   LYS  18          2HG       LYS  18  -9.152   7.046  -3.204
  150   2HG   LYS  18          1HG       LYS  18  -8.615   7.385  -4.838
  151   1HD   LYS  18          2HD       LYS  18  -9.998   4.843  -3.961
  152   2HD   LYS  18          1HD       LYS  18 -10.817   6.220  -4.690
  153   1HE   LYS  18          2HE       LYS  18  -9.429   5.936  -6.699
  154   2HE   LYS  18          1HE       LYS  18  -8.661   4.537  -5.955
  155   1HZ   LYS  18          1HZ       LYS  18 -11.548   4.792  -6.589
  156   2HZ   LYS  18          2HZ       LYS  18 -10.856   3.452  -5.882
  157   3HZ   LYS  18          3HZ       LYS  18 -10.453   3.874  -7.463
  158    H    LYS  19           H        LYS  19  -5.489   3.300  -3.275
  159    HA   LYS  19           HA       LYS  19  -6.886   0.936  -4.064
  160   1HB   LYS  19          2HB       LYS  19  -5.156   2.366  -6.113
  161   2HB   LYS  19          1HB       LYS  19  -5.523   0.663  -6.159
  162   1HG   LYS  19          2HG       LYS  19  -7.906   1.197  -6.411
  163   2HG   LYS  19          1HG       LYS  19  -7.498   2.917  -6.393
  164   1HD   LYS  19          2HD       LYS  19  -7.764   2.080  -8.703
  165   2HD   LYS  19          1HD       LYS  19  -6.119   2.633  -8.381
  166   1HE   LYS  19          2HE       LYS  19  -5.364   0.333  -8.092
  167   2HE   LYS  19          1HE       LYS  19  -7.007  -0.268  -8.305
  168   1HZ   LYS  19          1HZ       LYS  19  -5.691  -0.524 -10.285
  169   2HZ   LYS  19          2HZ       LYS  19  -5.366   1.132 -10.350
  170   3HZ   LYS  19          3HZ       LYS  19  -6.937   0.552 -10.583
  171    H    LEU  20           H        LEU  20  -5.681  -0.825  -3.766
  172    HA   LEU  20           HA       LEU  20  -2.842  -0.477  -3.211
  173   1HB   LEU  20          2HB       LEU  20  -4.176  -0.500  -1.082
  174   2HB   LEU  20          1HB       LEU  20  -4.846  -2.036  -1.550
  175    HG   LEU  20           HG       LEU  20  -1.904  -1.608  -0.955
  176   1HD1  LEU  20          1HD1      LEU  20  -2.392  -2.611   1.226
  177   2HD1  LEU  20          2HD1      LEU  20  -4.108  -2.656   0.838
  178   3HD1  LEU  20          3HD1      LEU  20  -3.290  -1.116   1.009
  179   1HD2  LEU  20          1HD2      LEU  20  -1.836  -4.059  -0.775
  180   2HD2  LEU  20          2HD2      LEU  20  -2.473  -3.598  -2.347
  181   3HD2  LEU  20          3HD2      LEU  20  -3.569  -4.131  -1.080
  182    H    GLU  21           H        GLU  21  -1.765  -1.846  -4.539
  183    HA   GLU  21           HA       GLU  21  -2.989  -4.400  -5.093
  184   1HB   GLU  21          2HB       GLU  21  -2.381  -4.164  -7.506
  185   2HB   GLU  21          1HB       GLU  21  -3.709  -3.118  -7.001
  186   1HG   GLU  21          2HG       GLU  21  -2.011  -1.276  -6.838
  187   2HG   GLU  21          1HG       GLU  21  -0.851  -2.390  -7.569
  188    H    MET  22           H        MET  22  -1.528  -6.042  -5.345
  189    HA   MET  22           HA       MET  22   1.201  -5.224  -4.772
  190   1HB   MET  22          2HB       MET  22  -0.254  -7.790  -4.173
  191   2HB   MET  22          1HB       MET  22   1.467  -7.550  -3.918
  192   1HG   MET  22          2HG       MET  22   0.988  -5.758  -2.322
  193   2HG   MET  22          1HG       MET  22  -0.736  -5.964  -2.600
  194   1HE   MET  22          1HE       MET  22  -2.121  -8.095  -1.817
  195   2HE   MET  22          2HE       MET  22  -1.398  -9.505  -1.045
  196   3HE   MET  22          3HE       MET  22  -1.042  -9.150  -2.733
  197    H    LYS  23           H        LYS  23   2.394  -5.189  -6.456
  198    HA   LYS  23           HA       LYS  23   2.715  -7.499  -8.126
  199   1HB   LYS  23          2HB       LYS  23   2.406  -6.215 -10.180
  200   2HB   LYS  23          1HB       LYS  23   0.918  -6.263  -9.245
  201   1HG   LYS  23          2HG       LYS  23   1.528  -4.009  -8.337
  202   2HG   LYS  23          1HG       LYS  23   2.856  -3.978  -9.496
  203   1HD   LYS  23          2HD       LYS  23   1.198  -4.306 -11.297
  204   2HD   LYS  23          1HD       LYS  23  -0.041  -4.211 -10.024
  205   1HE   LYS  23          2HE       LYS  23   0.687  -1.958  -9.453
  206   2HE   LYS  23          1HE       LYS  23   1.920  -2.023 -10.717
  207   1HZ   LYS  23          1HZ       LYS  23  -0.011  -0.817 -11.450
  208   2HZ   LYS  23          2HZ       LYS  23  -1.001  -2.114 -11.044
  209   3HZ   LYS  23          3HZ       LYS  23   0.088  -2.264 -12.335
  210    HA   PRO  24           HA       PRO  24   6.738  -5.655  -7.799
  211   1HB   PRO  24          2HB       PRO  24   7.977  -6.646 -10.018
  212   2HB   PRO  24          1HB       PRO  24   7.681  -7.625  -8.575
  213   1HG   PRO  24          2HG       PRO  24   6.181  -7.463 -11.115
  214   2HG   PRO  24          1HG       PRO  24   6.585  -8.912 -10.158
  215   1HD   PRO  24          2HD       PRO  24   4.121  -7.716 -10.131
  216   2HD   PRO  24          1HD       PRO  24   4.747  -8.567  -8.717
  217    H    LYS  25           H        LYS  25   6.979  -3.575  -8.148
  218    HA   LYS  25           HA       LYS  25   5.707  -2.131 -10.208
  219   1HB   LYS  25          2HB       LYS  25   6.659  -1.369  -7.787
  220   2HB   LYS  25          1HB       LYS  25   8.084  -1.068  -8.784
  221   1HG   LYS  25          2HG       LYS  25   5.453   0.187  -9.414
  222   2HG   LYS  25          1HG       LYS  25   6.616   0.913  -8.311
  223   1HD   LYS  25          2HD       LYS  25   8.240   1.058  -9.999
  224   2HD   LYS  25          1HD       LYS  25   7.277   0.052 -11.079
  225   1HE   LYS  25          2HE       LYS  25   5.554   1.833 -11.124
  226   2HE   LYS  25          1HE       LYS  25   6.562   2.810 -10.057
  227   1HZ   LYS  25          1HZ       LYS  25   7.314   1.948 -12.805
  228   2HZ   LYS  25          2HZ       LYS  25   8.219   2.969 -11.797
  229   3HZ   LYS  25          3HZ       LYS  25   6.724   3.455 -12.365
  230    H    TYR  26           H        TYR  26   8.791  -3.632  -9.870
  231    HA   TYR  26           HA       TYR  26   9.518  -2.803 -12.552
  232   1HB   TYR  26          2HB       TYR  26  11.329  -3.031 -10.110
  233   2HB   TYR  26          1HB       TYR  26  11.978  -3.084 -11.710
  234    HD1  TYR  26           1HD      TYR  26  12.199  -1.185 -12.998
  235    HD2  TYR  26           2HD      TYR  26  10.298  -0.972  -9.222
  236    HE1  TYR  26           1HE      TYR  26  12.412   1.294 -13.037
  237    HE2  TYR  26           2HE      TYR  26  10.511   1.479  -9.220
  238    HH   TYR  26           HH       TYR  26  11.919   3.153 -10.252
  239    HA   PRO  27           HA       PRO  27   9.584  -7.226 -13.187
  240   1HB   PRO  27          2HB       PRO  27  11.760  -6.684 -15.131
  241   2HB   PRO  27          1HB       PRO  27  10.210  -7.485 -15.394
  242   1HG   PRO  27          2HG       PRO  27  10.602  -5.035 -16.327
  243   2HG   PRO  27          1HG       PRO  27   9.055  -5.471 -15.586
  244   1HD   PRO  27          2HD       PRO  27  11.340  -3.937 -14.402
  245   2HD   PRO  27          1HD       PRO  27   9.591  -3.609 -14.328
  246    H    HIS  28           H        HIS  28  12.161  -5.383 -12.173
  247    HA   HIS  28           HA       HIS  28  13.853  -7.706 -11.599
  248   1HB   HIS  28          2HB       HIS  28  15.701  -6.093 -11.171
  249   2HB   HIS  28          1HB       HIS  28  15.025  -5.943 -12.783
  250    HD1  HIS  28           1HD      HIS  28  15.361  -4.119  -9.511
  251    HD2  HIS  28           2HD      HIS  28  13.866  -3.324 -13.322
  252    HE1  HIS  28           1HE      HIS  28  14.877  -1.692  -9.625
  253    HE2  HIS  28           2HE      HIS  28  14.571  -1.284 -12.041
  254    H    CYS  29           H        CYS  29  11.396  -7.096 -10.060
  255    HA   CYS  29           HA       CYS  29  12.565  -6.426  -7.443
  256   1HB   CYS  29          2HB       CYS  29   9.697  -6.493  -8.408
  257   2HB   CYS  29          1HB       CYS  29  10.154  -6.200  -6.748
  258    H    GLU  30           H        GLU  30  12.071  -7.842  -5.654
  259    HA   GLU  30           HA       GLU  30  11.783 -10.594  -6.465
  260   1HB   GLU  30          2HB       GLU  30  13.584  -9.891  -4.985
  261   2HB   GLU  30          1HB       GLU  30  12.422  -9.228  -3.848
  262   1HG   GLU  30          2HG       GLU  30  11.647 -11.450  -3.466
  263   2HG   GLU  30          1HG       GLU  30  12.882 -12.035  -4.608
  264    H    GLU  31           H        GLU  31   9.920 -11.661  -6.130
  265    HA   GLU  31           HA       GLU  31   7.703 -11.990  -5.846
  266   1HB   GLU  31          2HB       GLU  31   8.337 -10.692  -3.206
  267   2HB   GLU  31          1HB       GLU  31   6.893 -11.650  -3.535
  268   1HG   GLU  31          2HG       GLU  31   8.350 -13.576  -4.050
  269   2HG   GLU  31          1HG       GLU  31   9.743 -12.609  -3.577
  270    H    LYS  32           H        LYS  32   5.716 -10.523  -4.481
  271    HA   LYS  32           HA       LYS  32   5.317  -8.432  -6.466
  272   1HB   LYS  32          2HB       LYS  32   3.477  -9.232  -4.211
  273   2HB   LYS  32          1HB       LYS  32   3.075  -8.288  -5.635
  274   1HG   LYS  32          2HG       LYS  32   3.861 -11.174  -5.614
  275   2HG   LYS  32          1HG       LYS  32   2.204 -10.541  -5.761
  276   1HD   LYS  32          2HD       LYS  32   2.908  -9.458  -7.864
  277   2HD   LYS  32          1HD       LYS  32   4.500 -10.212  -7.664
  278   1HE   LYS  32          2HE       LYS  32   1.877 -11.679  -7.956
  279   2HE   LYS  32          1HE       LYS  32   3.082 -11.477  -9.219
  280   1HZ   LYS  32          1HZ       LYS  32   4.651 -12.740  -7.770
  281   2HZ   LYS  32          2HZ       LYS  32   3.338 -13.609  -8.287
  282   3HZ   LYS  32          3HZ       LYS  32   3.369 -13.052  -6.700
  283    H    MET  33           H        MET  33   5.159  -6.289  -6.008
  284    HA   MET  33           HA       MET  33   6.160  -5.358  -3.375
  285   1HB   MET  33          2HB       MET  33   5.854  -3.841  -5.977
  286   2HB   MET  33          1HB       MET  33   6.513  -3.193  -4.496
  287   1HG   MET  33          2HG       MET  33   7.772  -5.407  -6.110
  288   2HG   MET  33          1HG       MET  33   8.190  -3.704  -6.279
  289   1HE   MET  33          1HE       MET  33   7.737  -6.330  -3.196
  290   2HE   MET  33          2HE       MET  33   9.447  -6.587  -2.905
  291   3HE   MET  33          3HE       MET  33   8.755  -7.043  -4.447
  292    H    VAL  34           H        VAL  34   5.076  -3.512  -2.404
  293    HA   VAL  34           HA       VAL  34   2.207  -3.703  -2.815
  294    HB   VAL  34           HB       VAL  34   3.774  -2.218  -0.693
  295   1HG1  VAL  34          1HG1      VAL  34   1.597  -1.226  -1.075
  296   2HG1  VAL  34          2HG1      VAL  34   1.623  -2.044   0.487
  297   3HG1  VAL  34          3HG1      VAL  34   0.815  -2.797  -0.890
  298   1HG2  VAL  34          1HG2      VAL  34   3.071  -4.022   0.800
  299   2HG2  VAL  34          2HG2      VAL  34   4.064  -4.580  -0.544
  300   3HG2  VAL  34          3HG2      VAL  34   2.317  -4.848  -0.570
  301    H    ILE  35           H        ILE  35   1.346  -2.416  -4.291
  302    HA   ILE  35           HA       ILE  35   2.532   0.210  -4.781
  303    HB   ILE  35           HB       ILE  35   0.352  -1.209  -6.311
  304   1HG1  ILE  35          2HG1      ILE  35   2.322  -2.564  -6.423
  305   2HG1  ILE  35          1HG1      ILE  35   2.044  -1.807  -7.976
  306   1HG2  ILE  35          1HG2      ILE  35   0.905   0.387  -8.104
  307   2HG2  ILE  35          2HG2      ILE  35   2.091   1.147  -7.035
  308   3HG2  ILE  35          3HG2      ILE  35   0.380   1.186  -6.618
  309   1HD1  ILE  35          1HD1      ILE  35   3.800  -0.137  -7.462
  310   2HD1  ILE  35          2HD1      ILE  35   4.425  -1.788  -7.443
  311   3HD1  ILE  35          3HD1      ILE  35   4.096  -0.949  -5.928
  312    H    ILE  36           H        ILE  36   1.630   1.689  -3.568
  313    HA   ILE  36           HA       ILE  36  -1.238   1.477  -3.175
  314    HB   ILE  36           HB       ILE  36   0.811   2.454  -1.244
  315   1HG1  ILE  36          2HG1      ILE  36  -1.535   0.565  -1.091
  316   2HG1  ILE  36          1HG1      ILE  36   0.163   0.130  -1.163
  317   1HG2  ILE  36          1HG2      ILE  36  -0.708   4.286  -1.274
  318   2HG2  ILE  36          2HG2      ILE  36  -1.022   3.342   0.178
  319   3HG2  ILE  36          3HG2      ILE  36  -2.102   3.225  -1.227
  320   1HD1  ILE  36          1HD1      ILE  36  -0.764  -0.104   1.070
  321   2HD1  ILE  36          2HD1      ILE  36  -1.214   1.600   1.036
  322   3HD1  ILE  36          3HD1      ILE  36   0.500   1.139   1.024
  323    H    THR  37           H        THR  37  -2.410   2.745  -4.040
  324    HA   THR  37           HA       THR  37  -1.397   5.204  -5.279
  325    HB   THR  37           HB       THR  37  -4.043   3.795  -5.534
  326    HG1  THR  37           1HG      THR  37  -1.683   3.034  -6.332
  327   1HG2  THR  37          1HG2      THR  37  -2.705   5.861  -7.305
  328   2HG2  THR  37          2HG2      THR  37  -4.092   6.119  -6.237
  329   3HG2  THR  37          3HG2      THR  37  -4.251   5.063  -7.637
  330    H    THR  38           H        THR  38  -2.029   7.176  -4.379
  331    HA   THR  38           HA       THR  38  -3.790   6.889  -2.085
  332    HB   THR  38           HB       THR  38  -2.903   9.140  -1.400
  333    HG1  THR  38           1HG      THR  38  -1.045   8.739  -3.562
  334   1HG2  THR  38          1HG2      THR  38  -0.624   8.290  -0.811
  335   2HG2  THR  38          2HG2      THR  38  -0.875   6.963  -1.918
  336   3HG2  THR  38          3HG2      THR  38  -1.898   7.096  -0.497
  337    H    LYS  39           H        LYS  39  -5.394   8.466  -1.659
  338    HA   LYS  39           HA       LYS  39  -6.973   9.170  -3.978
  339   1HB   LYS  39          2HB       LYS  39  -7.981   8.283  -1.921
  340   2HB   LYS  39          1HB       LYS  39  -7.391   9.664  -1.029
  341   1HG   LYS  39          2HG       LYS  39  -8.889  11.138  -2.230
  342   2HG   LYS  39          1HG       LYS  39  -9.424   9.798  -3.252
  343   1HD   LYS  39          2HD       LYS  39 -10.294   8.630  -1.281
  344   2HD   LYS  39          1HD       LYS  39  -9.738   9.940  -0.246
  345   1HE   LYS  39          2HE       LYS  39 -11.808  10.194  -2.437
  346   2HE   LYS  39          1HE       LYS  39 -12.155  10.040  -0.720
  347   1HZ   LYS  39          1HZ       LYS  39 -10.984  12.127  -0.343
  348   2HZ   LYS  39          2HZ       LYS  39 -12.249  12.329  -1.429
  349   3HZ   LYS  39          3HZ       LYS  39 -10.667  12.283  -1.985
  350    H    SER  40           H        SER  40  -5.420  10.857  -1.365
  351    HA   SER  40           HA       SER  40  -4.326  13.055  -2.431
  352   1HB   SER  40          2HB       SER  40  -7.192  13.580  -1.457
  353   2HB   SER  40          1HB       SER  40  -5.989  14.850  -1.583
  354    HG   SER  40           HG       SER  40  -6.686  13.211  -3.759
  355    H    VAL  41           H        VAL  41  -4.513  14.785  -0.249
  356    HA   VAL  41           HA       VAL  41  -4.110  15.102   1.940
  357    HB   VAL  41           HB       VAL  41  -5.220  12.298   2.372
  358   1HG1  VAL  41          1HG1      VAL  41  -3.836  12.953   4.256
  359   2HG1  VAL  41          2HG1      VAL  41  -5.540  12.949   4.715
  360   3HG1  VAL  41          3HG1      VAL  41  -4.712  14.474   4.398
  361   1HG2  VAL  41          1HG2      VAL  41  -6.540  14.996   2.672
  362   2HG2  VAL  41          2HG2      VAL  41  -7.277  13.446   3.077
  363   3HG2  VAL  41          3HG2      VAL  41  -6.857  13.813   1.402
  364    H    SER  42           H        SER  42  -2.980  12.122   0.651
  365    HA   SER  42           HA       SER  42  -0.761  11.810   2.427
  366   1HB   SER  42          2HB       SER  42  -1.948   9.986   1.094
  367   2HB   SER  42          1HB       SER  42  -1.121  10.623  -0.324
  368    HG   SER  42           HG       SER  42  -0.221   9.419   1.952
  369    H    ARG  43           H        ARG  43   1.393  12.202   1.868
  370    HA   ARG  43           HA       ARG  43   1.966  14.575   0.554
  371   1HB   ARG  43          2HB       ARG  43   4.368  14.045   0.839
  372   2HB   ARG  43          1HB       ARG  43   3.428  13.846   2.296
  373   1HG   ARG  43          2HG       ARG  43   4.438  11.598   0.530
  374   2HG   ARG  43          1HG       ARG  43   5.169  12.135   2.037
  375   1HD   ARG  43          2HD       ARG  43   2.490  10.777   1.653
  376   2HD   ARG  43          1HD       ARG  43   3.890  10.159   2.515
  377    HE   ARG  43           HE       ARG  43   3.261  12.485   3.788
  378   1HH1  ARG  43          1HH1      ARG  43   1.664   9.324   3.342
  379   2HH1  ARG  43          2HH1      ARG  43   0.522   9.588   4.563
  380   1HH2  ARG  43          1HH2      ARG  43   1.662  12.760   5.558
  381   2HH2  ARG  43          2HH2      ARG  43   0.572  11.494   5.855
  382    H    TYR  44           H        TYR  44   1.464  11.616  -0.937
  383    HA   TYR  44           HA       TYR  44   3.018  12.354  -3.253
  384   1HB   TYR  44          2HB       TYR  44   1.452   9.924  -2.557
  385   2HB   TYR  44          1HB       TYR  44   1.833  10.232  -4.241
  386    HD1  TYR  44           1HD      TYR  44   3.291   9.681  -0.920
  387    HD2  TYR  44           2HD      TYR  44   3.988   9.834  -5.087
  388    HE1  TYR  44           1HE      TYR  44   5.541   8.691  -0.582
  389    HE2  TYR  44           2HE      TYR  44   6.212   8.843  -4.781
  390    HH   TYR  44           HH       TYR  44   7.878   8.655  -3.019
  391    H    ARG  45           H        ARG  45  -0.093  13.040  -2.121
  392    HA   ARG  45           HA       ARG  45  -1.845  14.080  -2.953
  393   1HB   ARG  45          2HB       ARG  45   0.094  15.610  -3.403
  394   2HB   ARG  45          1HB       ARG  45   0.110  15.006  -5.048
  395   1HG   ARG  45          2HG       ARG  45  -2.110  15.876  -5.406
  396   2HG   ARG  45          1HG       ARG  45  -2.153  16.384  -3.707
  397   1HD   ARG  45          2HD       ARG  45  -0.240  17.843  -4.079
  398   2HD   ARG  45          1HD       ARG  45  -0.190  17.380  -5.772
  399    HE   ARG  45           HE       ARG  45  -2.667  18.336  -5.506
  400   1HH1  ARG  45          1HH1      ARG  45   0.508  19.617  -4.573
  401   2HH1  ARG  45          2HH1      ARG  45   0.038  21.253  -4.719
  402   1HH2  ARG  45          1HH2      ARG  45  -3.280  20.624  -5.731
  403   2HH2  ARG  45          2HH2      ARG  45  -2.106  21.816  -5.384
  404    H    GLY  46           H        GLY  46  -1.698  11.406  -3.766
  405   1HA   GLY  46          2HA       GLY  46  -3.320  10.262  -5.046
  406   2HA   GLY  46          1HA       GLY  46  -3.224  11.522  -6.263
  407    H    GLN  47           H        GLN  47  -0.166  10.994  -5.476
  408    HA   GLN  47           HA       GLN  47   0.252   9.104  -7.590
  409   1HB   GLN  47          2HB       GLN  47   2.132  10.906  -6.090
  410   2HB   GLN  47          1HB       GLN  47   2.778   9.527  -6.968
  411   1HG   GLN  47          2HG       GLN  47   2.886  11.626  -8.249
  412   2HG   GLN  47          1HG       GLN  47   1.922  10.401  -9.048
  413   1HE2  GLN  47          1HE2      GLN  47  -0.271  10.739  -9.273
  414   2HE2  GLN  47          2HE2      GLN  47  -1.026  12.272  -9.025
  415    H    GLU  48           H        GLU  48   1.862   7.318  -7.316
  416    HA   GLU  48           HA       GLU  48   0.736   5.750  -5.145
  417   1HB   GLU  48          2HB       GLU  48   2.428   4.841  -7.464
  418   2HB   GLU  48          1HB       GLU  48   1.628   3.798  -6.308
  419   1HG   GLU  48          2HG       GLU  48   0.354   3.712  -8.287
  420   2HG   GLU  48          1HG       GLU  48  -0.560   4.739  -7.191
  421    H    HIS  49           H        HIS  49   1.879   4.553  -3.798
  422    HA   HIS  49           HA       HIS  49   4.674   5.312  -3.193
  423   1HB   HIS  49          2HB       HIS  49   2.597   3.897  -1.495
  424   2HB   HIS  49          1HB       HIS  49   4.243   4.191  -1.001
  425    HD1  HIS  49           1HD      HIS  49   4.249   5.923   0.737
  426    HD2  HIS  49           2HD      HIS  49   1.311   6.647  -2.120
  427    HE1  HIS  49           1HE      HIS  49   3.044   7.965   1.532
  428    HE2  HIS  49           2HE      HIS  49   1.096   8.181  -0.007
  429    H    CYS  50           H        CYS  50   6.159   3.469  -2.674
  430    HA   CYS  50           HA       CYS  50   4.997   0.909  -3.221
  431   1HB   CYS  50          2HB       CYS  50   7.210   0.220  -4.300
  432   2HB   CYS  50          1HB       CYS  50   6.201   1.284  -5.264
  433    H    LEU  51           H        LEU  51   5.366  -0.481  -1.697
  434    HA   LEU  51           HA       LEU  51   7.170   0.414   0.453
  435   1HB   LEU  51          2HB       LEU  51   4.520   0.578   0.699
  436   2HB   LEU  51          1HB       LEU  51   4.627  -1.138   0.876
  437    HG   LEU  51           HG       LEU  51   5.948   0.841   2.739
  438   1HD1  LEU  51          1HD1      LEU  51   4.153   0.250   4.300
  439   2HD1  LEU  51          2HD1      LEU  51   3.384  -0.703   3.033
  440   3HD1  LEU  51          3HD1      LEU  51   3.551   1.042   2.844
  441   1HD2  LEU  51          1HD2      LEU  51   7.043  -1.352   2.758
  442   2HD2  LEU  51          2HD2      LEU  51   5.481  -2.125   3.019
  443   3HD2  LEU  51          3HD2      LEU  51   6.157  -1.072   4.258
  444    H    HIS  52           H        HIS  52   8.400  -1.115   1.341
  445    HA   HIS  52           HA       HIS  52   8.890  -3.561  -0.043
  446   1HB   HIS  52          2HB       HIS  52  10.753  -2.337   0.896
  447   2HB   HIS  52          1HB       HIS  52  10.021  -2.346   2.487
  448    HD1  HIS  52           1HD      HIS  52  11.192  -5.009   0.010
  449    HD2  HIS  52           2HD      HIS  52  11.211  -4.107   4.044
  450    HE1  HIS  52           1HE      HIS  52  12.313  -6.975   1.143
  451    HE2  HIS  52           2HE      HIS  52  12.697  -6.142   3.469
  452    HA   PRO  53           HA       PRO  53   5.550  -5.542   2.219
  453   1HB   PRO  53          2HB       PRO  53   5.376  -7.723   0.708
  454   2HB   PRO  53          1HB       PRO  53   4.769  -6.165   0.159
  455   1HG   PRO  53          2HG       PRO  53   7.322  -7.557  -0.519
  456   2HG   PRO  53          1HG       PRO  53   6.230  -6.646  -1.572
  457   1HD   PRO  53          2HD       PRO  53   8.554  -5.634  -0.562
  458   2HD   PRO  53          1HD       PRO  53   7.151  -4.632  -0.988
  459    H    LYS  54           H        LYS  54   8.721  -6.540   2.108
  460    HA   LYS  54           HA       LYS  54   8.265  -9.073   3.081
  461   1HB   LYS  54          2HB       LYS  54  10.800  -7.557   2.871
  462   2HB   LYS  54          1HB       LYS  54  10.782  -9.031   3.835
  463   1HG   LYS  54          2HG       LYS  54  11.475  -9.538   1.601
  464   2HG   LYS  54          1HG       LYS  54   9.921 -10.267   1.903
  465   1HD   LYS  54          2HD       LYS  54   8.934  -8.209   0.811
  466   2HD   LYS  54          1HD       LYS  54  10.550  -7.853   0.246
  467   1HE   LYS  54          2HE       LYS  54   8.756 -10.169  -0.383
  468   2HE   LYS  54          1HE       LYS  54   9.537  -9.059  -1.527
  469   1HZ   LYS  54          1HZ       LYS  54  11.673 -10.188  -1.142
  470   2HZ   LYS  54          2HZ       LYS  54  10.453 -11.371  -1.380
  471   3HZ   LYS  54          3HZ       LYS  54  10.966 -11.048   0.120
  472    H    LEU  55           H        LEU  55   8.001  -6.150   4.577
  473    HA   LEU  55           HA       LEU  55   8.884  -6.835   7.241
  474   1HB   LEU  55          2HB       LEU  55   7.275  -4.496   6.223
  475   2HB   LEU  55          1HB       LEU  55   8.013  -4.621   7.804
  476    HG   LEU  55           HG       LEU  55   9.507  -4.472   5.189
  477   1HD1  LEU  55          1HD1      LEU  55  10.141  -2.228   5.922
  478   2HD1  LEU  55          2HD1      LEU  55   9.086  -2.392   7.327
  479   3HD1  LEU  55          3HD1      LEU  55   8.397  -2.383   5.705
  480   1HD2  LEU  55          1HD2      LEU  55  10.512  -4.412   8.039
  481   2HD2  LEU  55          2HD2      LEU  55  11.491  -4.155   6.597
  482   3HD2  LEU  55          3HD2      LEU  55  10.744  -5.725   6.884
  483    H    GLN  56           H        GLN  56   7.537  -7.382   8.912
  484    HA   GLN  56           HA       GLN  56   5.161  -8.762   8.294
  485   1HB   GLN  56          2HB       GLN  56   6.660  -9.345  10.169
  486   2HB   GLN  56          1HB       GLN  56   6.181  -7.870  10.993
  487   1HG   GLN  56          2HG       GLN  56   3.877  -8.686  11.104
  488   2HG   GLN  56          1HG       GLN  56   4.371 -10.157  10.273
  489   1HE2  GLN  56          1HE2      GLN  56   6.343  -8.587  12.691
  490   2HE2  GLN  56          2HE2      GLN  56   6.159  -9.813  13.891
  491    H    SER  57           H        SER  57   5.778  -5.537   9.370
  492    HA   SER  57           HA       SER  57   3.234  -4.813  10.281
  493   1HB   SER  57          2HB       SER  57   5.265  -3.472  10.706
  494   2HB   SER  57          1HB       SER  57   5.390  -3.105   8.991
  495    HG   SER  57           HG       SER  57   2.990  -2.502  10.266
  496    H    THR  58           H        THR  58   4.669  -4.934   7.048
  497    HA   THR  58           HA       THR  58   2.725  -3.428   5.747
  498    HB   THR  58           HB       THR  58   4.349  -5.651   4.493
  499    HG1  THR  58           1HG      THR  58   5.793  -3.579   4.229
  500   1HG2  THR  58          1HG2      THR  58   2.678  -4.489   3.076
  501   2HG2  THR  58          2HG2      THR  58   4.314  -4.085   2.557
  502   3HG2  THR  58          3HG2      THR  58   3.399  -2.940   3.511
  503    H    LYS  59           H        LYS  59   2.999  -6.912   6.454
  504    HA   LYS  59           HA       LYS  59   0.765  -7.768   4.947
  505   1HB   LYS  59          2HB       LYS  59   2.000  -8.935   7.424
  506   2HB   LYS  59          1HB       LYS  59   0.622  -9.655   6.613
  507   1HG   LYS  59          2HG       LYS  59   2.540 -10.828   5.915
  508   2HG   LYS  59          1HG       LYS  59   2.025  -9.838   4.572
  509   1HD   LYS  59          2HD       LYS  59   3.762  -8.224   5.013
  510   2HD   LYS  59          1HD       LYS  59   4.246  -9.104   6.465
  511   1HE   LYS  59          2HE       LYS  59   5.760  -9.583   4.613
  512   2HE   LYS  59          1HE       LYS  59   4.873 -11.027   5.082
  513   1HZ   LYS  59          1HZ       LYS  59   4.197  -9.286   2.766
  514   2HZ   LYS  59          2HZ       LYS  59   3.414 -10.720   3.164
  515   3HZ   LYS  59          3HZ       LYS  59   5.017 -10.734   2.657
  516    H    ARG  60           H        ARG  60   0.902  -6.635   8.325
  517    HA   ARG  60           HA       ARG  60  -1.847  -7.000   8.613
  518   1HB   ARG  60          2HB       ARG  60   0.164  -5.482  10.151
  519   2HB   ARG  60          1HB       ARG  60  -1.512  -5.000  10.315
  520   1HG   ARG  60          2HG       ARG  60  -1.114  -6.498  12.049
  521   2HG   ARG  60          1HG       ARG  60  -2.040  -7.352  10.852
  522   1HD   ARG  60          2HD       ARG  60   0.009  -8.372   9.943
  523   2HD   ARG  60          1HD       ARG  60   0.943  -7.603  11.223
  524    HE   ARG  60           HE       ARG  60  -1.263  -9.429  11.820
  525   1HH1  ARG  60          1HH1      ARG  60   2.107  -8.477  12.306
  526   2HH1  ARG  60          2HH1      ARG  60   2.472  -9.776  13.343
  527   1HH2  ARG  60          1HH2      ARG  60  -0.759 -11.206  13.238
  528   2HH2  ARG  60          2HH2      ARG  60   0.815 -11.376  13.864
  529    H    PHE  61           H        PHE  61   0.031  -4.278   7.480
  530    HA   PHE  61           HA       PHE  61  -2.060  -2.439   7.367
  531   1HB   PHE  61          2HB       PHE  61   0.438  -2.059   6.960
  532   2HB   PHE  61          1HB       PHE  61   0.094  -2.660   5.335
  533    HD1  PHE  61           1HD      PHE  61  -1.364  -1.326   3.783
  534    HD2  PHE  61           2HD      PHE  61  -0.208   0.174   7.597
  535    HE1  PHE  61           1HE      PHE  61  -2.020   0.932   3.095
  536    HE2  PHE  61           2HE      PHE  61  -0.874   2.441   6.904
  537    HZ   PHE  61           HZ       PHE  61  -1.775   2.820   4.659
  538    H    ILE  62           H        ILE  62  -0.973  -4.867   4.987
  539    HA   ILE  62           HA       ILE  62  -2.760  -4.115   2.934
  540    HB   ILE  62           HB       ILE  62  -1.661  -6.884   3.422
  541   1HG1  ILE  62          2HG1      ILE  62   0.229  -5.430   3.289
  542   2HG1  ILE  62          1HG1      ILE  62   0.076  -6.187   1.711
  543   1HG2  ILE  62          1HG2      ILE  62  -3.534  -6.850   1.862
  544   2HG2  ILE  62          2HG2      ILE  62  -2.041  -7.204   0.993
  545   3HG2  ILE  62          3HG2      ILE  62  -2.749  -5.585   0.926
  546   1HD1  ILE  62          1HD1      ILE  62  -0.859  -3.447   2.463
  547   2HD1  ILE  62          2HD1      ILE  62  -1.001  -4.182   0.873
  548   3HD1  ILE  62          3HD1      ILE  62   0.605  -3.817   1.524
  549    H    LYS  63           H        LYS  63  -2.888  -6.689   5.288
  550    HA   LYS  63           HA       LYS  63  -5.537  -7.352   4.489
  551   1HB   LYS  63          2HB       LYS  63  -3.914  -8.363   6.790
  552   2HB   LYS  63          1HB       LYS  63  -5.647  -8.643   6.801
  553   1HG   LYS  63          2HG       LYS  63  -4.630 -10.590   5.854
  554   2HG   LYS  63          1HG       LYS  63  -5.421  -9.729   4.550
  555   1HD   LYS  63          2HD       LYS  63  -3.351 -10.433   3.671
  556   2HD   LYS  63          1HD       LYS  63  -3.117  -8.728   4.051
  557   1HE   LYS  63          2HE       LYS  63  -1.184  -9.999   4.784
  558   2HE   LYS  63          1HE       LYS  63  -2.051  -9.376   6.176
  559   1HZ   LYS  63          1HZ       LYS  63  -3.037 -11.540   6.519
  560   2HZ   LYS  63          2HZ       LYS  63  -1.365 -11.715   6.446
  561   3HZ   LYS  63          3HZ       LYS  63  -2.316 -12.138   5.126
  562    H    TRP  64           H        TRP  64  -4.401  -5.110   6.734
  563    HA   TRP  64           HA       TRP  64  -6.867  -4.709   8.114
  564   1HB   TRP  64          2HB       TRP  64  -4.337  -3.957   8.618
  565   2HB   TRP  64          1HB       TRP  64  -4.887  -2.502   7.805
  566    HD1  TRP  64           HD       TRP  64  -4.877  -4.231  11.091
  567    HE1  TRP  64           1HE      TRP  64  -6.261  -2.883  12.806
  568    HE3  TRP  64           3HE      TRP  64  -7.182  -0.931   7.920
  569    HZ2  TRP  64           2HZ      TRP  64  -8.067  -0.737  12.817
  570    HZ3  TRP  64           3HZ      TRP  64  -8.719   0.733   8.872
  571    HH2  TRP  64           HH       TRP  64  -9.149   0.826  11.265
  572    H    TYR  65           H        TYR  65  -5.153  -3.030   5.364
  573    HA   TYR  65           HA       TYR  65  -7.242  -1.194   4.893
  574   1HB   TYR  65          2HB       TYR  65  -4.966  -0.846   3.920
  575   2HB   TYR  65          1HB       TYR  65  -5.234  -2.231   2.866
  576    HD1  TYR  65           1HD      TYR  65  -6.167  -1.877   0.714
  577    HD2  TYR  65           2HD      TYR  65  -6.750   1.052   3.735
  578    HE1  TYR  65           1HE      TYR  65  -7.301  -0.369  -0.941
  579    HE2  TYR  65           2HE      TYR  65  -7.875   2.518   2.107
  580    HH   TYR  65           HH       TYR  65  -7.980   2.880  -0.268
  581    H    ASN  66           H        ASN  66  -6.602  -4.385   3.868
  582    HA   ASN  66           HA       ASN  66  -8.376  -4.808   1.743
  583   1HB   ASN  66          2HB       ASN  66  -6.575  -6.298   2.935
  584   2HB   ASN  66          1HB       ASN  66  -7.925  -6.814   3.924
  585   1HD2  ASN  66          1HD2      ASN  66  -6.356  -6.928   0.940
  586   2HD2  ASN  66          2HD2      ASN  66  -7.238  -8.173   0.192
  587    H    ALA  67           H        ALA  67  -8.884  -5.100   5.230
  588    HA   ALA  67           HA       ALA  67 -11.660  -5.747   5.006
  589   1HB   ALA  67          1HB       ALA  67 -10.053  -4.816   7.380
  590   2HB   ALA  67          2HB       ALA  67 -10.306  -6.494   6.906
  591   3HB   ALA  67          3HB       ALA  67 -11.672  -5.515   7.448
  592    H    TRP  68           H        TRP  68  -9.834  -2.895   5.992
  593    HA   TRP  68           HA       TRP  68 -11.889  -1.102   6.557
  594   1HB   TRP  68          2HB       TRP  68  -9.771  -0.445   7.245
  595   2HB   TRP  68          1HB       TRP  68  -9.025  -0.924   5.741
  596    HD1  TRP  68           HD       TRP  68  -9.134   0.868   3.731
  597    HE1  TRP  68           1HE      TRP  68  -9.182   3.427   3.770
  598    HE3  TRP  68           3HE      TRP  68 -10.724   1.616   8.548
  599    HZ2  TRP  68           2HZ      TRP  68  -9.802   5.469   5.518
  600    HZ3  TRP  68           3HZ      TRP  68 -11.005   3.951   9.307
  601    HH2  TRP  68           HH       TRP  68 -10.528   5.848   7.765
  602    H    ASN  69           H        ASN  69 -10.438  -1.869   3.466
  603    HA   ASN  69           HA       ASN  69 -11.734   0.086   1.918
  604   1HB   ASN  69          2HB       ASN  69  -9.807  -1.208   1.103
  605   2HB   ASN  69          1HB       ASN  69 -10.768  -2.673   1.141
  606   1HD2  ASN  69          1HD2      ASN  69 -10.394  -3.046  -1.006
  607   2HD2  ASN  69          2HD2      ASN  69 -11.162  -2.144  -2.264
  608    H    GLU  70           H        GLU  70 -12.691  -3.157   2.917
  609    HA   GLU  70           HA       GLU  70 -15.083  -3.291   1.375
  610   1HB   GLU  70          2HB       GLU  70 -14.420  -4.689   3.968
  611   2HB   GLU  70          1HB       GLU  70 -15.764  -5.091   2.912
  612   1HG   GLU  70          2HG       GLU  70 -14.163  -5.648   1.133
  613   2HG   GLU  70          1HG       GLU  70 -12.843  -5.299   2.250
  614    H    LYS  71           H        LYS  71 -14.479  -2.085   4.661
  615    HA   LYS  71           HA       LYS  71 -17.184  -1.572   5.299
  616   1HB   LYS  71          2HB       LYS  71 -14.642  -0.290   6.279
  617   2HB   LYS  71          1HB       LYS  71 -16.206   0.257   6.838
  618   1HG   LYS  71          2HG       LYS  71 -15.226  -1.214   8.459
  619   2HG   LYS  71          1HG       LYS  71 -16.634  -1.983   7.731
  620   1HD   LYS  71          2HD       LYS  71 -15.188  -3.340   6.337
  621   2HD   LYS  71          1HD       LYS  71 -13.767  -2.516   6.976
  622   1HE   LYS  71          2HE       LYS  71 -15.699  -4.214   8.549
  623   2HE   LYS  71          1HE       LYS  71 -14.076  -4.685   8.043
  624   1HZ   LYS  71          1HZ       LYS  71 -13.206  -2.846   9.388
  625   2HZ   LYS  71          2HZ       LYS  71 -14.044  -3.963  10.321
  626   3HZ   LYS  71          3HZ       LYS  71 -14.761  -2.493   9.925
  627    H    ARG  72           H        ARG  72 -14.903   0.142   3.449
  628    HA   ARG  72           HA       ARG  72 -16.490   2.552   3.318
  629   1HB   ARG  72          2HB       ARG  72 -14.034   1.785   1.762
  630   2HB   ARG  72          1HB       ARG  72 -14.732   3.403   1.867
  631   1HG   ARG  72          2HG       ARG  72 -14.261   3.497   4.226
  632   2HG   ARG  72          1HG       ARG  72 -13.683   1.834   4.205
  633   1HD   ARG  72          2HD       ARG  72 -11.787   3.227   4.191
  634   2HD   ARG  72          1HD       ARG  72 -11.951   2.564   2.571
  635    HE   ARG  72           HE       ARG  72 -13.067   5.190   3.116
  636   1HH1  ARG  72          1HH1      ARG  72 -10.594   3.241   1.485
  637   2HH1  ARG  72          2HH1      ARG  72  -9.911   4.571   0.664
  638   1HH2  ARG  72          1HH2      ARG  72 -12.110   6.969   2.033
  639   2HH2  ARG  72          2HH2      ARG  72 -10.750   6.747   1.009
  640    H    ARG  73           H        ARG  73 -16.143  -0.358   1.484
  641    HA   ARG  73           HA       ARG  73 -17.434   0.699  -0.851
  642   1HB   ARG  73          2HB       ARG  73 -16.850  -2.141  -0.025
  643   2HB   ARG  73          1HB       ARG  73 -17.676  -1.732  -1.524
  644   1HG   ARG  73          2HG       ARG  73 -15.716  -0.428  -2.220
  645   2HG   ARG  73          1HG       ARG  73 -14.896  -0.900  -0.735
  646   1HD   ARG  73          2HD       ARG  73 -14.984  -3.222  -1.376
  647   2HD   ARG  73          1HD       ARG  73 -15.919  -2.822  -2.819
  648    HE   ARG  73           HE       ARG  73 -13.597  -1.329  -2.860
  649   1HH1  ARG  73          1HH1      ARG  73 -14.506  -4.748  -3.090
  650   2HH1  ARG  73          2HH1      ARG  73 -13.210  -5.188  -4.090
  651   1HH2  ARG  73          1HH2      ARG  73 -11.802  -1.923  -4.257
  652   2HH2  ARG  73          2HH2      ARG  73 -11.613  -3.541  -4.740
  653    H    VAL  74           H        VAL  74 -18.391  -1.048   1.989
  654    HA   VAL  74           HA       VAL  74 -21.174  -0.749   1.195
  655    HB   VAL  74           HB       VAL  74 -21.711  -1.958   3.279
  656   1HG1  VAL  74          1HG1      VAL  74 -20.740  -4.139   2.693
  657   2HG1  VAL  74          2HG1      VAL  74 -19.601  -3.314   1.626
  658   3HG1  VAL  74          3HG1      VAL  74 -21.329  -3.258   1.282
  659   1HG2  VAL  74          1HG2      VAL  74 -18.723  -2.097   3.710
  660   2HG2  VAL  74          2HG2      VAL  74 -19.941  -2.934   4.681
  661   3HG2  VAL  74          3HG2      VAL  74 -19.871  -1.174   4.680
  662    H    TYR  75           H        TYR  75 -22.342  -0.162   3.665
  663    HA   TYR  75           HA       TYR  75 -21.228   2.497   4.077
  664   1HB   TYR  75          2HB       TYR  75 -23.997   1.460   4.708
  665   2HB   TYR  75          1HB       TYR  75 -23.436   3.097   5.048
  666    HD1  TYR  75           1HD      TYR  75 -22.352   4.317   2.983
  667    HD2  TYR  75           2HD      TYR  75 -25.125   1.114   2.702
  668    HE1  TYR  75           1HE      TYR  75 -22.916   5.026   0.715
  669    HE2  TYR  75           2HE      TYR  75 -25.703   1.816   0.422
  670    HH   TYR  75           HH       TYR  75 -25.631   3.861  -0.885
  671    H    GLU  76           H        GLU  76 -20.969   3.339   6.170
  672    HA   GLU  76           HA       GLU  76 -20.389   1.218   8.089
  673   1HB   GLU  76          2HB       GLU  76 -19.291   4.021   7.958
  674   2HB   GLU  76          1HB       GLU  76 -18.894   2.828   9.182
  675   1HG   GLU  76          2HG       GLU  76 -17.993   1.382   7.382
  676   2HG   GLU  76          1HG       GLU  76 -18.259   2.708   6.250
  677    H    GLU  77           H        GLU  77 -20.486   1.949  10.370
  678    HA   GLU  77           HA       GLU  77 -22.896   3.535  10.874
  679   1HB   GLU  77          2HB       GLU  77 -21.911   1.079  12.326
  680   2HB   GLU  77          1HB       GLU  77 -23.337   2.007  12.751
  681   1HG   GLU  77          2HG       GLU  77 -24.389   1.371  10.668
  682   2HG   GLU  77          1HG       GLU  77 -22.934   0.501  10.182
  Start of MODEL    3
    1    H    SER   1           H        SER   1  18.706  -8.811  -5.912
    2    HA   SER   1           HA       SER   1  15.872  -8.961  -6.139
    3   1HB   SER   1          2HB       SER   1  17.211 -10.710  -5.043
    4   2HB   SER   1          1HB       SER   1  17.730  -9.556  -3.820
    5    HG   SER   1           HG       SER   1  15.829 -11.109  -3.538
    6    H    LYS   2           H        LYS   2  18.129  -6.878  -4.446
    7    HA   LYS   2           HA       LYS   2  16.009  -5.705  -2.907
    8   1HB   LYS   2          2HB       LYS   2  18.921  -4.910  -3.058
    9   2HB   LYS   2          1HB       LYS   2  17.735  -4.313  -1.906
   10   1HG   LYS   2          2HG       LYS   2  17.485  -6.579  -0.993
   11   2HG   LYS   2          1HG       LYS   2  18.695  -7.161  -2.134
   12   1HD   LYS   2          2HD       LYS   2  19.725  -6.803   0.029
   13   2HD   LYS   2          1HD       LYS   2  20.340  -5.611  -1.118
   14   1HE   LYS   2          2HE       LYS   2  18.777  -3.950  -0.228
   15   2HE   LYS   2          1HE       LYS   2  18.153  -5.146   0.908
   16   1HZ   LYS   2          1HZ       LYS   2  20.411  -5.237   1.896
   17   2HZ   LYS   2          2HZ       LYS   2  19.697  -3.726   1.979
   18   3HZ   LYS   2          3HZ       LYS   2  20.893  -3.986   0.867
   19    H    CYS   3           H        CYS   3  14.759  -4.946  -4.555
   20    HA   CYS   3           HA       CYS   3  15.665  -2.899  -6.343
   21   1HB   CYS   3          2HB       CYS   3  12.835  -3.565  -5.512
   22   2HB   CYS   3          1HB       CYS   3  13.325  -2.662  -6.939
   23    H    LYS   4           H        LYS   4  13.528  -2.994  -3.527
   24    HA   LYS   4           HA       LYS   4  12.898  -1.490  -1.951
   25   1HB   LYS   4          2HB       LYS   4  15.561  -0.204  -2.607
   26   2HB   LYS   4          1HB       LYS   4  14.597   0.110  -1.177
   27   1HG   LYS   4          2HG       LYS   4  14.922  -2.205  -0.444
   28   2HG   LYS   4          1HG       LYS   4  15.872  -2.531  -1.892
   29   1HD   LYS   4          2HD       LYS   4  17.351  -2.126  -0.013
   30   2HD   LYS   4          1HD       LYS   4  17.495  -0.803  -1.171
   31   1HE   LYS   4          2HE       LYS   4  15.961   0.534   0.211
   32   2HE   LYS   4          1HE       LYS   4  15.884  -0.779   1.384
   33   1HZ   LYS   4          1HZ       LYS   4  17.411   0.882   2.080
   34   2HZ   LYS   4          2HZ       LYS   4  18.239   0.849   0.637
   35   3HZ   LYS   4          3HZ       LYS   4  18.327  -0.487   1.691
   36    H    CYS   5           H        CYS   5  13.076   1.174  -1.650
   37    HA   CYS   5           HA       CYS   5  12.118   2.279  -4.168
   38   1HB   CYS   5          2HB       CYS   5  11.315   3.029  -1.331
   39   2HB   CYS   5          1HB       CYS   5  10.788   3.876  -2.788
   40    H    SER   6           H        SER   6  12.408   4.853  -4.045
   41    HA   SER   6           HA       SER   6  15.142   5.218  -4.232
   42   1HB   SER   6          2HB       SER   6  12.960   7.287  -4.003
   43   2HB   SER   6          1HB       SER   6  14.579   7.526  -4.659
   44    HG   SER   6           HG       SER   6  14.141   6.038  -6.233
   45    H    ARG   7           H        ARG   7  12.887   6.454  -1.737
   46    HA   ARG   7           HA       ARG   7  15.298   6.784  -0.126
   47   1HB   ARG   7          2HB       ARG   7  14.389   8.980  -0.802
   48   2HB   ARG   7          1HB       ARG   7  12.874   8.589   0.001
   49   1HG   ARG   7          2HG       ARG   7  14.248  10.040   1.389
   50   2HG   ARG   7          1HG       ARG   7  14.040   8.459   2.147
   51   1HD   ARG   7          2HD       ARG   7  16.242   7.768   1.264
   52   2HD   ARG   7          1HD       ARG   7  16.451   9.381   0.581
   53    HE   ARG   7           HE       ARG   7  16.012   9.874   3.169
   54   1HH1  ARG   7          1HH1      ARG   7  18.232   7.668   1.510
   55   2HH1  ARG   7          2HH1      ARG   7  19.409   7.690   2.738
   56   1HH2  ARG   7          1HH2      ARG   7  17.624   9.937   4.841
   57   2HH2  ARG   7          2HH2      ARG   7  19.065   9.050   4.701
   58    H    LYS   8           H        LYS   8  11.747   6.612   0.341
   59    HA   LYS   8           HA       LYS   8  12.098   4.510   2.313
   60   1HB   LYS   8          2HB       LYS   8  10.886   7.194   2.988
   61   2HB   LYS   8          1HB       LYS   8  10.548   5.736   3.890
   62   1HG   LYS   8          2HG       LYS   8  12.904   5.582   4.496
   63   2HG   LYS   8          1HG       LYS   8  13.232   7.056   3.585
   64   1HD   LYS   8          2HD       LYS   8  12.992   7.538   5.989
   65   2HD   LYS   8          1HD       LYS   8  11.728   8.321   5.048
   66   1HE   LYS   8          2HE       LYS   8  10.838   7.356   7.112
   67   2HE   LYS   8          1HE       LYS   8  10.145   6.553   5.713
   68   1HZ   LYS   8          1HZ       LYS   8  11.703   4.711   6.070
   69   2HZ   LYS   8          2HZ       LYS   8  10.758   4.980   7.429
   70   3HZ   LYS   8          3HZ       LYS   8  12.357   5.509   7.408
   71    H    GLY   9           H        GLY   9   9.898   3.990   3.203
   72   1HA   GLY   9          2HA       GLY   9   7.793   4.458   1.234
   73   2HA   GLY   9          1HA       GLY   9   7.888   2.983   2.178
   74    HA   PRO  10           HA       PRO  10   6.986   7.126   4.855
   75   1HB   PRO  10          2HB       PRO  10   4.729   7.770   3.016
   76   2HB   PRO  10          1HB       PRO  10   5.778   8.862   3.931
   77   1HG   PRO  10          2HG       PRO  10   6.153   8.528   1.323
   78   2HG   PRO  10          1HG       PRO  10   7.536   8.643   2.426
   79   1HD   PRO  10          2HD       PRO  10   6.393   6.191   1.107
   80   2HD   PRO  10          1HD       PRO  10   8.074   6.592   1.473
   81    H    LYS  11           H        LYS  11   5.517   7.099   6.475
   82    HA   LYS  11           HA       LYS  11   3.932   4.749   6.701
   83   1HB   LYS  11          2HB       LYS  11   5.181   5.765   8.589
   84   2HB   LYS  11          1HB       LYS  11   4.108   7.153   8.527
   85   1HG   LYS  11          2HG       LYS  11   2.225   5.719   9.095
   86   2HG   LYS  11          1HG       LYS  11   3.296   4.318   9.145
   87   1HD   LYS  11          2HD       LYS  11   4.613   5.458  10.919
   88   2HD   LYS  11          1HD       LYS  11   3.423   6.758  10.905
   89   1HE   LYS  11          2HE       LYS  11   1.676   5.171  11.518
   90   2HE   LYS  11          1HE       LYS  11   2.868   3.868  11.510
   91   1HZ   LYS  11          1HZ       LYS  11   4.050   5.036  13.279
   92   2HZ   LYS  11          2HZ       LYS  11   2.484   4.622  13.734
   93   3HZ   LYS  11          3HZ       LYS  11   2.839   6.215  13.312
   94    H    ILE  12           H        ILE  12   2.119   4.578   5.751
   95    HA   ILE  12           HA       ILE  12   0.401   6.876   5.088
   96    HB   ILE  12           HB       ILE  12   0.403   4.038   4.015
   97   1HG1  ILE  12          2HG1      ILE  12   1.582   6.526   2.777
   98   2HG1  ILE  12          1HG1      ILE  12   2.515   5.245   3.541
   99   1HG2  ILE  12          1HG2      ILE  12  -0.878   6.573   2.973
  100   2HG2  ILE  12          2HG2      ILE  12  -1.729   5.240   3.752
  101   3HG2  ILE  12          3HG2      ILE  12  -0.940   4.993   2.197
  102   1HD1  ILE  12          1HD1      ILE  12   2.551   5.051   1.141
  103   2HD1  ILE  12          2HD1      ILE  12   0.787   4.975   1.103
  104   3HD1  ILE  12          3HD1      ILE  12   1.711   3.679   1.864
  105    H    ARG  13           H        ARG  13  -1.757   6.890   5.687
  106    HA   ARG  13           HA       ARG  13  -2.525   4.853   7.626
  107   1HB   ARG  13          2HB       ARG  13  -3.848   7.462   6.868
  108   2HB   ARG  13          1HB       ARG  13  -4.460   6.309   8.041
  109   1HG   ARG  13          2HG       ARG  13  -2.547   6.690   9.464
  110   2HG   ARG  13          1HG       ARG  13  -1.869   7.804   8.270
  111   1HD   ARG  13          2HD       ARG  13  -2.987   9.016  10.084
  112   2HD   ARG  13          1HD       ARG  13  -3.801   9.275   8.544
  113    HE   ARG  13           HE       ARG  13  -4.881   7.131  10.144
  114   1HH1  ARG  13          1HH1      ARG  13  -5.054  10.603   9.446
  115   2HH1  ARG  13          2HH1      ARG  13  -6.635  10.785  10.021
  116   1HH2  ARG  13          1HH2      ARG  13  -7.068   7.388  10.942
  117   2HH2  ARG  13          2HH2      ARG  13  -7.806   8.925  10.886
  118    H    TYR  14           H        TYR  14  -4.822   4.101   7.374
  119    HA   TYR  14           HA       TYR  14  -5.076   2.944   4.785
  120   1HB   TYR  14          2HB       TYR  14  -7.083   2.981   7.043
  121   2HB   TYR  14          1HB       TYR  14  -7.029   1.842   5.703
  122    HD1  TYR  14           1HD      TYR  14  -5.851   2.582   9.011
  123    HD2  TYR  14           2HD      TYR  14  -5.007   0.253   5.541
  124    HE1  TYR  14           1HE      TYR  14  -4.403   1.117  10.336
  125    HE2  TYR  14           2HE      TYR  14  -3.595  -1.195   6.847
  126    HH   TYR  14           HH       TYR  14  -2.299  -1.138   8.898
  127    H    SER  15           H        SER  15  -6.292   5.699   6.376
  128    HA   SER  15           HA       SER  15  -8.574   6.282   4.871
  129   1HB   SER  15          2HB       SER  15  -6.683   8.127   6.305
  130   2HB   SER  15          1HB       SER  15  -8.371   8.462   5.901
  131    HG   SER  15           HG       SER  15  -8.984   7.361   7.551
  132    H    ASP  16           H        ASP  16  -5.150   6.632   4.284
  133    HA   ASP  16           HA       ASP  16  -5.342   8.790   2.359
  134   1HB   ASP  16          2HB       ASP  16  -3.031   7.091   3.262
  135   2HB   ASP  16          1HB       ASP  16  -2.900   8.332   2.029
  136    H    VAL  17           H        VAL  17  -5.584   5.438   2.334
  137    HA   VAL  17           HA       VAL  17  -4.383   5.159  -0.295
  138    HB   VAL  17           HB       VAL  17  -5.749   3.002   1.288
  139   1HG1  VAL  17          1HG1      VAL  17  -5.495   2.366  -0.949
  140   2HG1  VAL  17          2HG1      VAL  17  -4.283   1.505  -0.002
  141   3HG1  VAL  17          3HG1      VAL  17  -3.816   2.891  -0.987
  142   1HG2  VAL  17          1HG2      VAL  17  -3.534   2.339   2.113
  143   2HG2  VAL  17          2HG2      VAL  17  -3.987   3.943   2.683
  144   3HG2  VAL  17          3HG2      VAL  17  -2.831   3.773   1.362
  145    H    LYS  18           H        LYS  18  -5.439   5.245  -2.070
  146    HA   LYS  18           HA       LYS  18  -8.386   5.303  -2.123
  147   1HB   LYS  18          2HB       LYS  18  -6.741   7.074  -3.183
  148   2HB   LYS  18          1HB       LYS  18  -6.498   5.853  -4.412
  149   1HG   LYS  18          2HG       LYS  18  -9.079   7.125  -3.695
  150   2HG   LYS  18          1HG       LYS  18  -7.976   7.671  -4.948
  151   1HD   LYS  18          2HD       LYS  18  -8.237   5.504  -6.051
  152   2HD   LYS  18          1HD       LYS  18  -9.431   5.049  -4.821
  153   1HE   LYS  18          2HE       LYS  18 -10.645   7.028  -5.297
  154   2HE   LYS  18          1HE       LYS  18  -9.444   7.420  -6.524
  155   1HZ   LYS  18          1HZ       LYS  18 -11.446   6.398  -7.555
  156   2HZ   LYS  18          2HZ       LYS  18 -11.232   5.026  -6.611
  157   3HZ   LYS  18          3HZ       LYS  18 -10.094   5.433  -7.791
  158    H    LYS  19           H        LYS  19  -5.580   3.597  -3.091
  159    HA   LYS  19           HA       LYS  19  -7.015   1.282  -4.059
  160   1HB   LYS  19          2HB       LYS  19  -5.040   2.694  -5.883
  161   2HB   LYS  19          1HB       LYS  19  -5.596   1.060  -6.028
  162   1HG   LYS  19          2HG       LYS  19  -7.806   1.782  -6.577
  163   2HG   LYS  19          1HG       LYS  19  -7.369   3.471  -6.262
  164   1HD   LYS  19          2HD       LYS  19  -7.301   2.870  -8.701
  165   2HD   LYS  19          1HD       LYS  19  -5.768   3.471  -8.072
  166   1HE   LYS  19          2HE       LYS  19  -4.975   1.123  -7.831
  167   2HE   LYS  19          1HE       LYS  19  -6.494   0.562  -8.527
  168   1HZ   LYS  19          1HZ       LYS  19  -4.518   0.705 -10.008
  169   2HZ   LYS  19          2HZ       LYS  19  -4.587   2.360  -9.866
  170   3HZ   LYS  19          3HZ       LYS  19  -5.886   1.573 -10.602
  171    H    LEU  20           H        LEU  20  -5.797  -0.515  -3.793
  172    HA   LEU  20           HA       LEU  20  -2.939  -0.191  -3.258
  173   1HB   LEU  20          2HB       LEU  20  -4.392  -0.550  -1.181
  174   2HB   LEU  20          1HB       LEU  20  -4.848  -2.088  -1.856
  175    HG   LEU  20           HG       LEU  20  -2.043  -1.329  -0.986
  176   1HD1  LEU  20          1HD1      LEU  20  -2.459  -2.794   0.915
  177   2HD1  LEU  20          2HD1      LEU  20  -4.105  -3.077   0.358
  178   3HD1  LEU  20          3HD1      LEU  20  -3.609  -1.474   0.887
  179   1HD2  LEU  20          1HD2      LEU  20  -1.541  -3.720  -1.198
  180   2HD2  LEU  20          2HD2      LEU  20  -2.065  -3.062  -2.747
  181   3HD2  LEU  20          3HD2      LEU  20  -3.177  -4.028  -1.776
  182    H    GLU  21           H        GLU  21  -1.901  -1.359  -4.824
  183    HA   GLU  21           HA       GLU  21  -3.190  -3.787  -5.735
  184   1HB   GLU  21          2HB       GLU  21  -2.339  -3.299  -8.063
  185   2HB   GLU  21          1HB       GLU  21  -3.699  -2.297  -7.555
  186   1HG   GLU  21          2HG       GLU  21  -2.097  -0.462  -7.132
  187   2HG   GLU  21          1HG       GLU  21  -0.792  -1.537  -7.652
  188    H    MET  22           H        MET  22  -1.819  -5.453  -6.251
  189    HA   MET  22           HA       MET  22   0.862  -4.897  -5.398
  190   1HB   MET  22          2HB       MET  22   1.000  -7.395  -4.963
  191   2HB   MET  22          1HB       MET  22   0.027  -6.448  -3.855
  192   1HG   MET  22          2HG       MET  22  -1.138  -8.465  -4.240
  193   2HG   MET  22          1HG       MET  22  -1.980  -7.227  -5.159
  194   1HE   MET  22          1HE       MET  22  -2.562 -10.257  -5.619
  195   2HE   MET  22          2HE       MET  22  -2.569 -10.336  -7.379
  196   3HE   MET  22          3HE       MET  22  -3.293  -8.954  -6.551
  197    H    LYS  23           H        LYS  23   2.242  -4.675  -6.788
  198    HA   LYS  23           HA       LYS  23   2.753  -6.601  -8.731
  199   1HB   LYS  23          2HB       LYS  23   2.648  -5.063 -10.754
  200   2HB   LYS  23          1HB       LYS  23   1.096  -5.521 -10.106
  201   1HG   LYS  23          2HG       LYS  23   0.829  -3.278 -10.664
  202   2HG   LYS  23          1HG       LYS  23   1.157  -3.210  -8.939
  203   1HD   LYS  23          2HD       LYS  23   3.471  -2.622  -9.387
  204   2HD   LYS  23          1HD       LYS  23   3.189  -2.793 -11.121
  205   1HE   LYS  23          2HE       LYS  23   1.963  -0.694  -9.290
  206   2HE   LYS  23          1HE       LYS  23   3.151  -0.450 -10.560
  207   1HZ   LYS  23          1HZ       LYS  23   1.073   0.200 -11.369
  208   2HZ   LYS  23          2HZ       LYS  23   0.305  -1.215 -10.855
  209   3HZ   LYS  23          3HZ       LYS  23   1.416  -1.270 -12.131
  210    HA   PRO  24           HA       PRO  24   6.676  -5.380  -7.488
  211   1HB   PRO  24          2HB       PRO  24   8.254  -6.308  -9.476
  212   2HB   PRO  24          1HB       PRO  24   7.429  -7.381  -8.339
  213   1HG   PRO  24          2HG       PRO  24   6.615  -6.597 -11.111
  214   2HG   PRO  24          1HG       PRO  24   6.615  -8.210 -10.370
  215   1HD   PRO  24          2HD       PRO  24   4.357  -6.733 -10.565
  216   2HD   PRO  24          1HD       PRO  24   4.683  -7.807  -9.191
  217    H    LYS  25           H        LYS  25   8.261  -3.878  -7.768
  218    HA   LYS  25           HA       LYS  25   7.607  -1.611  -9.298
  219   1HB   LYS  25          2HB       LYS  25   8.843  -1.363  -7.314
  220   2HB   LYS  25          1HB       LYS  25  10.212  -2.358  -7.884
  221   1HG   LYS  25          2HG       LYS  25  10.826  -0.069  -7.904
  222   2HG   LYS  25          1HG       LYS  25  10.503  -0.504  -9.584
  223   1HD   LYS  25          2HD       LYS  25   8.220   0.338  -9.303
  224   2HD   LYS  25          1HD       LYS  25   8.626   0.877  -7.703
  225   1HE   LYS  25          2HE       LYS  25  10.056   1.846 -10.187
  226   2HE   LYS  25          1HE       LYS  25   8.816   2.754  -9.327
  227   1HZ   LYS  25          1HZ       LYS  25  11.014   3.489  -8.665
  228   2HZ   LYS  25          2HZ       LYS  25  11.450   1.929  -8.188
  229   3HZ   LYS  25          3HZ       LYS  25  10.228   2.746  -7.374
  230    H    TYR  26           H        TYR  26  10.101  -4.117  -9.670
  231    HA   TYR  26           HA       TYR  26  10.002  -3.676 -12.555
  232   1HB   TYR  26          2HB       TYR  26  12.598  -4.413 -11.112
  233   2HB   TYR  26          1HB       TYR  26  12.372  -3.898 -12.762
  234    HD1  TYR  26           1HD      TYR  26  11.436  -1.462 -13.072
  235    HD2  TYR  26           2HD      TYR  26  13.311  -2.961  -9.576
  236    HE1  TYR  26           1HE      TYR  26  11.935   0.846 -12.386
  237    HE2  TYR  26           2HE      TYR  26  13.817  -0.632  -8.853
  238    HH   TYR  26           HH       TYR  26  14.101   1.527  -9.891
  239    HA   PRO  27           HA       PRO  27   9.292  -8.100 -12.524
  240   1HB   PRO  27          2HB       PRO  27  11.426  -8.242 -14.584
  241   2HB   PRO  27          1HB       PRO  27   9.795  -8.922 -14.635
  242   1HG   PRO  27          2HG       PRO  27  10.337  -6.751 -16.040
  243   2HG   PRO  27          1HG       PRO  27   8.821  -6.854 -15.128
  244   1HD   PRO  27          2HD       PRO  27  11.312  -5.336 -14.477
  245   2HD   PRO  27          1HD       PRO  27   9.612  -4.878 -14.253
  246    H    HIS  28           H        HIS  28  12.519  -6.831 -12.235
  247    HA   HIS  28           HA       HIS  28  13.674  -9.324 -11.374
  248   1HB   HIS  28          2HB       HIS  28  15.760  -8.057 -10.904
  249   2HB   HIS  28          1HB       HIS  28  15.180  -7.855 -12.543
  250    HD1  HIS  28           1HD      HIS  28  15.812  -5.589 -13.252
  251    HD2  HIS  28           2HD      HIS  28  14.474  -5.446  -9.299
  252    HE1  HIS  28           1HE      HIS  28  15.968  -3.210 -12.489
  253    HE2  HIS  28           2HE      HIS  28  15.574  -3.324 -10.048
  254    H    CYS  29           H        CYS  29  11.444  -7.920  -9.735
  255    HA   CYS  29           HA       CYS  29  12.913  -7.787  -7.206
  256   1HB   CYS  29          2HB       CYS  29  10.158  -6.825  -7.965
  257   2HB   CYS  29          1HB       CYS  29  10.920  -6.593  -6.405
  258    H    GLU  30           H        GLU  30  12.061  -8.970  -5.412
  259    HA   GLU  30           HA       GLU  30  10.757 -11.416  -6.196
  260   1HB   GLU  30          2HB       GLU  30  11.876 -10.567  -3.521
  261   2HB   GLU  30          1HB       GLU  30  11.391 -12.178  -3.998
  262   1HG   GLU  30          2HG       GLU  30  13.571 -10.611  -5.210
  263   2HG   GLU  30          1HG       GLU  30  13.788 -11.909  -4.039
  264    H    GLU  31           H        GLU  31   8.725 -11.926  -5.736
  265    HA   GLU  31           HA       GLU  31   6.593 -11.835  -5.106
  266   1HB   GLU  31          2HB       GLU  31   7.509 -11.826  -2.776
  267   2HB   GLU  31          1HB       GLU  31   7.592 -10.080  -2.823
  268   1HG   GLU  31          2HG       GLU  31   5.697 -10.931  -1.517
  269   2HG   GLU  31          1HG       GLU  31   5.182  -9.935  -2.878
  270    H    LYS  32           H        LYS  32   4.757 -10.118  -4.682
  271    HA   LYS  32           HA       LYS  32   5.134  -8.045  -6.680
  272   1HB   LYS  32          2HB       LYS  32   2.685  -8.793  -5.086
  273   2HB   LYS  32          1HB       LYS  32   2.733  -7.760  -6.512
  274   1HG   LYS  32          2HG       LYS  32   3.460 -10.651  -6.419
  275   2HG   LYS  32          1HG       LYS  32   1.912  -9.999  -7.014
  276   1HD   LYS  32          2HD       LYS  32   3.109  -8.833  -8.770
  277   2HD   LYS  32          1HD       LYS  32   4.649  -9.433  -8.102
  278   1HE   LYS  32          2HE       LYS  32   2.438 -11.146  -9.233
  279   2HE   LYS  32          1HE       LYS  32   3.889 -10.675 -10.110
  280   1HZ   LYS  32          1HZ       LYS  32   5.231 -11.879  -8.489
  281   2HZ   LYS  32          2HZ       LYS  32   4.073 -12.885  -9.161
  282   3HZ   LYS  32          3HZ       LYS  32   3.871 -12.300  -7.609
  283    H    MET  33           H        MET  33   5.328  -5.988  -6.225
  284    HA   MET  33           HA       MET  33   5.784  -5.158  -3.504
  285   1HB   MET  33          2HB       MET  33   5.820  -3.618  -6.081
  286   2HB   MET  33          1HB       MET  33   5.760  -2.773  -4.569
  287   1HG   MET  33          2HG       MET  33   8.017  -2.814  -5.445
  288   2HG   MET  33          1HG       MET  33   7.937  -3.698  -3.937
  289   1HE   MET  33          1HE       MET  33   7.189  -6.618  -4.505
  290   2HE   MET  33          2HE       MET  33   8.684  -6.182  -3.685
  291   3HE   MET  33          3HE       MET  33   8.715  -7.337  -5.018
  292    H    VAL  34           H        VAL  34   4.751  -3.360  -2.531
  293    HA   VAL  34           HA       VAL  34   1.880  -3.520  -2.904
  294    HB   VAL  34           HB       VAL  34   3.578  -2.391  -0.678
  295   1HG1  VAL  34          1HG1      VAL  34   1.450  -1.172  -0.952
  296   2HG1  VAL  34          2HG1      VAL  34   1.504  -2.075   0.552
  297   3HG1  VAL  34          3HG1      VAL  34   0.565  -2.696  -0.818
  298   1HG2  VAL  34          1HG2      VAL  34   2.698  -4.284   0.627
  299   2HG2  VAL  34          2HG2      VAL  34   3.625  -4.814  -0.779
  300   3HG2  VAL  34          3HG2      VAL  34   1.863  -4.868  -0.810
  301    H    ILE  35           H        ILE  35   1.127  -2.080  -4.240
  302    HA   ILE  35           HA       ILE  35   2.519   0.466  -4.546
  303    HB   ILE  35           HB       ILE  35   0.425  -0.815  -6.286
  304   1HG1  ILE  35          2HG1      ILE  35   2.396  -2.218  -6.101
  305   2HG1  ILE  35          1HG1      ILE  35   2.223  -1.620  -7.723
  306   1HG2  ILE  35          1HG2      ILE  35   1.258   0.782  -7.982
  307   2HG2  ILE  35          2HG2      ILE  35   2.388   1.425  -6.781
  308   3HG2  ILE  35          3HG2      ILE  35   0.647   1.590  -6.534
  309   1HD1  ILE  35          1HD1      ILE  35   3.984   0.093  -7.213
  310   2HD1  ILE  35          2HD1      ILE  35   4.567  -1.564  -7.060
  311   3HD1  ILE  35          3HD1      ILE  35   4.173  -0.639  -5.617
  312    H    ILE  36           H        ILE  36   1.615   2.030  -3.453
  313    HA   ILE  36           HA       ILE  36  -1.233   1.808  -2.837
  314    HB   ILE  36           HB       ILE  36   0.970   3.136  -1.297
  315   1HG1  ILE  36          2HG1      ILE  36  -0.869   0.817  -0.741
  316   2HG1  ILE  36          1HG1      ILE  36   0.853   0.748  -1.104
  317   1HG2  ILE  36          1HG2      ILE  36  -1.047   4.545  -1.187
  318   2HG2  ILE  36          2HG2      ILE  36  -0.742   3.747   0.357
  319   3HG2  ILE  36          3HG2      ILE  36  -1.987   3.126  -0.720
  320   1HD1  ILE  36          1HD1      ILE  36   0.292   0.476   1.270
  321   2HD1  ILE  36          2HD1      ILE  36  -0.374   2.126   1.185
  322   3HD1  ILE  36          3HD1      ILE  36   1.351   1.880   0.926
  323    H    THR  37           H        THR  37  -2.463   3.056  -3.716
  324    HA   THR  37           HA       THR  37  -1.510   5.485  -5.090
  325    HB   THR  37           HB       THR  37  -4.219   4.198  -5.164
  326    HG1  THR  37           1HG      THR  37  -1.990   3.179  -6.014
  327   1HG2  THR  37          1HG2      THR  37  -2.837   6.098  -7.077
  328   2HG2  THR  37          2HG2      THR  37  -4.156   6.497  -5.975
  329   3HG2  THR  37          3HG2      THR  37  -4.438   5.393  -7.321
  330    H    THR  38           H        THR  38  -2.132   7.472  -4.293
  331    HA   THR  38           HA       THR  38  -3.501   7.343  -1.738
  332    HB   THR  38           HB       THR  38  -2.726   9.719  -1.536
  333    HG1  THR  38           1HG      THR  38  -1.081   9.094  -3.771
  334   1HG2  THR  38          1HG2      THR  38  -0.368   9.084  -1.220
  335   2HG2  THR  38          2HG2      THR  38  -0.673   7.616  -2.137
  336   3HG2  THR  38          3HG2      THR  38  -1.469   7.856  -0.577
  337    H    LYS  39           H        LYS  39  -5.143   8.819  -1.193
  338    HA   LYS  39           HA       LYS  39  -7.128   9.107  -3.240
  339   1HB   LYS  39          2HB       LYS  39  -7.642   8.439  -0.944
  340   2HB   LYS  39          1HB       LYS  39  -7.100  10.001  -0.369
  341   1HG   LYS  39          2HG       LYS  39  -8.929  11.069  -1.607
  342   2HG   LYS  39          1HG       LYS  39  -9.477   9.477  -2.140
  343   1HD   LYS  39          2HD       LYS  39  -9.778   8.789   0.174
  344   2HD   LYS  39          1HD       LYS  39  -9.229  10.367   0.731
  345   1HE   LYS  39          2HE       LYS  39 -11.149  11.402  -0.449
  346   2HE   LYS  39          1HE       LYS  39 -11.691   9.788  -0.912
  347   1HZ   LYS  39          1HZ       LYS  39 -11.911   9.241   1.451
  348   2HZ   LYS  39          2HZ       LYS  39 -12.856  10.583   1.040
  349   3HZ   LYS  39          3HZ       LYS  39 -11.403  10.801   1.854
  350    H    SER  40           H        SER  40  -5.326  11.397  -1.226
  351    HA   SER  40           HA       SER  40  -4.821  13.476  -2.926
  352   1HB   SER  40          2HB       SER  40  -7.355  13.546  -3.296
  353   2HB   SER  40          1HB       SER  40  -7.522  13.967  -1.604
  354    HG   SER  40           HG       SER  40  -7.181  15.545  -3.609
  355    H    VAL  41           H        VAL  41  -6.069  12.467   0.154
  356    HA   VAL  41           HA       VAL  41  -5.251  14.589   1.777
  357    HB   VAL  41           HB       VAL  41  -6.955  12.964   2.420
  358   1HG1  VAL  41          1HG1      VAL  41  -6.399  10.717   3.186
  359   2HG1  VAL  41          2HG1      VAL  41  -4.737  10.962   2.641
  360   3HG1  VAL  41          3HG1      VAL  41  -6.057  10.964   1.473
  361   1HG2  VAL  41          1HG2      VAL  41  -5.896  14.183   4.227
  362   2HG2  VAL  41          2HG2      VAL  41  -4.638  12.961   4.346
  363   3HG2  VAL  41          3HG2      VAL  41  -6.310  12.555   4.757
  364    H    SER  42           H        SER  42  -3.366  12.180   0.317
  365    HA   SER  42           HA       SER  42  -1.100  12.636   2.125
  366   1HB   SER  42          2HB       SER  42  -1.629  10.263   1.591
  367   2HB   SER  42          1HB       SER  42  -1.473  10.628  -0.124
  368    HG   SER  42           HG       SER  42   0.532  10.600   1.872
  369    H    ARG  43           H        ARG  43   0.928  13.383   1.174
  370    HA   ARG  43           HA       ARG  43   0.580  15.556  -0.545
  371   1HB   ARG  43          2HB       ARG  43   2.391  15.401   1.100
  372   2HB   ARG  43          1HB       ARG  43   3.157  14.143   0.137
  373   1HG   ARG  43          2HG       ARG  43   3.455  15.720  -1.698
  374   2HG   ARG  43          1HG       ARG  43   2.679  16.977  -0.747
  375   1HD   ARG  43          2HD       ARG  43   4.461  16.824   0.916
  376   2HD   ARG  43          1HD       ARG  43   5.231  15.544  -0.028
  377    HE   ARG  43           HE       ARG  43   4.906  17.603  -1.755
  378   1HH1  ARG  43          1HH1      ARG  43   6.568  17.220   1.346
  379   2HH1  ARG  43          2HH1      ARG  43   7.786  18.354   1.007
  380   1HH2  ARG  43          1HH2      ARG  43   6.567  19.189  -2.223
  381   2HH2  ARG  43          2HH2      ARG  43   7.778  19.506  -1.071
  382    H    TYR  44           H        TYR  44   1.088  12.306  -1.364
  383    HA   TYR  44           HA       TYR  44   2.213  12.732  -3.937
  384   1HB   TYR  44          2HB       TYR  44   1.036  10.420  -2.517
  385   2HB   TYR  44          1HB       TYR  44   1.129  10.294  -4.261
  386    HD1  TYR  44           1HD      TYR  44   2.903   9.019  -4.897
  387    HD2  TYR  44           2HD      TYR  44   3.413  11.646  -1.613
  388    HE1  TYR  44           1HE      TYR  44   5.270   8.369  -4.769
  389    HE2  TYR  44           2HE      TYR  44   5.799  11.001  -1.468
  390    HH   TYR  44           HH       TYR  44   7.331   9.296  -3.945
  391    H    ARG  45           H        ARG  45  -1.015  12.605  -2.724
  392    HA   ARG  45           HA       ARG  45  -3.054  13.021  -3.619
  393   1HB   ARG  45          2HB       ARG  45  -1.442  14.917  -5.320
  394   2HB   ARG  45          1HB       ARG  45  -3.172  15.008  -5.035
  395   1HG   ARG  45          2HG       ARG  45  -2.799  15.432  -2.685
  396   2HG   ARG  45          1HG       ARG  45  -1.060  15.234  -2.909
  397   1HD   ARG  45          2HD       ARG  45  -1.061  17.134  -4.451
  398   2HD   ARG  45          1HD       ARG  45  -2.789  17.349  -4.173
  399    HE   ARG  45           HE       ARG  45  -1.490  17.367  -1.708
  400   1HH1  ARG  45          1HH1      ARG  45  -1.716  19.334  -4.623
  401   2HH1  ARG  45          2HH1      ARG  45  -1.380  20.800  -3.840
  402   1HH2  ARG  45          1HH2      ARG  45  -1.051  19.358  -0.606
  403   2HH2  ARG  45          2HH2      ARG  45  -1.023  20.824  -1.481
  404    H    GLY  46           H        GLY  46  -2.617  10.714  -4.645
  405   1HA   GLY  46          2HA       GLY  46  -3.786   9.605  -6.384
  406   2HA   GLY  46          1HA       GLY  46  -3.515  10.999  -7.419
  407    H    GLN  47           H        GLN  47  -0.692  10.554  -5.942
  408    HA   GLN  47           HA       GLN  47   0.380   8.862  -8.071
  409   1HB   GLN  47          2HB       GLN  47   1.786  10.608  -6.027
  410   2HB   GLN  47          1HB       GLN  47   2.613   9.620  -7.219
  411   1HG   GLN  47          2HG       GLN  47   1.709  10.931  -9.001
  412   2HG   GLN  47          1HG       GLN  47   0.683  11.821  -7.876
  413   1HE2  GLN  47          1HE2      GLN  47   1.584  13.765  -8.495
  414   2HE2  GLN  47          2HE2      GLN  47   3.163  14.256  -8.014
  415    H    GLU  48           H        GLU  48   1.900   7.141  -7.487
  416    HA   GLU  48           HA       GLU  48   0.769   5.731  -5.208
  417   1HB   GLU  48          2HB       GLU  48   2.518   4.609  -7.394
  418   2HB   GLU  48          1HB       GLU  48   1.755   3.692  -6.118
  419   1HG   GLU  48          2HG       GLU  48   0.450   3.291  -8.015
  420   2HG   GLU  48          1HG       GLU  48  -0.462   4.491  -7.110
  421    H    HIS  49           H        HIS  49   1.811   5.110  -3.509
  422    HA   HIS  49           HA       HIS  49   4.690   5.695  -3.168
  423   1HB   HIS  49          2HB       HIS  49   2.651   4.679  -1.145
  424   2HB   HIS  49          1HB       HIS  49   4.343   4.935  -0.801
  425    HD1  HIS  49           1HD      HIS  49   5.056   7.326  -0.244
  426    HD2  HIS  49           2HD      HIS  49   1.064   6.994  -1.266
  427    HE1  HIS  49           1HE      HIS  49   3.992   9.431   0.580
  428    HE2  HIS  49           2HE      HIS  49   1.560   9.041   0.273
  429    H    CYS  50           H        CYS  50   6.077   3.893  -2.424
  430    HA   CYS  50           HA       CYS  50   4.931   1.328  -3.186
  431   1HB   CYS  50          2HB       CYS  50   7.289   0.695  -3.853
  432   2HB   CYS  50          1HB       CYS  50   6.487   1.885  -4.880
  433    H    LEU  51           H        LEU  51   4.885  -0.177  -1.727
  434    HA   LEU  51           HA       LEU  51   6.758  -0.021   0.497
  435   1HB   LEU  51          2HB       LEU  51   3.896  -0.917   0.514
  436   2HB   LEU  51          1HB       LEU  51   5.025  -1.486   1.734
  437    HG   LEU  51           HG       LEU  51   4.435   1.377   1.171
  438   1HD1  LEU  51          1HD1      LEU  51   3.059   1.268   3.262
  439   2HD1  LEU  51          2HD1      LEU  51   3.387  -0.458   3.371
  440   3HD1  LEU  51          3HD1      LEU  51   2.421   0.173   2.037
  441   1HD2  LEU  51          1HD2      LEU  51   6.592   1.020   2.235
  442   2HD2  LEU  51          2HD2      LEU  51   5.823   0.012   3.464
  443   3HD2  LEU  51          3HD2      LEU  51   5.467   1.735   3.386
  444    H    HIS  52           H        HIS  52   7.662  -1.733   1.204
  445    HA   HIS  52           HA       HIS  52   7.934  -3.825  -0.840
  446   1HB   HIS  52          2HB       HIS  52   9.940  -2.447  -0.150
  447   2HB   HIS  52          1HB       HIS  52   9.856  -3.232   1.422
  448    HD1  HIS  52           1HD      HIS  52  11.519  -5.067   1.580
  449    HD2  HIS  52           2HD      HIS  52  10.126  -4.590  -2.296
  450    HE1  HIS  52           1HE      HIS  52  12.718  -6.783   0.223
  451    HE2  HIS  52           2HE      HIS  52  12.037  -6.319  -2.147
  452    HA   PRO  53           HA       PRO  53   5.567  -6.451   1.899
  453   1HB   PRO  53          2HB       PRO  53   5.819  -8.748   0.504
  454   2HB   PRO  53          1HB       PRO  53   4.751  -7.426   0.013
  455   1HG   PRO  53          2HG       PRO  53   7.512  -8.086  -0.961
  456   2HG   PRO  53          1HG       PRO  53   6.069  -7.650  -1.898
  457   1HD   PRO  53          2HD       PRO  53   7.981  -5.859  -1.362
  458   2HD   PRO  53          1HD       PRO  53   6.268  -5.395  -1.404
  459    H    LYS  54           H        LYS  54   8.846  -6.620   1.636
  460    HA   LYS  54           HA       LYS  54   9.221  -9.070   3.035
  461   1HB   LYS  54          2HB       LYS  54  11.048  -7.004   2.013
  462   2HB   LYS  54          1HB       LYS  54  11.633  -7.926   3.394
  463   1HG   LYS  54          2HG       LYS  54  12.331  -8.887   1.252
  464   2HG   LYS  54          1HG       LYS  54  11.345  -9.994   2.186
  465   1HD   LYS  54          2HD       LYS  54   9.388  -9.258   0.772
  466   2HD   LYS  54          1HD       LYS  54  10.544  -8.393  -0.241
  467   1HE   LYS  54          2HE       LYS  54  11.744 -10.446  -0.717
  468   2HE   LYS  54          1HE       LYS  54  10.681 -11.291   0.434
  469   1HZ   LYS  54          1HZ       LYS  54  10.073 -11.732  -1.855
  470   2HZ   LYS  54          2HZ       LYS  54   9.785 -10.103  -2.179
  471   3HZ   LYS  54          3HZ       LYS  54   8.842 -10.954  -1.066
  472    H    LEU  55           H        LEU  55   8.325  -5.977   4.006
  473    HA   LEU  55           HA       LEU  55   9.320  -6.215   6.733
  474   1HB   LEU  55          2HB       LEU  55   7.509  -4.159   5.455
  475   2HB   LEU  55          1HB       LEU  55   8.127  -4.080   7.087
  476    HG   LEU  55           HG       LEU  55   9.813  -3.940   4.584
  477   1HD1  LEU  55          1HD1      LEU  55  10.098  -1.583   5.178
  478   2HD1  LEU  55          2HD1      LEU  55   8.968  -1.788   6.518
  479   3HD1  LEU  55          3HD1      LEU  55   8.406  -1.971   4.857
  480   1HD2  LEU  55          1HD2      LEU  55  10.532  -3.549   7.494
  481   2HD2  LEU  55          2HD2      LEU  55  11.610  -3.276   6.125
  482   3HD2  LEU  55          3HD2      LEU  55  11.033  -4.900   6.477
  483    H    GLN  56           H        GLN  56   7.971  -6.560   8.517
  484    HA   GLN  56           HA       GLN  56   5.631  -8.130   8.006
  485   1HB   GLN  56          2HB       GLN  56   6.817  -7.168  10.611
  486   2HB   GLN  56          1HB       GLN  56   5.466  -8.281  10.475
  487   1HG   GLN  56          2HG       GLN  56   6.899  -9.879   9.314
  488   2HG   GLN  56          1HG       GLN  56   8.256  -8.765   9.471
  489   1HE2  GLN  56          1HE2      GLN  56   7.886 -11.447  10.495
  490   2HE2  GLN  56          2HE2      GLN  56   8.121 -11.359  12.200
  491    H    SER  57           H        SER  57   6.332  -4.873   8.937
  492    HA   SER  57           HA       SER  57   3.890  -3.963   9.924
  493   1HB   SER  57          2HB       SER  57   5.799  -2.485   8.098
  494   2HB   SER  57          1HB       SER  57   4.703  -1.778   9.286
  495    HG   SER  57           HG       SER  57   5.894  -2.818  10.910
  496    H    THR  58           H        THR  58   5.027  -4.497   6.648
  497    HA   THR  58           HA       THR  58   3.016  -3.261   5.211
  498    HB   THR  58           HB       THR  58   4.589  -5.730   4.430
  499    HG1  THR  58           1HG      THR  58   6.121  -4.118   3.652
  500   1HG2  THR  58          1HG2      THR  58   2.784  -5.055   2.887
  501   2HG2  THR  58          2HG2      THR  58   4.375  -4.781   2.173
  502   3HG2  THR  58          3HG2      THR  58   3.460  -3.428   2.828
  503    H    LYS  59           H        LYS  59   3.260  -6.603   6.533
  504    HA   LYS  59           HA       LYS  59   1.032  -7.650   5.225
  505   1HB   LYS  59          2HB       LYS  59   2.376  -8.475   7.771
  506   2HB   LYS  59          1HB       LYS  59   0.931  -9.285   7.194
  507   1HG   LYS  59          2HG       LYS  59   2.812 -10.545   6.500
  508   2HG   LYS  59          1HG       LYS  59   2.109  -9.774   5.092
  509   1HD   LYS  59          2HD       LYS  59   3.842  -8.037   5.181
  510   2HD   LYS  59          1HD       LYS  59   4.547  -8.840   6.580
  511   1HE   LYS  59          2HE       LYS  59   5.750  -9.414   4.537
  512   2HE   LYS  59          1HE       LYS  59   4.980 -10.828   5.251
  513   1HZ   LYS  59          1HZ       LYS  59   3.903  -9.248   2.979
  514   2HZ   LYS  59          2HZ       LYS  59   3.202 -10.637   3.614
  515   3HZ   LYS  59          3HZ       LYS  59   4.689 -10.721   2.835
  516    H    ARG  60           H        ARG  60   1.122  -6.134   8.486
  517    HA   ARG  60           HA       ARG  60  -1.625  -6.551   8.700
  518   1HB   ARG  60          2HB       ARG  60   0.275  -4.914  10.270
  519   2HB   ARG  60          1HB       ARG  60  -1.440  -4.602  10.420
  520   1HG   ARG  60          2HG       ARG  60  -0.994  -6.100  12.141
  521   2HG   ARG  60          1HG       ARG  60  -1.704  -7.042  10.878
  522   1HD   ARG  60          2HD       ARG  60   0.482  -7.776  10.055
  523   2HD   ARG  60          1HD       ARG  60   1.267  -6.886  11.355
  524    HE   ARG  60           HE       ARG  60  -0.694  -8.816  12.207
  525   1HH1  ARG  60          1HH1      ARG  60   2.770  -8.214  11.610
  526   2HH1  ARG  60          2HH1      ARG  60   3.248  -9.624  12.445
  527   1HH2  ARG  60          1HH2      ARG  60   0.047 -10.710  13.336
  528   2HH2  ARG  60          2HH2      ARG  60   1.715 -11.036  13.433
  529    H    PHE  61           H        PHE  61   0.234  -3.932   7.369
  530    HA   PHE  61           HA       PHE  61  -1.927  -2.154   7.256
  531   1HB   PHE  61          2HB       PHE  61   0.535  -1.664   6.816
  532   2HB   PHE  61          1HB       PHE  61   0.223  -2.358   5.219
  533    HD1  PHE  61           1HD      PHE  61  -0.594  -0.982   3.471
  534    HD2  PHE  61           2HD      PHE  61  -0.930   0.357   7.491
  535    HE1  PHE  61           1HE      PHE  61  -1.360   1.229   2.692
  536    HE2  PHE  61           2HE      PHE  61  -1.682   2.559   6.705
  537    HZ   PHE  61           HZ       PHE  61  -1.883   3.014   4.337
  538    H    ILE  62           H        ILE  62  -0.798  -4.663   5.017
  539    HA   ILE  62           HA       ILE  62  -2.705  -4.113   2.977
  540    HB   ILE  62           HB       ILE  62  -1.330  -6.748   3.539
  541   1HG1  ILE  62          2HG1      ILE  62   0.360  -5.061   3.262
  542   2HG1  ILE  62          1HG1      ILE  62   0.283  -6.012   1.784
  543   1HG2  ILE  62          1HG2      ILE  62  -3.225  -6.969   2.069
  544   2HG2  ILE  62          2HG2      ILE  62  -1.733  -7.181   1.131
  545   3HG2  ILE  62          3HG2      ILE  62  -2.634  -5.659   1.052
  546   1HD1  ILE  62          1HD1      ILE  62  -0.955  -3.329   2.229
  547   2HD1  ILE  62          2HD1      ILE  62  -1.019  -4.267   0.736
  548   3HD1  ILE  62          3HD1      ILE  62   0.533  -3.656   1.334
  549    H    LYS  63           H        LYS  63  -2.553  -6.521   5.522
  550    HA   LYS  63           HA       LYS  63  -5.069  -7.782   4.878
  551   1HB   LYS  63          2HB       LYS  63  -3.699  -7.729   7.571
  552   2HB   LYS  63          1HB       LYS  63  -4.965  -8.821   7.080
  553   1HG   LYS  63          2HG       LYS  63  -2.139  -8.775   5.990
  554   2HG   LYS  63          1HG       LYS  63  -2.768  -9.898   7.180
  555   1HD   LYS  63          2HD       LYS  63  -2.763 -11.116   5.171
  556   2HD   LYS  63          1HD       LYS  63  -4.438 -10.603   5.341
  557   1HE   LYS  63          2HE       LYS  63  -3.976  -8.753   3.729
  558   2HE   LYS  63          1HE       LYS  63  -2.326  -9.326   3.601
  559   1HZ   LYS  63          1HZ       LYS  63  -3.184 -11.439   2.736
  560   2HZ   LYS  63          2HZ       LYS  63  -3.647 -10.158   1.770
  561   3HZ   LYS  63          3HZ       LYS  63  -4.748 -10.860   2.831
  562    H    TRP  64           H        TRP  64  -4.233  -5.039   6.790
  563    HA   TRP  64           HA       TRP  64  -6.812  -4.877   8.032
  564   1HB   TRP  64          2HB       TRP  64  -4.357  -3.918   8.657
  565   2HB   TRP  64          1HB       TRP  64  -5.077  -2.502   7.914
  566    HD1  TRP  64           HD       TRP  64  -5.142  -4.633  11.006
  567    HE1  TRP  64           1HE      TRP  64  -6.673  -3.530  12.762
  568    HE3  TRP  64           3HE      TRP  64  -7.245  -0.977   8.104
  569    HZ2  TRP  64           2HZ      TRP  64  -8.509  -1.396  12.905
  570    HZ3  TRP  64           3HZ      TRP  64  -8.868   0.555   9.127
  571    HH2  TRP  64           HH       TRP  64  -9.486   0.353  11.473
  572    H    TYR  65           H        TYR  65  -5.069  -3.279   5.296
  573    HA   TYR  65           HA       TYR  65  -7.125  -1.440   4.807
  574   1HB   TYR  65          2HB       TYR  65  -4.832  -1.117   3.882
  575   2HB   TYR  65          1HB       TYR  65  -5.127  -2.450   2.768
  576    HD1  TYR  65           1HD      TYR  65  -6.007  -1.956   0.626
  577    HD2  TYR  65           2HD      TYR  65  -6.631   0.787   3.816
  578    HE1  TYR  65           1HE      TYR  65  -7.118  -0.334  -0.943
  579    HE2  TYR  65           2HE      TYR  65  -7.723   2.345   2.267
  580    HH   TYR  65           HH       TYR  65  -7.780   2.852  -0.079
  581    H    ASN  66           H        ASN  66  -6.564  -4.683   3.669
  582    HA   ASN  66           HA       ASN  66  -8.546  -4.800   1.719
  583   1HB   ASN  66          2HB       ASN  66  -7.563  -6.950   3.587
  584   2HB   ASN  66          1HB       ASN  66  -8.751  -7.291   2.346
  585   1HD2  ASN  66          1HD2      ASN  66  -6.125  -8.377   2.646
  586   2HD2  ASN  66          2HD2      ASN  66  -5.249  -7.983   1.212
  587    H    ALA  67           H        ALA  67  -8.892  -5.277   5.199
  588    HA   ALA  67           HA       ALA  67 -11.681  -5.824   5.084
  589   1HB   ALA  67          1HB       ALA  67 -10.028  -4.787   7.390
  590   2HB   ALA  67          2HB       ALA  67 -10.283  -6.482   6.991
  591   3HB   ALA  67          3HB       ALA  67 -11.642  -5.489   7.512
  592    H    TRP  68           H        TRP  68  -9.796  -2.942   5.754
  593    HA   TRP  68           HA       TRP  68 -11.869  -1.112   6.219
  594   1HB   TRP  68          2HB       TRP  68  -9.626  -0.544   6.826
  595   2HB   TRP  68          1HB       TRP  68  -9.041  -0.872   5.215
  596    HD1  TRP  68           HD       TRP  68  -9.270   1.062   3.426
  597    HE1  TRP  68           1HE      TRP  68  -9.563   3.600   3.659
  598    HE3  TRP  68           3HE      TRP  68 -10.877   1.283   8.285
  599    HZ2  TRP  68           2HZ      TRP  68 -10.367   5.435   5.566
  600    HZ3  TRP  68           3HZ      TRP  68 -11.382   3.508   9.227
  601    HH2  TRP  68           HH       TRP  68 -11.112   5.555   7.843
  602    H    ASN  69           H        ASN  69 -10.341  -2.075   3.198
  603    HA   ASN  69           HA       ASN  69 -11.694  -0.239   1.541
  604   1HB   ASN  69          2HB       ASN  69  -9.643  -1.564   0.891
  605   2HB   ASN  69          1HB       ASN  69 -10.659  -2.992   0.795
  606   1HD2  ASN  69          1HD2      ASN  69  -9.040  -1.698  -1.257
  607   2HD2  ASN  69          2HD2      ASN  69 -10.106  -1.304  -2.547
  608    H    GLU  70           H        GLU  70 -12.382  -3.616   2.448
  609    HA   GLU  70           HA       GLU  70 -14.770  -3.834   0.965
  610   1HB   GLU  70          2HB       GLU  70 -13.931  -5.310   3.461
  611   2HB   GLU  70          1HB       GLU  70 -15.289  -5.749   2.440
  612   1HG   GLU  70          2HG       GLU  70 -12.396  -5.723   1.616
  613   2HG   GLU  70          1HG       GLU  70 -13.347  -7.150   2.014
  614    H    LYS  71           H        LYS  71 -14.169  -2.618   4.230
  615    HA   LYS  71           HA       LYS  71 -16.880  -2.453   4.904
  616   1HB   LYS  71          2HB       LYS  71 -14.507  -1.023   5.950
  617   2HB   LYS  71          1HB       LYS  71 -16.134  -0.853   6.623
  618   1HG   LYS  71          2HG       LYS  71 -16.214  -3.341   6.841
  619   2HG   LYS  71          1HG       LYS  71 -14.512  -3.362   6.397
  620   1HD   LYS  71          2HD       LYS  71 -15.715  -1.810   8.508
  621   2HD   LYS  71          1HD       LYS  71 -15.014  -3.416   8.820
  622   1HE   LYS  71          2HE       LYS  71 -12.832  -2.502   7.894
  623   2HE   LYS  71          1HE       LYS  71 -13.575  -0.906   7.858
  624   1HZ   LYS  71          1HZ       LYS  71 -12.179  -1.311   9.859
  625   2HZ   LYS  71          2HZ       LYS  71 -13.227  -2.536  10.301
  626   3HZ   LYS  71          3HZ       LYS  71 -13.796  -0.964  10.242
  627    H    ARG  72           H        ARG  72 -14.746  -0.247   3.231
  628    HA   ARG  72           HA       ARG  72 -16.685   1.892   3.129
  629   1HB   ARG  72          2HB       ARG  72 -14.143   1.449   1.555
  630   2HB   ARG  72          1HB       ARG  72 -15.091   2.928   1.520
  631   1HG   ARG  72          2HG       ARG  72 -14.628   3.304   3.877
  632   2HG   ARG  72          1HG       ARG  72 -13.744   1.775   3.954
  633   1HD   ARG  72          2HD       ARG  72 -12.210   3.644   3.766
  634   2HD   ARG  72          1HD       ARG  72 -12.132   2.633   2.326
  635    HE   ARG  72           HE       ARG  72 -13.929   4.866   2.133
  636   1HH1  ARG  72          1HH1      ARG  72 -10.630   3.732   1.558
  637   2HH1  ARG  72          2HH1      ARG  72 -10.214   4.989   0.485
  638   1HH2  ARG  72          1HH2      ARG  72 -13.383   6.575   0.651
  639   2HH2  ARG  72          2HH2      ARG  72 -11.834   6.649  -0.053
  640    H    ARG  73           H        ARG  73 -15.702  -0.761   1.148
  641    HA   ARG  73           HA       ARG  73 -17.145  -0.241  -1.241
  642   1HB   ARG  73          2HB       ARG  73 -15.283  -1.855  -1.004
  643   2HB   ARG  73          1HB       ARG  73 -16.275  -2.811   0.071
  644   1HG   ARG  73          2HG       ARG  73 -17.795  -3.305  -1.774
  645   2HG   ARG  73          1HG       ARG  73 -16.766  -2.366  -2.865
  646   1HD   ARG  73          2HD       ARG  73 -14.874  -3.849  -2.340
  647   2HD   ARG  73          1HD       ARG  73 -15.910  -4.793  -1.280
  648    HE   ARG  73           HE       ARG  73 -17.092  -4.709  -3.793
  649   1HH1  ARG  73          1HH1      ARG  73 -14.231  -6.122  -2.211
  650   2HH1  ARG  73          2HH1      ARG  73 -14.058  -7.375  -3.339
  651   1HH2  ARG  73          1HH2      ARG  73 -16.871  -6.486  -5.309
  652   2HH2  ARG  73          2HH2      ARG  73 -15.608  -7.612  -5.144
  653    H    VAL  74           H        VAL  74 -17.911  -1.414   1.838
  654    HA   VAL  74           HA       VAL  74 -19.775  -1.694   2.986
  655    HB   VAL  74           HB       VAL  74 -21.290  -1.653   0.430
  656   1HG1  VAL  74          1HG1      VAL  74 -22.529  -2.899   2.127
  657   2HG1  VAL  74          2HG1      VAL  74 -23.348  -1.358   1.871
  658   3HG1  VAL  74          3HG1      VAL  74 -22.320  -1.588   3.284
  659   1HG2  VAL  74          1HG2      VAL  74 -20.989   0.527   2.502
  660   2HG2  VAL  74          2HG2      VAL  74 -22.097   0.621   1.139
  661   3HG2  VAL  74          3HG2      VAL  74 -20.355   0.541   0.856
  662    H    TYR  75           H        TYR  75 -19.568  -3.322   3.789
  663    HA   TYR  75           HA       TYR  75 -20.238  -5.944   2.668
  664   1HB   TYR  75          2HB       TYR  75 -17.822  -5.645   2.335
  665   2HB   TYR  75          1HB       TYR  75 -17.633  -5.149   4.001
  666    HD1  TYR  75           1HD      TYR  75 -18.374  -8.010   1.797
  667    HD2  TYR  75           2HD      TYR  75 -17.297  -6.738   5.689
  668    HE1  TYR  75           1HE      TYR  75 -17.806 -10.335   2.388
  669    HE2  TYR  75           2HE      TYR  75 -16.726  -9.060   6.306
  670    HH   TYR  75           HH       TYR  75 -16.420 -11.498   3.954
  671    H    GLU  76           H        GLU  76 -21.833  -6.504   4.091
  672    HA   GLU  76           HA       GLU  76 -21.410  -5.772   6.901
  673   1HB   GLU  76          2HB       GLU  76 -24.025  -5.935   5.458
  674   2HB   GLU  76          1HB       GLU  76 -23.806  -5.490   7.143
  675   1HG   GLU  76          2HG       GLU  76 -22.513  -3.535   6.455
  676   2HG   GLU  76          1HG       GLU  76 -22.773  -3.957   4.770
  677    H    GLU  77           H        GLU  77 -20.649  -7.596   7.585
  678    HA   GLU  77           HA       GLU  77 -22.431  -9.925   7.570
  679   1HB   GLU  77          2HB       GLU  77 -19.401  -9.926   7.497
  680   2HB   GLU  77          1HB       GLU  77 -20.388 -11.351   7.750
  681   1HG   GLU  77          2HG       GLU  77 -20.387  -9.637   5.276
  682   2HG   GLU  77          1HG       GLU  77 -19.563 -11.182   5.450
  Start of MODEL    4
    1    H    SER   1           H        SER   1  19.538 -10.426  -4.344
    2    HA   SER   1           HA       SER   1  17.274  -9.017  -5.228
    3   1HB   SER   1          2HB       SER   1  17.269 -10.492  -3.244
    4   2HB   SER   1          1HB       SER   1  18.352  -9.376  -2.422
    5    HG   SER   1           HG       SER   1  15.728  -9.339  -2.542
    6    H    LYS   2           H        LYS   2  17.608  -7.102  -6.131
    7    HA   LYS   2           HA       LYS   2  18.552  -4.986  -4.383
    8   1HB   LYS   2          2HB       LYS   2  19.132  -5.149  -7.367
    9   2HB   LYS   2          1HB       LYS   2  19.439  -3.752  -6.356
   10   1HG   LYS   2          2HG       LYS   2  21.046  -5.103  -5.051
   11   2HG   LYS   2          1HG       LYS   2  20.792  -6.437  -6.181
   12   1HD   LYS   2          2HD       LYS   2  21.559  -4.993  -8.024
   13   2HD   LYS   2          1HD       LYS   2  21.810  -3.688  -6.865
   14   1HE   LYS   2          2HE       LYS   2  23.235  -6.346  -6.891
   15   2HE   LYS   2          1HE       LYS   2  23.910  -4.806  -7.402
   16   1HZ   LYS   2          1HZ       LYS   2  23.660  -3.983  -5.143
   17   2HZ   LYS   2          2HZ       LYS   2  24.618  -5.360  -5.176
   18   3HZ   LYS   2          3HZ       LYS   2  23.025  -5.463  -4.634
   19    H    CYS   3           H        CYS   3  16.841  -3.767  -4.006
   20    HA   CYS   3           HA       CYS   3  15.039  -3.165  -6.170
   21   1HB   CYS   3          2HB       CYS   3  14.232  -5.313  -5.263
   22   2HB   CYS   3          1HB       CYS   3  14.100  -4.568  -3.677
   23    H    LYS   4           H        LYS   4  15.509  -1.024  -5.918
   24    HA   LYS   4           HA       LYS   4  14.748   0.152  -3.356
   25   1HB   LYS   4          2HB       LYS   4  17.083   0.626  -4.051
   26   2HB   LYS   4          1HB       LYS   4  16.470   1.293  -5.559
   27   1HG   LYS   4          2HG       LYS   4  15.305   3.053  -4.314
   28   2HG   LYS   4          1HG       LYS   4  15.923   2.392  -2.802
   29   1HD   LYS   4          2HD       LYS   4  17.261   4.292  -3.500
   30   2HD   LYS   4          1HD       LYS   4  18.217   2.813  -3.587
   31   1HE   LYS   4          2HE       LYS   4  17.839   2.707  -6.007
   32   2HE   LYS   4          1HE       LYS   4  16.857   4.172  -5.915
   33   1HZ   LYS   4          1HZ       LYS   4  18.782   5.375  -5.168
   34   2HZ   LYS   4          2HZ       LYS   4  19.122   4.617  -6.640
   35   3HZ   LYS   4          3HZ       LYS   4  19.709   3.973  -5.184
   36    H    CYS   5           H        CYS   5  12.751   0.888  -3.465
   37    HA   CYS   5           HA       CYS   5  11.891   2.018  -6.016
   38   1HB   CYS   5          2HB       CYS   5  10.744  -0.116  -5.422
   39   2HB   CYS   5          1HB       CYS   5  10.166   0.638  -3.941
   40    H    SER   6           H        SER   6  11.786   4.117  -5.882
   41    HA   SER   6           HA       SER   6  11.450   6.200  -5.247
   42   1HB   SER   6          2HB       SER   6   9.190   5.460  -4.461
   43   2HB   SER   6          1HB       SER   6   9.881   5.087  -2.889
   44    HG   SER   6           HG       SER   6   9.576   7.085  -2.403
   45    H    ARG   7           H        ARG   7  11.895   4.450  -2.198
   46    HA   ARG   7           HA       ARG   7  14.561   5.212  -1.747
   47   1HB   ARG   7          2HB       ARG   7  13.522   7.462  -1.406
   48   2HB   ARG   7          1HB       ARG   7  12.530   6.787  -0.129
   49   1HG   ARG   7          2HG       ARG   7  14.567   6.262   1.152
   50   2HG   ARG   7          1HG       ARG   7  15.536   6.994  -0.128
   51   1HD   ARG   7          2HD       ARG   7  13.448   8.388   1.544
   52   2HD   ARG   7          1HD       ARG   7  15.192   8.557   1.715
   53    HE   ARG   7           HE       ARG   7  14.567   9.199  -0.906
   54   1HH1  ARG   7          1HH1      ARG   7  13.934  10.483   2.313
   55   2HH1  ARG   7          2HH1      ARG   7  13.705  12.088   1.808
   56   1HH2  ARG   7          1HH2      ARG   7  14.287  11.384  -1.632
   57   2HH2  ARG   7          2HH2      ARG   7  13.890  12.621  -0.531
   58    H    LYS   8           H        LYS   8  11.486   4.853  -0.010
   59    HA   LYS   8           HA       LYS   8  12.180   2.283   1.019
   60   1HB   LYS   8          2HB       LYS   8  13.323   3.762   2.670
   61   2HB   LYS   8          1HB       LYS   8  11.815   4.628   2.916
   62   1HG   LYS   8          2HG       LYS   8  10.781   2.545   3.754
   63   2HG   LYS   8          1HG       LYS   8  12.330   1.730   3.565
   64   1HD   LYS   8          2HD       LYS   8  13.331   3.283   5.187
   65   2HD   LYS   8          1HD       LYS   8  11.771   4.090   5.366
   66   1HE   LYS   8          2HE       LYS   8  10.783   1.972   6.153
   67   2HE   LYS   8          1HE       LYS   8  12.356   1.200   6.001
   68   1HZ   LYS   8          1HZ       LYS   8  11.704   3.446   7.834
   69   2HZ   LYS   8          2HZ       LYS   8  13.216   2.724   7.669
   70   3HZ   LYS   8          3HZ       LYS   8  11.936   1.836   8.274
   71    H    GLY   9           H        GLY   9  10.279   1.216   1.576
   72   1HA   GLY   9          2HA       GLY   9   7.813   2.309   0.734
   73   2HA   GLY   9          1HA       GLY   9   8.048   0.830   1.649
   74    HA   PRO  10           HA       PRO  10   7.144   4.331   4.725
   75   1HB   PRO  10          2HB       PRO  10   5.539   6.265   3.865
   76   2HB   PRO  10          1HB       PRO  10   7.259   6.268   3.460
   77   1HG   PRO  10          2HG       PRO  10   4.921   5.607   1.749
   78   2HG   PRO  10          1HG       PRO  10   6.477   6.318   1.297
   79   1HD   PRO  10          2HD       PRO  10   5.707   3.584   1.061
   80   2HD   PRO  10          1HD       PRO  10   7.314   4.283   0.785
   81    H    LYS  11           H        LYS  11   5.416   4.424   6.210
   82    HA   LYS  11           HA       LYS  11   3.200   2.713   5.539
   83   1HB   LYS  11          2HB       LYS  11   4.297   2.421   7.724
   84   2HB   LYS  11          1HB       LYS  11   3.853   4.064   8.175
   85   1HG   LYS  11          2HG       LYS  11   1.480   3.465   8.037
   86   2HG   LYS  11          1HG       LYS  11   1.919   1.825   7.577
   87   1HD   LYS  11          2HD       LYS  11   2.617   3.168  10.192
   88   2HD   LYS  11          1HD       LYS  11   1.312   2.009   9.957
   89   1HE   LYS  11          2HE       LYS  11   2.979   0.306   9.298
   90   2HE   LYS  11          1HE       LYS  11   4.266   1.478   9.595
   91   1HZ   LYS  11          1HZ       LYS  11   3.981   0.021  11.507
   92   2HZ   LYS  11          2HZ       LYS  11   2.354   0.451  11.615
   93   3HZ   LYS  11          3HZ       LYS  11   3.542   1.593  11.911
   94    H    ILE  12           H        ILE  12   1.741   3.584   4.427
   95    HA   ILE  12           HA       ILE  12   0.875   6.340   4.611
   96    HB   ILE  12           HB       ILE  12  -0.213   4.034   2.951
   97   1HG1  ILE  12          2HG1      ILE  12   2.145   4.407   2.426
   98   2HG1  ILE  12          1HG1      ILE  12   1.135   4.915   1.085
   99   1HG2  ILE  12          1HG2      ILE  12  -0.540   7.014   2.580
  100   2HG2  ILE  12          2HG2      ILE  12  -1.781   5.896   3.149
  101   3HG2  ILE  12          3HG2      ILE  12  -1.160   5.765   1.506
  102   1HD1  ILE  12          1HD1      ILE  12   2.451   6.708   3.110
  103   2HD1  ILE  12          2HD1      ILE  12   1.391   7.243   1.802
  104   3HD1  ILE  12          3HD1      ILE  12   2.936   6.473   1.429
  105    H    ARG  13           H        ARG  13  -1.258   6.954   5.388
  106    HA   ARG  13           HA       ARG  13  -2.327   4.907   7.141
  107   1HB   ARG  13          2HB       ARG  13  -3.658   7.579   6.617
  108   2HB   ARG  13          1HB       ARG  13  -4.045   6.297   7.766
  109   1HG   ARG  13          2HG       ARG  13  -3.039   8.111   8.989
  110   2HG   ARG  13          1HG       ARG  13  -1.943   6.734   8.970
  111   1HD   ARG  13          2HD       ARG  13  -0.726   8.790   8.595
  112   2HD   ARG  13          1HD       ARG  13  -0.733   7.740   7.159
  113    HE   ARG  13           HE       ARG  13  -2.660   9.223   6.388
  114   1HH1  ARG  13          1HH1      ARG  13  -0.018  10.546   8.394
  115   2HH1  ARG  13          2HH1      ARG  13  -0.098  12.083   7.687
  116   1HH2  ARG  13          1HH2      ARG  13  -2.731  11.299   5.435
  117   2HH2  ARG  13          2HH2      ARG  13  -1.678  12.532   5.962
  118    H    TYR  14           H        TYR  14  -4.602   4.277   7.068
  119    HA   TYR  14           HA       TYR  14  -5.048   3.052   4.567
  120   1HB   TYR  14          2HB       TYR  14  -6.909   3.236   6.943
  121   2HB   TYR  14          1HB       TYR  14  -6.979   2.049   5.642
  122    HD1  TYR  14           1HD      TYR  14  -5.334   3.012   8.744
  123    HD2  TYR  14           2HD      TYR  14  -5.207   0.321   5.447
  124    HE1  TYR  14           1HE      TYR  14  -3.760   1.582   9.974
  125    HE2  TYR  14           2HE      TYR  14  -3.649  -1.093   6.659
  126    HH   TYR  14           HH       TYR  14  -2.041  -0.886   8.425
  127    H    SER  15           H        SER  15  -6.484   5.833   6.142
  128    HA   SER  15           HA       SER  15  -8.637   6.145   4.315
  129   1HB   SER  15          2HB       SER  15  -7.349   8.121   6.179
  130   2HB   SER  15          1HB       SER  15  -8.872   8.389   5.325
  131    HG   SER  15           HG       SER  15  -8.543   6.071   6.885
  132    H    ASP  16           H        ASP  16  -5.276   6.964   4.162
  133    HA   ASP  16           HA       ASP  16  -5.596   9.015   2.129
  134   1HB   ASP  16          2HB       ASP  16  -3.124   7.655   3.223
  135   2HB   ASP  16          1HB       ASP  16  -3.092   8.883   1.968
  136    H    VAL  17           H        VAL  17  -5.368   5.666   2.326
  137    HA   VAL  17           HA       VAL  17  -4.209   5.282  -0.288
  138    HB   VAL  17           HB       VAL  17  -5.594   3.227   1.439
  139   1HG1  VAL  17          1HG1      VAL  17  -5.400   2.514  -0.822
  140   2HG1  VAL  17          2HG1      VAL  17  -4.268   1.607   0.179
  141   3HG1  VAL  17          3HG1      VAL  17  -3.687   2.915  -0.850
  142   1HG2  VAL  17          1HG2      VAL  17  -3.364   2.542   2.200
  143   2HG2  VAL  17          2HG2      VAL  17  -3.749   4.188   2.700
  144   3HG2  VAL  17          3HG2      VAL  17  -2.658   3.915   1.346
  145    H    LYS  18           H        LYS  18  -5.304   5.275  -2.060
  146    HA   LYS  18           HA       LYS  18  -8.249   5.104  -1.959
  147   1HB   LYS  18          2HB       LYS  18  -7.046   7.020  -2.940
  148   2HB   LYS  18          1HB       LYS  18  -6.473   5.988  -4.201
  149   1HG   LYS  18          2HG       LYS  18  -8.644   5.583  -5.108
  150   2HG   LYS  18          1HG       LYS  18  -9.437   6.327  -3.722
  151   1HD   LYS  18          2HD       LYS  18  -9.490   7.769  -5.723
  152   2HD   LYS  18          1HD       LYS  18  -8.616   8.532  -4.408
  153   1HE   LYS  18          2HE       LYS  18  -6.496   7.822  -5.478
  154   2HE   LYS  18          1HE       LYS  18  -7.426   7.125  -6.802
  155   1HZ   LYS  18          1HZ       LYS  18  -7.354  10.013  -6.041
  156   2HZ   LYS  18          2HZ       LYS  18  -8.278   9.375  -7.297
  157   3HZ   LYS  18          3HZ       LYS  18  -6.595   9.333  -7.355
  158    H    LYS  19           H        LYS  19  -5.470   3.608  -2.961
  159    HA   LYS  19           HA       LYS  19  -6.874   1.198  -3.894
  160   1HB   LYS  19          2HB       LYS  19  -4.811   2.457  -5.737
  161   2HB   LYS  19          1HB       LYS  19  -5.548   0.907  -5.905
  162   1HG   LYS  19          2HG       LYS  19  -7.674   1.894  -6.394
  163   2HG   LYS  19          1HG       LYS  19  -7.016   3.515  -6.110
  164   1HD   LYS  19          2HD       LYS  19  -5.393   3.197  -7.899
  165   2HD   LYS  19          1HD       LYS  19  -5.984   1.564  -8.172
  166   1HE   LYS  19          2HE       LYS  19  -8.138   2.457  -8.858
  167   2HE   LYS  19          1HE       LYS  19  -7.572   4.092  -8.519
  168   1HZ   LYS  19          1HZ       LYS  19  -6.351   2.282 -10.538
  169   2HZ   LYS  19          2HZ       LYS  19  -5.919   3.877 -10.222
  170   3HZ   LYS  19          3HZ       LYS  19  -7.423   3.533 -10.878
  171    H    LEU  20           H        LEU  20  -5.767  -0.577  -3.647
  172    HA   LEU  20           HA       LEU  20  -2.905  -0.464  -3.056
  173   1HB   LEU  20          2HB       LEU  20  -4.282  -0.718  -0.944
  174   2HB   LEU  20          1HB       LEU  20  -4.958  -2.177  -1.610
  175    HG   LEU  20           HG       LEU  20  -2.024  -1.836  -0.907
  176   1HD1  LEU  20          1HD1      LEU  20  -2.538  -3.186   1.053
  177   2HD1  LEU  20          2HD1      LEU  20  -4.245  -3.165   0.624
  178   3HD1  LEU  20          3HD1      LEU  20  -3.429  -1.667   1.062
  179   1HD2  LEU  20          1HD2      LEU  20  -1.931  -4.283  -1.054
  180   2HD2  LEU  20          2HD2      LEU  20  -2.459  -3.600  -2.590
  181   3HD2  LEU  20          3HD2      LEU  20  -3.635  -4.335  -1.501
  182    H    GLU  21           H        GLU  21  -1.909  -1.720  -4.504
  183    HA   GLU  21           HA       GLU  21  -3.251  -4.066  -5.534
  184   1HB   GLU  21          2HB       GLU  21  -2.645  -3.261  -7.904
  185   2HB   GLU  21          1HB       GLU  21  -4.067  -2.567  -7.140
  186   1HG   GLU  21          2HG       GLU  21  -2.598  -0.603  -6.473
  187   2HG   GLU  21          1HG       GLU  21  -1.359  -1.334  -7.496
  188    H    MET  22           H        MET  22  -1.830  -5.721  -6.174
  189    HA   MET  22           HA       MET  22   0.912  -5.076  -5.464
  190   1HB   MET  22          2HB       MET  22  -0.559  -7.676  -5.286
  191   2HB   MET  22          1HB       MET  22   1.153  -7.489  -5.007
  192   1HG   MET  22          2HG       MET  22   0.700  -5.975  -3.155
  193   2HG   MET  22          1HG       MET  22  -1.031  -6.158  -3.439
  194   1HE   MET  22          1HE       MET  22   0.408  -6.684  -0.627
  195   2HE   MET  22          2HE       MET  22  -0.427  -8.150  -0.116
  196   3HE   MET  22          3HE       MET  22  -1.330  -6.845  -0.883
  197    H    LYS  23           H        LYS  23   2.179  -4.801  -7.072
  198    HA   LYS  23           HA       LYS  23   2.933  -7.051  -8.547
  199   1HB   LYS  23          2HB       LYS  23   3.068  -5.952 -10.813
  200   2HB   LYS  23          1HB       LYS  23   1.438  -6.330 -10.307
  201   1HG   LYS  23          2HG       LYS  23   2.451  -3.592  -9.801
  202   2HG   LYS  23          1HG       LYS  23   2.085  -4.049 -11.467
  203   1HD   LYS  23          2HD       LYS  23  -0.159  -4.748 -10.751
  204   2HD   LYS  23          1HD       LYS  23   0.225  -4.232  -9.109
  205   1HE   LYS  23          2HE       LYS  23   0.397  -1.970  -9.770
  206   2HE   LYS  23          1HE       LYS  23   0.359  -2.399 -11.481
  207   1HZ   LYS  23          1HZ       LYS  23  -1.768  -1.535 -10.480
  208   2HZ   LYS  23          2HZ       LYS  23  -1.899  -3.019  -9.681
  209   3HZ   LYS  23          3HZ       LYS  23  -1.873  -2.969 -11.350
  210    HA   PRO  24           HA       PRO  24   6.769  -5.230  -7.616
  211   1HB   PRO  24          2HB       PRO  24   8.285  -5.998  -9.772
  212   2HB   PRO  24          1HB       PRO  24   8.022  -7.013  -8.374
  213   1HG   PRO  24          2HG       PRO  24   6.685  -7.056 -11.040
  214   2HG   PRO  24          1HG       PRO  24   7.077  -8.415  -9.972
  215   1HD   PRO  24          2HD       PRO  24   4.566  -7.455 -10.227
  216   2HD   PRO  24          1HD       PRO  24   5.181  -8.127  -8.707
  217    H    LYS  25           H        LYS  25   7.386  -3.210  -7.851
  218    HA   LYS  25           HA       LYS  25   6.533  -1.683 -10.124
  219   1HB   LYS  25          2HB       LYS  25   6.574  -0.729  -7.889
  220   2HB   LYS  25          1HB       LYS  25   8.353  -0.815  -7.814
  221   1HG   LYS  25          2HG       LYS  25   7.708   1.419  -8.269
  222   2HG   LYS  25          1HG       LYS  25   8.257   0.751  -9.813
  223   1HD   LYS  25          2HD       LYS  25   5.882   0.171 -10.298
  224   2HD   LYS  25          1HD       LYS  25   5.425   1.042  -8.861
  225   1HE   LYS  25          2HE       LYS  25   6.349   3.114  -9.698
  226   2HE   LYS  25          1HE       LYS  25   6.939   2.292 -11.140
  227   1HZ   LYS  25          1HZ       LYS  25   4.610   1.842 -11.756
  228   2HZ   LYS  25          2HZ       LYS  25   4.935   3.476 -11.630
  229   3HZ   LYS  25          3HZ       LYS  25   4.059   2.734 -10.435
  230    H    TYR  26           H        TYR  26   9.240  -3.464  -9.192
  231    HA   TYR  26           HA       TYR  26  10.531  -2.883 -11.734
  232   1HB   TYR  26          2HB       TYR  26  11.967  -3.378  -9.054
  233   2HB   TYR  26          1HB       TYR  26  12.719  -3.425 -10.615
  234    HD1  TYR  26           1HD      TYR  26  13.305  -1.528 -11.759
  235    HD2  TYR  26           2HD      TYR  26  11.113  -1.211  -8.153
  236    HE1  TYR  26           1HE      TYR  26  13.818   0.896 -11.668
  237    HE2  TYR  26           2HE      TYR  26  11.611   1.192  -8.029
  238    HH   TYR  26           HH       TYR  26  13.364   2.698  -8.875
  239    HA   PRO  27           HA       PRO  27   9.545  -7.278 -12.001
  240   1HB   PRO  27          2HB       PRO  27  11.556  -7.215 -14.186
  241   2HB   PRO  27          1HB       PRO  27   9.883  -7.772 -14.231
  242   1HG   PRO  27          2HG       PRO  27  10.538  -5.466 -15.373
  243   2HG   PRO  27          1HG       PRO  27   9.029  -5.616 -14.463
  244   1HD   PRO  27          2HD       PRO  27  11.607  -4.335 -13.635
  245   2HD   PRO  27          1HD       PRO  27   9.933  -3.802 -13.379
  246    H    HIS  28           H        HIS  28  12.688  -5.950 -11.820
  247    HA   HIS  28           HA       HIS  28  14.054  -8.443 -11.208
  248   1HB   HIS  28          2HB       HIS  28  16.082  -7.083 -10.870
  249   2HB   HIS  28          1HB       HIS  28  15.306  -6.632 -12.378
  250    HD1  HIS  28           1HD      HIS  28  15.963  -5.401  -8.876
  251    HD2  HIS  28           2HD      HIS  28  14.537  -3.820 -12.472
  252    HE1  HIS  28           1HE      HIS  28  15.775  -2.935  -8.582
  253    HE2  HIS  28           2HE      HIS  28  15.487  -2.118 -10.915
  254    H    CYS  29           H        CYS  29  11.820  -7.271  -9.413
  255    HA   CYS  29           HA       CYS  29  13.332  -7.136  -6.883
  256   1HB   CYS  29          2HB       CYS  29  11.670  -5.200  -7.629
  257   2HB   CYS  29          1HB       CYS  29  10.471  -6.392  -7.319
  258    H    GLU  30           H        GLU  30  12.433  -8.420  -5.074
  259    HA   GLU  30           HA       GLU  30  11.226 -10.743  -6.110
  260   1HB   GLU  30          2HB       GLU  30  11.679 -11.252  -3.454
  261   2HB   GLU  30          1HB       GLU  30  12.689 -11.729  -4.812
  262   1HG   GLU  30          2HG       GLU  30  13.970 -10.818  -3.186
  263   2HG   GLU  30          1HG       GLU  30  13.911  -9.680  -4.511
  264    H    GLU  31           H        GLU  31   9.295 -11.509  -5.713
  265    HA   GLU  31           HA       GLU  31   7.144 -11.700  -5.115
  266   1HB   GLU  31          2HB       GLU  31   7.959 -11.617  -2.754
  267   2HB   GLU  31          1HB       GLU  31   7.859  -9.868  -2.791
  268   1HG   GLU  31          2HG       GLU  31   6.029 -10.912  -1.541
  269   2HG   GLU  31          1HG       GLU  31   5.450  -9.969  -2.910
  270    H    LYS  32           H        LYS  32   5.095 -10.181  -4.692
  271    HA   LYS  32           HA       LYS  32   5.256  -8.080  -6.675
  272   1HB   LYS  32          2HB       LYS  32   2.966  -9.453  -5.286
  273   2HB   LYS  32          1HB       LYS  32   2.720  -7.943  -6.159
  274   1HG   LYS  32          2HG       LYS  32   2.137  -9.972  -7.457
  275   2HG   LYS  32          1HG       LYS  32   3.372  -8.984  -8.226
  276   1HD   LYS  32          2HD       LYS  32   5.057 -10.406  -7.381
  277   2HD   LYS  32          1HD       LYS  32   3.864 -11.451  -6.593
  278   1HE   LYS  32          2HE       LYS  32   2.858 -11.938  -8.803
  279   2HE   LYS  32          1HE       LYS  32   4.064 -10.915  -9.575
  280   1HZ   LYS  32          1HZ       LYS  32   5.780 -12.457  -8.771
  281   2HZ   LYS  32          2HZ       LYS  32   4.686 -13.212  -9.773
  282   3HZ   LYS  32          3HZ       LYS  32   4.594 -13.454  -8.118
  283    H    MET  33           H        MET  33   5.483  -6.115  -6.244
  284    HA   MET  33           HA       MET  33   5.718  -5.089  -3.576
  285   1HB   MET  33          2HB       MET  33   5.600  -3.608  -6.181
  286   2HB   MET  33          1HB       MET  33   5.605  -2.779  -4.662
  287   1HG   MET  33          2HG       MET  33   7.806  -2.759  -5.695
  288   2HG   MET  33          1HG       MET  33   7.831  -3.601  -4.160
  289   1HE   MET  33          1HE       MET  33   7.181  -6.501  -4.458
  290   2HE   MET  33          2HE       MET  33   8.742  -5.953  -3.838
  291   3HE   MET  33          3HE       MET  33   8.671  -7.207  -5.077
  292    H    VAL  34           H        VAL  34   4.554  -3.542  -2.590
  293    HA   VAL  34           HA       VAL  34   1.714  -3.744  -3.117
  294    HB   VAL  34           HB       VAL  34   3.219  -2.538  -0.795
  295   1HG1  VAL  34          1HG1      VAL  34   1.007  -1.523  -1.134
  296   2HG1  VAL  34          2HG1      VAL  34   1.045  -2.491   0.340
  297   3HG1  VAL  34          3HG1      VAL  34   0.273  -3.126  -1.112
  298   1HG2  VAL  34          1HG2      VAL  34   2.483  -4.530   0.450
  299   2HG2  VAL  34          2HG2      VAL  34   3.522  -4.950  -0.913
  300   3HG2  VAL  34          3HG2      VAL  34   1.777  -5.171  -1.032
  301    H    ILE  35           H        ILE  35   1.004  -2.296  -4.493
  302    HA   ILE  35           HA       ILE  35   2.290   0.293  -4.703
  303    HB   ILE  35           HB       ILE  35   0.099  -0.986  -6.322
  304   1HG1  ILE  35          2HG1      ILE  35   2.133  -2.228  -6.570
  305   2HG1  ILE  35          1HG1      ILE  35   1.794  -1.362  -8.062
  306   1HG2  ILE  35          1HG2      ILE  35   0.561   0.774  -7.987
  307   2HG2  ILE  35          2HG2      ILE  35   1.724   1.488  -6.867
  308   3HG2  ILE  35          3HG2      ILE  35   0.010   1.435  -6.447
  309   1HD1  ILE  35          1HD1      ILE  35   3.482   0.331  -7.439
  310   2HD1  ILE  35          2HD1      ILE  35   4.180  -1.284  -7.544
  311   3HD1  ILE  35          3HD1      ILE  35   3.834  -0.575  -5.967
  312    H    ILE  36           H        ILE  36   1.504   1.832  -3.601
  313    HA   ILE  36           HA       ILE  36  -1.290   1.749  -2.698
  314    HB   ILE  36           HB       ILE  36   1.127   3.058  -1.441
  315   1HG1  ILE  36          2HG1      ILE  36   0.890   0.621  -1.152
  316   2HG1  ILE  36          1HG1      ILE  36   0.781   1.485   0.392
  317   1HG2  ILE  36          1HG2      ILE  36  -0.765   4.541  -1.149
  318   2HG2  ILE  36          2HG2      ILE  36  -0.374   3.760   0.386
  319   3HG2  ILE  36          3HG2      ILE  36  -1.747   3.198  -0.563
  320   1HD1  ILE  36          1HD1      ILE  36  -1.460   0.310  -1.243
  321   2HD1  ILE  36          2HD1      ILE  36  -1.673   1.228   0.248
  322   3HD1  ILE  36          3HD1      ILE  36  -0.818  -0.315   0.274
  323    H    THR  37           H        THR  37  -2.512   3.007  -3.792
  324    HA   THR  37           HA       THR  37  -1.447   5.400  -5.085
  325    HB   THR  37           HB       THR  37  -4.168   4.126  -5.222
  326    HG1  THR  37           1HG      THR  37  -1.978   3.132  -6.143
  327   1HG2  THR  37          1HG2      THR  37  -2.846   6.173  -7.007
  328   2HG2  THR  37          2HG2      THR  37  -4.184   6.456  -5.889
  329   3HG2  THR  37          3HG2      THR  37  -4.422   5.428  -7.300
  330    H    THR  38           H        THR  38  -1.874   7.346  -4.202
  331    HA   THR  38           HA       THR  38  -3.336   7.463  -1.727
  332    HB   THR  38           HB       THR  38  -2.663   9.880  -1.777
  333    HG1  THR  38           1HG      THR  38  -2.276   9.275  -4.307
  334   1HG2  THR  38          1HG2      THR  38  -0.243   9.362  -1.467
  335   2HG2  THR  38          2HG2      THR  38  -0.562   7.781  -2.197
  336   3HG2  THR  38          3HG2      THR  38  -1.326   8.188  -0.672
  337    H    LYS  39           H        LYS  39  -4.955   9.168  -1.334
  338    HA   LYS  39           HA       LYS  39  -7.060   8.861  -3.242
  339   1HB   LYS  39          2HB       LYS  39  -7.472   8.791  -0.844
  340   2HB   LYS  39          1HB       LYS  39  -6.948  10.455  -0.685
  341   1HG   LYS  39          2HG       LYS  39  -8.835  11.160  -2.115
  342   2HG   LYS  39          1HG       LYS  39  -9.377   9.484  -2.193
  343   1HD   LYS  39          2HD       LYS  39  -9.102  11.121   0.335
  344   2HD   LYS  39          1HD       LYS  39 -10.619  10.787  -0.494
  345   1HE   LYS  39          2HE       LYS  39 -10.303   8.389  -0.083
  346   2HE   LYS  39          1HE       LYS  39  -8.769   8.725   0.712
  347   1HZ   LYS  39          1HZ       LYS  39 -10.538   8.405   2.300
  348   2HZ   LYS  39          2HZ       LYS  39 -11.427   9.667   1.640
  349   3HZ   LYS  39          3HZ       LYS  39  -9.950   9.978   2.393
  350    H    SER  40           H        SER  40  -5.222  11.674  -2.085
  351    HA   SER  40           HA       SER  40  -5.220  12.949  -4.561
  352   1HB   SER  40          2HB       SER  40  -7.671  13.170  -4.219
  353   2HB   SER  40          1HB       SER  40  -7.372  14.040  -2.716
  354    HG   SER  40           HG       SER  40  -6.425  14.862  -5.262
  355    H    VAL  41           H        VAL  41  -5.551  13.717  -1.056
  356    HA   VAL  41           HA       VAL  41  -3.828  15.975  -1.442
  357    HB   VAL  41           HB       VAL  41  -4.979  14.990   1.187
  358   1HG1  VAL  41          1HG1      VAL  41  -3.065  16.463   1.504
  359   2HG1  VAL  41          2HG1      VAL  41  -4.553  17.282   1.984
  360   3HG1  VAL  41          3HG1      VAL  41  -3.794  17.666   0.439
  361   1HG2  VAL  41          1HG2      VAL  41  -6.760  15.523  -0.392
  362   2HG2  VAL  41          2HG2      VAL  41  -6.030  17.097  -0.701
  363   3HG2  VAL  41          3HG2      VAL  41  -6.682  16.724   0.895
  364    H    SER  42           H        SER  42  -2.304  14.360  -2.230
  365    HA   SER  42           HA       SER  42  -0.257  14.082  -0.182
  366   1HB   SER  42          2HB       SER  42   0.607  12.143  -1.486
  367   2HB   SER  42          1HB       SER  42  -1.015  11.829  -0.872
  368    HG   SER  42           HG       SER  42  -1.212  11.264  -2.922
  369    H    ARG  43           H        ARG  43   1.966  14.167  -1.469
  370    HA   ARG  43           HA       ARG  43   1.794  16.370  -3.325
  371   1HB   ARG  43          2HB       ARG  43   3.703  16.082  -1.685
  372   2HB   ARG  43          1HB       ARG  43   4.223  14.694  -2.626
  373   1HG   ARG  43          2HG       ARG  43   4.648  16.088  -4.541
  374   2HG   ARG  43          1HG       ARG  43   3.997  17.494  -3.704
  375   1HD   ARG  43          2HD       ARG  43   5.788  17.233  -2.005
  376   2HD   ARG  43          1HD       ARG  43   6.469  15.930  -2.984
  377    HE   ARG  43           HE       ARG  43   6.427  17.819  -4.781
  378   1HH1  ARG  43          1HH1      ARG  43   7.386  18.076  -1.383
  379   2HH1  ARG  43          2HH1      ARG  43   8.389  19.435  -1.626
  380   1HH2  ARG  43          1HH2      ARG  43   7.855  19.649  -5.113
  381   2HH2  ARG  43          2HH2      ARG  43   8.655  20.347  -3.767
  382    H    TYR  44           H        TYR  44   1.479  13.132  -3.410
  383    HA   TYR  44           HA       TYR  44   2.497  12.572  -6.033
  384   1HB   TYR  44          2HB       TYR  44   0.998  10.945  -3.999
  385   2HB   TYR  44          1HB       TYR  44   1.384  10.306  -5.586
  386    HD1  TYR  44           1HD      TYR  44   3.477   9.363  -5.995
  387    HD2  TYR  44           2HD      TYR  44   2.947  11.765  -2.531
  388    HE1  TYR  44           1HE      TYR  44   5.712   8.734  -5.230
  389    HE2  TYR  44           2HE      TYR  44   5.197  11.148  -1.757
  390    HH   TYR  44           HH       TYR  44   7.440   9.599  -3.775
  391    H    ARG  45           H        ARG  45  -0.630  13.218  -4.557
  392    HA   ARG  45           HA       ARG  45  -2.644  13.826  -5.453
  393   1HB   ARG  45          2HB       ARG  45  -1.000  14.313  -7.953
  394   2HB   ARG  45          1HB       ARG  45  -2.628  14.912  -7.671
  395   1HG   ARG  45          2HG       ARG  45  -1.855  16.274  -5.843
  396   2HG   ARG  45          1HG       ARG  45  -0.232  15.606  -5.995
  397   1HD   ARG  45          2HD       ARG  45  -0.096  16.541  -8.264
  398   2HD   ARG  45          1HD       ARG  45  -1.691  17.266  -8.044
  399    HE   ARG  45           HE       ARG  45  -0.455  18.260  -5.964
  400   1HH1  ARG  45          1HH1      ARG  45   0.733  17.972  -9.284
  401   2HH1  ARG  45          2HH1      ARG  45   1.758  19.324  -9.178
  402   1HH2  ARG  45          1HH2      ARG  45   0.979  20.114  -5.825
  403   2HH2  ARG  45          2HH2      ARG  45   1.896  20.541  -7.192
  404    H    GLY  46           H        GLY  46  -1.949  11.134  -5.433
  405   1HA   GLY  46          2HA       GLY  46  -3.361   9.316  -6.138
  406   2HA   GLY  46          1HA       GLY  46  -3.577  10.152  -7.668
  407    H    GLN  47           H        GLN  47  -0.415  10.479  -7.084
  408    HA   GLN  47           HA       GLN  47   0.282   8.236  -8.666
  409   1HB   GLN  47          2HB       GLN  47   2.101  10.311  -7.420
  410   2HB   GLN  47          1HB       GLN  47   2.687   8.961  -8.381
  411   1HG   GLN  47          2HG       GLN  47   1.316   9.758 -10.269
  412   2HG   GLN  47          1HG       GLN  47   0.837  11.146  -9.293
  413   1HE2  GLN  47          1HE2      GLN  47   2.260  11.005 -11.807
  414   2HE2  GLN  47          2HE2      GLN  47   3.759  11.834 -11.553
  415    H    GLU  48           H        GLU  48   2.139   6.819  -8.074
  416    HA   GLU  48           HA       GLU  48   0.947   5.198  -5.982
  417   1HB   GLU  48          2HB       GLU  48   3.137   4.637  -7.928
  418   2HB   GLU  48          1HB       GLU  48   2.283   3.469  -6.940
  419   1HG   GLU  48          2HG       GLU  48   0.309   3.737  -8.156
  420   2HG   GLU  48          1HG       GLU  48   0.891   5.200  -8.945
  421    H    HIS  49           H        HIS  49   1.881   4.585  -4.208
  422    HA   HIS  49           HA       HIS  49   4.721   5.107  -3.657
  423   1HB   HIS  49          2HB       HIS  49   2.407   4.510  -1.804
  424   2HB   HIS  49          1HB       HIS  49   4.079   4.451  -1.283
  425    HD1  HIS  49           1HD      HIS  49   5.205   6.648  -0.777
  426    HD2  HIS  49           2HD      HIS  49   1.389   7.080  -2.325
  427    HE1  HIS  49           1HE      HIS  49   4.555   9.033  -0.321
  428    HE2  HIS  49           2HE      HIS  49   2.145   9.092  -0.892
  429    H    CYS  50           H        CYS  50   5.884   3.285  -2.713
  430    HA   CYS  50           HA       CYS  50   4.581   0.759  -3.286
  431   1HB   CYS  50          2HB       CYS  50   6.827   0.026  -4.214
  432   2HB   CYS  50          1HB       CYS  50   5.862   1.106  -5.215
  433    H    LEU  51           H        LEU  51   4.711  -0.577  -1.713
  434    HA   LEU  51           HA       LEU  51   6.736  -0.161   0.361
  435   1HB   LEU  51          2HB       LEU  51   4.430   0.225   1.134
  436   2HB   LEU  51          1HB       LEU  51   3.950  -1.339   0.546
  437    HG   LEU  51           HG       LEU  51   5.230  -2.434   2.300
  438   1HD1  LEU  51          1HD1      LEU  51   6.313  -1.112   4.056
  439   2HD1  LEU  51          2HD1      LEU  51   5.985   0.365   3.148
  440   3HD1  LEU  51          3HD1      LEU  51   7.081  -0.853   2.489
  441   1HD2  LEU  51          1HD2      LEU  51   3.926  -1.663   4.207
  442   2HD2  LEU  51          2HD2      LEU  51   2.924  -1.699   2.749
  443   3HD2  LEU  51          3HD2      LEU  51   3.547  -0.169   3.356
  444    H    HIS  52           H        HIS  52   8.057  -1.821   0.845
  445    HA   HIS  52           HA       HIS  52   8.105  -4.015  -1.014
  446   1HB   HIS  52          2HB       HIS  52  10.184  -2.803  -0.228
  447   2HB   HIS  52          1HB       HIS  52   9.946  -3.517   1.359
  448    HD1  HIS  52           1HD      HIS  52  11.301  -5.612   1.723
  449    HD2  HIS  52           2HD      HIS  52  10.543  -4.929  -2.316
  450    HE1  HIS  52           1HE      HIS  52  12.435  -7.462   0.497
  451    HE2  HIS  52           2HE      HIS  52  12.092  -6.980  -1.938
  452    HA   PRO  53           HA       PRO  53   5.374  -6.468   1.500
  453   1HB   PRO  53          2HB       PRO  53   5.591  -8.776   0.107
  454   2HB   PRO  53          1HB       PRO  53   4.640  -7.389  -0.445
  455   1HG   PRO  53          2HG       PRO  53   7.402  -8.235  -1.231
  456   2HG   PRO  53          1HG       PRO  53   6.068  -7.652  -2.248
  457   1HD   PRO  53          2HD       PRO  53   8.108  -6.064  -1.526
  458   2HD   PRO  53          1HD       PRO  53   6.456  -5.440  -1.714
  459    H    LYS  54           H        LYS  54   8.640  -6.906   1.529
  460    HA   LYS  54           HA       LYS  54   8.541  -9.374   2.895
  461   1HB   LYS  54          2HB       LYS  54  10.829  -7.670   2.113
  462   2HB   LYS  54          1HB       LYS  54  11.082  -8.833   3.413
  463   1HG   LYS  54          2HG       LYS  54  11.702  -9.786   1.287
  464   2HG   LYS  54          1HG       LYS  54  10.320 -10.627   1.954
  465   1HD   LYS  54          2HD       LYS  54   8.887  -9.147   0.506
  466   2HD   LYS  54          1HD       LYS  54  10.372  -8.637  -0.289
  467   1HE   LYS  54          2HE       LYS  54   9.158 -11.367  -0.143
  468   2HE   LYS  54          1HE       LYS  54   9.462 -10.368  -1.587
  469   1HZ   LYS  54          1HZ       LYS  54  11.821 -10.604  -1.189
  470   2HZ   LYS  54          2HZ       LYS  54  11.092 -12.122  -1.440
  471   3HZ   LYS  54          3HZ       LYS  54  11.539 -11.626   0.113
  472    H    LEU  55           H        LEU  55   8.063  -6.234   3.824
  473    HA   LEU  55           HA       LEU  55   9.061  -6.442   6.531
  474   1HB   LEU  55          2HB       LEU  55   7.249  -4.406   5.231
  475   2HB   LEU  55          1HB       LEU  55   7.953  -4.263   6.826
  476    HG   LEU  55           HG       LEU  55   9.501  -4.295   4.233
  477   1HD1  LEU  55          1HD1      LEU  55   9.901  -1.926   4.721
  478   2HD1  LEU  55          2HD1      LEU  55   8.836  -2.041   6.121
  479   3HD1  LEU  55          3HD1      LEU  55   8.182  -2.262   4.499
  480   1HD2  LEU  55          1HD2      LEU  55  10.381  -3.804   7.075
  481   2HD2  LEU  55          2HD2      LEU  55  11.392  -3.645   5.638
  482   3HD2  LEU  55          3HD2      LEU  55  10.763  -5.225   6.098
  483    H    GLN  56           H        GLN  56   7.812  -6.844   8.322
  484    HA   GLN  56           HA       GLN  56   5.397  -8.268   7.844
  485   1HB   GLN  56          2HB       GLN  56   6.662  -7.505  10.472
  486   2HB   GLN  56          1HB       GLN  56   5.316  -8.624  10.270
  487   1HG   GLN  56          2HG       GLN  56   8.107  -8.972   9.207
  488   2HG   GLN  56          1HG       GLN  56   7.365  -9.846  10.545
  489   1HE2  GLN  56          1HE2      GLN  56   8.497 -10.773   8.039
  490   2HE2  GLN  56          2HE2      GLN  56   7.295 -11.753   7.289
  491    H    SER  57           H        SER  57   6.223  -5.083   8.814
  492    HA   SER  57           HA       SER  57   3.815  -4.141   9.824
  493   1HB   SER  57          2HB       SER  57   5.714  -2.692   7.963
  494   2HB   SER  57          1HB       SER  57   4.638  -1.967   9.157
  495    HG   SER  57           HG       SER  57   5.984  -3.550  10.602
  496    H    THR  58           H        THR  58   4.916  -4.804   6.519
  497    HA   THR  58           HA       THR  58   2.888  -3.551   5.098
  498    HB   THR  58           HB       THR  58   4.464  -6.011   4.293
  499    HG1  THR  58           1HG      THR  58   5.831  -4.194   3.344
  500   1HG2  THR  58          1HG2      THR  58   2.608  -5.398   2.777
  501   2HG2  THR  58          2HG2      THR  58   4.167  -5.070   2.020
  502   3HG2  THR  58          3HG2      THR  58   3.233  -3.750   2.703
  503    H    LYS  59           H        LYS  59   3.257  -6.954   6.217
  504    HA   LYS  59           HA       LYS  59   0.866  -7.931   5.106
  505   1HB   LYS  59          2HB       LYS  59   2.345  -8.877   7.549
  506   2HB   LYS  59          1HB       LYS  59   0.890  -9.660   6.963
  507   1HG   LYS  59          2HG       LYS  59   2.683 -10.929   6.168
  508   2HG   LYS  59          1HG       LYS  59   2.096 -10.024   4.795
  509   1HD   LYS  59          2HD       LYS  59   3.922  -8.416   5.037
  510   2HD   LYS  59          1HD       LYS  59   4.492  -9.288   6.462
  511   1HE   LYS  59          2HE       LYS  59   4.337 -10.418   3.670
  512   2HE   LYS  59          1HE       LYS  59   5.802  -9.845   4.454
  513   1HZ   LYS  59          1HZ       LYS  59   5.648 -12.221   4.586
  514   2HZ   LYS  59          2HZ       LYS  59   4.128 -12.156   5.257
  515   3HZ   LYS  59          3HZ       LYS  59   5.452 -11.629   6.162
  516    H    ARG  60           H        ARG  60   1.415  -6.306   8.190
  517    HA   ARG  60           HA       ARG  60  -1.165  -6.720   9.235
  518   1HB   ARG  60          2HB       ARG  60   1.111  -5.646  10.257
  519   2HB   ARG  60          1HB       ARG  60   0.246  -4.195   9.736
  520   1HG   ARG  60          2HG       ARG  60  -0.163  -4.610  12.035
  521   2HG   ARG  60          1HG       ARG  60  -1.644  -4.804  11.069
  522   1HD   ARG  60          2HD       ARG  60  -1.411  -7.208  11.114
  523   2HD   ARG  60          1HD       ARG  60   0.152  -7.049  11.919
  524    HE   ARG  60           HE       ARG  60  -2.061  -5.920  13.346
  525   1HH1  ARG  60          1HH1      ARG  60  -0.237  -8.867  12.672
  526   2HH1  ARG  60          2HH1      ARG  60  -0.581  -9.611  14.152
  527   1HH2  ARG  60          1HH2      ARG  60  -2.530  -6.927  15.424
  528   2HH2  ARG  60          2HH2      ARG  60  -1.891  -8.457  15.781
  529    H    PHE  61           H        PHE  61   0.352  -4.110   7.432
  530    HA   PHE  61           HA       PHE  61  -1.768  -2.297   7.305
  531   1HB   PHE  61          2HB       PHE  61   0.659  -1.897   6.764
  532   2HB   PHE  61          1HB       PHE  61   0.359  -2.791   5.281
  533    HD1  PHE  61           1HD      PHE  61   0.239  -1.440   3.386
  534    HD2  PHE  61           2HD      PHE  61  -1.288   0.072   7.065
  535    HE1  PHE  61           1HE      PHE  61  -0.359   0.685   2.278
  536    HE2  PHE  61           2HE      PHE  61  -1.886   2.198   5.949
  537    HZ   PHE  61           HZ       PHE  61  -1.410   2.513   3.603
  538    H    ILE  62           H        ILE  62  -0.829  -4.896   5.089
  539    HA   ILE  62           HA       ILE  62  -2.797  -4.344   3.126
  540    HB   ILE  62           HB       ILE  62  -1.568  -7.047   3.707
  541   1HG1  ILE  62          2HG1      ILE  62   0.236  -5.488   3.366
  542   2HG1  ILE  62          1HG1      ILE  62   0.053  -6.450   1.904
  543   1HG2  ILE  62          1HG2      ILE  62  -3.525  -7.111   2.274
  544   2HG2  ILE  62          2HG2      ILE  62  -2.068  -7.511   1.352
  545   3HG2  ILE  62          3HG2      ILE  62  -2.800  -5.908   1.204
  546   1HD1  ILE  62          1HD1      ILE  62  -0.979  -3.679   2.343
  547   2HD1  ILE  62          2HD1      ILE  62  -1.124  -4.626   0.852
  548   3HD1  ILE  62          3HD1      ILE  62   0.469  -4.110   1.428
  549    H    LYS  63           H        LYS  63  -2.655  -6.737   5.701
  550    HA   LYS  63           HA       LYS  63  -5.271  -7.762   5.220
  551   1HB   LYS  63          2HB       LYS  63  -3.408  -7.991   7.554
  552   2HB   LYS  63          1HB       LYS  63  -5.072  -8.464   7.766
  553   1HG   LYS  63          2HG       LYS  63  -3.663 -10.411   7.346
  554   2HG   LYS  63          1HG       LYS  63  -4.820 -10.202   6.055
  555   1HD   LYS  63          2HD       LYS  63  -1.956  -9.259   5.827
  556   2HD   LYS  63          1HD       LYS  63  -2.420 -10.911   5.454
  557   1HE   LYS  63          2HE       LYS  63  -3.505  -8.425   4.117
  558   2HE   LYS  63          1HE       LYS  63  -2.273  -9.490   3.447
  559   1HZ   LYS  63          1HZ       LYS  63  -5.102 -10.235   4.023
  560   2HZ   LYS  63          2HZ       LYS  63  -3.936 -11.285   3.416
  561   3HZ   LYS  63          3HZ       LYS  63  -4.447  -9.960   2.523
  562    H    TRP  64           H        TRP  64  -4.144  -5.087   7.031
  563    HA   TRP  64           HA       TRP  64  -6.534  -4.599   8.512
  564   1HB   TRP  64          2HB       TRP  64  -3.982  -3.709   8.644
  565   2HB   TRP  64          1HB       TRP  64  -4.719  -2.388   7.756
  566    HD1  TRP  64           HD       TRP  64  -4.084  -3.628  11.117
  567    HE1  TRP  64           1HE      TRP  64  -5.371  -2.233  12.891
  568    HE3  TRP  64           3HE      TRP  64  -7.241  -1.078   8.019
  569    HZ2  TRP  64           2HZ      TRP  64  -7.429  -0.307  12.939
  570    HZ3  TRP  64           3HZ      TRP  64  -8.833   0.527   9.001
  571    HH2  TRP  64           HH       TRP  64  -8.923   0.903  11.399
  572    H    TYR  65           H        TYR  65  -5.074  -3.329   5.460
  573    HA   TYR  65           HA       TYR  65  -7.152  -1.570   4.841
  574   1HB   TYR  65          2HB       TYR  65  -4.978  -1.362   3.753
  575   2HB   TYR  65          1HB       TYR  65  -5.170  -2.937   2.984
  576    HD1  TYR  65           1HD      TYR  65  -6.662  -3.162   1.015
  577    HD2  TYR  65           2HD      TYR  65  -6.127   0.621   2.906
  578    HE1  TYR  65           1HE      TYR  65  -7.655  -2.016  -0.954
  579    HE2  TYR  65           2HE      TYR  65  -7.130   1.730   0.900
  580    HH   TYR  65           HH       TYR  65  -8.778   0.027  -1.473
  581    H    ASN  66           H        ASN  66  -6.689  -4.973   4.208
  582    HA   ASN  66           HA       ASN  66  -8.728  -5.445   2.370
  583   1HB   ASN  66          2HB       ASN  66  -7.826  -7.244   4.628
  584   2HB   ASN  66          1HB       ASN  66  -8.903  -7.755   3.342
  585   1HD2  ASN  66          1HD2      ASN  66  -7.447  -6.235   1.261
  586   2HD2  ASN  66          2HD2      ASN  66  -5.986  -7.093   1.023
  587    H    ALA  67           H        ALA  67  -9.006  -5.063   5.854
  588    HA   ALA  67           HA       ALA  67 -11.824  -5.632   5.881
  589   1HB   ALA  67          1HB       ALA  67 -10.103  -4.236   7.941
  590   2HB   ALA  67          2HB       ALA  67 -10.449  -5.963   7.886
  591   3HB   ALA  67          3HB       ALA  67 -11.751  -4.813   8.195
  592    H    TRP  68           H        TRP  68  -9.861  -2.743   6.130
  593    HA   TRP  68           HA       TRP  68 -11.822  -0.783   6.254
  594   1HB   TRP  68          2HB       TRP  68  -9.621  -0.173   6.794
  595   2HB   TRP  68          1HB       TRP  68  -8.983  -0.835   5.303
  596    HD1  TRP  68           HD       TRP  68  -8.301   0.901   3.612
  597    HE1  TRP  68           1HE      TRP  68  -8.828   3.360   3.149
  598    HE3  TRP  68           3HE      TRP  68 -11.948   1.639   7.133
  599    HZ2  TRP  68           2HZ      TRP  68 -10.558   5.332   4.088
  600    HZ3  TRP  68           3HZ      TRP  68 -12.993   3.869   7.262
  601    HH2  TRP  68           HH       TRP  68 -12.280   5.680   5.740
  602    H    ASN  69           H        ASN  69 -10.366  -2.258   3.429
  603    HA   ASN  69           HA       ASN  69 -11.418  -0.614   1.424
  604   1HB   ASN  69          2HB       ASN  69  -9.628  -2.289   1.060
  605   2HB   ASN  69          1HB       ASN  69 -10.799  -3.578   1.294
  606   1HD2  ASN  69          1HD2      ASN  69 -12.290  -4.046  -0.370
  607   2HD2  ASN  69          2HD2      ASN  69 -12.091  -3.380  -1.945
  608    H    GLU  70           H        GLU  70 -12.790  -3.329   3.136
  609    HA   GLU  70           HA       GLU  70 -15.057  -3.556   1.419
  610   1HB   GLU  70          2HB       GLU  70 -14.711  -4.579   4.236
  611   2HB   GLU  70          1HB       GLU  70 -15.928  -5.102   3.075
  612   1HG   GLU  70          2HG       GLU  70 -12.957  -5.521   2.909
  613   2HG   GLU  70          1HG       GLU  70 -14.202  -6.737   3.183
  614    H    LYS  71           H        LYS  71 -14.351  -2.061   4.507
  615    HA   LYS  71           HA       LYS  71 -16.957  -1.270   5.262
  616   1HB   LYS  71          2HB       LYS  71 -14.380   0.185   5.847
  617   2HB   LYS  71          1HB       LYS  71 -15.877   0.306   6.742
  618   1HG   LYS  71          2HG       LYS  71 -14.175  -2.190   6.585
  619   2HG   LYS  71          1HG       LYS  71 -14.062  -0.997   7.861
  620   1HD   LYS  71          2HD       LYS  71 -15.329  -2.813   8.701
  621   2HD   LYS  71          1HD       LYS  71 -16.473  -1.515   8.414
  622   1HE   LYS  71          2HE       LYS  71 -17.234  -2.665   6.354
  623   2HE   LYS  71          1HE       LYS  71 -16.009  -3.915   6.609
  624   1HZ   LYS  71          1HZ       LYS  71 -17.164  -4.541   8.629
  625   2HZ   LYS  71          2HZ       LYS  71 -18.225  -4.571   7.327
  626   3HZ   LYS  71          3HZ       LYS  71 -18.285  -3.306   8.413
  627    H    ARG  72           H        ARG  72 -14.650   0.188   3.143
  628    HA   ARG  72           HA       ARG  72 -16.233   2.586   2.900
  629   1HB   ARG  72          2HB       ARG  72 -14.433   3.322   1.319
  630   2HB   ARG  72          1HB       ARG  72 -13.909   2.968   2.961
  631   1HG   ARG  72          2HG       ARG  72 -13.069   0.836   2.252
  632   2HG   ARG  72          1HG       ARG  72 -13.626   1.122   0.608
  633   1HD   ARG  72          2HD       ARG  72 -11.689   2.842   2.105
  634   2HD   ARG  72          1HD       ARG  72 -11.204   1.578   0.961
  635    HE   ARG  72           HE       ARG  72 -12.987   3.318  -0.301
  636   1HH1  ARG  72          1HH1      ARG  72  -9.728   3.270   0.963
  637   2HH1  ARG  72          2HH1      ARG  72  -9.085   4.492   0.005
  638   1HH2  ARG  72          1HH2      ARG  72 -12.221   5.012  -1.706
  639   2HH2  ARG  72          2HH2      ARG  72 -10.604   5.543  -1.630
  640    H    ARG  73           H        ARG  73 -16.184  -0.423   1.274
  641    HA   ARG  73           HA       ARG  73 -17.486   0.904  -0.985
  642   1HB   ARG  73          2HB       ARG  73 -17.122  -1.084  -2.386
  643   2HB   ARG  73          1HB       ARG  73 -15.625  -0.384  -1.821
  644   1HG   ARG  73          2HG       ARG  73 -15.394  -2.158  -0.184
  645   2HG   ARG  73          1HG       ARG  73 -16.945  -2.842  -0.694
  646   1HD   ARG  73          2HD       ARG  73 -16.075  -3.199  -2.934
  647   2HD   ARG  73          1HD       ARG  73 -14.547  -2.455  -2.479
  648    HE   ARG  73           HE       ARG  73 -14.611  -4.448  -0.744
  649   1HH1  ARG  73          1HH1      ARG  73 -15.467  -4.557  -4.187
  650   2HH1  ARG  73          2HH1      ARG  73 -14.982  -6.176  -4.360
  651   1HH2  ARG  73          1HH2      ARG  73 -13.955  -6.563  -1.009
  652   2HH2  ARG  73          2HH2      ARG  73 -14.080  -7.385  -2.508
  653    H    VAL  74           H        VAL  74 -18.158  -1.130   1.645
  654    HA   VAL  74           HA       VAL  74 -20.715  -1.732   0.398
  655    HB   VAL  74           HB       VAL  74 -19.467  -3.603   1.502
  656   1HG1  VAL  74          1HG1      VAL  74 -20.153  -2.203   4.068
  657   2HG1  VAL  74          2HG1      VAL  74 -18.535  -2.503   3.425
  658   3HG1  VAL  74          3HG1      VAL  74 -19.545  -3.852   3.947
  659   1HG2  VAL  74          1HG2      VAL  74 -21.812  -3.845   1.086
  660   2HG2  VAL  74          2HG2      VAL  74 -22.204  -3.012   2.587
  661   3HG2  VAL  74          3HG2      VAL  74 -21.427  -4.595   2.637
  662    H    TYR  75           H        TYR  75 -22.604  -1.085   1.309
  663    HA   TYR  75           HA       TYR  75 -22.291   1.388   2.832
  664   1HB   TYR  75          2HB       TYR  75 -23.479   1.354   0.614
  665   2HB   TYR  75          1HB       TYR  75 -24.740   0.386   1.363
  666    HD1  TYR  75           1HD      TYR  75 -22.958   3.609   1.700
  667    HD2  TYR  75           2HD      TYR  75 -26.554   1.468   2.339
  668    HE1  TYR  75           1HE      TYR  75 -24.052   5.695   2.372
  669    HE2  TYR  75           2HE      TYR  75 -27.679   3.540   3.018
  670    HH   TYR  75           HH       TYR  75 -27.118   5.724   3.874
  671    H    GLU  76           H        GLU  76 -22.751  -1.682   3.543
  672    HA   GLU  76           HA       GLU  76 -24.883  -1.464   5.470
  673   1HB   GLU  76          2HB       GLU  76 -22.848  -3.671   5.108
  674   2HB   GLU  76          1HB       GLU  76 -24.321  -3.760   6.057
  675   1HG   GLU  76          2HG       GLU  76 -24.139  -3.490   3.061
  676   2HG   GLU  76          1HG       GLU  76 -24.583  -4.930   3.972
  677    H    GLU  77           H        GLU  77 -24.192  -2.306   7.836
  678    HA   GLU  77           HA       GLU  77 -21.676  -1.036   8.548
  679   1HB   GLU  77          2HB       GLU  77 -23.417   0.681   8.745
  680   2HB   GLU  77          1HB       GLU  77 -24.340  -0.372   9.803
  681   1HG   GLU  77          2HG       GLU  77 -22.552  -0.277  11.459
  682   2HG   GLU  77          1HG       GLU  77 -21.623   0.774  10.394
  Start of MODEL    5
    1    H    SER   1           H        SER   1  18.280 -10.162  -2.647
    2    HA   SER   1           HA       SER   1  18.685  -8.197  -4.697
    3   1HB   SER   1          2HB       SER   1  17.331  -9.828  -5.874
    4   2HB   SER   1          1HB       SER   1  16.131  -9.806  -4.586
    5    HG   SER   1           HG       SER   1  15.486  -8.529  -6.277
    6    H    LYS   2           H        LYS   2  18.682  -6.427  -3.538
    7    HA   LYS   2           HA       LYS   2  16.459  -6.006  -1.693
    8   1HB   LYS   2          2HB       LYS   2  19.119  -4.533  -1.830
    9   2HB   LYS   2          1HB       LYS   2  17.800  -4.186  -0.714
   10   1HG   LYS   2          2HG       LYS   2  18.092  -6.356   0.344
   11   2HG   LYS   2          1HG       LYS   2  19.341  -6.769  -0.822
   12   1HD   LYS   2          2HD       LYS   2  20.421  -6.172   1.235
   13   2HD   LYS   2          1HD       LYS   2  20.722  -4.885   0.087
   14   1HE   LYS   2          2HE       LYS   2  18.601  -4.798   2.254
   15   2HE   LYS   2          1HE       LYS   2  20.208  -4.125   2.427
   16   1HZ   LYS   2          1HZ       LYS   2  18.105  -3.177   0.516
   17   2HZ   LYS   2          2HZ       LYS   2  19.675  -2.598   0.578
   18   3HZ   LYS   2          3HZ       LYS   2  18.677  -2.406   1.888
   19    H    CYS   3           H        CYS   3  15.126  -5.627  -3.384
   20    HA   CYS   3           HA       CYS   3  15.766  -3.796  -5.479
   21   1HB   CYS   3          2HB       CYS   3  14.273  -5.780  -5.680
   22   2HB   CYS   3          1HB       CYS   3  13.049  -4.912  -4.752
   23    H    LYS   4           H        LYS   4  15.658  -1.657  -5.357
   24    HA   LYS   4           HA       LYS   4  14.156  -0.580  -3.135
   25   1HB   LYS   4          2HB       LYS   4  16.240   0.772  -4.823
   26   2HB   LYS   4          1HB       LYS   4  15.422   1.480  -3.437
   27   1HG   LYS   4          2HG       LYS   4  16.401  -0.316  -2.026
   28   2HG   LYS   4          1HG       LYS   4  17.333  -0.846  -3.430
   29   1HD   LYS   4          2HD       LYS   4  17.462   1.861  -2.096
   30   2HD   LYS   4          1HD       LYS   4  18.681   0.588  -1.999
   31   1HE   LYS   4          2HE       LYS   4  19.065   0.785  -4.403
   32   2HE   LYS   4          1HE       LYS   4  17.828   2.035  -4.502
   33   1HZ   LYS   4          1HZ       LYS   4  20.393   2.214  -3.016
   34   2HZ   LYS   4          2HZ       LYS   4  19.186   3.375  -2.959
   35   3HZ   LYS   4          3HZ       LYS   4  19.976   3.059  -4.417
   36    H    CYS   5           H        CYS   5  12.219  -0.812  -4.080
   37    HA   CYS   5           HA       CYS   5  11.487   0.991  -6.267
   38   1HB   CYS   5          2HB       CYS   5  10.452  -1.303  -5.923
   39   2HB   CYS   5          1HB       CYS   5   9.799  -0.708  -4.404
   40    H    SER   6           H        SER   6  11.995   0.771  -3.036
   41    HA   SER   6           HA       SER   6  12.005   3.329  -2.267
   42   1HB   SER   6          2HB       SER   6   9.422   3.005  -2.318
   43   2HB   SER   6          1HB       SER   6   9.653   1.739  -1.116
   44    HG   SER   6           HG       SER   6   9.838   4.482  -0.917
   45    H    ARG   7           H        ARG   7  12.844   3.087   0.052
   46    HA   ARG   7           HA       ARG   7  14.330   0.690   0.255
   47   1HB   ARG   7          2HB       ARG   7  15.127   2.793   1.232
   48   2HB   ARG   7          1HB       ARG   7  13.799   2.778   2.380
   49   1HG   ARG   7          2HG       ARG   7  14.686   0.809   3.440
   50   2HG   ARG   7          1HG       ARG   7  15.965   0.693   2.232
   51   1HD   ARG   7          2HD       ARG   7  16.847   2.830   2.946
   52   2HD   ARG   7          1HD       ARG   7  15.565   2.987   4.145
   53    HE   ARG   7           HE       ARG   7  16.843   0.579   4.597
   54   1HH1  ARG   7          1HH1      ARG   7  17.720   4.023   4.693
   55   2HH1  ARG   7          2HH1      ARG   7  18.863   3.820   5.936
   56   1HH2  ARG   7          1HH2      ARG   7  18.449   0.343   6.309
   57   2HH2  ARG   7          2HH2      ARG   7  19.270   1.729   6.858
   58    H    LYS   8           H        LYS   8  11.552   1.863   1.957
   59    HA   LYS   8           HA       LYS   8  10.714  -0.903   2.459
   60   1HB   LYS   8          2HB       LYS   8  10.483   1.370   4.452
   61   2HB   LYS   8          1HB       LYS   8   9.749  -0.211   4.634
   62   1HG   LYS   8          2HG       LYS   8  12.017  -1.200   4.712
   63   2HG   LYS   8          1HG       LYS   8  12.688   0.435   4.630
   64   1HD   LYS   8          2HD       LYS   8  11.500   1.041   6.679
   65   2HD   LYS   8          1HD       LYS   8  10.808  -0.577   6.759
   66   1HE   LYS   8          2HE       LYS   8  13.057  -1.514   6.976
   67   2HE   LYS   8          1HE       LYS   8  13.736   0.117   6.923
   68   1HZ   LYS   8          1HZ       LYS   8  12.458   0.621   8.945
   69   2HZ   LYS   8          2HZ       LYS   8  13.543  -0.635   9.182
   70   3HZ   LYS   8          3HZ       LYS   8  11.907  -0.971   8.994
   71    H    GLY   9           H        GLY   9   9.808   2.483   2.703
   72   1HA   GLY   9          2HA       GLY   9   8.043   3.249   1.113
   73   2HA   GLY   9          1HA       GLY   9   7.125   1.875   1.700
   74    HA   PRO  10           HA       PRO  10   7.623   5.609   4.984
   75   1HB   PRO  10          2HB       PRO  10   5.735   7.112   3.223
   76   2HB   PRO  10          1HB       PRO  10   7.024   7.727   4.269
   77   1HG   PRO  10          2HG       PRO  10   7.398   7.632   1.660
   78   2HG   PRO  10          1HG       PRO  10   8.699   7.150   2.767
   79   1HD   PRO  10          2HD       PRO  10   6.853   5.450   1.155
   80   2HD   PRO  10          1HD       PRO  10   8.593   5.228   1.463
   81    H    LYS  11           H        LYS  11   5.976   6.030   6.507
   82    HA   LYS  11           HA       LYS  11   3.955   4.050   6.491
   83   1HB   LYS  11          2HB       LYS  11   5.010   4.684   8.600
   84   2HB   LYS  11          1HB       LYS  11   4.372   6.319   8.446
   85   1HG   LYS  11          2HG       LYS  11   3.064   4.992  10.036
   86   2HG   LYS  11          1HG       LYS  11   2.095   5.475   8.642
   87   1HD   LYS  11          2HD       LYS  11   2.464   3.241   7.647
   88   2HD   LYS  11          1HD       LYS  11   3.371   2.769   9.089
   89   1HE   LYS  11          2HE       LYS  11   0.480   3.619   9.005
   90   2HE   LYS  11          1HE       LYS  11   1.054   1.962   9.117
   91   1HZ   LYS  11          1HZ       LYS  11   2.035   2.472  11.255
   92   2HZ   LYS  11          2HZ       LYS  11   0.416   2.840  11.258
   93   3HZ   LYS  11          3HZ       LYS  11   1.529   4.086  11.147
   94    H    ILE  12           H        ILE  12   2.285   4.130   5.382
   95    HA   ILE  12           HA       ILE  12   0.885   6.616   4.689
   96    HB   ILE  12           HB       ILE  12   0.384   3.814   3.681
   97   1HG1  ILE  12          2HG1      ILE  12   2.170   5.901   2.430
   98   2HG1  ILE  12          1HG1      ILE  12   2.746   4.472   3.278
   99   1HG2  ILE  12          1HG2      ILE  12  -0.218   6.555   2.538
  100   2HG2  ILE  12          2HG2      ILE  12  -1.388   5.467   3.282
  101   3HG2  ILE  12          3HG2      ILE  12  -0.612   5.017   1.768
  102   1HD1  ILE  12          1HD1      ILE  12   2.815   4.161   0.902
  103   2HD1  ILE  12          2HD1      ILE  12   1.094   4.542   0.797
  104   3HD1  ILE  12          3HD1      ILE  12   1.621   3.071   1.621
  105    H    ARG  13           H        ARG  13  -1.291   6.833   5.236
  106    HA   ARG  13           HA       ARG  13  -2.202   4.996   7.311
  107   1HB   ARG  13          2HB       ARG  13  -3.411   7.540   6.284
  108   2HB   ARG  13          1HB       ARG  13  -3.908   6.599   7.690
  109   1HG   ARG  13          2HG       ARG  13  -1.919   7.165   8.878
  110   2HG   ARG  13          1HG       ARG  13  -1.212   7.913   7.443
  111   1HD   ARG  13          2HD       ARG  13  -3.658   8.856   8.932
  112   2HD   ARG  13          1HD       ARG  13  -2.063   9.616   8.952
  113    HE   ARG  13           HE       ARG  13  -2.892   9.380   6.295
  114   1HH1  ARG  13          1HH1      ARG  13  -3.733  11.263   9.185
  115   2HH1  ARG  13          2HH1      ARG  13  -4.391  12.551   8.283
  116   1HH2  ARG  13          1HH2      ARG  13  -3.798  11.133   5.112
  117   2HH2  ARG  13          2HH2      ARG  13  -4.420  12.496   5.938
  118    H    TYR  14           H        TYR  14  -4.422   4.207   7.089
  119    HA   TYR  14           HA       TYR  14  -4.808   2.988   4.543
  120   1HB   TYR  14          2HB       TYR  14  -6.733   3.117   6.879
  121   2HB   TYR  14          1HB       TYR  14  -6.740   1.940   5.569
  122    HD1  TYR  14           1HD      TYR  14  -5.327   2.832   8.773
  123    HD2  TYR  14           2HD      TYR  14  -4.866   0.293   5.399
  124    HE1  TYR  14           1HE      TYR  14  -3.824   1.393  10.074
  125    HE2  TYR  14           2HE      TYR  14  -3.380  -1.145   6.671
  126    HH   TYR  14           HH       TYR  14  -1.894  -0.991   8.630
  127    H    SER  15           H        SER  15  -6.039   5.736   6.173
  128    HA   SER  15           HA       SER  15  -8.347   6.310   4.714
  129   1HB   SER  15          2HB       SER  15  -6.440   8.208   6.056
  130   2HB   SER  15          1HB       SER  15  -8.161   8.465   5.750
  131    HG   SER  15           HG       SER  15  -8.550   7.485   7.527
  132    H    ASP  16           H        ASP  16  -4.929   6.758   4.018
  133    HA   ASP  16           HA       ASP  16  -5.328   8.867   2.063
  134   1HB   ASP  16          2HB       ASP  16  -2.804   7.328   2.776
  135   2HB   ASP  16          1HB       ASP  16  -2.880   8.661   1.652
  136    H    VAL  17           H        VAL  17  -5.390   5.500   2.115
  137    HA   VAL  17           HA       VAL  17  -4.283   5.201  -0.553
  138    HB   VAL  17           HB       VAL  17  -5.504   3.047   1.142
  139   1HG1  VAL  17          1HG1      VAL  17  -5.336   2.354  -1.079
  140   2HG1  VAL  17          2HG1      VAL  17  -4.050   1.556  -0.190
  141   3HG1  VAL  17          3HG1      VAL  17  -3.699   2.942  -1.249
  142   1HG2  VAL  17          1HG2      VAL  17  -3.214   2.483   1.866
  143   2HG2  VAL  17          2HG2      VAL  17  -3.727   4.072   2.433
  144   3HG2  VAL  17          3HG2      VAL  17  -2.622   3.941   1.066
  145    H    LYS  18           H        LYS  18  -5.438   5.360  -2.255
  146    HA   LYS  18           HA       LYS  18  -8.357   5.090  -2.317
  147   1HB   LYS  18          2HB       LYS  18  -6.285   5.751  -4.369
  148   2HB   LYS  18          1HB       LYS  18  -7.964   5.525  -4.792
  149   1HG   LYS  18          2HG       LYS  18  -6.914   7.567  -2.847
  150   2HG   LYS  18          1HG       LYS  18  -7.269   7.884  -4.549
  151   1HD   LYS  18          2HD       LYS  18  -9.285   6.965  -2.479
  152   2HD   LYS  18          1HD       LYS  18  -9.100   8.614  -3.070
  153   1HE   LYS  18          2HE       LYS  18  -9.624   7.851  -5.343
  154   2HE   LYS  18          1HE       LYS  18  -9.856   6.214  -4.729
  155   1HZ   LYS  18          1HZ       LYS  18 -11.440   8.596  -3.961
  156   2HZ   LYS  18          2HZ       LYS  18 -11.665   7.028  -3.364
  157   3HZ   LYS  18          3HZ       LYS  18 -11.934   7.372  -4.989
  158    H    LYS  19           H        LYS  19  -5.512   3.340  -3.249
  159    HA   LYS  19           HA       LYS  19  -7.011   1.037  -4.056
  160   1HB   LYS  19          2HB       LYS  19  -7.065   2.398  -6.066
  161   2HB   LYS  19          1HB       LYS  19  -5.324   2.602  -6.008
  162   1HG   LYS  19          2HG       LYS  19  -5.066   0.183  -6.287
  163   2HG   LYS  19          1HG       LYS  19  -6.823   0.064  -6.414
  164   1HD   LYS  19          2HD       LYS  19  -5.048   1.675  -8.245
  165   2HD   LYS  19          1HD       LYS  19  -5.681   0.078  -8.636
  166   1HE   LYS  19          2HE       LYS  19  -7.973   0.994  -8.457
  167   2HE   LYS  19          1HE       LYS  19  -7.292   2.585  -8.128
  168   1HZ   LYS  19          1HZ       LYS  19  -6.864   1.002 -10.584
  169   2HZ   LYS  19          2HZ       LYS  19  -6.237   2.529 -10.302
  170   3HZ   LYS  19          3HZ       LYS  19  -7.905   2.316 -10.451
  171    H    LEU  20           H        LEU  20  -5.769  -0.763  -3.852
  172    HA   LEU  20           HA       LEU  20  -2.895  -0.464  -3.309
  173   1HB   LEU  20          2HB       LEU  20  -4.334  -0.900  -1.285
  174   2HB   LEU  20          1HB       LEU  20  -4.922  -2.345  -2.046
  175    HG   LEU  20           HG       LEU  20  -2.055  -1.915  -1.137
  176   1HD1  LEU  20          1HD1      LEU  20  -2.646  -3.393   0.721
  177   2HD1  LEU  20          2HD1      LEU  20  -4.301  -3.464   0.143
  178   3HD1  LEU  20          3HD1      LEU  20  -3.651  -1.947   0.737
  179   1HD2  LEU  20          1HD2      LEU  20  -1.838  -4.348  -1.394
  180   2HD2  LEU  20          2HD2      LEU  20  -2.266  -3.594  -2.934
  181   3HD2  LEU  20          3HD2      LEU  20  -3.492  -4.439  -1.990
  182    H    GLU  21           H        GLU  21  -1.777  -1.554  -4.904
  183    HA   GLU  21           HA       GLU  21  -3.057  -3.951  -6.085
  184   1HB   GLU  21          2HB       GLU  21  -1.263  -1.954  -7.490
  185   2HB   GLU  21          1HB       GLU  21  -1.898  -3.427  -8.188
  186   1HG   GLU  21          2HG       GLU  21  -4.165  -2.524  -8.005
  187   2HG   GLU  21          1HG       GLU  21  -3.501  -1.040  -7.318
  188    H    MET  22           H        MET  22  -1.723  -5.796  -5.849
  189    HA   MET  22           HA       MET  22   1.023  -5.130  -5.155
  190   1HB   MET  22          2HB       MET  22  -0.435  -7.764  -4.929
  191   2HB   MET  22          1HB       MET  22   1.211  -7.452  -4.411
  192   1HG   MET  22          2HG       MET  22   0.319  -5.805  -2.782
  193   2HG   MET  22          1HG       MET  22  -1.306  -6.285  -3.250
  194   1HE   MET  22          1HE       MET  22  -1.267 -10.108  -2.167
  195   2HE   MET  22          2HE       MET  22  -0.711  -9.503  -3.724
  196   3HE   MET  22          3HE       MET  22  -2.189  -8.863  -3.004
  197    H    LYS  23           H        LYS  23   2.236  -4.987  -6.789
  198    HA   LYS  23           HA       LYS  23   2.780  -7.112  -8.423
  199   1HB   LYS  23          2HB       LYS  23   2.380  -5.909 -10.664
  200   2HB   LYS  23          1HB       LYS  23   0.985  -6.602  -9.874
  201   1HG   LYS  23          2HG       LYS  23   0.260  -4.551 -10.766
  202   2HG   LYS  23          1HG       LYS  23   0.472  -4.245  -9.055
  203   1HD   LYS  23          2HD       LYS  23   2.595  -3.124  -9.515
  204   2HD   LYS  23          1HD       LYS  23   2.431  -3.501 -11.233
  205   1HE   LYS  23          2HE       LYS  23   0.312  -2.233 -11.288
  206   2HE   LYS  23          1HE       LYS  23   0.541  -1.789  -9.606
  207   1HZ   LYS  23          1HZ       LYS  23   2.640  -0.627 -10.333
  208   2HZ   LYS  23          2HZ       LYS  23   1.247  -0.014 -11.048
  209   3HZ   LYS  23          3HZ       LYS  23   2.255  -1.028 -11.907
  210    HA   PRO  24           HA       PRO  24   6.538  -5.135  -7.791
  211   1HB   PRO  24          2HB       PRO  24   8.143  -6.373  -9.572
  212   2HB   PRO  24          1HB       PRO  24   7.536  -7.177  -8.123
  213   1HG   PRO  24          2HG       PRO  24   6.511  -7.309 -10.914
  214   2HG   PRO  24          1HG       PRO  24   6.776  -8.635  -9.765
  215   1HD   PRO  24          2HD       PRO  24   4.313  -7.589 -10.189
  216   2HD   PRO  24          1HD       PRO  24   4.823  -8.182  -8.598
  217    H    LYS  25           H        LYS  25   6.906  -3.118  -8.299
  218    HA   LYS  25           HA       LYS  25   6.355  -2.012 -10.819
  219   1HB   LYS  25          2HB       LYS  25   6.223  -0.774  -8.721
  220   2HB   LYS  25          1HB       LYS  25   7.968  -0.874  -8.557
  221   1HG   LYS  25          2HG       LYS  25   8.323   0.529 -10.413
  222   2HG   LYS  25          1HG       LYS  25   6.632   0.410 -10.913
  223   1HD   LYS  25          2HD       LYS  25   5.941   1.461  -8.933
  224   2HD   LYS  25          1HD       LYS  25   7.606   1.627  -8.352
  225   1HE   LYS  25          2HE       LYS  25   8.121   3.054 -10.297
  226   2HE   LYS  25          1HE       LYS  25   6.465   2.873 -10.871
  227   1HZ   LYS  25          1HZ       LYS  25   5.686   4.007  -8.914
  228   2HZ   LYS  25          2HZ       LYS  25   6.800   4.974  -9.712
  229   3HZ   LYS  25          3HZ       LYS  25   7.238   4.161  -8.302
  230    H    TYR  26           H        TYR  26   9.090  -3.577  -9.403
  231    HA   TYR  26           HA       TYR  26  10.525  -3.178 -11.891
  232   1HB   TYR  26          2HB       TYR  26  11.860  -3.299  -9.091
  233   2HB   TYR  26          1HB       TYR  26  12.679  -3.407 -10.604
  234    HD1  TYR  26           1HD      TYR  26  13.311  -1.594 -11.792
  235    HD2  TYR  26           2HD      TYR  26  10.599  -1.127  -8.568
  236    HE1  TYR  26           1HE      TYR  26  13.578   0.893 -11.925
  237    HE2  TYR  26           2HE      TYR  26  10.849   1.316  -8.662
  238    HH   TYR  26           HH       TYR  26  12.437   2.948  -9.436
  239    HA   PRO  27           HA       PRO  27   9.884  -7.621 -12.010
  240   1HB   PRO  27          2HB       PRO  27  12.259  -7.522 -13.804
  241   2HB   PRO  27          1HB       PRO  27  10.667  -8.229 -14.101
  242   1HG   PRO  27          2HG       PRO  27  11.351  -5.952 -15.281
  243   2HG   PRO  27          1HG       PRO  27   9.714  -6.177 -14.638
  244   1HD   PRO  27          2HD       PRO  27  12.007  -4.636 -13.485
  245   2HD   PRO  27          1HD       PRO  27  10.275  -4.227 -13.548
  246    H    HIS  28           H        HIS  28  12.820  -6.032 -11.384
  247    HA   HIS  28           HA       HIS  28  14.170  -8.381 -10.332
  248   1HB   HIS  28          2HB       HIS  28  16.134  -6.931  -9.990
  249   2HB   HIS  28          1HB       HIS  28  15.503  -6.710 -11.612
  250    HD1  HIS  28           1HD      HIS  28  15.939  -4.991  -8.349
  251    HD2  HIS  28           2HD      HIS  28  14.537  -3.992 -12.139
  252    HE1  HIS  28           1HE      HIS  28  15.603  -2.517  -8.396
  253    HE2  HIS  28           2HE      HIS  28  15.362  -2.028 -10.804
  254    H    CYS  29           H        CYS  29  11.697  -7.260  -9.057
  255    HA   CYS  29           HA       CYS  29  12.725  -6.674  -6.372
  256   1HB   CYS  29          2HB       CYS  29  10.158  -6.056  -7.757
  257   2HB   CYS  29          1HB       CYS  29  10.136  -6.066  -6.033
  258    H    GLU  30           H        GLU  30  11.758  -7.760  -4.550
  259    HA   GLU  30           HA       GLU  30  11.340 -10.533  -4.992
  260   1HB   GLU  30          2HB       GLU  30  11.105  -8.825  -2.512
  261   2HB   GLU  30          1HB       GLU  30  11.315 -10.560  -2.603
  262   1HG   GLU  30          2HG       GLU  30  13.471 -10.347  -3.306
  263   2HG   GLU  30          1HG       GLU  30  13.273  -8.605  -3.592
  264    H    GLU  31           H        GLU  31   9.310 -11.398  -5.186
  265    HA   GLU  31           HA       GLU  31   7.093 -11.751  -5.034
  266   1HB   GLU  31          2HB       GLU  31   7.736 -11.752  -2.627
  267   2HB   GLU  31          1HB       GLU  31   7.439 -10.038  -2.545
  268   1HG   GLU  31          2HG       GLU  31   5.105 -10.345  -2.687
  269   2HG   GLU  31          1HG       GLU  31   5.295 -12.035  -3.180
  270    H    LYS  32           H        LYS  32   4.872 -10.215  -4.426
  271    HA   LYS  32           HA       LYS  32   4.972  -8.270  -6.557
  272   1HB   LYS  32          2HB       LYS  32   2.701  -9.549  -5.061
  273   2HB   LYS  32          1HB       LYS  32   2.439  -8.124  -6.051
  274   1HG   LYS  32          2HG       LYS  32   1.870 -10.223  -7.212
  275   2HG   LYS  32          1HG       LYS  32   3.131  -9.318  -8.024
  276   1HD   LYS  32          2HD       LYS  32   4.795 -10.701  -7.149
  277   2HD   LYS  32          1HD       LYS  32   3.654 -11.605  -6.149
  278   1HE   LYS  32          2HE       LYS  32   3.666 -11.517  -9.182
  279   2HE   LYS  32          1HE       LYS  32   4.243 -12.863  -8.209
  280   1HZ   LYS  32          1HZ       LYS  32   2.031 -13.190  -7.356
  281   2HZ   LYS  32          2HZ       LYS  32   1.980 -13.220  -9.044
  282   3HZ   LYS  32          3HZ       LYS  32   1.433 -11.874  -8.218
  283    H    MET  33           H        MET  33   5.642  -6.442  -6.092
  284    HA   MET  33           HA       MET  33   5.789  -5.238  -3.566
  285   1HB   MET  33          2HB       MET  33   5.786  -3.916  -6.267
  286   2HB   MET  33          1HB       MET  33   6.315  -3.171  -4.787
  287   1HG   MET  33          2HG       MET  33   7.607  -5.592  -6.040
  288   2HG   MET  33          1HG       MET  33   8.203  -3.938  -6.166
  289   1HE   MET  33          1HE       MET  33   8.885  -2.538  -4.113
  290   2HE   MET  33          2HE       MET  33   9.072  -3.139  -2.450
  291   3HE   MET  33          3HE       MET  33   7.465  -3.015  -3.177
  292    H    VAL  34           H        VAL  34   4.635  -3.424  -2.772
  293    HA   VAL  34           HA       VAL  34   1.842  -3.600  -3.552
  294    HB   VAL  34           HB       VAL  34   3.064  -2.377  -1.097
  295   1HG1  VAL  34          1HG1      VAL  34   0.906  -1.410  -1.742
  296   2HG1  VAL  34          2HG1      VAL  34   0.765  -2.331  -0.245
  297   3HG1  VAL  34          3HG1      VAL  34   0.196  -3.024  -1.762
  298   1HG2  VAL  34          1HG2      VAL  34   2.239  -4.359   0.089
  299   2HG2  VAL  34          2HG2      VAL  34   3.395  -4.777  -1.177
  300   3HG2  VAL  34          3HG2      VAL  34   1.674  -5.030  -1.443
  301    H    ILE  35           H        ILE  35   1.126  -2.135  -4.826
  302    HA   ILE  35           HA       ILE  35   2.398   0.481  -4.931
  303    HB   ILE  35           HB       ILE  35   0.258  -0.692  -6.718
  304   1HG1  ILE  35          2HG1      ILE  35   2.292  -2.013  -6.885
  305   2HG1  ILE  35          1HG1      ILE  35   2.018  -1.102  -8.361
  306   1HG2  ILE  35          1HG2      ILE  35   0.899   1.116  -8.246
  307   2HG2  ILE  35          2HG2      ILE  35   2.036   1.709  -7.029
  308   3HG2  ILE  35          3HG2      ILE  35   0.299   1.714  -6.696
  309   1HD1  ILE  35          1HD1      ILE  35   3.720   0.540  -7.628
  310   2HD1  ILE  35          2HD1      ILE  35   4.377  -1.087  -7.809
  311   3HD1  ILE  35          3HD1      ILE  35   4.031  -0.442  -6.199
  312    H    ILE  36           H        ILE  36   1.515   1.972  -3.780
  313    HA   ILE  36           HA       ILE  36  -1.304   1.732  -2.960
  314    HB   ILE  36           HB       ILE  36   1.033   3.035  -1.579
  315   1HG1  ILE  36          2HG1      ILE  36   0.855   0.601  -1.348
  316   2HG1  ILE  36          1HG1      ILE  36   0.646   1.419   0.202
  317   1HG2  ILE  36          1HG2      ILE  36  -0.868   4.489  -1.261
  318   2HG2  ILE  36          2HG2      ILE  36  -0.535   3.612   0.237
  319   3HG2  ILE  36          3HG2      ILE  36  -1.859   3.102  -0.795
  320   1HD1  ILE  36          1HD1      ILE  36  -1.510   0.227  -1.544
  321   2HD1  ILE  36          2HD1      ILE  36  -1.794   1.097  -0.035
  322   3HD1  ILE  36          3HD1      ILE  36  -0.901  -0.421  -0.025
  323    H    THR  37           H        THR  37  -2.598   3.091  -3.906
  324    HA   THR  37           HA       THR  37  -1.526   5.505  -5.154
  325    HB   THR  37           HB       THR  37  -4.267   4.219  -5.311
  326    HG1  THR  37           1HG      THR  37  -2.104   3.278  -6.201
  327   1HG2  THR  37          1HG2      THR  37  -2.974   6.365  -7.019
  328   2HG2  THR  37          2HG2      THR  37  -4.290   6.602  -5.865
  329   3HG2  THR  37          3HG2      THR  37  -4.552   5.621  -7.311
  330    H    THR  38           H        THR  38  -1.819   7.467  -4.183
  331    HA   THR  38           HA       THR  38  -3.410   7.545  -1.768
  332    HB   THR  38           HB       THR  38  -2.328   9.820  -1.468
  333    HG1  THR  38           1HG      THR  38  -0.548   9.013  -3.567
  334   1HG2  THR  38          1HG2      THR  38  -0.112   8.857  -0.883
  335   2HG2  THR  38          2HG2      THR  38  -0.541   7.418  -1.811
  336   3HG2  THR  38          3HG2      THR  38  -1.463   7.830  -0.372
  337    H    LYS  39           H        LYS  39  -4.807   9.521  -1.339
  338    HA   LYS  39           HA       LYS  39  -6.731   9.625  -3.457
  339   1HB   LYS  39          2HB       LYS  39  -6.673  11.375  -0.989
  340   2HB   LYS  39          1HB       LYS  39  -8.029  11.129  -2.056
  341   1HG   LYS  39          2HG       LYS  39  -8.057   8.725  -1.389
  342   2HG   LYS  39          1HG       LYS  39  -6.799   9.102  -0.215
  343   1HD   LYS  39          2HD       LYS  39  -9.521  10.416  -0.306
  344   2HD   LYS  39          1HD       LYS  39  -9.087   9.100   0.774
  345   1HE   LYS  39          2HE       LYS  39  -7.385  10.483   1.794
  346   2HE   LYS  39          1HE       LYS  39  -7.771  11.819   0.705
  347   1HZ   LYS  39          1HZ       LYS  39  -9.625  10.616   2.694
  348   2HZ   LYS  39          2HZ       LYS  39  -9.984  11.917   1.710
  349   3HZ   LYS  39          3HZ       LYS  39  -8.804  12.061   2.902
  350    H    SER  40           H        SER  40  -4.646  12.131  -2.046
  351    HA   SER  40           HA       SER  40  -3.888  13.451  -4.340
  352   1HB   SER  40          2HB       SER  40  -5.427  15.447  -4.387
  353   2HB   SER  40          1HB       SER  40  -6.179  13.938  -4.907
  354    HG   SER  40           HG       SER  40  -7.376  13.888  -3.190
  355    H    VAL  41           H        VAL  41  -5.081  14.023  -1.056
  356    HA   VAL  41           HA       VAL  41  -3.479  16.393  -0.804
  357    HB   VAL  41           HB       VAL  41  -4.381  16.600   1.473
  358   1HG1  VAL  41          1HG1      VAL  41  -6.430  15.986  -0.650
  359   2HG1  VAL  41          2HG1      VAL  41  -5.620  17.533  -0.396
  360   3HG1  VAL  41          3HG1      VAL  41  -6.740  16.913   0.815
  361   1HG2  VAL  41          1HG2      VAL  41  -6.094  15.030   2.269
  362   2HG2  VAL  41          2HG2      VAL  41  -4.542  14.221   2.038
  363   3HG2  VAL  41          3HG2      VAL  41  -5.828  14.030   0.844
  364    H    SER  42           H        SER  42  -2.740  13.235  -0.498
  365    HA   SER  42           HA       SER  42  -0.903  13.322   1.679
  366   1HB   SER  42          2HB       SER  42  -1.000  11.450  -0.704
  367   2HB   SER  42          1HB       SER  42  -0.161  11.153   0.813
  368    HG   SER  42           HG       SER  42  -2.128  11.096   1.876
  369    H    ARG  43           H        ARG  43   1.527  12.828   1.159
  370    HA   ARG  43           HA       ARG  43   2.626  15.109  -0.040
  371   1HB   ARG  43          2HB       ARG  43   3.954  12.531   0.731
  372   2HB   ARG  43          1HB       ARG  43   4.825  13.963   0.225
  373   1HG   ARG  43          2HG       ARG  43   3.932  15.194   2.130
  374   2HG   ARG  43          1HG       ARG  43   3.030  13.762   2.633
  375   1HD   ARG  43          2HD       ARG  43   5.130  14.045   3.883
  376   2HD   ARG  43          1HD       ARG  43   5.092  12.538   2.974
  377    HE   ARG  43           HE       ARG  43   6.283  14.617   1.475
  378   1HH1  ARG  43          1HH1      ARG  43   6.987  12.433   4.174
  379   2HH1  ARG  43          2HH1      ARG  43   8.669  12.351   3.834
  380   1HH2  ARG  43          1HH2      ARG  43   8.599  14.479   1.037
  381   2HH2  ARG  43          2HH2      ARG  43   9.577  13.518   2.065
  382    H    TYR  44           H        TYR  44   2.041  11.968  -1.361
  383    HA   TYR  44           HA       TYR  44   3.515  12.556  -3.755
  384   1HB   TYR  44          2HB       TYR  44   1.927  10.219  -2.858
  385   2HB   TYR  44          1HB       TYR  44   2.248  10.386  -4.572
  386    HD1  TYR  44           1HD      TYR  44   4.437   9.990  -5.453
  387    HD2  TYR  44           2HD      TYR  44   3.783   9.948  -1.266
  388    HE1  TYR  44           1HE      TYR  44   6.651   8.987  -5.132
  389    HE2  TYR  44           2HE      TYR  44   6.007   8.940  -0.929
  390    HH   TYR  44           HH       TYR  44   8.316   8.849  -3.354
  391    H    ARG  45           H        ARG  45   0.619  13.675  -2.722
  392    HA   ARG  45           HA       ARG  45  -1.116  14.716  -3.700
  393   1HB   ARG  45          2HB       ARG  45   0.899  15.007  -5.923
  394   2HB   ARG  45          1HB       ARG  45  -0.643  15.850  -5.880
  395   1HG   ARG  45          2HG       ARG  45  -0.003  16.921  -3.793
  396   2HG   ARG  45          1HG       ARG  45   1.550  16.083  -3.836
  397   1HD   ARG  45          2HD       ARG  45   2.120  17.220  -5.902
  398   2HD   ARG  45          1HD       ARG  45   0.537  17.999  -5.930
  399    HE   ARG  45           HE       ARG  45   1.733  18.589  -3.501
  400   1HH1  ARG  45          1HH1      ARG  45   2.283  19.306  -6.915
  401   2HH1  ARG  45          2HH1      ARG  45   2.978  20.824  -6.635
  402   1HH2  ARG  45          1HH2      ARG  45   2.684  20.639  -3.102
  403   2HH2  ARG  45          2HH2      ARG  45   3.233  21.620  -4.382
  404    H    GLY  46           H        GLY  46  -1.070  11.833  -4.055
  405   1HA   GLY  46          2HA       GLY  46  -2.872  10.600  -4.962
  406   2HA   GLY  46          1HA       GLY  46  -2.915  11.712  -6.322
  407    H    GLN  47           H        GLN  47   0.240  11.180  -5.867
  408    HA   GLN  47           HA       GLN  47   0.373   9.163  -7.864
  409   1HB   GLN  47          2HB       GLN  47   2.648  10.570  -6.437
  410   2HB   GLN  47          1HB       GLN  47   2.858   9.378  -7.707
  411   1HG   GLN  47          2HG       GLN  47   1.602  10.851  -9.238
  412   2HG   GLN  47          1HG       GLN  47   1.520  12.056  -7.951
  413   1HE2  GLN  47          1HE2      GLN  47   2.696  13.564  -9.113
  414   2HE2  GLN  47          2HE2      GLN  47   4.387  13.401  -9.386
  415    H    GLU  48           H        GLU  48   1.911   7.331  -7.621
  416    HA   GLU  48           HA       GLU  48   0.703   5.751  -5.519
  417   1HB   GLU  48          2HB       GLU  48   2.464   5.006  -7.823
  418   2HB   GLU  48          1HB       GLU  48   1.559   3.906  -6.798
  419   1HG   GLU  48          2HG       GLU  48  -0.496   4.637  -7.660
  420   2HG   GLU  48          1HG       GLU  48   0.244   6.035  -8.442
  421    H    HIS  49           H        HIS  49   1.715   5.162  -3.823
  422    HA   HIS  49           HA       HIS  49   4.576   5.404  -3.351
  423   1HB   HIS  49          2HB       HIS  49   2.245   4.473  -1.746
  424   2HB   HIS  49          1HB       HIS  49   3.857   3.998  -1.257
  425    HD1  HIS  49           1HD      HIS  49   5.166   5.669  -0.003
  426    HD2  HIS  49           2HD      HIS  49   1.599   7.192  -1.447
  427    HE1  HIS  49           1HE      HIS  49   4.784   7.782   1.286
  428    HE2  HIS  49           2HE      HIS  49   2.487   8.484   0.629
  429    H    CYS  50           H        CYS  50   5.853   3.543  -2.846
  430    HA   CYS  50           HA       CYS  50   4.667   1.037  -3.706
  431   1HB   CYS  50          2HB       CYS  50   6.207   1.914  -5.398
  432   2HB   CYS  50          1HB       CYS  50   7.490   2.040  -4.190
  433    H    LEU  51           H        LEU  51   4.759  -0.397  -2.146
  434    HA   LEU  51           HA       LEU  51   6.491   0.135   0.169
  435   1HB   LEU  51          2HB       LEU  51   4.079   0.550   0.617
  436   2HB   LEU  51          1HB       LEU  51   3.702  -1.060   0.085
  437    HG   LEU  51           HG       LEU  51   4.837  -1.964   2.073
  438   1HD1  LEU  51          1HD1      LEU  51   5.570  -0.446   3.839
  439   2HD1  LEU  51          2HD1      LEU  51   5.241   0.939   2.801
  440   3HD1  LEU  51          3HD1      LEU  51   6.518  -0.201   2.373
  441   1HD2  LEU  51          1HD2      LEU  51   3.231  -1.110   3.718
  442   2HD2  LEU  51          2HD2      LEU  51   2.466  -1.447   2.161
  443   3HD2  LEU  51          3HD2      LEU  51   2.831   0.213   2.632
  444    H    HIS  52           H        HIS  52   7.594  -1.565   0.978
  445    HA   HIS  52           HA       HIS  52   7.885  -3.810  -0.842
  446   1HB   HIS  52          2HB       HIS  52   9.852  -2.461  -0.048
  447   2HB   HIS  52          1HB       HIS  52   9.542  -3.046   1.579
  448    HD1  HIS  52           1HD      HIS  52  10.739  -5.122   2.209
  449    HD2  HIS  52           2HD      HIS  52  10.631  -4.590  -1.908
  450    HE1  HIS  52           1HE      HIS  52  12.023  -7.035   1.211
  451    HE2  HIS  52           2HE      HIS  52  12.203  -6.586  -1.146
  452    HA   PRO  53           HA       PRO  53   4.938  -5.940   1.907
  453   1HB   PRO  53          2HB       PRO  53   4.498  -7.988   0.349
  454   2HB   PRO  53          1HB       PRO  53   3.864  -6.382  -0.068
  455   1HG   PRO  53          2HG       PRO  53   6.305  -7.815  -1.082
  456   2HG   PRO  53          1HG       PRO  53   5.073  -6.945  -2.016
  457   1HD   PRO  53          2HD       PRO  53   7.438  -5.833  -1.392
  458   2HD   PRO  53          1HD       PRO  53   5.943  -4.875  -1.468
  459    H    LYS  54           H        LYS  54   7.928  -6.649   1.730
  460    HA   LYS  54           HA       LYS  54   7.845  -9.455   2.391
  461   1HB   LYS  54          2HB       LYS  54  10.190  -7.586   2.347
  462   2HB   LYS  54          1HB       LYS  54  10.216  -9.352   2.428
  463   1HG   LYS  54          2HG       LYS  54   8.910  -7.902   0.155
  464   2HG   LYS  54          1HG       LYS  54  10.616  -8.321   0.205
  465   1HD   LYS  54          2HD       LYS  54   8.497 -10.317   0.656
  466   2HD   LYS  54          1HD       LYS  54   9.057  -9.854  -0.986
  467   1HE   LYS  54          2HE       LYS  54  11.266 -10.495  -0.434
  468   2HE   LYS  54          1HE       LYS  54  10.822 -10.894   1.235
  469   1HZ   LYS  54          1HZ       LYS  54  11.013 -12.863  -0.128
  470   2HZ   LYS  54          2HZ       LYS  54   9.907 -12.269  -1.233
  471   3HZ   LYS  54          3HZ       LYS  54   9.403 -12.669   0.327
  472    H    LEU  55           H        LEU  55   7.609  -6.493   3.985
  473    HA   LEU  55           HA       LEU  55   8.817  -7.295   6.500
  474   1HB   LEU  55          2HB       LEU  55   7.308  -4.810   5.715
  475   2HB   LEU  55          1HB       LEU  55   8.179  -5.046   7.213
  476    HG   LEU  55           HG       LEU  55   9.420  -4.933   4.467
  477   1HD1  LEU  55          1HD1      LEU  55  10.355  -2.808   5.229
  478   2HD1  LEU  55          2HD1      LEU  55   9.432  -2.934   6.724
  479   3HD1  LEU  55          3HD1      LEU  55   8.593  -2.767   5.179
  480   1HD2  LEU  55          1HD2      LEU  55  10.679  -5.143   7.204
  481   2HD2  LEU  55          2HD2      LEU  55  11.543  -4.881   5.693
  482   3HD2  LEU  55          3HD2      LEU  55  10.676  -6.391   5.955
  483    H    GLN  56           H        GLN  56   7.665  -7.676   8.374
  484    HA   GLN  56           HA       GLN  56   5.074  -8.831   8.112
  485   1HB   GLN  56          2HB       GLN  56   6.574  -8.074  10.626
  486   2HB   GLN  56          1HB       GLN  56   5.132  -9.066  10.574
  487   1HG   GLN  56          2HG       GLN  56   6.351 -10.738   9.240
  488   2HG   GLN  56          1HG       GLN  56   7.801  -9.746   9.355
  489   1HE2  GLN  56          1HE2      GLN  56   8.935 -11.359  10.428
  490   2HE2  GLN  56          2HE2      GLN  56   8.622 -11.749  12.079
  491    H    SER  57           H        SER  57   6.207  -5.682   9.019
  492    HA   SER  57           HA       SER  57   3.802  -4.683  10.101
  493   1HB   SER  57          2HB       SER  57   4.933  -2.485   9.527
  494   2HB   SER  57          1HB       SER  57   5.857  -3.559  10.579
  495    HG   SER  57           HG       SER  57   6.316  -2.777   7.959
  496    H    THR  58           H        THR  58   5.009  -5.105   6.836
  497    HA   THR  58           HA       THR  58   3.079  -3.442   5.629
  498    HB   THR  58           HB       THR  58   4.580  -5.744   4.344
  499    HG1  THR  58           1HG      THR  58   5.381  -3.199   5.215
  500   1HG2  THR  58          1HG2      THR  58   2.828  -4.796   2.905
  501   2HG2  THR  58          2HG2      THR  58   4.400  -4.213   2.343
  502   3HG2  THR  58          3HG2      THR  58   3.388  -3.171   3.303
  503    H    LYS  59           H        LYS  59   3.261  -6.918   6.459
  504    HA   LYS  59           HA       LYS  59   0.975  -7.743   5.165
  505   1HB   LYS  59          2HB       LYS  59   2.266  -8.755   7.666
  506   2HB   LYS  59          1HB       LYS  59   0.730  -9.413   7.128
  507   1HG   LYS  59          2HG       LYS  59   2.446 -10.838   6.337
  508   2HG   LYS  59          1HG       LYS  59   1.779  -9.949   4.974
  509   1HD   LYS  59          2HD       LYS  59   3.689  -8.442   5.010
  510   2HD   LYS  59          1HD       LYS  59   4.355  -9.314   6.389
  511   1HE   LYS  59          2HE       LYS  59   5.451 -10.044   4.370
  512   2HE   LYS  59          1HE       LYS  59   4.465 -11.356   5.011
  513   1HZ   LYS  59          1HZ       LYS  59   3.740  -9.548   2.786
  514   2HZ   LYS  59          2HZ       LYS  59   2.743 -10.769   3.342
  515   3HZ   LYS  59          3HZ       LYS  59   4.223 -11.133   2.609
  516    H    ARG  60           H        ARG  60   1.247  -6.195   8.367
  517    HA   ARG  60           HA       ARG  60  -1.476  -6.347   8.934
  518   1HB   ARG  60          2HB       ARG  60   0.702  -4.569   9.850
  519   2HB   ARG  60          1HB       ARG  60  -0.948  -4.057  10.118
  520   1HG   ARG  60          2HG       ARG  60  -0.281  -5.126  12.093
  521   2HG   ARG  60          1HG       ARG  60  -1.327  -6.219  11.256
  522   1HD   ARG  60          2HD       ARG  60   0.515  -7.530  10.404
  523   2HD   ARG  60          1HD       ARG  60   1.674  -6.417  11.131
  524    HE   ARG  60           HE       ARG  60   0.228  -7.119  13.230
  525   1HH1  ARG  60          1HH1      ARG  60   1.759  -9.118  10.741
  526   2HH1  ARG  60          2HH1      ARG  60   2.010 -10.445  11.764
  527   1HH2  ARG  60          1HH2      ARG  60   0.613  -8.937  14.658
  528   2HH2  ARG  60          2HH2      ARG  60   1.358 -10.335  14.051
  529    H    PHE  61           H        PHE  61   0.391  -3.799   7.363
  530    HA   PHE  61           HA       PHE  61  -1.679  -1.994   7.036
  531   1HB   PHE  61          2HB       PHE  61   0.795  -1.644   6.554
  532   2HB   PHE  61          1HB       PHE  61   0.458  -2.479   5.039
  533    HD1  PHE  61           1HD      PHE  61   0.058  -1.153   3.149
  534    HD2  PHE  61           2HD      PHE  61  -0.904   0.415   6.993
  535    HE1  PHE  61           1HE      PHE  61  -0.596   0.993   2.123
  536    HE2  PHE  61           2HE      PHE  61  -1.562   2.565   5.956
  537    HZ   PHE  61           HZ       PHE  61  -1.398   2.863   3.562
  538    H    ILE  62           H        ILE  62  -0.685  -4.639   4.932
  539    HA   ILE  62           HA       ILE  62  -2.558  -4.036   2.868
  540    HB   ILE  62           HB       ILE  62  -1.183  -6.681   3.382
  541   1HG1  ILE  62          2HG1      ILE  62   0.510  -4.980   3.218
  542   2HG1  ILE  62          1HG1      ILE  62   0.474  -5.870   1.700
  543   1HG2  ILE  62          1HG2      ILE  62  -3.058  -6.818   1.864
  544   2HG2  ILE  62          2HG2      ILE  62  -1.538  -7.062   0.987
  545   3HG2  ILE  62          3HG2      ILE  62  -2.394  -5.518   0.877
  546   1HD1  ILE  62          1HD1      ILE  62  -0.816  -3.202   2.181
  547   2HD1  ILE  62          2HD1      ILE  62  -0.725  -4.076   0.647
  548   3HD1  ILE  62          3HD1      ILE  62   0.750  -3.473   1.399
  549    H    LYS  63           H        LYS  63  -2.492  -6.496   5.402
  550    HA   LYS  63           HA       LYS  63  -5.037  -7.615   4.674
  551   1HB   LYS  63          2HB       LYS  63  -3.367  -7.872   7.166
  552   2HB   LYS  63          1HB       LYS  63  -5.003  -8.473   7.155
  553   1HG   LYS  63          2HG       LYS  63  -3.356 -10.269   6.833
  554   2HG   LYS  63          1HG       LYS  63  -4.411 -10.123   5.448
  555   1HD   LYS  63          2HD       LYS  63  -1.701  -8.812   5.471
  556   2HD   LYS  63          1HD       LYS  63  -1.865 -10.528   5.110
  557   1HE   LYS  63          2HE       LYS  63  -3.254  -8.294   3.630
  558   2HE   LYS  63          1HE       LYS  63  -1.785  -9.104   3.091
  559   1HZ   LYS  63          1HZ       LYS  63  -4.438 -10.431   3.473
  560   2HZ   LYS  63          2HZ       LYS  63  -3.012 -11.181   3.004
  561   3HZ   LYS  63          3HZ       LYS  63  -3.721 -10.069   1.999
  562    H    TRP  64           H        TRP  64  -4.077  -5.006   6.675
  563    HA   TRP  64           HA       TRP  64  -6.581  -4.700   8.037
  564   1HB   TRP  64          2HB       TRP  64  -4.085  -3.818   8.533
  565   2HB   TRP  64          1HB       TRP  64  -4.700  -2.428   7.661
  566    HD1  TRP  64           HD       TRP  64  -4.517  -3.938  11.020
  567    HE1  TRP  64           1HE      TRP  64  -5.948  -2.622  12.694
  568    HE3  TRP  64           3HE      TRP  64  -7.173  -1.025   7.739
  569    HZ2  TRP  64           2HZ      TRP  64  -7.936  -0.610  12.648
  570    HZ3  TRP  64           3HZ      TRP  64  -8.813   0.570   8.649
  571    HH2  TRP  64           HH       TRP  64  -9.183   0.772  11.046
  572    H    TYR  65           H        TYR  65  -4.904  -3.168   5.216
  573    HA   TYR  65           HA       TYR  65  -6.932  -1.315   4.712
  574   1HB   TYR  65          2HB       TYR  65  -4.675  -1.063   3.720
  575   2HB   TYR  65          1HB       TYR  65  -4.989  -2.455   2.687
  576    HD1  TYR  65           1HD      TYR  65  -5.992  -2.128   0.562
  577    HD2  TYR  65           2HD      TYR  65  -6.337   0.907   3.514
  578    HE1  TYR  65           1HE      TYR  65  -7.090  -0.627  -1.090
  579    HE2  TYR  65           2HE      TYR  65  -7.426   2.380   1.862
  580    HH   TYR  65           HH       TYR  65  -7.597   2.665  -0.504
  581    H    ASN  66           H        ASN  66  -6.483  -4.603   3.642
  582    HA   ASN  66           HA       ASN  66  -8.579  -4.615   1.771
  583   1HB   ASN  66          2HB       ASN  66  -7.483  -6.916   3.401
  584   2HB   ASN  66          1HB       ASN  66  -8.654  -7.112   2.104
  585   1HD2  ASN  66          1HD2      ASN  66  -6.009  -8.208   2.283
  586   2HD2  ASN  66          2HD2      ASN  66  -5.129  -7.602   0.918
  587    H    ALA  67           H        ALA  67  -8.610  -5.200   5.235
  588    HA   ALA  67           HA       ALA  67 -11.404  -5.821   5.361
  589   1HB   ALA  67          1HB       ALA  67  -9.523  -4.896   7.536
  590   2HB   ALA  67          2HB       ALA  67  -9.824  -6.574   7.089
  591   3HB   ALA  67          3HB       ALA  67 -11.120  -5.604   7.790
  592    H    TRP  68           H        TRP  68  -9.468  -2.952   5.738
  593    HA   TRP  68           HA       TRP  68 -11.452  -1.093   6.468
  594   1HB   TRP  68          2HB       TRP  68  -9.152  -0.496   6.698
  595   2HB   TRP  68          1HB       TRP  68  -8.822  -0.930   5.034
  596    HD1  TRP  68           HD       TRP  68  -8.861   0.948   3.302
  597    HE1  TRP  68           1HE      TRP  68  -9.285   3.481   3.373
  598    HE3  TRP  68           3HE      TRP  68 -10.805   1.350   8.027
  599    HZ2  TRP  68           2HZ      TRP  68 -10.301   5.368   5.113
  600    HZ3  TRP  68           3HZ      TRP  68 -11.482   3.594   8.800
  601    HH2  TRP  68           HH       TRP  68 -11.215   5.569   7.326
  602    H    ASN  69           H        ASN  69 -10.264  -2.153   3.342
  603    HA   ASN  69           HA       ASN  69 -11.882  -0.549   1.727
  604   1HB   ASN  69          2HB       ASN  69  -9.949  -1.719   0.832
  605   2HB   ASN  69          1HB       ASN  69 -10.684  -3.274   1.193
  606   1HD2  ASN  69          1HD2      ASN  69 -10.753  -0.489  -0.865
  607   2HD2  ASN  69          2HD2      ASN  69 -11.675  -1.178  -2.148
  608    H    GLU  70           H        GLU  70 -12.456  -3.757   3.131
  609    HA   GLU  70           HA       GLU  70 -14.962  -4.231   1.926
  610   1HB   GLU  70          2HB       GLU  70 -14.033  -5.080   4.664
  611   2HB   GLU  70          1HB       GLU  70 -15.420  -5.728   3.812
  612   1HG   GLU  70          2HG       GLU  70 -13.881  -6.556   2.069
  613   2HG   GLU  70          1HG       GLU  70 -12.531  -6.003   3.065
  614    H    LYS  71           H        LYS  71 -14.007  -2.518   4.855
  615    HA   LYS  71           HA       LYS  71 -16.571  -2.079   5.883
  616   1HB   LYS  71          2HB       LYS  71 -14.429  -1.995   7.153
  617   2HB   LYS  71          1HB       LYS  71 -14.020  -0.527   6.298
  618   1HG   LYS  71          2HG       LYS  71 -14.829  -0.039   8.512
  619   2HG   LYS  71          1HG       LYS  71 -15.913   0.606   7.268
  620   1HD   LYS  71          2HD       LYS  71 -17.185  -0.426   9.113
  621   2HD   LYS  71          1HD       LYS  71 -17.441  -1.293   7.602
  622   1HE   LYS  71          2HE       LYS  71 -15.756  -2.953   8.310
  623   2HE   LYS  71          1HE       LYS  71 -15.566  -2.088   9.834
  624   1HZ   LYS  71          1HZ       LYS  71 -17.946  -2.527  10.255
  625   2HZ   LYS  71          2HZ       LYS  71 -17.020  -3.941  10.122
  626   3HZ   LYS  71          3HZ       LYS  71 -18.011  -3.450   8.849
  627    H    ARG  72           H        ARG  72 -14.730  -0.537   3.428
  628    HA   ARG  72           HA       ARG  72 -16.381   1.847   3.435
  629   1HB   ARG  72          2HB       ARG  72 -14.148   1.017   1.579
  630   2HB   ARG  72          1HB       ARG  72 -14.939   2.589   1.579
  631   1HG   ARG  72          2HG       ARG  72 -14.150   3.027   3.814
  632   2HG   ARG  72          1HG       ARG  72 -13.430   1.423   3.900
  633   1HD   ARG  72          2HD       ARG  72 -11.730   3.028   3.456
  634   2HD   ARG  72          1HD       ARG  72 -11.964   2.041   2.012
  635    HE   ARG  72           HE       ARG  72 -13.511   4.404   1.915
  636   1HH1  ARG  72          1HH1      ARG  72 -10.287   3.136   1.375
  637   2HH1  ARG  72          2HH1      ARG  72  -9.710   4.527   0.549
  638   1HH2  ARG  72          1HH2      ARG  72 -12.774   6.278   0.777
  639   2HH2  ARG  72          2HH2      ARG  72 -11.159   6.359   0.201
  640    H    ARG  73           H        ARG  73 -16.274  -1.212   1.939
  641    HA   ARG  73           HA       ARG  73 -18.050  -0.416  -0.235
  642   1HB   ARG  73          2HB       ARG  73 -17.029  -3.161   0.536
  643   2HB   ARG  73          1HB       ARG  73 -18.025  -2.820  -0.870
  644   1HG   ARG  73          2HG       ARG  73 -15.226  -1.823  -0.372
  645   2HG   ARG  73          1HG       ARG  73 -15.709  -3.074  -1.516
  646   1HD   ARG  73          2HD       ARG  73 -17.078  -1.385  -2.718
  647   2HD   ARG  73          1HD       ARG  73 -16.476  -0.158  -1.601
  648    HE   ARG  73           HE       ARG  73 -14.442  -1.655  -2.961
  649   1HH1  ARG  73          1HH1      ARG  73 -16.404   1.312  -3.054
  650   2HH1  ARG  73          2HH1      ARG  73 -15.406   2.072  -4.193
  651   1HH2  ARG  73          1HH2      ARG  73 -13.108  -0.586  -4.508
  652   2HH2  ARG  73          2HH2      ARG  73 -13.512   0.980  -5.045
  653    H    VAL  74           H        VAL  74 -18.137  -2.499   2.626
  654    HA   VAL  74           HA       VAL  74 -21.055  -2.337   2.583
  655    HB   VAL  74           HB       VAL  74 -19.290  -3.857   4.441
  656   1HG1  VAL  74          1HG1      VAL  74 -21.510  -3.532   5.320
  657   2HG1  VAL  74          2HG1      VAL  74 -21.332  -5.235   4.891
  658   3HG1  VAL  74          3HG1      VAL  74 -22.226  -4.148   3.833
  659   1HG2  VAL  74          1HG2      VAL  74 -19.774  -5.930   3.143
  660   2HG2  VAL  74          2HG2      VAL  74 -18.836  -4.743   2.235
  661   3HG2  VAL  74          3HG2      VAL  74 -20.560  -4.931   1.923
  662    H    TYR  75           H        TYR  75 -21.452  -0.515   3.415
  663    HA   TYR  75           HA       TYR  75 -19.697   0.732   5.377
  664   1HB   TYR  75          2HB       TYR  75 -20.476   1.885   3.266
  665   2HB   TYR  75          1HB       TYR  75 -22.081   1.941   3.970
  666    HD1  TYR  75           1HD      TYR  75 -22.637   3.633   5.566
  667    HD2  TYR  75           2HD      TYR  75 -18.620   3.137   4.294
  668    HE1  TYR  75           1HE      TYR  75 -22.042   5.782   6.618
  669    HE2  TYR  75           2HE      TYR  75 -18.010   5.275   5.341
  670    HH   TYR  75           HH       TYR  75 -19.108   7.361   5.998
  671    H    GLU  76           H        GLU  76 -20.218   0.834   7.497
  672    HA   GLU  76           HA       GLU  76 -22.841  -0.158   8.227
  673   1HB   GLU  76          2HB       GLU  76 -21.948  -0.408  10.537
  674   2HB   GLU  76          1HB       GLU  76 -21.073  -1.342   9.339
  675   1HG   GLU  76          2HG       GLU  76 -19.271   0.275   9.361
  676   2HG   GLU  76          1HG       GLU  76 -20.174   1.293  10.482
  677    H    GLU  77           H        GLU  77 -24.357   0.943   9.110
  678    HA   GLU  77           HA       GLU  77 -23.857   3.629  10.130
  679   1HB   GLU  77          2HB       GLU  77 -26.147   2.823   8.300
  680   2HB   GLU  77          1HB       GLU  77 -25.895   4.401   9.018
  681   1HG   GLU  77          2HG       GLU  77 -23.893   4.721   7.686
  682   2HG   GLU  77          1HG       GLU  77 -24.077   3.100   7.019
  Start of MODEL    6
    1    H    SER   1           H        SER   1  21.418  -3.620  -8.296
    2    HA   SER   1           HA       SER   1  19.946  -1.118  -8.653
    3   1HB   SER   1          2HB       SER   1  20.766  -3.128 -10.756
    4   2HB   SER   1          1HB       SER   1  19.777  -1.703 -11.048
    5    HG   SER   1           HG       SER   1  21.437  -0.426 -10.693
    6    H    LYS   2           H        LYS   2  19.582  -3.869  -7.147
    7    HA   LYS   2           HA       LYS   2  17.189  -4.693  -8.519
    8   1HB   LYS   2          2HB       LYS   2  18.614  -5.998  -6.219
    9   2HB   LYS   2          1HB       LYS   2  17.055  -6.525  -6.811
   10   1HG   LYS   2          2HG       LYS   2  18.110  -6.937  -9.028
   11   2HG   LYS   2          1HG       LYS   2  19.674  -6.557  -8.292
   12   1HD   LYS   2          2HD       LYS   2  19.383  -8.338  -6.678
   13   2HD   LYS   2          1HD       LYS   2  17.788  -8.702  -7.327
   14   1HE   LYS   2          2HE       LYS   2  18.849  -9.271  -9.482
   15   2HE   LYS   2          1HE       LYS   2  20.429  -8.996  -8.749
   16   1HZ   LYS   2          1HZ       LYS   2  18.444 -11.025  -7.869
   17   2HZ   LYS   2          2HZ       LYS   2  19.939 -10.757  -7.149
   18   3HZ   LYS   2          3HZ       LYS   2  19.858 -11.353  -8.719
   19    H    CYS   3           H        CYS   3  16.016  -2.831  -8.120
   20    HA   CYS   3           HA       CYS   3  14.023  -2.122  -7.349
   21   1HB   CYS   3          2HB       CYS   3  14.227  -4.203  -5.181
   22   2HB   CYS   3          1HB       CYS   3  12.762  -3.437  -5.802
   23    H    LYS   4           H        LYS   4  14.259  -0.140  -6.647
   24    HA   LYS   4           HA       LYS   4  15.657   0.332  -4.151
   25   1HB   LYS   4          2HB       LYS   4  14.757   2.270  -6.287
   26   2HB   LYS   4          1HB       LYS   4  15.586   2.718  -4.810
   27   1HG   LYS   4          2HG       LYS   4  16.711   0.922  -6.949
   28   2HG   LYS   4          1HG       LYS   4  17.071   2.640  -6.758
   29   1HD   LYS   4          2HD       LYS   4  17.976   2.182  -4.519
   30   2HD   LYS   4          1HD       LYS   4  17.647   0.462  -4.750
   31   1HE   LYS   4          2HE       LYS   4  19.162   0.423  -6.654
   32   2HE   LYS   4          1HE       LYS   4  19.472   2.148  -6.453
   33   1HZ   LYS   4          1HZ       LYS   4  21.225   0.820  -5.463
   34   2HZ   LYS   4          2HZ       LYS   4  20.111   0.030  -4.475
   35   3HZ   LYS   4          3HZ       LYS   4  20.402   1.664  -4.267
   36    H    CYS   5           H        CYS   5  12.888   2.024  -5.605
   37    HA   CYS   5           HA       CYS   5  11.175   3.111  -4.682
   38   1HB   CYS   5          2HB       CYS   5  11.073   0.567  -3.093
   39   2HB   CYS   5          1HB       CYS   5  10.007   1.896  -2.660
   40    H    SER   6           H        SER   6  12.166   1.813  -1.606
   41    HA   SER   6           HA       SER   6  13.452   4.128  -0.684
   42   1HB   SER   6          2HB       SER   6  10.638   3.514   0.323
   43   2HB   SER   6          1HB       SER   6  11.731   4.688   1.043
   44    HG   SER   6           HG       SER   6  11.470   5.148  -1.583
   45    H    ARG   7           H        ARG   7  14.088   3.627   1.609
   46    HA   ARG   7           HA       ARG   7  14.367   0.773   1.871
   47   1HB   ARG   7          2HB       ARG   7  15.418   3.031   3.604
   48   2HB   ARG   7          1HB       ARG   7  15.671   1.335   3.989
   49   1HG   ARG   7          2HG       ARG   7  17.658   2.180   2.941
   50   2HG   ARG   7          1HG       ARG   7  16.860   1.083   1.818
   51   1HD   ARG   7          2HD       ARG   7  15.847   3.095   0.720
   52   2HD   ARG   7          1HD       ARG   7  16.858   4.094   1.759
   53    HE   ARG   7           HE       ARG   7  18.449   2.219   0.434
   54   1HH1  ARG   7          1HH1      ARG   7  16.642   5.195  -0.187
   55   2HH1  ARG   7          2HH1      ARG   7  17.494   5.633  -1.589
   56   1HH2  ARG   7          1HH2      ARG   7  19.641   2.781  -1.521
   57   2HH2  ARG   7          2HH2      ARG   7  19.297   4.210  -2.364
   58    H    LYS   8           H        LYS   8  12.549   3.336   3.187
   59    HA   LYS   8           HA       LYS   8  10.794   1.408   4.444
   60   1HB   LYS   8          2HB       LYS   8  12.293   2.344   6.214
   61   2HB   LYS   8          1HB       LYS   8  11.783   3.959   5.764
   62   1HG   LYS   8          2HG       LYS   8  10.629   3.254   7.760
   63   2HG   LYS   8          1HG       LYS   8   9.483   3.387   6.424
   64   1HD   LYS   8          2HD       LYS   8   9.561   0.968   6.097
   65   2HD   LYS   8          1HD       LYS   8  10.741   0.818   7.395
   66   1HE   LYS   8          2HE       LYS   8   7.918   1.844   7.681
   67   2HE   LYS   8          1HE       LYS   8   8.477   0.238   8.134
   68   1HZ   LYS   8          1HZ       LYS   8   8.367   1.686  10.053
   69   2HZ   LYS   8          2HZ       LYS   8   9.366   2.807   9.338
   70   3HZ   LYS   8          3HZ       LYS   8   9.981   1.302   9.761
   71    H    GLY   9           H        GLY   9   8.916   1.762   3.360
   72   1HA   GLY   9          2HA       GLY   9   8.324   4.097   1.855
   73   2HA   GLY   9          1HA       GLY   9   7.176   2.872   2.288
   74    HA   PRO  10           HA       PRO  10   7.112   6.933   5.131
   75   1HB   PRO  10          2HB       PRO  10   5.018   7.772   3.177
   76   2HB   PRO  10          1HB       PRO  10   6.184   8.761   4.061
   77   1HG   PRO  10          2HG       PRO  10   6.569   8.259   1.496
   78   2HG   PRO  10          1HG       PRO  10   7.930   8.227   2.628
   79   1HD   PRO  10          2HD       PRO  10   6.450   5.942   1.389
   80   2HD   PRO  10          1HD       PRO  10   8.186   6.119   1.726
   81    H    LYS  11           H        LYS  11   5.479   7.168   6.661
   82    HA   LYS  11           HA       LYS  11   3.734   4.953   6.830
   83   1HB   LYS  11          2HB       LYS  11   2.927   5.942   8.950
   84   2HB   LYS  11          1HB       LYS  11   4.675   5.818   8.876
   85   1HG   LYS  11          2HG       LYS  11   4.813   8.215   8.388
   86   2HG   LYS  11          1HG       LYS  11   3.054   8.326   8.457
   87   1HD   LYS  11          2HD       LYS  11   3.121   7.518  10.776
   88   2HD   LYS  11          1HD       LYS  11   4.879   7.480  10.700
   89   1HE   LYS  11          2HE       LYS  11   4.890   9.904  10.273
   90   2HE   LYS  11          1HE       LYS  11   3.131   9.912  10.384
   91   1HZ   LYS  11          1HZ       LYS  11   5.006   9.180  12.571
   92   2HZ   LYS  11          2HZ       LYS  11   3.322   9.125  12.661
   93   3HZ   LYS  11          3HZ       LYS  11   4.089  10.599  12.467
   94    H    ILE  12           H        ILE  12   1.909   4.681   6.005
   95    HA   ILE  12           HA       ILE  12   0.182   6.942   5.144
   96    HB   ILE  12           HB       ILE  12   0.450   4.207   3.856
   97   1HG1  ILE  12          2HG1      ILE  12   1.566   6.834   2.873
   98   2HG1  ILE  12          1HG1      ILE  12   2.528   5.563   3.617
   99   1HG2  ILE  12          1HG2      ILE  12  -0.895   6.754   2.935
  100   2HG2  ILE  12          2HG2      ILE  12  -1.720   5.313   3.531
  101   3HG2  ILE  12          3HG2      ILE  12  -0.813   5.256   2.018
  102   1HD1  ILE  12          1HD1      ILE  12   2.711   5.527   1.204
  103   2HD1  ILE  12          2HD1      ILE  12   0.964   5.341   1.064
  104   3HD1  ILE  12          3HD1      ILE  12   1.937   4.064   1.807
  105    H    ARG  13           H        ARG  13  -2.002   6.707   5.570
  106    HA   ARG  13           HA       ARG  13  -2.587   4.351   7.158
  107   1HB   ARG  13          2HB       ARG  13  -3.966   7.045   7.185
  108   2HB   ARG  13          1HB       ARG  13  -4.445   5.614   8.107
  109   1HG   ARG  13          2HG       ARG  13  -2.303   5.636   9.274
  110   2HG   ARG  13          1HG       ARG  13  -1.838   7.074   8.376
  111   1HD   ARG  13          2HD       ARG  13  -3.643   8.327   9.393
  112   2HD   ARG  13          1HD       ARG  13  -4.202   6.872  10.227
  113    HE   ARG  13           HE       ARG  13  -1.469   7.551  10.717
  114   1HH1  ARG  13          1HH1      ARG  13  -4.777   8.109  11.807
  115   2HH1  ARG  13          2HH1      ARG  13  -4.336   8.442  13.413
  116   1HH2  ARG  13          1HH2      ARG  13  -0.853   8.003  12.896
  117   2HH2  ARG  13          2HH2      ARG  13  -2.036   8.396  14.051
  118    H    TYR  14           H        TYR  14  -4.854   3.605   6.932
  119    HA   TYR  14           HA       TYR  14  -5.181   2.776   4.263
  120   1HB   TYR  14          2HB       TYR  14  -7.272   2.601   6.441
  121   2HB   TYR  14          1HB       TYR  14  -7.068   1.535   5.053
  122    HD1  TYR  14           1HD      TYR  14  -6.275   2.077   8.457
  123    HD2  TYR  14           2HD      TYR  14  -4.821   0.155   4.943
  124    HE1  TYR  14           1HE      TYR  14  -4.829   0.659   9.832
  125    HE2  TYR  14           2HE      TYR  14  -3.395  -1.252   6.306
  126    HH   TYR  14           HH       TYR  14  -2.321  -1.143   8.552
  127    H    SER  15           H        SER  15  -6.669   5.285   6.174
  128    HA   SER  15           HA       SER  15  -8.834   5.981   4.511
  129   1HB   SER  15          2HB       SER  15  -7.211   7.745   6.336
  130   2HB   SER  15          1HB       SER  15  -8.850   8.070   5.760
  131    HG   SER  15           HG       SER  15  -8.901   5.673   6.820
  132    H    ASP  16           H        ASP  16  -5.403   6.590   4.198
  133    HA   ASP  16           HA       ASP  16  -5.704   8.896   2.480
  134   1HB   ASP  16          2HB       ASP  16  -3.246   7.263   3.180
  135   2HB   ASP  16          1HB       ASP  16  -3.220   8.699   2.178
  136    H    VAL  17           H        VAL  17  -5.582   5.547   2.233
  137    HA   VAL  17           HA       VAL  17  -4.465   5.481  -0.443
  138    HB   VAL  17           HB       VAL  17  -5.600   3.177   1.106
  139   1HG1  VAL  17          1HG1      VAL  17  -5.313   2.658  -1.170
  140   2HG1  VAL  17          2HG1      VAL  17  -4.061   1.831  -0.250
  141   3HG1  VAL  17          3HG1      VAL  17  -3.673   3.291  -1.176
  142   1HG2  VAL  17          1HG2      VAL  17  -3.306   2.676   1.866
  143   2HG2  VAL  17          2HG2      VAL  17  -3.913   4.205   2.507
  144   3HG2  VAL  17          3HG2      VAL  17  -2.765   4.202   1.172
  145    H    LYS  18           H        LYS  18  -5.608   5.412  -2.206
  146    HA   LYS  18           HA       LYS  18  -8.530   5.139  -2.130
  147   1HB   LYS  18          2HB       LYS  18  -6.589   5.884  -4.302
  148   2HB   LYS  18          1HB       LYS  18  -8.302   5.685  -4.593
  149   1HG   LYS  18          2HG       LYS  18  -7.067   7.675  -2.697
  150   2HG   LYS  18          1HG       LYS  18  -7.608   8.026  -4.341
  151   1HD   LYS  18          2HD       LYS  18  -9.374   7.047  -2.083
  152   2HD   LYS  18          1HD       LYS  18  -9.274   8.708  -2.658
  153   1HE   LYS  18          2HE       LYS  18 -10.010   7.943  -4.890
  154   2HE   LYS  18          1HE       LYS  18 -10.175   6.316  -4.251
  155   1HZ   LYS  18          1HZ       LYS  18 -11.709   8.695  -3.344
  156   2HZ   LYS  18          2HZ       LYS  18 -11.845   7.143  -2.683
  157   3HZ   LYS  18          3HZ       LYS  18 -12.303   7.446  -4.278
  158    H    LYS  19           H        LYS  19  -5.643   3.627  -3.301
  159    HA   LYS  19           HA       LYS  19  -7.005   1.191  -3.893
  160   1HB   LYS  19          2HB       LYS  19  -7.250   2.368  -6.017
  161   2HB   LYS  19          1HB       LYS  19  -5.534   2.754  -6.038
  162   1HG   LYS  19          2HG       LYS  19  -5.017   0.358  -6.162
  163   2HG   LYS  19          1HG       LYS  19  -6.747   0.029  -6.166
  164   1HD   LYS  19          2HD       LYS  19  -6.975   1.255  -8.265
  165   2HD   LYS  19          1HD       LYS  19  -5.247   1.612  -8.248
  166   1HE   LYS  19          2HE       LYS  19  -4.718  -0.760  -8.364
  167   2HE   LYS  19          1HE       LYS  19  -6.433  -1.167  -8.324
  168   1HZ   LYS  19          1HZ       LYS  19  -5.513  -1.254 -10.558
  169   2HZ   LYS  19          2HZ       LYS  19  -5.071   0.364 -10.471
  170   3HZ   LYS  19          3HZ       LYS  19  -6.708  -0.086 -10.457
  171    H    LEU  20           H        LEU  20  -5.602  -0.492  -3.723
  172    HA   LEU  20           HA       LEU  20  -2.748   0.092  -3.406
  173   1HB   LEU  20          2HB       LEU  20  -3.934  -0.108  -1.195
  174   2HB   LEU  20          1HB       LEU  20  -4.450  -1.703  -1.660
  175    HG   LEU  20           HG       LEU  20  -1.543  -0.949  -1.328
  176   1HD1  LEU  20          1HD1      LEU  20  -1.702  -1.973   0.875
  177   2HD1  LEU  20          2HD1      LEU  20  -3.438  -2.212   0.662
  178   3HD1  LEU  20          3HD1      LEU  20  -2.776  -0.585   0.753
  179   1HD2  LEU  20          1HD2      LEU  20  -1.198  -3.358  -1.173
  180   2HD2  LEU  20          2HD2      LEU  20  -2.047  -2.981  -2.666
  181   3HD2  LEU  20          3HD2      LEU  20  -2.941  -3.636  -1.302
  182    H    GLU  21           H        GLU  21  -1.642  -1.132  -4.796
  183    HA   GLU  21           HA       GLU  21  -2.928  -3.591  -5.718
  184   1HB   GLU  21          2HB       GLU  21  -3.189  -1.812  -7.392
  185   2HB   GLU  21          1HB       GLU  21  -1.451  -1.552  -7.395
  186   1HG   GLU  21          2HG       GLU  21  -2.163  -2.847  -9.327
  187   2HG   GLU  21          1HG       GLU  21  -1.112  -3.779  -8.256
  188    H    MET  22           H        MET  22  -1.578  -5.339  -5.739
  189    HA   MET  22           HA       MET  22   1.145  -4.737  -4.960
  190   1HB   MET  22          2HB       MET  22   1.203  -7.030  -4.020
  191   2HB   MET  22          1HB       MET  22   0.081  -5.951  -3.209
  192   1HG   MET  22          2HG       MET  22  -1.770  -7.014  -4.383
  193   2HG   MET  22          1HG       MET  22  -0.641  -8.072  -5.228
  194   1HE   MET  22          1HE       MET  22  -3.214  -9.062  -3.536
  195   2HE   MET  22          2HE       MET  22  -2.524 -10.471  -2.734
  196   3HE   MET  22          3HE       MET  22  -2.139 -10.142  -4.423
  197    H    LYS  23           H        LYS  23   2.524  -4.853  -6.474
  198    HA   LYS  23           HA       LYS  23   2.994  -7.261  -7.838
  199   1HB   LYS  23          2HB       LYS  23   3.037  -6.461 -10.150
  200   2HB   LYS  23          1HB       LYS  23   1.425  -6.283  -9.510
  201   1HG   LYS  23          2HG       LYS  23   3.419  -4.029  -9.774
  202   2HG   LYS  23          1HG       LYS  23   2.234  -4.435 -11.004
  203   1HD   LYS  23          2HD       LYS  23   0.459  -4.022  -9.375
  204   2HD   LYS  23          1HD       LYS  23   1.667  -3.534  -8.182
  205   1HE   LYS  23          2HE       LYS  23   0.750  -1.552  -9.222
  206   2HE   LYS  23          1HE       LYS  23   2.419  -1.773  -9.755
  207   1HZ   LYS  23          1HZ       LYS  23   0.963  -1.138 -11.561
  208   2HZ   LYS  23          2HZ       LYS  23  -0.011  -2.465 -11.291
  209   3HZ   LYS  23          3HZ       LYS  23   1.560  -2.690 -11.853
  210    HA   PRO  24           HA       PRO  24   7.050  -6.187  -6.927
  211   1HB   PRO  24          2HB       PRO  24   8.352  -6.922  -9.279
  212   2HB   PRO  24          1HB       PRO  24   7.965  -8.002  -7.930
  213   1HG   PRO  24          2HG       PRO  24   6.529  -7.553 -10.504
  214   2HG   PRO  24          1HG       PRO  24   6.773  -9.057  -9.603
  215   1HD   PRO  24          2HD       PRO  24   4.438  -7.787  -9.573
  216   2HD   PRO  24          1HD       PRO  24   5.033  -8.577  -8.110
  217    H    LYS  25           H        LYS  25   5.630  -4.691  -9.623
  218    HA   LYS  25           HA       LYS  25   5.829  -2.680 -10.619
  219   1HB   LYS  25          2HB       LYS  25   6.248  -1.765  -8.396
  220   2HB   LYS  25          1HB       LYS  25   7.957  -2.101  -8.567
  221   1HG   LYS  25          2HG       LYS  25   8.247  -0.426 -10.179
  222   2HG   LYS  25          1HG       LYS  25   6.509  -0.283 -10.460
  223   1HD   LYS  25          2HD       LYS  25   6.163   0.520  -8.302
  224   2HD   LYS  25          1HD       LYS  25   7.853   0.337  -7.843
  225   1HE   LYS  25          2HE       LYS  25   6.740   2.201  -9.969
  226   2HE   LYS  25          1HE       LYS  25   7.304   2.703  -8.379
  227   1HZ   LYS  25          1HZ       LYS  25   8.990   1.482 -10.502
  228   2HZ   LYS  25          2HZ       LYS  25   9.530   1.980  -8.974
  229   3HZ   LYS  25          3HZ       LYS  25   8.969   3.100 -10.095
  230    H    TYR  26           H        TYR  26   8.955  -4.109  -9.854
  231    HA   TYR  26           HA       TYR  26   9.698  -3.859 -12.668
  232   1HB   TYR  26          2HB       TYR  26  11.418  -3.895 -10.184
  233   2HB   TYR  26          1HB       TYR  26  12.083  -4.314 -11.746
  234    HD1  TYR  26           1HD      TYR  26  12.695  -2.687 -13.261
  235    HD2  TYR  26           2HD      TYR  26  10.490  -1.603  -9.812
  236    HE1  TYR  26           1HE      TYR  26  13.110  -0.293 -13.752
  237    HE2  TYR  26           2HE      TYR  26  10.905   0.779 -10.273
  238    HH   TYR  26           HH       TYR  26  12.525   2.103 -11.464
  239    HA   PRO  27           HA       PRO  27   9.061  -8.284 -12.763
  240   1HB   PRO  27          2HB       PRO  27  11.213  -8.198 -14.812
  241   2HB   PRO  27          1HB       PRO  27   9.590  -8.887 -14.921
  242   1HG   PRO  27          2HG       PRO  27  10.195  -6.589 -16.142
  243   2HG   PRO  27          1HG       PRO  27   8.607  -6.850 -15.403
  244   1HD   PRO  27          2HD       PRO  27  10.892  -5.195 -14.442
  245   2HD   PRO  27          1HD       PRO  27   9.146  -4.946 -14.276
  246    H    HIS  28           H        HIS  28  12.116  -6.763 -12.445
  247    HA   HIS  28           HA       HIS  28  13.500  -9.178 -11.604
  248   1HB   HIS  28          2HB       HIS  28  15.502  -7.795 -11.336
  249   2HB   HIS  28          1HB       HIS  28  14.772  -7.513 -12.911
  250    HD1  HIS  28           1HD      HIS  28  15.016  -5.920  -9.486
  251    HD2  HIS  28           2HD      HIS  28  14.369  -4.754 -13.430
  252    HE1  HIS  28           1HE      HIS  28  15.031  -3.420  -9.520
  253    HE2  HIS  28           2HE      HIS  28  15.167  -2.887 -11.914
  254    H    CYS  29           H        CYS  29  11.210  -7.819  -9.950
  255    HA   CYS  29           HA       CYS  29  12.779  -7.530  -7.499
  256   1HB   CYS  29          2HB       CYS  29  10.063  -6.546  -8.311
  257   2HB   CYS  29          1HB       CYS  29  10.607  -6.438  -6.655
  258    H    GLU  30           H        GLU  30  12.126  -8.653  -5.659
  259    HA   GLU  30           HA       GLU  30  10.850 -11.170  -6.238
  260   1HB   GLU  30          2HB       GLU  30  12.971 -11.112  -5.015
  261   2HB   GLU  30          1HB       GLU  30  12.206 -10.193  -3.730
  262   1HG   GLU  30          2HG       GLU  30  10.689 -12.054  -3.443
  263   2HG   GLU  30          1HG       GLU  30  11.675 -12.939  -4.619
  264    H    GLU  31           H        GLU  31   8.861 -11.710  -5.607
  265    HA   GLU  31           HA       GLU  31   6.893 -11.795  -4.577
  266   1HB   GLU  31          2HB       GLU  31   8.362 -11.596  -2.480
  267   2HB   GLU  31          1HB       GLU  31   8.019  -9.881  -2.490
  268   1HG   GLU  31          2HG       GLU  31   5.671 -10.322  -2.075
  269   2HG   GLU  31          1HG       GLU  31   5.951 -12.062  -2.191
  270    H    LYS  32           H        LYS  32   5.043 -10.161  -3.777
  271    HA   LYS  32           HA       LYS  32   4.842  -8.249  -5.934
  272   1HB   LYS  32          2HB       LYS  32   2.826  -8.930  -3.805
  273   2HB   LYS  32          1HB       LYS  32   2.547  -8.004  -5.272
  274   1HG   LYS  32          2HG       LYS  32   3.445 -10.810  -5.189
  275   2HG   LYS  32          1HG       LYS  32   1.722 -10.345  -5.383
  276   1HD   LYS  32          2HD       LYS  32   2.540  -9.145  -7.481
  277   2HD   LYS  32          1HD       LYS  32   4.095  -9.951  -7.154
  278   1HE   LYS  32          2HE       LYS  32   3.015 -12.123  -7.310
  279   2HE   LYS  32          1HE       LYS  32   1.465 -11.346  -7.602
  280   1HZ   LYS  32          1HZ       LYS  32   3.839 -11.230  -9.389
  281   2HZ   LYS  32          2HZ       LYS  32   2.378 -10.445  -9.691
  282   3HZ   LYS  32          3HZ       LYS  32   2.451 -12.120  -9.655
  283    H    MET  33           H        MET  33   5.614  -6.381  -5.648
  284    HA   MET  33           HA       MET  33   5.984  -5.099  -3.160
  285   1HB   MET  33          2HB       MET  33   6.203  -4.037  -5.939
  286   2HB   MET  33          1HB       MET  33   6.177  -2.924  -4.595
  287   1HG   MET  33          2HG       MET  33   8.443  -3.466  -5.236
  288   2HG   MET  33          1HG       MET  33   8.081  -3.985  -3.597
  289   1HE   MET  33          1HE       MET  33  10.517  -6.697  -4.443
  290   2HE   MET  33          2HE       MET  33   9.789  -5.604  -3.247
  291   3HE   MET  33          3HE       MET  33  10.579  -4.926  -4.679
  292    H    VAL  34           H        VAL  34   4.975  -3.132  -2.512
  293    HA   VAL  34           HA       VAL  34   2.103  -3.310  -3.000
  294    HB   VAL  34           HB       VAL  34   3.628  -2.106  -0.706
  295   1HG1  VAL  34          1HG1      VAL  34   1.483  -0.992  -1.067
  296   2HG1  VAL  34          2HG1      VAL  34   1.444  -1.949   0.413
  297   3HG1  VAL  34          3HG1      VAL  34   0.663  -2.550  -1.054
  298   1HG2  VAL  34          1HG2      VAL  34   2.803  -4.035   0.575
  299   2HG2  VAL  34          2HG2      VAL  34   3.828  -4.529  -0.776
  300   3HG2  VAL  34          3HG2      VAL  34   2.076  -4.684  -0.894
  301    H    ILE  35           H        ILE  35   1.430  -1.879  -4.456
  302    HA   ILE  35           HA       ILE  35   2.721   0.738  -4.628
  303    HB   ILE  35           HB       ILE  35   0.578  -0.472  -6.383
  304   1HG1  ILE  35          2HG1      ILE  35   2.554  -1.849  -6.492
  305   2HG1  ILE  35          1HG1      ILE  35   2.319  -0.972  -7.993
  306   1HG2  ILE  35          1HG2      ILE  35   1.261   1.247  -8.008
  307   2HG2  ILE  35          2HG2      ILE  35   2.401   1.894  -6.828
  308   3HG2  ILE  35          3HG2      ILE  35   0.672   1.959  -6.504
  309   1HD1  ILE  35          1HD1      ILE  35   4.084   0.613  -7.312
  310   2HD1  ILE  35          2HD1      ILE  35   4.647  -1.044  -7.456
  311   3HD1  ILE  35          3HD1      ILE  35   4.356  -0.351  -5.850
  312    H    ILE  36           H        ILE  36   1.835   2.224  -3.416
  313    HA   ILE  36           HA       ILE  36  -0.985   1.945  -2.765
  314    HB   ILE  36           HB       ILE  36   1.198   3.390  -1.283
  315   1HG1  ILE  36          2HG1      ILE  36  -0.508   0.979  -0.664
  316   2HG1  ILE  36          1HG1      ILE  36   1.218   1.009  -1.016
  317   1HG2  ILE  36          1HG2      ILE  36  -0.879   4.702  -1.159
  318   2HG2  ILE  36          2HG2      ILE  36  -0.507   3.941   0.392
  319   3HG2  ILE  36          3HG2      ILE  36  -1.749   3.252  -0.645
  320   1HD1  ILE  36          1HD1      ILE  36   0.743   0.724   1.345
  321   2HD1  ILE  36          2HD1      ILE  36  -0.128   2.275   1.296
  322   3HD1  ILE  36          3HD1      ILE  36   1.620   2.235   1.004
  323    H    THR  37           H        THR  37  -2.298   3.131  -3.599
  324    HA   THR  37           HA       THR  37  -1.518   5.547  -5.037
  325    HB   THR  37           HB       THR  37  -4.030   3.862  -5.142
  326    HG1  THR  37           1HG      THR  37  -1.619   3.765  -6.330
  327   1HG2  THR  37          1HG2      THR  37  -3.215   6.195  -6.917
  328   2HG2  THR  37          2HG2      THR  37  -4.539   6.202  -5.744
  329   3HG2  THR  37          3HG2      THR  37  -4.629   5.167  -7.156
  330    H    THR  38           H        THR  38  -1.914   7.418  -4.044
  331    HA   THR  38           HA       THR  38  -3.721   7.466  -1.755
  332    HB   THR  38           HB       THR  38  -2.607   9.664  -1.241
  333    HG1  THR  38           1HG      THR  38  -0.688   8.979  -3.247
  334   1HG2  THR  38          1HG2      THR  38  -0.425   8.719  -0.582
  335   2HG2  THR  38          2HG2      THR  38  -0.749   7.306  -1.573
  336   3HG2  THR  38          3HG2      THR  38  -1.759   7.638  -0.157
  337    H    LYS  39           H        LYS  39  -5.118   9.354  -1.501
  338    HA   LYS  39           HA       LYS  39  -6.597   9.958  -3.904
  339   1HB   LYS  39          2HB       LYS  39  -7.624   9.684  -1.654
  340   2HB   LYS  39          1HB       LYS  39  -6.790  11.124  -1.118
  341   1HG   LYS  39          2HG       LYS  39  -8.101  12.491  -2.615
  342   2HG   LYS  39          1HG       LYS  39  -8.881  11.054  -3.287
  343   1HD   LYS  39          2HD       LYS  39  -9.780  10.514  -1.071
  344   2HD   LYS  39          1HD       LYS  39  -9.016  11.959  -0.414
  345   1HE   LYS  39          2HE       LYS  39 -10.404  13.357  -1.836
  346   2HE   LYS  39          1HE       LYS  39 -11.122  11.926  -2.576
  347   1HZ   LYS  39          1HZ       LYS  39 -12.001  11.297  -0.425
  348   2HZ   LYS  39          2HZ       LYS  39 -12.566  12.819  -0.840
  349   3HZ   LYS  39          3HZ       LYS  39 -11.326  12.653   0.295
  350    H    SER  40           H        SER  40  -4.717  11.715  -1.662
  351    HA   SER  40           HA       SER  40  -3.047  13.195  -3.137
  352   1HB   SER  40          2HB       SER  40  -5.520  14.845  -2.363
  353   2HB   SER  40          1HB       SER  40  -3.962  15.564  -2.756
  354    HG   SER  40           HG       SER  40  -5.419  13.859  -4.460
  355    H    VAL  41           H        VAL  41  -5.244  14.164  -0.541
  356    HA   VAL  41           HA       VAL  41  -4.873  14.669   1.617
  357    HB   VAL  41           HB       VAL  41  -4.702  12.488   2.958
  358   1HG1  VAL  41          1HG1      VAL  41  -6.827  13.515   2.232
  359   2HG1  VAL  41          2HG1      VAL  41  -6.900  11.753   2.189
  360   3HG1  VAL  41          3HG1      VAL  41  -6.692  12.657   0.694
  361   1HG2  VAL  41          1HG2      VAL  41  -4.625  11.358   0.152
  362   2HG2  VAL  41          2HG2      VAL  41  -5.007  10.439   1.593
  363   3HG2  VAL  41          3HG2      VAL  41  -3.399  11.116   1.403
  364    H    SER  42           H        SER  42  -2.274  12.337   1.253
  365    HA   SER  42           HA       SER  42  -0.649  13.372   3.268
  366   1HB   SER  42          2HB       SER  42   1.051  11.922   2.179
  367   2HB   SER  42          1HB       SER  42  -0.479  11.092   2.490
  368    HG   SER  42           HG       SER  42  -0.707  12.163   0.102
  369    H    ARG  43           H        ARG  43   1.567  14.172   2.795
  370    HA   ARG  43           HA       ARG  43   1.439  16.583   1.286
  371   1HB   ARG  43          2HB       ARG  43   3.762  15.257   2.692
  372   2HB   ARG  43          1HB       ARG  43   3.753  16.915   2.099
  373   1HG   ARG  43          2HG       ARG  43   1.941  17.478   3.610
  374   2HG   ARG  43          1HG       ARG  43   1.860  15.814   4.169
  375   1HD   ARG  43          2HD       ARG  43   4.153  16.027   5.036
  376   2HD   ARG  43          1HD       ARG  43   4.172  17.715   4.517
  377    HE   ARG  43           HE       ARG  43   1.925  17.469   6.026
  378   1HH1  ARG  43          1HH1      ARG  43   5.350  16.938   6.638
  379   2HH1  ARG  43          2HH1      ARG  43   5.295  17.281   8.293
  380   1HH2  ARG  43          1HH2      ARG  43   1.768  17.936   8.283
  381   2HH2  ARG  43          2HH2      ARG  43   3.131  17.902   9.292
  382    H    TYR  44           H        TYR  44   1.976  13.477   0.353
  383    HA   TYR  44           HA       TYR  44   4.034  13.818  -1.584
  384   1HB   TYR  44          2HB       TYR  44   3.303  11.781  -0.153
  385   2HB   TYR  44          1HB       TYR  44   2.092  11.553  -1.397
  386    HD1  TYR  44           1HD      TYR  44   2.632  10.068  -3.080
  387    HD2  TYR  44           2HD      TYR  44   5.697  12.175  -1.094
  388    HE1  TYR  44           1HE      TYR  44   4.306   8.785  -4.350
  389    HE2  TYR  44           2HE      TYR  44   7.417  10.902  -2.364
  390    HH   TYR  44           HH       TYR  44   6.603   8.914  -5.047
  391    H    ARG  45           H        ARG  45   0.881  14.834  -1.481
  392    HA   ARG  45           HA       ARG  45  -0.547  15.769  -2.938
  393   1HB   ARG  45          2HB       ARG  45   1.841  15.741  -4.767
  394   2HB   ARG  45          1HB       ARG  45   0.325  16.526  -5.166
  395   1HG   ARG  45          2HG       ARG  45   2.103  17.202  -2.825
  396   2HG   ARG  45          1HG       ARG  45   1.939  18.128  -4.318
  397   1HD   ARG  45          2HD       ARG  45  -0.220  17.626  -2.258
  398   2HD   ARG  45          1HD       ARG  45   0.611  19.143  -2.561
  399    HE   ARG  45           HE       ARG  45  -0.427  18.703  -4.954
  400   1HH1  ARG  45          1HH1      ARG  45  -2.023  18.385  -1.777
  401   2HH1  ARG  45          2HH1      ARG  45  -3.561  18.782  -2.403
  402   1HH2  ARG  45          1HH2      ARG  45  -2.543  19.217  -5.727
  403   2HH2  ARG  45          2HH2      ARG  45  -3.873  19.258  -4.633
  404    H    GLY  46           H        GLY  46  -0.227  12.696  -3.123
  405   1HA   GLY  46          2HA       GLY  46  -2.020  11.407  -4.046
  406   2HA   GLY  46          1HA       GLY  46  -2.158  12.585  -5.338
  407    H    GLN  47           H        GLN  47   1.013  11.848  -4.761
  408    HA   GLN  47           HA       GLN  47   1.184  10.157  -7.061
  409   1HB   GLN  47          2HB       GLN  47   3.277  11.399  -5.286
  410   2HB   GLN  47          1HB       GLN  47   3.714  10.149  -6.435
  411   1HG   GLN  47          2HG       GLN  47   4.166  12.371  -7.320
  412   2HG   GLN  47          1HG       GLN  47   2.951  11.546  -8.276
  413   1HE2  GLN  47          1HE2      GLN  47   0.867  12.325  -8.271
  414   2HE2  GLN  47          2HE2      GLN  47   0.448  13.894  -7.682
  415    H    GLU  48           H        GLU  48   2.504   8.136  -6.987
  416    HA   GLU  48           HA       GLU  48   1.176   6.495  -4.975
  417   1HB   GLU  48          2HB       GLU  48   2.821   5.621  -7.366
  418   2HB   GLU  48          1HB       GLU  48   1.936   4.564  -6.291
  419   1HG   GLU  48          2HG       GLU  48   0.720   4.772  -8.328
  420   2HG   GLU  48          1HG       GLU  48  -0.172   5.643  -7.085
  421    H    HIS  49           H        HIS  49   2.146   5.411  -3.488
  422    HA   HIS  49           HA       HIS  49   5.062   5.731  -3.088
  423   1HB   HIS  49          2HB       HIS  49   2.929   4.835  -1.134
  424   2HB   HIS  49          1HB       HIS  49   4.632   4.974  -0.768
  425    HD1  HIS  49           1HD      HIS  49   5.508   7.345  -0.243
  426    HD2  HIS  49           2HD      HIS  49   1.461   7.214  -1.151
  427    HE1  HIS  49           1HE      HIS  49   4.560   9.464   0.658
  428    HE2  HIS  49           2HE      HIS  49   2.106   9.108   0.487
  429    H    CYS  50           H        CYS  50   6.254   3.728  -2.417
  430    HA   CYS  50           HA       CYS  50   4.692   1.380  -2.859
  431   1HB   CYS  50          2HB       CYS  50   6.690   0.336  -4.092
  432   2HB   CYS  50          1HB       CYS  50   5.721   1.492  -4.991
  433    H    LEU  51           H        LEU  51   4.911  -0.051  -1.432
  434    HA   LEU  51           HA       LEU  51   6.889   0.448   0.664
  435   1HB   LEU  51          2HB       LEU  51   4.478   0.590   1.313
  436   2HB   LEU  51          1HB       LEU  51   4.255  -1.045   0.777
  437    HG   LEU  51           HG       LEU  51   5.632  -1.879   2.607
  438   1HD1  LEU  51          1HD1      LEU  51   6.433  -0.363   4.340
  439   2HD1  LEU  51          2HD1      LEU  51   5.901   1.024   3.393
  440   3HD1  LEU  51          3HD1      LEU  51   7.208   0.000   2.790
  441   1HD2  LEU  51          1HD2      LEU  51   4.158  -1.263   4.440
  442   2HD2  LEU  51          2HD2      LEU  51   3.216  -1.476   2.955
  443   3HD2  LEU  51          3HD2      LEU  51   3.595   0.138   3.536
  444    H    HIS  52           H        HIS  52   8.234  -1.128   1.292
  445    HA   HIS  52           HA       HIS  52   8.663  -3.211  -0.627
  446   1HB   HIS  52          2HB       HIS  52  10.548  -1.872   0.285
  447   2HB   HIS  52          1HB       HIS  52  10.219  -2.531   1.882
  448    HD1  HIS  52           1HD      HIS  52  11.942  -4.229   2.428
  449    HD2  HIS  52           2HD      HIS  52  10.932  -4.289  -1.596
  450    HE1  HIS  52           1HE      HIS  52  13.211  -6.150   1.435
  451    HE2  HIS  52           2HE      HIS  52  12.895  -5.845  -1.029
  452    HA   PRO  53           HA       PRO  53   5.970  -5.947   1.626
  453   1HB   PRO  53          2HB       PRO  53   6.404  -8.128   0.116
  454   2HB   PRO  53          1HB       PRO  53   5.335  -6.795  -0.359
  455   1HG   PRO  53          2HG       PRO  53   8.129  -7.408  -1.221
  456   2HG   PRO  53          1HG       PRO  53   6.752  -6.781  -2.151
  457   1HD   PRO  53          2HD       PRO  53   8.767  -5.210  -1.263
  458   2HD   PRO  53          1HD       PRO  53   7.106  -4.624  -1.479
  459    H    LYS  54           H        LYS  54   9.125  -6.044   1.989
  460    HA   LYS  54           HA       LYS  54   9.237  -8.688   3.140
  461   1HB   LYS  54          2HB       LYS  54  11.322  -6.648   2.635
  462   2HB   LYS  54          1HB       LYS  54  11.622  -7.827   3.908
  463   1HG   LYS  54          2HG       LYS  54  12.546  -8.502   1.756
  464   2HG   LYS  54          1HG       LYS  54  11.366  -9.647   2.357
  465   1HD   LYS  54          2HD       LYS  54   9.687  -8.444   0.850
  466   2HD   LYS  54          1HD       LYS  54  11.083  -7.639   0.132
  467   1HE   LYS  54          2HE       LYS  54  10.617 -10.587   0.307
  468   2HE   LYS  54          1HE       LYS  54  10.431  -9.612  -1.152
  469   1HZ   LYS  54          1HZ       LYS  54  12.970  -9.997   0.338
  470   2HZ   LYS  54          2HZ       LYS  54  12.789  -9.123  -1.101
  471   3HZ   LYS  54          3HZ       LYS  54  12.546 -10.813  -1.057
  472    H    LEU  55           H        LEU  55   8.318  -5.675   4.135
  473    HA   LEU  55           HA       LEU  55   9.139  -5.939   6.883
  474   1HB   LEU  55          2HB       LEU  55   7.323  -3.971   5.506
  475   2HB   LEU  55          1HB       LEU  55   7.863  -3.833   7.161
  476    HG   LEU  55           HG       LEU  55   9.626  -3.696   4.714
  477   1HD1  LEU  55          1HD1      LEU  55   9.904  -1.355   5.333
  478   2HD1  LEU  55          2HD1      LEU  55   8.731  -1.561   6.634
  479   3HD1  LEU  55          3HD1      LEU  55   8.221  -1.741   4.957
  480   1HD2  LEU  55          1HD2      LEU  55  10.299  -3.347   7.638
  481   2HD2  LEU  55          2HD2      LEU  55  11.391  -3.034   6.289
  482   3HD2  LEU  55          3HD2      LEU  55  10.822  -4.669   6.593
  483    H    GLN  56           H        GLN  56   7.823  -6.466   8.549
  484    HA   GLN  56           HA       GLN  56   5.643  -8.224   7.934
  485   1HB   GLN  56          2HB       GLN  56   5.542  -8.617  10.358
  486   2HB   GLN  56          1HB       GLN  56   7.187  -8.752   9.756
  487   1HG   GLN  56          2HG       GLN  56   7.649  -6.487  10.572
  488   2HG   GLN  56          1HG       GLN  56   6.015  -6.402  11.232
  489   1HE2  GLN  56          1HE2      GLN  56   5.504  -7.710  12.986
  490   2HE2  GLN  56          2HE2      GLN  56   6.708  -8.380  14.008
  491    H    SER  57           H        SER  57   5.943  -4.947   9.032
  492    HA   SER  57           HA       SER  57   3.290  -4.599   9.894
  493   1HB   SER  57          2HB       SER  57   5.216  -2.565   8.749
  494   2HB   SER  57          1HB       SER  57   3.759  -2.194   9.676
  495    HG   SER  57           HG       SER  57   6.230  -2.977  10.515
  496    H    THR  58           H        THR  58   4.805  -4.661   6.745
  497    HA   THR  58           HA       THR  58   2.884  -3.384   5.210
  498    HB   THR  58           HB       THR  58   4.634  -5.735   4.433
  499    HG1  THR  58           1HG      THR  58   5.151  -2.933   4.570
  500   1HG2  THR  58          1HG2      THR  58   2.918  -5.146   2.763
  501   2HG2  THR  58          2HG2      THR  58   4.529  -4.717   2.188
  502   3HG2  THR  58          3HG2      THR  58   3.457  -3.469   2.808
  503    H    LYS  59           H        LYS  59   3.242  -6.786   6.240
  504    HA   LYS  59           HA       LYS  59   1.050  -7.756   4.788
  505   1HB   LYS  59          2HB       LYS  59   2.488  -8.866   7.168
  506   2HB   LYS  59          1HB       LYS  59   1.095  -9.683   6.466
  507   1HG   LYS  59          2HG       LYS  59   3.040 -10.699   5.590
  508   2HG   LYS  59          1HG       LYS  59   2.340  -9.734   4.305
  509   1HD   LYS  59          2HD       LYS  59   3.972  -7.958   4.732
  510   2HD   LYS  59          1HD       LYS  59   4.681  -8.921   6.027
  511   1HE   LYS  59          2HE       LYS  59   6.023  -9.125   4.028
  512   2HE   LYS  59          1HE       LYS  59   5.251 -10.666   4.384
  513   1HZ   LYS  59          1HZ       LYS  59   4.282  -8.710   2.360
  514   2HZ   LYS  59          2HZ       LYS  59   3.625 -10.220   2.642
  515   3HZ   LYS  59          3HZ       LYS  59   5.170 -10.067   1.985
  516    H    ARG  60           H        ARG  60   1.151  -6.548   8.162
  517    HA   ARG  60           HA       ARG  60  -1.570  -7.012   8.601
  518   1HB   ARG  60          2HB       ARG  60   0.411  -5.176   9.793
  519   2HB   ARG  60          1HB       ARG  60  -1.267  -4.737   9.969
  520   1HG   ARG  60          2HG       ARG  60  -0.778  -5.873  11.928
  521   2HG   ARG  60          1HG       ARG  60  -1.603  -7.028  10.947
  522   1HD   ARG  60          2HD       ARG  60   1.402  -6.941  11.024
  523   2HD   ARG  60          1HD       ARG  60   0.459  -7.908  12.150
  524    HE   ARG  60           HE       ARG  60  -0.429  -8.652   9.693
  525   1HH1  ARG  60          1HH1      ARG  60   2.765  -8.493  11.182
  526   2HH1  ARG  60          2HH1      ARG  60   3.350  -9.884  10.395
  527   1HH2  ARG  60          1HH2      ARG  60   0.364 -10.561   8.646
  528   2HH2  ARG  60          2HH2      ARG  60   1.966 -11.085   8.908
  529    H    PHE  61           H        PHE  61   0.128  -4.238   7.250
  530    HA   PHE  61           HA       PHE  61  -2.022  -2.504   7.057
  531   1HB   PHE  61          2HB       PHE  61   0.480  -2.099   6.645
  532   2HB   PHE  61          1HB       PHE  61   0.131  -2.701   5.022
  533    HD1  PHE  61           1HD      PHE  61  -0.969  -1.263   3.371
  534    HD2  PHE  61           2HD      PHE  61  -0.541   0.019   7.411
  535    HE1  PHE  61           1HE      PHE  61  -1.611   1.032   2.720
  536    HE2  PHE  61           2HE      PHE  61  -1.189   2.302   6.758
  537    HZ   PHE  61           HZ       PHE  61  -1.698   2.835   4.458
  538    H    ILE  62           H        ILE  62  -0.831  -4.927   4.758
  539    HA   ILE  62           HA       ILE  62  -2.715  -4.306   2.733
  540    HB   ILE  62           HB       ILE  62  -1.317  -6.961   3.152
  541   1HG1  ILE  62          2HG1      ILE  62   0.359  -5.223   2.972
  542   2HG1  ILE  62          1HG1      ILE  62   0.302  -6.113   1.456
  543   1HG2  ILE  62          1HG2      ILE  62  -3.225  -7.061   1.667
  544   2HG2  ILE  62          2HG2      ILE  62  -1.727  -7.288   0.752
  545   3HG2  ILE  62          3HG2      ILE  62  -2.578  -5.735   0.704
  546   1HD1  ILE  62          1HD1      ILE  62  -0.928  -3.445   2.020
  547   2HD1  ILE  62          2HD1      ILE  62  -1.089  -4.326   0.515
  548   3HD1  ILE  62          3HD1      ILE  62   0.503  -3.745   1.030
  549    H    LYS  63           H        LYS  63  -2.615  -6.883   5.157
  550    HA   LYS  63           HA       LYS  63  -5.141  -7.974   4.388
  551   1HB   LYS  63          2HB       LYS  63  -3.526  -8.291   6.908
  552   2HB   LYS  63          1HB       LYS  63  -5.159  -8.901   6.849
  553   1HG   LYS  63          2HG       LYS  63  -3.563 -10.707   6.501
  554   2HG   LYS  63          1HG       LYS  63  -4.507 -10.470   5.048
  555   1HD   LYS  63          2HD       LYS  63  -1.751  -9.282   5.373
  556   2HD   LYS  63          1HD       LYS  63  -1.973 -10.941   4.848
  557   1HE   LYS  63          2HE       LYS  63  -3.102  -8.505   3.461
  558   2HE   LYS  63          1HE       LYS  63  -1.628  -9.342   2.985
  559   1HZ   LYS  63          1HZ       LYS  63  -4.361 -10.540   2.987
  560   2HZ   LYS  63          2HZ       LYS  63  -2.948 -11.321   2.543
  561   3HZ   LYS  63          3HZ       LYS  63  -3.503 -10.017   1.635
  562    H    TRP  64           H        TRP  64  -4.286  -5.404   6.500
  563    HA   TRP  64           HA       TRP  64  -6.844  -5.129   7.763
  564   1HB   TRP  64          2HB       TRP  64  -4.387  -4.277   8.399
  565   2HB   TRP  64          1HB       TRP  64  -4.930  -2.855   7.528
  566    HD1  TRP  64           HD       TRP  64  -4.895  -4.383  10.854
  567    HE1  TRP  64           1HE      TRP  64  -6.458  -3.102  12.485
  568    HE3  TRP  64           3HE      TRP  64  -7.514  -1.529   7.486
  569    HZ2  TRP  64           2HZ      TRP  64  -8.488  -1.173  12.356
  570    HZ3  TRP  64           3HZ      TRP  64  -9.242  -0.004   8.329
  571    HH2  TRP  64           HH       TRP  64  -9.718   0.168  10.720
  572    H    TYR  65           H        TYR  65  -5.097  -3.615   5.012
  573    HA   TYR  65           HA       TYR  65  -7.002  -1.693   4.363
  574   1HB   TYR  65          2HB       TYR  65  -4.802  -1.623   3.342
  575   2HB   TYR  65          1HB       TYR  65  -5.081  -3.158   2.511
  576    HD1  TYR  65           1HD      TYR  65  -6.437  -3.213   0.482
  577    HD2  TYR  65           2HD      TYR  65  -5.890   0.424   2.625
  578    HE1  TYR  65           1HE      TYR  65  -7.345  -1.953  -1.424
  579    HE2  TYR  65           2HE      TYR  65  -6.809   1.678   0.696
  580    HH   TYR  65           HH       TYR  65  -7.012   1.359  -1.732
  581    H    ASN  66           H        ASN  66  -6.804  -5.071   3.566
  582    HA   ASN  66           HA       ASN  66  -8.963  -5.155   1.765
  583   1HB   ASN  66          2HB       ASN  66  -7.762  -7.262   3.532
  584   2HB   ASN  66          1HB       ASN  66  -9.195  -7.607   2.576
  585   1HD2  ASN  66          1HD2      ASN  66  -5.776  -6.868   2.465
  586   2HD2  ASN  66          2HD2      ASN  66  -5.578  -7.327   0.823
  587    H    ALA  67           H        ALA  67  -8.901  -5.196   5.257
  588    HA   ALA  67           HA       ALA  67 -11.681  -5.730   5.562
  589   1HB   ALA  67          1HB       ALA  67  -9.753  -4.373   7.459
  590   2HB   ALA  67          2HB       ALA  67 -10.073  -6.104   7.394
  591   3HB   ALA  67          3HB       ALA  67 -11.347  -4.990   7.886
  592    H    TRP  68           H        TRP  68  -9.683  -2.858   5.489
  593    HA   TRP  68           HA       TRP  68 -11.636  -0.887   5.807
  594   1HB   TRP  68          2HB       TRP  68  -9.380  -0.203   5.999
  595   2HB   TRP  68          1HB       TRP  68  -8.953  -0.922   4.457
  596    HD1  TRP  68           HD       TRP  68  -8.485   0.812   2.673
  597    HE1  TRP  68           1HE      TRP  68  -9.283   3.203   2.128
  598    HE3  TRP  68           3HE      TRP  68 -11.880   1.464   6.460
  599    HZ2  TRP  68           2HZ      TRP  68 -11.077   5.075   3.112
  600    HZ3  TRP  68           3HZ      TRP  68 -13.098   3.605   6.562
  601    HH2  TRP  68           HH       TRP  68 -12.684   5.369   4.892
  602    H    ASN  69           H        ASN  69 -10.485  -2.453   2.890
  603    HA   ASN  69           HA       ASN  69 -11.873  -0.945   0.973
  604   1HB   ASN  69          2HB       ASN  69 -10.017  -2.590   0.525
  605   2HB   ASN  69          1HB       ASN  69 -11.145  -3.893   0.845
  606   1HD2  ASN  69          1HD2      ASN  69  -9.581  -3.262  -1.545
  607   2HD2  ASN  69          2HD2      ASN  69 -10.712  -3.107  -2.826
  608    H    GLU  70           H        GLU  70 -12.871  -3.758   2.844
  609    HA   GLU  70           HA       GLU  70 -15.452  -3.975   1.633
  610   1HB   GLU  70          2HB       GLU  70 -14.416  -4.991   4.277
  611   2HB   GLU  70          1HB       GLU  70 -15.960  -5.432   3.571
  612   1HG   GLU  70          2HG       GLU  70 -13.259  -6.006   2.375
  613   2HG   GLU  70          1HG       GLU  70 -14.248  -7.153   3.273
  614    H    LYS  71           H        LYS  71 -14.171  -2.543   4.602
  615    HA   LYS  71           HA       LYS  71 -16.582  -1.812   5.817
  616   1HB   LYS  71          2HB       LYS  71 -14.402  -2.115   6.946
  617   2HB   LYS  71          1HB       LYS  71 -13.806  -0.684   6.142
  618   1HG   LYS  71          2HG       LYS  71 -14.344  -0.186   8.413
  619   2HG   LYS  71          1HG       LYS  71 -15.450   0.662   7.324
  620   1HD   LYS  71          2HD       LYS  71 -16.656  -0.269   9.259
  621   2HD   LYS  71          1HD       LYS  71 -17.183  -1.025   7.762
  622   1HE   LYS  71          2HE       LYS  71 -16.912  -2.674   9.554
  623   2HE   LYS  71          1HE       LYS  71 -15.780  -2.982   8.245
  624   1HZ   LYS  71          1HZ       LYS  71 -14.025  -1.955   9.588
  625   2HZ   LYS  71          2HZ       LYS  71 -14.757  -3.202  10.427
  626   3HZ   LYS  71          3HZ       LYS  71 -15.141  -1.617  10.810
  627    H    ARG  72           H        ARG  72 -14.589  -0.179   3.451
  628    HA   ARG  72           HA       ARG  72 -15.991   2.355   3.738
  629   1HB   ARG  72          2HB       ARG  72 -14.535   3.168   1.965
  630   2HB   ARG  72          1HB       ARG  72 -13.558   2.233   3.087
  631   1HG   ARG  72          2HG       ARG  72 -13.630   0.345   1.565
  632   2HG   ARG  72          1HG       ARG  72 -14.645   1.267   0.462
  633   1HD   ARG  72          2HD       ARG  72 -12.820   2.941   0.297
  634   2HD   ARG  72          1HD       ARG  72 -11.816   1.880   1.272
  635    HE   ARG  72           HE       ARG  72 -12.991   0.678  -1.089
  636   1HH1  ARG  72          1HH1      ARG  72 -10.144   2.324   0.189
  637   2HH1  ARG  72          2HH1      ARG  72  -9.072   1.616  -0.954
  638   1HH2  ARG  72          1HH2      ARG  72 -11.466  -0.226  -2.706
  639   2HH2  ARG  72          2HH2      ARG  72  -9.823   0.204  -2.592
  640    H    ARG  73           H        ARG  73 -16.405  -0.562   2.116
  641    HA   ARG  73           HA       ARG  73 -17.837   0.524  -0.170
  642   1HB   ARG  73          2HB       ARG  73 -16.313  -1.474  -0.280
  643   2HB   ARG  73          1HB       ARG  73 -17.478  -2.335   0.708
  644   1HG   ARG  73          2HG       ARG  73 -19.170  -1.980  -1.055
  645   2HG   ARG  73          1HG       ARG  73 -17.917  -1.226  -2.045
  646   1HD   ARG  73          2HD       ARG  73 -18.008  -4.068  -1.053
  647   2HD   ARG  73          1HD       ARG  73 -18.129  -3.503  -2.718
  648    HE   ARG  73           HE       ARG  73 -15.686  -2.911  -1.250
  649   1HH1  ARG  73          1HH1      ARG  73 -17.275  -4.759  -3.803
  650   2HH1  ARG  73          2HH1      ARG  73 -15.862  -5.480  -4.390
  651   1HH2  ARG  73          1HH2      ARG  73 -13.704  -3.896  -2.047
  652   2HH2  ARG  73          2HH2      ARG  73 -13.764  -4.966  -3.351
  653    H    VAL  74           H        VAL  74 -18.411  -1.653   2.565
  654    HA   VAL  74           HA       VAL  74 -21.197  -0.771   2.648
  655    HB   VAL  74           HB       VAL  74 -20.188  -3.581   3.215
  656   1HG1  VAL  74          1HG1      VAL  74 -22.085  -2.957   4.591
  657   2HG1  VAL  74          2HG1      VAL  74 -22.546  -4.182   3.416
  658   3HG1  VAL  74          3HG1      VAL  74 -23.002  -2.499   3.154
  659   1HG2  VAL  74          1HG2      VAL  74 -20.147  -3.166   0.812
  660   2HG2  VAL  74          2HG2      VAL  74 -21.810  -2.587   0.869
  661   3HG2  VAL  74          3HG2      VAL  74 -21.455  -4.279   1.213
  662    H    TYR  75           H        TYR  75 -21.845  -0.277   4.678
  663    HA   TYR  75           HA       TYR  75 -19.773  -0.028   6.624
  664   1HB   TYR  75          2HB       TYR  75 -21.371   1.794   6.390
  665   2HB   TYR  75          1HB       TYR  75 -22.701   0.716   6.778
  666    HD1  TYR  75           1HD      TYR  75 -19.550   2.095   8.211
  667    HD2  TYR  75           2HD      TYR  75 -23.431   0.534   8.978
  668    HE1  TYR  75           1HE      TYR  75 -19.311   2.671  10.584
  669    HE2  TYR  75           2HE      TYR  75 -23.201   1.102  11.350
  670    HH   TYR  75           HH       TYR  75 -20.740   3.134  12.517
  671    H    GLU  76           H        GLU  76 -19.180  -1.974   7.240
  672    HA   GLU  76           HA       GLU  76 -21.155  -3.653   8.552
  673   1HB   GLU  76          2HB       GLU  76 -18.257  -4.232   7.882
  674   2HB   GLU  76          1HB       GLU  76 -19.369  -5.358   8.653
  675   1HG   GLU  76          2HG       GLU  76 -20.808  -5.239   6.645
  676   2HG   GLU  76          1HG       GLU  76 -19.597  -4.221   5.877
  677    H    GLU  77           H        GLU  77 -20.346  -4.672  10.624
  678    HA   GLU  77           HA       GLU  77 -19.680  -2.447  12.359
  679   1HB   GLU  77          2HB       GLU  77 -20.725  -5.206  12.954
  680   2HB   GLU  77          1HB       GLU  77 -20.501  -3.927  14.143
  681   1HG   GLU  77          2HG       GLU  77 -22.150  -2.557  13.033
  682   2HG   GLU  77          1HG       GLU  77 -22.323  -3.760  11.756
  Start of MODEL    7
    1    H    SER   1           H        SER   1  19.329 -10.359  -9.910
    2    HA   SER   1           HA       SER   1  19.371  -8.175  -9.453
    3   1HB   SER   1          2HB       SER   1  16.691  -8.090 -10.843
    4   2HB   SER   1          1HB       SER   1  17.627  -6.664 -10.394
    5    HG   SER   1           HG       SER   1  19.357  -7.791 -11.675
    6    H    LYS   2           H        LYS   2  18.549  -6.549  -7.951
    7    HA   LYS   2           HA       LYS   2  16.495  -7.579  -6.164
    8   1HB   LYS   2          2HB       LYS   2  19.193  -6.591  -5.263
    9   2HB   LYS   2          1HB       LYS   2  17.820  -6.742  -4.189
   10   1HG   LYS   2          2HG       LYS   2  17.758  -9.173  -4.698
   11   2HG   LYS   2          1HG       LYS   2  19.216  -8.955  -5.671
   12   1HD   LYS   2          2HD       LYS   2  20.434  -8.161  -3.721
   13   2HD   LYS   2          1HD       LYS   2  18.981  -8.289  -2.733
   14   1HE   LYS   2          2HE       LYS   2  18.946 -10.722  -3.147
   15   2HE   LYS   2          1HE       LYS   2  20.428 -10.564  -4.090
   16   1HZ   LYS   2          1HZ       LYS   2  21.558  -9.761  -2.090
   17   2HZ   LYS   2          2HZ       LYS   2  20.895 -11.280  -1.824
   18   3HZ   LYS   2          3HZ       LYS   2  20.143  -9.917  -1.201
   19    H    CYS   3           H        CYS   3  14.962  -6.199  -6.532
   20    HA   CYS   3           HA       CYS   3  15.388  -3.603  -5.404
   21   1HB   CYS   3          2HB       CYS   3  13.598  -2.707  -7.050
   22   2HB   CYS   3          1HB       CYS   3  15.220  -2.932  -7.671
   23    H    LYS   4           H        LYS   4  14.014  -3.142  -3.899
   24    HA   LYS   4           HA       LYS   4  11.792  -5.039  -3.434
   25   1HB   LYS   4          2HB       LYS   4  12.651  -5.399  -1.176
   26   2HB   LYS   4          1HB       LYS   4  13.772  -5.961  -2.416
   27   1HG   LYS   4          2HG       LYS   4  15.078  -3.876  -2.162
   28   2HG   LYS   4          1HG       LYS   4  13.982  -3.360  -0.890
   29   1HD   LYS   4          2HD       LYS   4  14.625  -5.315   0.433
   30   2HD   LYS   4          1HD       LYS   4  15.731  -5.799  -0.861
   31   1HE   LYS   4          2HE       LYS   4  15.877  -3.252   0.748
   32   2HE   LYS   4          1HE       LYS   4  16.893  -4.670   0.983
   33   1HZ   LYS   4          1HZ       LYS   4  16.817  -2.965  -1.455
   34   2HZ   LYS   4          2HZ       LYS   4  17.774  -4.338  -1.253
   35   3HZ   LYS   4          3HZ       LYS   4  18.033  -2.993  -0.287
   36    H    CYS   5           H        CYS   5  12.827  -1.872  -3.509
   37    HA   CYS   5           HA       CYS   5  12.243   0.075  -2.678
   38   1HB   CYS   5          2HB       CYS   5   9.793  -1.398  -1.682
   39   2HB   CYS   5          1HB       CYS   5  10.012   0.341  -1.492
   40    H    SER   6           H        SER   6  12.304   1.396  -0.808
   41    HA   SER   6           HA       SER   6  14.259   0.424   0.883
   42   1HB   SER   6          2HB       SER   6  13.934   2.637   2.053
   43   2HB   SER   6          1HB       SER   6  14.277   2.701   0.322
   44    HG   SER   6           HG       SER   6  12.502   3.734   0.098
   45    H    ARG   7           H        ARG   7  11.294   1.830   2.211
   46    HA   ARG   7           HA       ARG   7  11.195  -0.417   4.093
   47   1HB   ARG   7          2HB       ARG   7  11.082   2.498   4.961
   48   2HB   ARG   7          1HB       ARG   7  10.943   1.093   5.998
   49   1HG   ARG   7          2HG       ARG   7  13.232   0.478   5.591
   50   2HG   ARG   7          1HG       ARG   7  13.398   1.738   4.376
   51   1HD   ARG   7          2HD       ARG   7  13.024   3.438   6.102
   52   2HD   ARG   7          1HD       ARG   7  12.897   2.165   7.322
   53    HE   ARG   7           HE       ARG   7  15.273   1.651   6.247
   54   1HH1  ARG   7          1HH1      ARG   7  13.887   4.679   7.456
   55   2HH1  ARG   7          2HH1      ARG   7  15.368   5.365   7.899
   56   1HH2  ARG   7          1HH2      ARG   7  17.341   2.604   6.853
   57   2HH2  ARG   7          2HH2      ARG   7  17.396   4.157   7.554
   58    H    LYS   8           H        LYS   8   9.459   2.670   4.014
   59    HA   LYS   8           HA       LYS   8   7.012   1.287   3.133
   60   1HB   LYS   8          2HB       LYS   8   7.124   2.985   5.638
   61   2HB   LYS   8          1HB       LYS   8   5.677   2.278   4.956
   62   1HG   LYS   8          2HG       LYS   8   6.671   0.010   5.418
   63   2HG   LYS   8          1HG       LYS   8   7.987   0.832   6.251
   64   1HD   LYS   8          2HD       LYS   8   5.056   1.009   6.982
   65   2HD   LYS   8          1HD       LYS   8   6.266   0.045   7.821
   66   1HE   LYS   8          2HE       LYS   8   6.307   3.051   7.549
   67   2HE   LYS   8          1HE       LYS   8   5.771   2.169   8.971
   68   1HZ   LYS   8          1HZ       LYS   8   7.976   1.290   9.254
   69   2HZ   LYS   8          2HZ       LYS   8   8.091   2.963   9.137
   70   3HZ   LYS   8          3HZ       LYS   8   8.523   2.015   7.844
   71    H    GLY   9           H        GLY   9   9.068   3.921   3.034
   72   1HA   GLY   9          2HA       GLY   9   8.887   5.982   2.085
   73   2HA   GLY   9          1HA       GLY   9   7.230   5.564   1.621
   74    HA   PRO  10           HA       PRO  10   6.760   8.415   5.343
   75   1HB   PRO  10          2HB       PRO  10   4.578   9.403   3.587
   76   2HB   PRO  10          1HB       PRO  10   5.736  10.327   4.550
   77   1HG   PRO  10          2HG       PRO  10   5.945  10.216   1.894
   78   2HG   PRO  10          1HG       PRO  10   7.380  10.222   2.936
   79   1HD   PRO  10          2HD       PRO  10   6.079   7.914   1.526
   80   2HD   PRO  10          1HD       PRO  10   7.812   8.266   1.743
   81    H    LYS  11           H        LYS  11   5.145   7.982   6.842
   82    HA   LYS  11           HA       LYS  11   3.730   5.564   6.555
   83   1HB   LYS  11          2HB       LYS  11   3.500   7.713   8.659
   84   2HB   LYS  11          1HB       LYS  11   2.741   6.129   8.768
   85   1HG   LYS  11          2HG       LYS  11   4.898   5.048   8.749
   86   2HG   LYS  11          1HG       LYS  11   5.698   6.597   8.505
   87   1HD   LYS  11          2HD       LYS  11   4.884   7.355  10.689
   88   2HD   LYS  11          1HD       LYS  11   4.076   5.806  10.924
   89   1HE   LYS  11          2HE       LYS  11   6.211   5.882  12.099
   90   2HE   LYS  11          1HE       LYS  11   6.214   4.652  10.838
   91   1HZ   LYS  11          1HZ       LYS  11   7.443   6.218   9.409
   92   2HZ   LYS  11          2HZ       LYS  11   8.280   5.907  10.824
   93   3HZ   LYS  11          3HZ       LYS  11   7.460   7.356  10.622
   94    H    ILE  12           H        ILE  12   1.772   5.088   5.977
   95    HA   ILE  12           HA       ILE  12  -0.009   7.260   5.030
   96    HB   ILE  12           HB       ILE  12  -0.142   4.403   4.104
   97   1HG1  ILE  12          2HG1      ILE  12   1.514   6.577   2.820
   98   2HG1  ILE  12          1HG1      ILE  12   2.177   5.214   3.721
   99   1HG2  ILE  12          1HG2      ILE  12  -0.902   7.034   2.830
  100   2HG2  ILE  12          2HG2      ILE  12  -2.017   5.886   3.578
  101   3HG2  ILE  12          3HG2      ILE  12  -1.131   5.449   2.110
  102   1HD1  ILE  12          1HD1      ILE  12   2.284   4.832   1.339
  103   2HD1  ILE  12          2HD1      ILE  12   0.539   5.081   1.231
  104   3HD1  ILE  12          3HD1      ILE  12   1.175   3.685   2.107
  105    H    ARG  13           H        ARG  13  -2.122   7.148   5.613
  106    HA   ARG  13           HA       ARG  13  -2.889   5.077   7.520
  107   1HB   ARG  13          2HB       ARG  13  -4.325   7.576   6.653
  108   2HB   ARG  13          1HB       ARG  13  -4.898   6.386   7.814
  109   1HG   ARG  13          2HG       ARG  13  -3.029   6.937   9.294
  110   2HG   ARG  13          1HG       ARG  13  -2.491   8.164   8.142
  111   1HD   ARG  13          2HD       ARG  13  -4.598   9.347   8.378
  112   2HD   ARG  13          1HD       ARG  13  -5.191   8.092   9.459
  113    HE   ARG  13           HE       ARG  13  -2.776   9.297  10.368
  114   1HH1  ARG  13          1HH1      ARG  13  -6.293   9.653  10.284
  115   2HH1  ARG  13          2HH1      ARG  13  -6.378  10.577  11.712
  116   1HH2  ARG  13          1HH2      ARG  13  -2.881  10.578  12.318
  117   2HH2  ARG  13          2HH2      ARG  13  -4.380  11.137  12.877
  118    H    TYR  14           H        TYR  14  -5.121   4.177   7.165
  119    HA   TYR  14           HA       TYR  14  -5.201   2.986   4.582
  120   1HB   TYR  14          2HB       TYR  14  -7.271   2.920   6.782
  121   2HB   TYR  14          1HB       TYR  14  -7.141   1.801   5.427
  122    HD1  TYR  14           1HD      TYR  14  -5.930   2.642   8.734
  123    HD2  TYR  14           2HD      TYR  14  -5.199   0.242   5.304
  124    HE1  TYR  14           1HE      TYR  14  -4.416   1.216  10.050
  125    HE2  TYR  14           2HE      TYR  14  -3.722  -1.164   6.587
  126    HH   TYR  14           HH       TYR  14  -2.314  -0.972   8.613
  127    H    SER  15           H        SER  15  -6.753   5.632   6.126
  128    HA   SER  15           HA       SER  15  -8.981   5.929   4.451
  129   1HB   SER  15          2HB       SER  15  -7.496   7.988   6.033
  130   2HB   SER  15          1HB       SER  15  -9.141   8.166   5.406
  131    HG   SER  15           HG       SER  15  -9.868   7.051   7.011
  132    H    ASP  16           H        ASP  16  -5.631   6.756   3.982
  133    HA   ASP  16           HA       ASP  16  -6.248   8.821   2.030
  134   1HB   ASP  16          2HB       ASP  16  -4.183   8.951   3.500
  135   2HB   ASP  16          1HB       ASP  16  -3.533   7.584   2.610
  136    H    VAL  17           H        VAL  17  -5.621   5.498   2.184
  137    HA   VAL  17           HA       VAL  17  -4.360   5.232  -0.368
  138    HB   VAL  17           HB       VAL  17  -5.725   3.004   1.123
  139   1HG1  VAL  17          1HG1      VAL  17  -5.209   2.382  -1.090
  140   2HG1  VAL  17          2HG1      VAL  17  -4.088   1.574   0.006
  141   3HG1  VAL  17          3HG1      VAL  17  -3.558   2.972  -0.927
  142   1HG2  VAL  17          1HG2      VAL  17  -3.548   2.520   2.161
  143   2HG2  VAL  17          2HG2      VAL  17  -4.158   4.101   2.641
  144   3HG2  VAL  17          3HG2      VAL  17  -2.889   3.982   1.425
  145    H    LYS  18           H        LYS  18  -5.205   5.292  -2.227
  146    HA   LYS  18           HA       LYS  18  -8.093   5.021  -2.599
  147   1HB   LYS  18          2HB       LYS  18  -5.906   5.754  -4.504
  148   2HB   LYS  18          1HB       LYS  18  -7.591   5.626  -4.961
  149   1HG   LYS  18          2HG       LYS  18  -6.344   7.573  -3.015
  150   2HG   LYS  18          1HG       LYS  18  -7.011   7.959  -4.600
  151   1HD   LYS  18          2HD       LYS  18  -8.568   6.943  -2.214
  152   2HD   LYS  18          1HD       LYS  18  -8.538   8.601  -2.796
  153   1HE   LYS  18          2HE       LYS  18  -9.590   7.897  -4.883
  154   2HE   LYS  18          1HE       LYS  18  -9.562   6.219  -4.346
  155   1HZ   LYS  18          1HZ       LYS  18 -11.083   8.428  -3.052
  156   2HZ   LYS  18          2HZ       LYS  18 -11.032   6.827  -2.505
  157   3HZ   LYS  18          3HZ       LYS  18 -11.726   7.202  -3.983
  158    H    LYS  19           H        LYS  19  -5.197   3.384  -3.286
  159    HA   LYS  19           HA       LYS  19  -6.585   1.001  -4.168
  160   1HB   LYS  19          2HB       LYS  19  -4.581   2.295  -6.033
  161   2HB   LYS  19          1HB       LYS  19  -5.292   0.708  -6.200
  162   1HG   LYS  19          2HG       LYS  19  -7.483   1.734  -6.562
  163   2HG   LYS  19          1HG       LYS  19  -6.753   3.339  -6.404
  164   1HD   LYS  19          2HD       LYS  19  -6.950   2.813  -8.757
  165   2HD   LYS  19          1HD       LYS  19  -5.246   2.785  -8.308
  166   1HE   LYS  19          2HE       LYS  19  -5.421   0.290  -8.072
  167   2HE   LYS  19          1HE       LYS  19  -7.062   0.401  -8.699
  168   1HZ   LYS  19          1HZ       LYS  19  -5.661  -0.173 -10.452
  169   2HZ   LYS  19          2HZ       LYS  19  -4.507   0.913 -10.011
  170   3HZ   LYS  19          3HZ       LYS  19  -5.955   1.485 -10.728
  171    H    LEU  20           H        LEU  20  -5.280  -0.790  -4.108
  172    HA   LEU  20           HA       LEU  20  -2.535  -0.477  -3.161
  173   1HB   LEU  20          2HB       LEU  20  -4.202  -0.867  -1.291
  174   2HB   LEU  20          1HB       LEU  20  -4.692  -2.330  -2.085
  175    HG   LEU  20           HG       LEU  20  -1.951  -1.855  -0.880
  176   1HD1  LEU  20          1HD1      LEU  20  -2.726  -3.299   0.916
  177   2HD1  LEU  20          2HD1      LEU  20  -4.312  -3.410   0.169
  178   3HD1  LEU  20          3HD1      LEU  20  -3.744  -1.869   0.795
  179   1HD2  LEU  20          1HD2      LEU  20  -1.677  -4.285  -1.086
  180   2HD2  LEU  20          2HD2      LEU  20  -1.942  -3.560  -2.668
  181   3HD2  LEU  20          3HD2      LEU  20  -3.256  -4.410  -1.860
  182    H    GLU  21           H        GLU  21  -1.324  -1.639  -4.661
  183    HA   GLU  21           HA       GLU  21  -2.690  -3.908  -5.943
  184   1HB   GLU  21          2HB       GLU  21  -1.018  -1.798  -7.280
  185   2HB   GLU  21          1HB       GLU  21  -1.475  -3.313  -8.037
  186   1HG   GLU  21          2HG       GLU  21  -3.820  -2.680  -7.889
  187   2HG   GLU  21          1HG       GLU  21  -3.365  -1.166  -7.104
  188    H    MET  22           H        MET  22  -1.521  -5.740  -6.013
  189    HA   MET  22           HA       MET  22   1.275  -5.494  -5.244
  190   1HB   MET  22          2HB       MET  22  -0.534  -7.903  -5.391
  191   2HB   MET  22          1HB       MET  22   1.170  -7.965  -5.002
  192   1HG   MET  22          2HG       MET  22   0.763  -6.604  -3.012
  193   2HG   MET  22          1HG       MET  22  -0.955  -6.562  -3.404
  194   1HE   MET  22          1HE       MET  22   0.235  -7.549  -0.598
  195   2HE   MET  22          2HE       MET  22  -0.785  -8.956  -0.292
  196   3HE   MET  22          3HE       MET  22  -1.493  -7.489  -0.963
  197    H    LYS  23           H        LYS  23   2.527  -5.217  -6.889
  198    HA   LYS  23           HA       LYS  23   2.882  -7.322  -8.675
  199   1HB   LYS  23          2HB       LYS  23   2.786  -6.114 -10.838
  200   2HB   LYS  23          1HB       LYS  23   1.219  -6.135 -10.084
  201   1HG   LYS  23          2HG       LYS  23   3.093  -3.760 -10.172
  202   2HG   LYS  23          1HG       LYS  23   1.753  -4.036 -11.273
  203   1HD   LYS  23          2HD       LYS  23   0.222  -3.964  -9.323
  204   2HD   LYS  23          1HD       LYS  23   1.601  -3.559  -8.299
  205   1HE   LYS  23          2HE       LYS  23   0.544  -1.482  -8.848
  206   2HE   LYS  23          1HE       LYS  23   2.009  -1.602  -9.823
  207   1HZ   LYS  23          1HZ       LYS  23   0.239  -0.769 -11.077
  208   2HZ   LYS  23          2HZ       LYS  23  -0.765  -2.048 -10.717
  209   3HZ   LYS  23          3HZ       LYS  23   0.605  -2.291 -11.719
  210    HA   PRO  24           HA       PRO  24   6.905  -6.306  -7.643
  211   1HB   PRO  24          2HB       PRO  24   8.325  -6.929  -9.909
  212   2HB   PRO  24          1HB       PRO  24   7.741  -8.115  -8.740
  213   1HG   PRO  24          2HG       PRO  24   6.556  -7.273 -11.354
  214   2HG   PRO  24          1HG       PRO  24   6.687  -8.901 -10.661
  215   1HD   PRO  24          2HD       PRO  24   4.373  -7.540 -10.602
  216   2HD   PRO  24          1HD       PRO  24   4.875  -8.584  -9.258
  217    H    LYS  25           H        LYS  25   5.437  -4.644 -10.178
  218    HA   LYS  25           HA       LYS  25   5.566  -2.611 -11.039
  219   1HB   LYS  25          2HB       LYS  25   6.582  -2.011  -8.586
  220   2HB   LYS  25          1HB       LYS  25   8.046  -1.894  -9.571
  221   1HG   LYS  25          2HG       LYS  25   5.608  -0.288 -10.206
  222   2HG   LYS  25          1HG       LYS  25   6.883   0.279  -9.130
  223   1HD   LYS  25          2HD       LYS  25   8.490   0.123 -10.845
  224   2HD   LYS  25          1HD       LYS  25   7.351  -0.709 -11.897
  225   1HE   LYS  25          2HE       LYS  25   5.982   1.354 -11.989
  226   2HE   LYS  25          1HE       LYS  25   7.114   2.140 -10.887
  227   1HZ   LYS  25          1HZ       LYS  25   7.768   1.177 -13.627
  228   2HZ   LYS  25          2HZ       LYS  25   8.829   2.014 -12.606
  229   3HZ   LYS  25          3HZ       LYS  25   7.464   2.763 -13.204
  230    H    TYR  26           H        TYR  26   8.844  -3.797 -10.369
  231    HA   TYR  26           HA       TYR  26   9.485  -3.680 -13.207
  232   1HB   TYR  26          2HB       TYR  26  11.345  -3.570 -10.773
  233   2HB   TYR  26          1HB       TYR  26  11.880  -3.825 -12.407
  234    HD1  TYR  26           1HD      TYR  26  11.919  -2.170 -13.959
  235    HD2  TYR  26           2HD      TYR  26  10.430  -1.394 -10.100
  236    HE1  TYR  26           1HE      TYR  26  12.022   0.298 -14.428
  237    HE2  TYR  26           2HE      TYR  26  10.523   1.033 -10.510
  238    HH   TYR  26           HH       TYR  26  11.751   2.568 -11.963
  239    HA   PRO  27           HA       PRO  27   9.174  -8.145 -12.927
  240   1HB   PRO  27          2HB       PRO  27  11.062  -8.205 -15.207
  241   2HB   PRO  27          1HB       PRO  27   9.416  -8.832 -15.108
  242   1HG   PRO  27          2HG       PRO  27   9.986  -6.642 -16.542
  243   2HG   PRO  27          1HG       PRO  27   8.463  -6.798 -15.647
  244   1HD   PRO  27          2HD       PRO  27  10.917  -5.230 -14.958
  245   2HD   PRO  27          1HD       PRO  27   9.196  -4.819 -14.763
  246    H    HIS  28           H        HIS  28  11.958  -6.367 -12.673
  247    HA   HIS  28           HA       HIS  28  13.669  -8.642 -12.014
  248   1HB   HIS  28          2HB       HIS  28  15.565  -7.039 -12.119
  249   2HB   HIS  28          1HB       HIS  28  14.631  -7.064 -13.603
  250    HD1  HIS  28           1HD      HIS  28  15.518  -4.890 -10.694
  251    HD2  HIS  28           2HD      HIS  28  13.362  -4.493 -14.250
  252    HE1  HIS  28           1HE      HIS  28  15.030  -2.473 -11.005
  253    HE2  HIS  28           2HE      HIS  28  14.210  -2.327 -13.338
  254    H    CYS  29           H        CYS  29  11.450  -7.450 -10.263
  255    HA   CYS  29           HA       CYS  29  13.051  -6.705  -7.926
  256   1HB   CYS  29          2HB       CYS  29  10.230  -6.117  -8.744
  257   2HB   CYS  29          1HB       CYS  29  10.703  -5.862  -7.088
  258    H    GLU  30           H        GLU  30  12.315  -7.508  -5.810
  259    HA   GLU  30           HA       GLU  30  11.899 -10.364  -5.916
  260   1HB   GLU  30          2HB       GLU  30  12.248  -8.485  -3.576
  261   2HB   GLU  30          1HB       GLU  30  12.282 -10.234  -3.496
  262   1HG   GLU  30          2HG       GLU  30  14.250 -10.170  -4.901
  263   2HG   GLU  30          1HG       GLU  30  14.173  -8.403  -4.805
  264    H    GLU  31           H        GLU  31  10.011 -11.404  -5.407
  265    HA   GLU  31           HA       GLU  31   7.790 -11.719  -5.104
  266   1HB   GLU  31          2HB       GLU  31   8.312  -9.672  -2.945
  267   2HB   GLU  31          1HB       GLU  31   6.813 -10.588  -3.053
  268   1HG   GLU  31          2HG       GLU  31   8.156 -12.669  -2.778
  269   2HG   GLU  31          1HG       GLU  31   9.586 -11.665  -2.549
  270    H    LYS  32           H        LYS  32   5.703  -9.999  -4.389
  271    HA   LYS  32           HA       LYS  32   5.632  -8.232  -6.705
  272   1HB   LYS  32          2HB       LYS  32   3.447  -8.789  -4.683
  273   2HB   LYS  32          1HB       LYS  32   3.276  -7.973  -6.225
  274   1HG   LYS  32          2HG       LYS  32   3.923 -10.866  -5.805
  275   2HG   LYS  32          1HG       LYS  32   2.359 -10.181  -6.311
  276   1HD   LYS  32          2HD       LYS  32   3.425  -9.365  -8.318
  277   2HD   LYS  32          1HD       LYS  32   4.962 -10.097  -7.797
  278   1HE   LYS  32          2HE       LYS  32   2.378 -11.545  -8.440
  279   2HE   LYS  32          1HE       LYS  32   3.829 -11.523  -9.438
  280   1HZ   LYS  32          1HZ       LYS  32   4.995 -12.605  -7.533
  281   2HZ   LYS  32          2HZ       LYS  32   3.805 -13.566  -8.216
  282   3HZ   LYS  32          3HZ       LYS  32   3.541 -12.772  -6.745
  283    H    MET  33           H        MET  33   5.548  -6.046  -6.419
  284    HA   MET  33           HA       MET  33   6.267  -5.063  -3.753
  285   1HB   MET  33          2HB       MET  33   5.869  -3.498  -6.314
  286   2HB   MET  33          1HB       MET  33   6.428  -2.856  -4.795
  287   1HG   MET  33          2HG       MET  33   7.966  -4.879  -6.416
  288   2HG   MET  33          1HG       MET  33   8.159  -3.148  -6.591
  289   1HE   MET  33          1HE       MET  33   7.962  -5.605  -3.339
  290   2HE   MET  33          2HE       MET  33   9.688  -5.738  -3.093
  291   3HE   MET  33          3HE       MET  33   8.958  -6.360  -4.577
  292    H    VAL  34           H        VAL  34   5.056  -3.539  -2.711
  293    HA   VAL  34           HA       VAL  34   2.246  -3.760  -3.369
  294    HB   VAL  34           HB       VAL  34   3.613  -2.724  -0.904
  295   1HG1  VAL  34          1HG1      VAL  34   1.425  -1.670  -1.342
  296   2HG1  VAL  34          2HG1      VAL  34   1.376  -2.709   0.079
  297   3HG1  VAL  34          3HG1      VAL  34   0.690  -3.274  -1.446
  298   1HG2  VAL  34          1HG2      VAL  34   2.760  -4.771   0.177
  299   2HG2  VAL  34          2HG2      VAL  34   3.881  -5.130  -1.134
  300   3HG2  VAL  34          3HG2      VAL  34   2.144  -5.318  -1.381
  301    H    ILE  35           H        ILE  35   1.562  -2.244  -4.630
  302    HA   ILE  35           HA       ILE  35   2.843   0.375  -4.635
  303    HB   ILE  35           HB       ILE  35   0.755  -0.800  -6.464
  304   1HG1  ILE  35          2HG1      ILE  35   2.822  -2.074  -6.555
  305   2HG1  ILE  35          1HG1      ILE  35   2.519  -1.230  -8.057
  306   1HG2  ILE  35          1HG2      ILE  35   1.389   1.016  -7.999
  307   2HG2  ILE  35          2HG2      ILE  35   2.461   1.667  -6.754
  308   3HG2  ILE  35          3HG2      ILE  35   0.722   1.602  -6.474
  309   1HD1  ILE  35          1HD1      ILE  35   4.196   0.482  -7.359
  310   2HD1  ILE  35          2HD1      ILE  35   4.829  -1.125  -7.619
  311   3HD1  ILE  35          3HD1      ILE  35   4.588  -0.538  -5.958
  312    H    ILE  36           H        ILE  36   1.927   1.832  -3.389
  313    HA   ILE  36           HA       ILE  36  -0.929   1.568  -2.750
  314    HB   ILE  36           HB       ILE  36   1.259   3.035  -1.256
  315   1HG1  ILE  36          2HG1      ILE  36   1.325   0.558  -1.103
  316   2HG1  ILE  36          1HG1      ILE  36   1.010   1.318   0.465
  317   1HG2  ILE  36          1HG2      ILE  36  -0.903   4.187  -1.054
  318   2HG2  ILE  36          2HG2      ILE  36  -0.436   3.433   0.478
  319   3HG2  ILE  36          3HG2      ILE  36  -1.642   2.668  -0.539
  320   1HD1  ILE  36          1HD1      ILE  36  -0.963  -0.030  -1.368
  321   2HD1  ILE  36          2HD1      ILE  36  -1.379   0.760   0.155
  322   3HD1  ILE  36          3HD1      ILE  36  -0.332  -0.663   0.150
  323    H    THR  37           H        THR  37  -2.224   2.916  -3.675
  324    HA   THR  37           HA       THR  37  -1.207   5.289  -5.030
  325    HB   THR  37           HB       THR  37  -3.930   3.963  -5.038
  326    HG1  THR  37           1HG      THR  37  -1.638   3.192  -6.086
  327   1HG2  THR  37          1HG2      THR  37  -2.732   5.940  -6.995
  328   2HG2  THR  37          2HG2      THR  37  -3.966   6.328  -5.789
  329   3HG2  THR  37          3HG2      THR  37  -4.324   5.212  -7.108
  330    H    THR  38           H        THR  38  -1.613   7.289  -4.159
  331    HA   THR  38           HA       THR  38  -3.056   7.365  -1.623
  332    HB   THR  38           HB       THR  38  -1.840   9.502  -1.284
  333    HG1  THR  38           1HG      THR  38  -0.343   8.790  -3.625
  334   1HG2  THR  38          1HG2      THR  38   0.384   8.463  -1.005
  335   2HG2  THR  38          2HG2      THR  38  -0.156   7.123  -2.017
  336   3HG2  THR  38          3HG2      THR  38  -0.934   7.401  -0.461
  337    H    LYS  39           H        LYS  39  -4.366   9.208  -1.138
  338    HA   LYS  39           HA       LYS  39  -6.054   9.886  -3.379
  339   1HB   LYS  39          2HB       LYS  39  -7.523  11.051  -1.795
  340   2HB   LYS  39          1HB       LYS  39  -7.167   9.408  -1.287
  341   1HG   LYS  39          2HG       LYS  39  -5.501  10.314   0.308
  342   2HG   LYS  39          1HG       LYS  39  -5.975  11.939  -0.179
  343   1HD   LYS  39          2HD       LYS  39  -7.809   9.881   1.060
  344   2HD   LYS  39          1HD       LYS  39  -7.058  11.224   1.912
  345   1HE   LYS  39          2HE       LYS  39  -8.263  12.804   0.507
  346   2HE   LYS  39          1HE       LYS  39  -8.982  11.472  -0.400
  347   1HZ   LYS  39          1HZ       LYS  39 -10.099  10.748   1.591
  348   2HZ   LYS  39          2HZ       LYS  39 -10.462  12.373   1.323
  349   3HZ   LYS  39          3HZ       LYS  39  -9.349  11.943   2.499
  350    H    SER  40           H        SER  40  -3.977  11.722  -1.227
  351    HA   SER  40           HA       SER  40  -2.946  13.600  -2.927
  352   1HB   SER  40          2HB       SER  40  -5.293  14.301  -3.472
  353   2HB   SER  40          1HB       SER  40  -5.548  14.682  -1.772
  354    HG   SER  40           HG       SER  40  -4.423  16.134  -3.713
  355    H    VAL  41           H        VAL  41  -4.513  13.093   0.193
  356    HA   VAL  41           HA       VAL  41  -3.329  15.206   1.610
  357    HB   VAL  41           HB       VAL  41  -4.310  12.554   2.714
  358   1HG1  VAL  41          1HG1      VAL  41  -3.934  15.218   4.090
  359   2HG1  VAL  41          2HG1      VAL  41  -2.956  13.779   4.338
  360   3HG1  VAL  41          3HG1      VAL  41  -4.653  13.782   4.824
  361   1HG2  VAL  41          1HG2      VAL  41  -5.780  15.152   2.308
  362   2HG2  VAL  41          2HG2      VAL  41  -6.422  13.735   3.137
  363   3HG2  VAL  41          3HG2      VAL  41  -6.043  13.653   1.417
  364    H    SER  42           H        SER  42  -2.283  11.939   0.994
  365    HA   SER  42           HA       SER  42  -0.018  11.859   2.617
  366   1HB   SER  42          2HB       SER  42  -0.972   9.903   1.456
  367   2HB   SER  42          1HB       SER  42  -0.486  10.597  -0.089
  368    HG   SER  42           HG       SER  42   1.045   9.608   2.007
  369    H    ARG  43           H        ARG  43   2.166  12.230   2.108
  370    HA   ARG  43           HA       ARG  43   2.773  14.701   0.976
  371   1HB   ARG  43          2HB       ARG  43   4.108  13.563   2.712
  372   2HB   ARG  43          1HB       ARG  43   4.648  12.396   1.519
  373   1HG   ARG  43          2HG       ARG  43   5.762  14.184   0.285
  374   2HG   ARG  43          1HG       ARG  43   5.219  15.350   1.489
  375   1HD   ARG  43          2HD       ARG  43   6.445  14.113   3.217
  376   2HD   ARG  43          1HD       ARG  43   7.015  12.980   1.989
  377    HE   ARG  43           HE       ARG  43   7.595  15.765   1.506
  378   1HH1  ARG  43          1HH1      ARG  43   8.787  12.738   2.879
  379   2HH1  ARG  43          2HH1      ARG  43  10.431  13.180   2.795
  380   1HH2  ARG  43          1HH2      ARG  43   9.803  16.370   1.415
  381   2HH2  ARG  43          2HH2      ARG  43  11.029  15.321   1.951
  382    H    TYR  44           H        TYR  44   2.433  11.676  -0.535
  383    HA   TYR  44           HA       TYR  44   4.068  12.259  -2.790
  384   1HB   TYR  44          2HB       TYR  44   2.211  10.045  -2.135
  385   2HB   TYR  44          1HB       TYR  44   2.701  10.256  -3.807
  386    HD1  TYR  44           1HD      TYR  44   4.277  10.271  -0.462
  387    HD2  TYR  44           2HD      TYR  44   4.496   9.011  -4.474
  388    HE1  TYR  44           1HE      TYR  44   6.409   9.095   0.024
  389    HE2  TYR  44           2HE      TYR  44   6.607   7.824  -4.018
  390    HH   TYR  44           HH       TYR  44   8.433   7.965  -2.395
  391    H    ARG  45           H        ARG  45   0.937  13.291  -1.955
  392    HA   ARG  45           HA       ARG  45  -0.555  14.608  -3.006
  393   1HB   ARG  45          2HB       ARG  45   1.859  15.647  -3.383
  394   2HB   ARG  45          1HB       ARG  45   1.574  15.219  -5.053
  395   1HG   ARG  45          2HG       ARG  45  -0.239  16.961  -3.436
  396   2HG   ARG  45          1HG       ARG  45   1.104  17.613  -4.366
  397   1HD   ARG  45          2HD       ARG  45   0.040  16.700  -6.419
  398   2HD   ARG  45          1HD       ARG  45  -1.307  16.124  -5.438
  399    HE   ARG  45           HE       ARG  45  -1.144  18.753  -4.843
  400   1HH1  ARG  45          1HH1      ARG  45  -1.546  16.967  -7.850
  401   2HH1  ARG  45          2HH1      ARG  45  -2.430  18.184  -8.633
  402   1HH2  ARG  45          1HH2      ARG  45  -2.381  20.458  -5.922
  403   2HH2  ARG  45          2HH2      ARG  45  -2.894  20.220  -7.525
  404    H    GLY  46           H        GLY  46  -0.508  11.793  -3.803
  405   1HA   GLY  46          2HA       GLY  46  -2.053  10.795  -5.288
  406   2HA   GLY  46          1HA       GLY  46  -1.754  12.099  -6.427
  407    H    GLN  47           H        GLN  47   1.140  11.061  -5.168
  408    HA   GLN  47           HA       GLN  47   1.553   9.277  -7.421
  409   1HB   GLN  47          2HB       GLN  47   3.616  10.511  -5.573
  410   2HB   GLN  47          1HB       GLN  47   3.983   9.432  -6.914
  411   1HG   GLN  47          2HG       GLN  47   2.968  11.100  -8.438
  412   2HG   GLN  47          1HG       GLN  47   2.780  12.176  -7.052
  413   1HE2  GLN  47          1HE2      GLN  47   4.983  10.699  -9.236
  414   2HE2  GLN  47          2HE2      GLN  47   6.363  11.644  -8.829
  415    H    GLU  48           H        GLU  48   2.820   7.286  -7.029
  416    HA   GLU  48           HA       GLU  48   1.426   5.971  -4.853
  417   1HB   GLU  48          2HB       GLU  48   3.027   4.775  -7.115
  418   2HB   GLU  48          1HB       GLU  48   2.141   3.866  -5.915
  419   1HG   GLU  48          2HG       GLU  48   0.882   3.878  -7.939
  420   2HG   GLU  48          1HG       GLU  48   0.038   4.894  -6.780
  421    H    HIS  49           H        HIS  49   2.312   4.963  -3.248
  422    HA   HIS  49           HA       HIS  49   5.205   5.267  -2.658
  423   1HB   HIS  49          2HB       HIS  49   2.972   4.121  -0.933
  424   2HB   HIS  49          1HB       HIS  49   4.641   4.255  -0.452
  425    HD1  HIS  49           1HD      HIS  49   4.759   5.971   1.321
  426    HD2  HIS  49           2HD      HIS  49   2.031   6.990  -1.644
  427    HE1  HIS  49           1HE      HIS  49   3.779   8.149   2.032
  428    HE2  HIS  49           2HE      HIS  49   1.937   8.571   0.400
  429    H    CYS  50           H        CYS  50   6.403   3.283  -2.110
  430    HA   CYS  50           HA       CYS  50   4.860   0.951  -2.841
  431   1HB   CYS  50          2HB       CYS  50   6.833  -0.132  -3.837
  432   2HB   CYS  50          1HB       CYS  50   6.432   1.345  -4.693
  433    H    LEU  51           H        LEU  51   4.791  -0.514  -1.423
  434    HA   LEU  51           HA       LEU  51   6.260   0.015   1.018
  435   1HB   LEU  51          2HB       LEU  51   3.841   0.077   1.166
  436   2HB   LEU  51          1HB       LEU  51   3.702  -1.516   0.498
  437    HG   LEU  51           HG       LEU  51   4.660  -2.468   2.534
  438   1HD1  LEU  51          1HD1      LEU  51   5.041  -1.040   4.460
  439   2HD1  LEU  51          2HD1      LEU  51   4.755   0.389   3.467
  440   3HD1  LEU  51          3HD1      LEU  51   6.147  -0.655   3.143
  441   1HD2  LEU  51          1HD2      LEU  51   2.818  -1.892   4.034
  442   2HD2  LEU  51          2HD2      LEU  51   2.260  -2.124   2.378
  443   3HD2  LEU  51          3HD2      LEU  51   2.437  -0.496   3.031
  444    H    HIS  52           H        HIS  52   7.669  -1.325   1.794
  445    HA   HIS  52           HA       HIS  52   8.696  -3.409   0.146
  446   1HB   HIS  52          2HB       HIS  52  10.171  -1.871   1.297
  447   2HB   HIS  52          1HB       HIS  52   9.479  -2.301   2.843
  448    HD1  HIS  52           1HD      HIS  52  11.176  -4.247   0.065
  449    HD2  HIS  52           2HD      HIS  52  11.225  -3.730   4.150
  450    HE1  HIS  52           1HE      HIS  52  12.830  -6.000   0.982
  451    HE2  HIS  52           2HE      HIS  52  13.084  -5.343   3.370
  452    HA   PRO  53           HA       PRO  53   5.817  -6.409   1.945
  453   1HB   PRO  53          2HB       PRO  53   6.386  -8.443   0.277
  454   2HB   PRO  53          1HB       PRO  53   5.412  -7.050  -0.219
  455   1HG   PRO  53          2HG       PRO  53   8.329  -7.571  -0.672
  456   2HG   PRO  53          1HG       PRO  53   7.107  -7.022  -1.831
  457   1HD   PRO  53          2HD       PRO  53   8.802  -5.303  -0.671
  458   2HD   PRO  53          1HD       PRO  53   7.123  -4.853  -1.013
  459    H    LYS  54           H        LYS  54   9.094  -6.456   2.187
  460    HA   LYS  54           HA       LYS  54   9.326  -9.079   3.164
  461   1HB   LYS  54          2HB       LYS  54  11.252  -6.833   3.056
  462   2HB   LYS  54          1HB       LYS  54  11.603  -8.185   4.122
  463   1HG   LYS  54          2HG       LYS  54  12.666  -8.445   1.988
  464   2HG   LYS  54          1HG       LYS  54  11.512  -9.719   2.225
  465   1HD   LYS  54          2HD       LYS  54   9.916  -8.388   0.838
  466   2HD   LYS  54          1HD       LYS  54  11.246  -7.292   0.470
  467   1HE   LYS  54          2HE       LYS  54  11.035 -10.199  -0.019
  468   2HE   LYS  54          1HE       LYS  54  11.029  -8.969  -1.299
  469   1HZ   LYS  54          1HZ       LYS  54  13.418  -8.453  -0.613
  470   2HZ   LYS  54          2HZ       LYS  54  13.283 -10.002  -1.180
  471   3HZ   LYS  54          3HZ       LYS  54  13.346  -9.728   0.456
  472    H    LEU  55           H        LEU  55   8.216  -6.148   4.469
  473    HA   LEU  55           HA       LEU  55   9.014  -6.614   7.226
  474   1HB   LEU  55          2HB       LEU  55   7.355  -4.415   6.007
  475   2HB   LEU  55          1HB       LEU  55   7.919  -4.468   7.661
  476    HG   LEU  55           HG       LEU  55   9.640  -4.225   5.210
  477   1HD1  LEU  55          1HD1      LEU  55  10.104  -1.966   6.054
  478   2HD1  LEU  55          2HD1      LEU  55   8.944  -2.224   7.355
  479   3HD1  LEU  55          3HD1      LEU  55   8.395  -2.197   5.681
  480   1HD2  LEU  55          1HD2      LEU  55  10.400  -4.216   8.135
  481   2HD2  LEU  55          2HD2      LEU  55  11.483  -3.833   6.798
  482   3HD2  LEU  55          3HD2      LEU  55  10.812  -5.456   6.948
  483    H    GLN  56           H        GLN  56   7.567  -6.982   8.888
  484    HA   GLN  56           HA       GLN  56   5.223  -8.470   8.155
  485   1HB   GLN  56          2HB       GLN  56   6.638  -9.233  10.002
  486   2HB   GLN  56          1HB       GLN  56   6.347  -7.737  10.869
  487   1HG   GLN  56          2HG       GLN  56   5.038  -9.509  11.841
  488   2HG   GLN  56          1HG       GLN  56   3.972  -8.336  11.084
  489   1HE2  GLN  56          1HE2      GLN  56   3.486 -11.108  11.783
  490   2HE2  GLN  56          2HE2      GLN  56   3.008 -11.904  10.332
  491    H    SER  57           H        SER  57   5.924  -5.278   9.361
  492    HA   SER  57           HA       SER  57   3.347  -4.562  10.225
  493   1HB   SER  57          2HB       SER  57   5.496  -2.790   9.029
  494   2HB   SER  57          1HB       SER  57   4.128  -2.245  10.004
  495    HG   SER  57           HG       SER  57   4.966  -3.649  11.680
  496    H    THR  58           H        THR  58   4.809  -4.800   7.092
  497    HA   THR  58           HA       THR  58   3.006  -3.389   5.514
  498    HB   THR  58           HB       THR  58   4.653  -5.857   4.937
  499    HG1  THR  58           1HG      THR  58   6.071  -4.142   3.996
  500   1HG2  THR  58          1HG2      THR  58   2.953  -5.577   3.214
  501   2HG2  THR  58          2HG2      THR  58   4.515  -5.108   2.549
  502   3HG2  THR  58          3HG2      THR  58   3.353  -3.875   3.043
  503    H    LYS  59           H        LYS  59   2.995  -6.773   6.639
  504    HA   LYS  59           HA       LYS  59   0.815  -7.512   5.121
  505   1HB   LYS  59          2HB       LYS  59   2.000  -8.752   7.577
  506   2HB   LYS  59          1HB       LYS  59   0.536  -9.400   6.838
  507   1HG   LYS  59          2HG       LYS  59   2.392 -10.634   6.007
  508   2HG   LYS  59          1HG       LYS  59   1.781  -9.622   4.708
  509   1HD   LYS  59          2HD       LYS  59   3.603  -7.997   5.237
  510   2HD   LYS  59          1HD       LYS  59   4.249  -9.179   6.377
  511   1HE   LYS  59          2HE       LYS  59   3.915  -9.549   3.394
  512   2HE   LYS  59          1HE       LYS  59   5.424  -9.307   4.272
  513   1HZ   LYS  59          1HZ       LYS  59   5.018 -11.626   3.672
  514   2HZ   LYS  59          2HZ       LYS  59   3.617 -11.639   4.586
  515   3HZ   LYS  59          3HZ       LYS  59   5.100 -11.431   5.361
  516    H    ARG  60           H        ARG  60   0.802  -6.203   8.449
  517    HA   ARG  60           HA       ARG  60  -1.963  -6.484   8.596
  518   1HB   ARG  60          2HB       ARG  60  -0.014  -4.921  10.164
  519   2HB   ARG  60          1HB       ARG  60  -1.705  -4.461  10.257
  520   1HG   ARG  60          2HG       ARG  60  -1.412  -5.940  12.041
  521   2HG   ARG  60          1HG       ARG  60  -2.185  -6.850  10.786
  522   1HD   ARG  60          2HD       ARG  60  -0.058  -7.797  10.036
  523   2HD   ARG  60          1HD       ARG  60   0.778  -6.953  11.335
  524    HE   ARG  60           HE       ARG  60  -1.382  -8.810  11.941
  525   1HH1  ARG  60          1HH1      ARG  60   2.031  -7.927  12.254
  526   2HH1  ARG  60          2HH1      ARG  60   2.436  -9.240  13.268
  527   1HH2  ARG  60          1HH2      ARG  60  -0.804 -10.661  13.363
  528   2HH2  ARG  60          2HH2      ARG  60   0.777 -10.807  13.920
  529    H    PHE  61           H        PHE  61   0.005  -3.805   7.456
  530    HA   PHE  61           HA       PHE  61  -2.088  -1.973   7.208
  531   1HB   PHE  61          2HB       PHE  61   0.388  -1.498   6.937
  532   2HB   PHE  61          1HB       PHE  61   0.213  -2.242   5.345
  533    HD1  PHE  61           1HD      PHE  61  -0.129  -0.818   3.502
  534    HD2  PHE  61           2HD      PHE  61  -1.338   0.536   7.360
  535    HE1  PHE  61           1HE      PHE  61  -0.746   1.381   2.554
  536    HE2  PHE  61           2HE      PHE  61  -1.945   2.732   6.408
  537    HZ   PHE  61           HZ       PHE  61  -1.652   3.162   4.041
  538    H    ILE  62           H        ILE  62  -0.911  -4.457   5.067
  539    HA   ILE  62           HA       ILE  62  -2.661  -3.800   2.916
  540    HB   ILE  62           HB       ILE  62  -1.264  -6.427   3.425
  541   1HG1  ILE  62          2HG1      ILE  62   0.402  -4.726   3.364
  542   2HG1  ILE  62          1HG1      ILE  62   0.421  -5.523   1.796
  543   1HG2  ILE  62          1HG2      ILE  62  -3.078  -6.572   1.839
  544   2HG2  ILE  62          2HG2      ILE  62  -1.516  -6.802   1.049
  545   3HG2  ILE  62          3HG2      ILE  62  -2.385  -5.270   0.872
  546   1HD1  ILE  62          1HD1      ILE  62  -0.957  -2.925   2.390
  547   2HD1  ILE  62          2HD1      ILE  62  -0.714  -3.659   0.788
  548   3HD1  ILE  62          3HD1      ILE  62   0.660  -3.091   1.747
  549    H    LYS  63           H        LYS  63  -2.714  -6.331   5.361
  550    HA   LYS  63           HA       LYS  63  -5.191  -7.447   4.420
  551   1HB   LYS  63          2HB       LYS  63  -3.701  -7.813   7.012
  552   2HB   LYS  63          1HB       LYS  63  -5.332  -8.403   6.866
  553   1HG   LYS  63          2HG       LYS  63  -3.754 -10.228   6.574
  554   2HG   LYS  63          1HG       LYS  63  -4.603  -9.950   5.071
  555   1HD   LYS  63          2HD       LYS  63  -1.857  -8.816   5.590
  556   2HD   LYS  63          1HD       LYS  63  -2.074 -10.463   5.016
  557   1HE   LYS  63          2HE       LYS  63  -3.086  -7.986   3.624
  558   2HE   LYS  63          1HE       LYS  63  -1.594  -8.828   3.218
  559   1HZ   LYS  63          1HZ       LYS  63  -4.321 -10.020   3.066
  560   2HZ   LYS  63          2HZ       LYS  63  -2.876 -10.773   2.656
  561   3HZ   LYS  63          3HZ       LYS  63  -3.408  -9.467   1.761
  562    H    TRP  64           H        TRP  64  -4.440  -4.900   6.583
  563    HA   TRP  64           HA       TRP  64  -7.045  -4.732   7.751
  564   1HB   TRP  64          2HB       TRP  64  -4.651  -3.835   8.532
  565   2HB   TRP  64          1HB       TRP  64  -5.192  -2.398   7.683
  566    HD1  TRP  64           HD       TRP  64  -5.442  -4.205  10.914
  567    HE1  TRP  64           1HE      TRP  64  -7.068  -2.992  12.499
  568    HE3  TRP  64           3HE      TRP  64  -7.557  -0.921   7.589
  569    HZ2  TRP  64           2HZ      TRP  64  -8.983  -0.911  12.367
  570    HZ3  TRP  64           3HZ      TRP  64  -9.268   0.645   8.404
  571    HH2  TRP  64           HH       TRP  64  -9.964   0.650  10.738
  572    H    TYR  65           H        TYR  65  -5.289  -3.126   5.046
  573    HA   TYR  65           HA       TYR  65  -7.305  -1.251   4.506
  574   1HB   TYR  65          2HB       TYR  65  -5.029  -1.023   3.530
  575   2HB   TYR  65          1HB       TYR  65  -5.337  -2.430   2.519
  576    HD1  TYR  65           1HD      TYR  65  -6.057  -2.043   0.324
  577    HD2  TYR  65           2HD      TYR  65  -6.889   0.881   3.300
  578    HE1  TYR  65           1HE      TYR  65  -7.062  -0.559  -1.397
  579    HE2  TYR  65           2HE      TYR  65  -7.888   2.336   1.581
  580    HH   TYR  65           HH       TYR  65  -7.816   2.674  -0.734
  581    H    ASN  66           H        ASN  66  -6.865  -4.534   3.493
  582    HA   ASN  66           HA       ASN  66  -9.008  -4.584   1.662
  583   1HB   ASN  66          2HB       ASN  66  -7.672  -6.798   3.197
  584   2HB   ASN  66          1HB       ASN  66  -9.035  -7.128   2.140
  585   1HD2  ASN  66          1HD2      ASN  66  -5.665  -6.204   2.282
  586   2HD2  ASN  66          2HD2      ASN  66  -5.373  -6.419   0.599
  587    H    ALA  67           H        ALA  67  -8.942  -4.931   5.144
  588    HA   ALA  67           HA       ALA  67 -11.698  -5.669   5.377
  589   1HB   ALA  67          1HB       ALA  67  -9.846  -4.411   7.413
  590   2HB   ALA  67          2HB       ALA  67 -10.071  -6.142   7.168
  591   3HB   ALA  67          3HB       ALA  67 -11.406  -5.153   7.763
  592    H    TRP  68           H        TRP  68  -9.845  -2.701   5.536
  593    HA   TRP  68           HA       TRP  68 -11.818  -0.829   6.120
  594   1HB   TRP  68          2HB       TRP  68  -9.489  -0.227   6.158
  595   2HB   TRP  68          1HB       TRP  68  -9.296  -0.672   4.474
  596    HD1  TRP  68           HD       TRP  68  -9.495   1.208   2.763
  597    HE1  TRP  68           1HE      TRP  68 -10.122   3.694   2.833
  598    HE3  TRP  68           3HE      TRP  68 -11.243   1.479   7.562
  599    HZ2  TRP  68           2HZ      TRP  68 -11.212   5.517   4.641
  600    HZ3  TRP  68           3HZ      TRP  68 -12.064   3.654   8.371
  601    HH2  TRP  68           HH       TRP  68 -12.037   5.640   6.898
  602    H    ASN  69           H        ASN  69 -10.842  -2.200   3.033
  603    HA   ASN  69           HA       ASN  69 -12.469  -0.722   1.308
  604   1HB   ASN  69          2HB       ASN  69 -10.726  -2.234   0.468
  605   2HB   ASN  69          1HB       ASN  69 -11.624  -3.628   1.050
  606   1HD2  ASN  69          1HD2      ASN  69 -13.474  -4.354  -0.143
  607   2HD2  ASN  69          2HD2      ASN  69 -13.786  -3.746  -1.717
  608    H    GLU  70           H        GLU  70 -13.185  -3.612   3.181
  609    HA   GLU  70           HA       GLU  70 -15.806  -3.991   2.110
  610   1HB   GLU  70          2HB       GLU  70 -14.657  -5.026   4.710
  611   2HB   GLU  70          1HB       GLU  70 -16.058  -5.652   3.857
  612   1HG   GLU  70          2HG       GLU  70 -13.205  -5.739   2.897
  613   2HG   GLU  70          1HG       GLU  70 -14.121  -7.088   3.560
  614    H    LYS  71           H        LYS  71 -14.406  -2.412   4.927
  615    HA   LYS  71           HA       LYS  71 -16.753  -1.917   6.373
  616   1HB   LYS  71          2HB       LYS  71 -14.464  -1.940   7.309
  617   2HB   LYS  71          1HB       LYS  71 -14.095  -0.490   6.404
  618   1HG   LYS  71          2HG       LYS  71 -14.505   0.054   8.697
  619   2HG   LYS  71          1HG       LYS  71 -15.766   0.732   7.661
  620   1HD   LYS  71          2HD       LYS  71 -16.750  -0.203   9.706
  621   2HD   LYS  71          1HD       LYS  71 -17.271  -1.133   8.304
  622   1HE   LYS  71          2HE       LYS  71 -15.533  -2.822   8.814
  623   2HE   LYS  71          1HE       LYS  71 -15.070  -1.881  10.235
  624   1HZ   LYS  71          1HZ       LYS  71 -17.323  -2.239  11.108
  625   2HZ   LYS  71          2HZ       LYS  71 -16.499  -3.674  10.849
  626   3HZ   LYS  71          3HZ       LYS  71 -17.686  -3.199   9.757
  627    H    ARG  72           H        ARG  72 -15.211  -0.216   3.744
  628    HA   ARG  72           HA       ARG  72 -16.759   2.191   4.092
  629   1HB   ARG  72          2HB       ARG  72 -15.069   1.246   1.785
  630   2HB   ARG  72          1HB       ARG  72 -15.853   2.816   1.856
  631   1HG   ARG  72          2HG       ARG  72 -14.519   3.417   3.786
  632   2HG   ARG  72          1HG       ARG  72 -13.768   1.818   3.786
  633   1HD   ARG  72          2HD       ARG  72 -12.339   3.469   2.762
  634   2HD   ARG  72          1HD       ARG  72 -12.828   2.252   1.574
  635    HE   ARG  72           HE       ARG  72 -13.954   4.965   1.795
  636   1HH1  ARG  72          1HH1      ARG  72 -13.128   2.155  -0.234
  637   2HH1  ARG  72          2HH1      ARG  72 -13.383   2.984  -1.682
  638   1HH2  ARG  72          1HH2      ARG  72 -14.290   6.079  -0.267
  639   2HH2  ARG  72          2HH2      ARG  72 -14.037   5.226  -1.710
  640    H    ARG  73           H        ARG  73 -17.338  -0.839   2.791
  641    HA   ARG  73           HA       ARG  73 -19.395   0.144   0.961
  642   1HB   ARG  73          2HB       ARG  73 -17.812  -1.626   0.207
  643   2HB   ARG  73          1HB       ARG  73 -18.433  -2.673   1.468
  644   1HG   ARG  73          2HG       ARG  73 -20.656  -2.598   0.420
  645   2HG   ARG  73          1HG       ARG  73 -19.990  -1.590  -0.871
  646   1HD   ARG  73          2HD       ARG  73 -20.063  -3.873  -1.610
  647   2HD   ARG  73          1HD       ARG  73 -18.383  -3.391  -1.396
  648    HE   ARG  73           HE       ARG  73 -19.940  -5.072   0.435
  649   1HH1  ARG  73          1HH1      ARG  73 -16.762  -4.035  -0.809
  650   2HH1  ARG  73          2HH1      ARG  73 -15.902  -5.285  -0.038
  651   1HH2  ARG  73          1HH2      ARG  73 -18.719  -6.820   1.479
  652   2HH2  ARG  73          2HH2      ARG  73 -17.025  -6.888   1.245
  653    H    VAL  74           H        VAL  74 -19.004  -2.228   3.588
  654    HA   VAL  74           HA       VAL  74 -21.850  -1.939   4.202
  655    HB   VAL  74           HB       VAL  74 -19.860  -3.892   5.286
  656   1HG1  VAL  74          1HG1      VAL  74 -22.873  -3.887   5.419
  657   2HG1  VAL  74          2HG1      VAL  74 -21.754  -3.594   6.749
  658   3HG1  VAL  74          3HG1      VAL  74 -21.842  -5.192   6.005
  659   1HG2  VAL  74          1HG2      VAL  74 -21.836  -4.321   3.049
  660   2HG2  VAL  74          2HG2      VAL  74 -20.865  -5.592   3.797
  661   3HG2  VAL  74          3HG2      VAL  74 -20.080  -4.288   2.904
  662    H    TYR  75           H        TYR  75 -22.265  -0.634   5.729
  663    HA   TYR  75           HA       TYR  75 -20.123   0.446   7.380
  664   1HB   TYR  75          2HB       TYR  75 -22.964   1.413   7.021
  665   2HB   TYR  75          1HB       TYR  75 -21.722   2.226   7.964
  666    HD1  TYR  75           1HD      TYR  75 -19.740   3.184   6.799
  667    HD2  TYR  75           2HD      TYR  75 -23.071   1.650   4.665
  668    HE1  TYR  75           1HE      TYR  75 -18.997   4.391   4.782
  669    HE2  TYR  75           2HE      TYR  75 -22.342   2.841   2.644
  670    HH   TYR  75           HH       TYR  75 -19.257   4.191   2.373
  671    H    GLU  76           H        GLU  76 -20.166   0.523   9.586
  672    HA   GLU  76           HA       GLU  76 -22.320  -0.774  11.015
  673   1HB   GLU  76          2HB       GLU  76 -20.739  -2.584  10.494
  674   2HB   GLU  76          1HB       GLU  76 -19.434  -1.644  11.204
  675   1HG   GLU  76          2HG       GLU  76 -20.202  -3.400  12.713
  676   2HG   GLU  76          1HG       GLU  76 -20.482  -1.797  13.389
  677    H    GLU  77           H        GLU  77 -22.659   0.252  12.837
  678    HA   GLU  77           HA       GLU  77 -20.606   2.073  13.832
  679   1HB   GLU  77          2HB       GLU  77 -22.488   3.185  12.457
  680   2HB   GLU  77          1HB       GLU  77 -23.577   2.704  13.737
  681   1HG   GLU  77          2HG       GLU  77 -21.209   4.552  14.091
  682   2HG   GLU  77          1HG       GLU  77 -22.861   5.086  13.822
  Start of MODEL    8
    1    H    SER   1           H        SER   1  12.482   4.913  -5.167
    2    HA   SER   1           HA       SER   1  12.334   5.359  -7.967
    3   1HB   SER   1          2HB       SER   1  14.644   4.359  -6.302
    4   2HB   SER   1          1HB       SER   1  14.744   5.126  -7.886
    5    HG   SER   1           HG       SER   1  13.920   7.022  -6.966
    6    H    LYS   2           H        LYS   2  12.740   2.491  -5.953
    7    HA   LYS   2           HA       LYS   2  12.192   0.695  -8.115
    8   1HB   LYS   2          2HB       LYS   2  14.310  -0.556  -7.856
    9   2HB   LYS   2          1HB       LYS   2  14.600   1.069  -8.442
   10   1HG   LYS   2          2HG       LYS   2  15.247   1.772  -6.182
   11   2HG   LYS   2          1HG       LYS   2  14.971   0.130  -5.599
   12   1HD   LYS   2          2HD       LYS   2  16.688  -0.694  -7.137
   13   2HD   LYS   2          1HD       LYS   2  16.956   0.948  -7.714
   14   1HE   LYS   2          2HE       LYS   2  17.615   1.623  -5.456
   15   2HE   LYS   2          1HE       LYS   2  17.389  -0.027  -4.893
   16   1HZ   LYS   2          1HZ       LYS   2  19.109  -0.746  -6.433
   17   2HZ   LYS   2          2HZ       LYS   2  19.700   0.409  -5.365
   18   3HZ   LYS   2          3HZ       LYS   2  19.331   0.846  -6.959
   19    H    CYS   3           H        CYS   3  13.051  -1.667  -6.754
   20    HA   CYS   3           HA       CYS   3  11.150  -1.649  -4.622
   21   1HB   CYS   3          2HB       CYS   3  12.945  -3.882  -5.579
   22   2HB   CYS   3          1HB       CYS   3  11.660  -4.036  -4.390
   23    H    LYS   4           H        LYS   4  12.320  -0.040  -3.530
   24    HA   LYS   4           HA       LYS   4  13.532  -1.067  -1.222
   25   1HB   LYS   4          2HB       LYS   4  15.552  -1.020  -2.719
   26   2HB   LYS   4          1HB       LYS   4  15.284   0.699  -2.962
   27   1HG   LYS   4          2HG       LYS   4  15.621   1.096  -0.578
   28   2HG   LYS   4          1HG       LYS   4  15.882  -0.630  -0.327
   29   1HD   LYS   4          2HD       LYS   4  17.821  -0.525  -1.846
   30   2HD   LYS   4          1HD       LYS   4  17.561   1.211  -2.022
   31   1HE   LYS   4          2HE       LYS   4  17.907   1.500   0.390
   32   2HE   LYS   4          1HE       LYS   4  18.157  -0.235   0.557
   33   1HZ   LYS   4          1HZ       LYS   4  20.091  -0.050  -0.877
   34   2HZ   LYS   4          2HZ       LYS   4  20.250   0.959   0.453
   35   3HZ   LYS   4          3HZ       LYS   4  19.847   1.606  -1.039
   36    H    CYS   5           H        CYS   5  11.900  -0.045  -0.298
   37    HA   CYS   5           HA       CYS   5  12.132   2.736   0.160
   38   1HB   CYS   5          2HB       CYS   5   9.855   3.337  -0.737
   39   2HB   CYS   5          1HB       CYS   5  11.044   2.966  -1.975
   40    H    SER   6           H        SER   6  12.107   0.284   1.622
   41    HA   SER   6           HA       SER   6   9.642  -0.282   2.845
   42   1HB   SER   6          2HB       SER   6  12.454  -0.635   3.883
   43   2HB   SER   6          1HB       SER   6  11.010  -1.411   4.539
   44    HG   SER   6           HG       SER   6  12.439  -1.943   2.219
   45    H    ARG   7           H        ARG   7   8.537   1.369   3.676
   46    HA   ARG   7           HA       ARG   7   7.829   2.974   5.085
   47   1HB   ARG   7          2HB       ARG   7  10.328   2.326   6.663
   48   2HB   ARG   7          1HB       ARG   7   9.061   3.404   7.223
   49   1HG   ARG   7          2HG       ARG   7   7.464   1.538   7.156
   50   2HG   ARG   7          1HG       ARG   7   8.766   0.463   6.636
   51   1HD   ARG   7          2HD       ARG   7   8.369   0.283   9.035
   52   2HD   ARG   7          1HD       ARG   7   9.979   0.929   8.705
   53    HE   ARG   7           HE       ARG   7   8.005   2.951   9.072
   54   1HH1  ARG   7          1HH1      ARG   7  10.166   0.751  10.839
   55   2HH1  ARG   7          2HH1      ARG   7  10.301   1.755  12.197
   56   1HH2  ARG   7          1HH2      ARG   7   8.187   4.323  11.000
   57   2HH2  ARG   7          2HH2      ARG   7   9.170   3.792  12.291
   58    H    LYS   8           H        LYS   8   9.985   3.337   2.942
   59    HA   LYS   8           HA       LYS   8  10.808   6.050   3.660
   60   1HB   LYS   8          2HB       LYS   8  12.577   4.465   2.813
   61   2HB   LYS   8          1HB       LYS   8  11.652   4.312   1.335
   62   1HG   LYS   8          2HG       LYS   8  13.359   5.793   0.787
   63   2HG   LYS   8          1HG       LYS   8  11.965   6.817   1.053
   64   1HD   LYS   8          2HD       LYS   8  14.254   6.379   3.007
   65   2HD   LYS   8          1HD       LYS   8  14.074   7.768   1.958
   66   1HE   LYS   8          2HE       LYS   8  13.301   8.621   3.965
   67   2HE   LYS   8          1HE       LYS   8  11.809   8.030   3.252
   68   1HZ   LYS   8          1HZ       LYS   8  12.046   5.981   4.700
   69   2HZ   LYS   8          2HZ       LYS   8  11.992   7.416   5.582
   70   3HZ   LYS   8          3HZ       LYS   8  13.444   6.671   5.325
   71    H    GLY   9           H        GLY   9   9.128   7.251   3.339
   72   1HA   GLY   9          2HA       GLY   9   8.240   8.277   1.094
   73   2HA   GLY   9          1HA       GLY   9   7.277   6.798   1.221
   74    HA   PRO  10           HA       PRO  10   6.043  10.508   4.339
   75   1HB   PRO  10          2HB       PRO  10   3.928  10.655   2.211
   76   2HB   PRO  10          1HB       PRO  10   4.520  11.932   3.278
   77   1HG   PRO  10          2HG       PRO  10   5.392  11.843   0.783
   78   2HG   PRO  10          1HG       PRO  10   6.514  12.192   2.102
   79   1HD   PRO  10          2HD       PRO  10   6.225   9.697   0.495
   80   2HD   PRO  10          1HD       PRO  10   7.664  10.406   1.252
   81    H    LYS  11           H        LYS  11   4.326  10.174   5.788
   82    HA   LYS  11           HA       LYS  11   3.774   7.453   6.164
   83   1HB   LYS  11          2HB       LYS  11   2.621   9.845   7.578
   84   2HB   LYS  11          1HB       LYS  11   2.438   8.178   8.103
   85   1HG   LYS  11          2HG       LYS  11   4.834   7.979   8.391
   86   2HG   LYS  11          1HG       LYS  11   5.051   9.633   7.813
   87   1HD   LYS  11          2HD       LYS  11   3.722  10.452   9.696
   88   2HD   LYS  11          1HD       LYS  11   3.523   8.794  10.274
   89   1HE   LYS  11          2HE       LYS  11   5.929   8.591  10.557
   90   2HE   LYS  11          1HE       LYS  11   6.151  10.218   9.926
   91   1HZ   LYS  11          1HZ       LYS  11   6.234  10.227  12.322
   92   2HZ   LYS  11          2HZ       LYS  11   4.739   9.474  12.426
   93   3HZ   LYS  11          3HZ       LYS  11   4.842  11.045  11.823
   94    H    ILE  12           H        ILE  12   2.073   6.242   5.936
   95    HA   ILE  12           HA       ILE  12  -0.184   7.282   4.322
   96    HB   ILE  12           HB       ILE  12   0.922   4.482   4.309
   97   1HG1  ILE  12          2HG1      ILE  12   1.486   6.677   2.308
   98   2HG1  ILE  12          1HG1      ILE  12   2.644   6.078   3.493
   99   1HG2  ILE  12          1HG2      ILE  12  -0.869   5.992   2.393
  100   2HG2  ILE  12          2HG2      ILE  12  -1.409   4.803   3.578
  101   3HG2  ILE  12          3HG2      ILE  12  -0.371   4.304   2.248
  102   1HD1  ILE  12          1HD1      ILE  12   3.040   5.110   1.335
  103   2HD1  ILE  12          2HD1      ILE  12   1.375   4.534   1.270
  104   3HD1  ILE  12          3HD1      ILE  12   2.500   3.852   2.457
  105    H    ARG  13           H        ARG  13  -2.047   7.108   5.323
  106    HA   ARG  13           HA       ARG  13  -2.331   4.895   7.179
  107   1HB   ARG  13          2HB       ARG  13  -4.046   7.387   6.948
  108   2HB   ARG  13          1HB       ARG  13  -4.198   6.040   8.087
  109   1HG   ARG  13          2HG       ARG  13  -2.156   6.597   9.167
  110   2HG   ARG  13          1HG       ARG  13  -1.801   7.848   7.978
  111   1HD   ARG  13          2HD       ARG  13  -2.615   8.881   9.996
  112   2HD   ARG  13          1HD       ARG  13  -3.810   9.067   8.719
  113    HE   ARG  13           HE       ARG  13  -4.413   6.769  10.241
  114   1HH1  ARG  13          1HH1      ARG  13  -4.538  10.307  10.437
  115   2HH1  ARG  13          2HH1      ARG  13  -5.723  10.319  11.668
  116   1HH2  ARG  13          1HH2      ARG  13  -6.065   6.832  11.921
  117   2HH2  ARG  13          2HH2      ARG  13  -6.612   8.348  12.496
  118    H    TYR  14           H        TYR  14  -4.665   4.052   7.038
  119    HA   TYR  14           HA       TYR  14  -4.917   2.981   4.445
  120   1HB   TYR  14          2HB       TYR  14  -6.950   2.946   6.685
  121   2HB   TYR  14          1HB       TYR  14  -6.821   1.804   5.350
  122    HD1  TYR  14           1HD      TYR  14  -5.538   2.747   8.616
  123    HD2  TYR  14           2HD      TYR  14  -4.898   0.186   5.261
  124    HE1  TYR  14           1HE      TYR  14  -4.021   1.364   9.956
  125    HE2  TYR  14           2HE      TYR  14  -3.409  -1.179   6.592
  126    HH   TYR  14           HH       TYR  14  -1.990  -0.959   8.580
  127    H    SER  15           H        SER  15  -6.362   5.652   6.074
  128    HA   SER  15           HA       SER  15  -8.515   6.158   4.305
  129   1HB   SER  15          2HB       SER  15  -7.047   7.966   6.197
  130   2HB   SER  15          1HB       SER  15  -8.633   8.299   5.482
  131    HG   SER  15           HG       SER  15  -9.546   6.814   6.711
  132    H    ASP  16           H        ASP  16  -5.110   6.670   4.041
  133    HA   ASP  16           HA       ASP  16  -5.208   8.914   2.189
  134   1HB   ASP  16          2HB       ASP  16  -2.962   7.119   3.132
  135   2HB   ASP  16          1HB       ASP  16  -2.743   8.256   1.826
  136    H    VAL  17           H        VAL  17  -5.324   5.553   2.164
  137    HA   VAL  17           HA       VAL  17  -4.319   5.272  -0.545
  138    HB   VAL  17           HB       VAL  17  -5.547   3.142   1.192
  139   1HG1  VAL  17          1HG1      VAL  17  -5.424   2.485  -1.077
  140   2HG1  VAL  17          2HG1      VAL  17  -4.189   1.600  -0.175
  141   3HG1  VAL  17          3HG1      VAL  17  -3.740   2.966  -1.195
  142   1HG2  VAL  17          1HG2      VAL  17  -3.265   2.509   1.855
  143   2HG2  VAL  17          2HG2      VAL  17  -3.710   4.119   2.426
  144   3HG2  VAL  17          3HG2      VAL  17  -2.645   3.941   1.033
  145    H    LYS  18           H        LYS  18  -5.552   5.007  -2.289
  146    HA   LYS  18           HA       LYS  18  -8.492   5.011  -1.960
  147   1HB   LYS  18          2HB       LYS  18  -7.290   6.748  -3.318
  148   2HB   LYS  18          1HB       LYS  18  -6.861   5.478  -4.425
  149   1HG   LYS  18          2HG       LYS  18  -9.213   4.980  -4.886
  150   2HG   LYS  18          1HG       LYS  18  -9.706   6.260  -3.780
  151   1HD   LYS  18          2HD       LYS  18  -9.837   7.013  -6.097
  152   2HD   LYS  18          1HD       LYS  18  -8.599   7.915  -5.222
  153   1HE   LYS  18          2HE       LYS  18  -6.861   6.545  -6.211
  154   2HE   LYS  18          1HE       LYS  18  -8.072   5.544  -7.012
  155   1HZ   LYS  18          1HZ       LYS  18  -7.576   8.421  -7.493
  156   2HZ   LYS  18          2HZ       LYS  18  -8.760   7.505  -8.267
  157   3HZ   LYS  18          3HZ       LYS  18  -7.126   7.159  -8.510
  158    H    LYS  19           H        LYS  19  -5.772   3.385  -3.177
  159    HA   LYS  19           HA       LYS  19  -7.120   0.914  -3.481
  160   1HB   LYS  19          2HB       LYS  19  -6.603   0.497  -5.831
  161   2HB   LYS  19          1HB       LYS  19  -7.693   1.898  -5.679
  162   1HG   LYS  19          2HG       LYS  19  -5.843   3.341  -6.111
  163   2HG   LYS  19          1HG       LYS  19  -4.750   1.945  -6.200
  164   1HD   LYS  19          2HD       LYS  19  -7.087   2.535  -8.026
  165   2HD   LYS  19          1HD       LYS  19  -5.382   2.715  -8.433
  166   1HE   LYS  19          2HE       LYS  19  -6.791   0.106  -7.774
  167   2HE   LYS  19          1HE       LYS  19  -6.309   0.661  -9.364
  168   1HZ   LYS  19          1HZ       LYS  19  -4.387   0.088  -7.151
  169   2HZ   LYS  19          2HZ       LYS  19  -4.014   0.514  -8.744
  170   3HZ   LYS  19          3HZ       LYS  19  -4.775  -0.944  -8.417
  171    H    LEU  20           H        LEU  20  -5.698  -0.830  -3.653
  172    HA   LEU  20           HA       LEU  20  -2.849  -0.197  -3.353
  173   1HB   LEU  20          2HB       LEU  20  -4.092  -0.467  -1.174
  174   2HB   LEU  20          1HB       LEU  20  -4.531  -2.071  -1.683
  175    HG   LEU  20           HG       LEU  20  -1.675  -1.195  -1.211
  176   1HD1  LEU  20          1HD1      LEU  20  -1.895  -2.294   0.955
  177   2HD1  LEU  20          2HD1      LEU  20  -3.599  -2.623   0.642
  178   3HD1  LEU  20          3HD1      LEU  20  -3.043  -0.971   0.819
  179   1HD2  LEU  20          1HD2      LEU  20  -1.237  -3.601  -1.083
  180   2HD2  LEU  20          2HD2      LEU  20  -1.975  -3.210  -2.636
  181   3HD2  LEU  20          3HD2      LEU  20  -2.944  -3.939  -1.357
  182    H    GLU  21           H        GLU  21  -1.656  -1.482  -4.733
  183    HA   GLU  21           HA       GLU  21  -2.960  -3.921  -5.673
  184   1HB   GLU  21          2HB       GLU  21  -3.112  -2.160  -7.390
  185   2HB   GLU  21          1HB       GLU  21  -1.371  -1.939  -7.313
  186   1HG   GLU  21          2HG       GLU  21  -2.012  -3.249  -9.254
  187   2HG   GLU  21          1HG       GLU  21  -1.033  -4.199  -8.135
  188    H    MET  22           H        MET  22  -1.618  -5.671  -5.697
  189    HA   MET  22           HA       MET  22   1.135  -5.137  -4.881
  190   1HB   MET  22          2HB       MET  22  -0.570  -7.601  -4.618
  191   2HB   MET  22          1HB       MET  22   1.131  -7.533  -4.194
  192   1HG   MET  22          2HG       MET  22   0.683  -5.919  -2.465
  193   2HG   MET  22          1HG       MET  22  -1.009  -5.828  -2.948
  194   1HE   MET  22          1HE       MET  22  -2.737  -7.745  -2.663
  195   2HE   MET  22          2HE       MET  22  -2.392  -9.311  -1.948
  196   3HE   MET  22          3HE       MET  22  -1.726  -8.906  -3.526
  197    H    LYS  23           H        LYS  23   2.397  -5.077  -6.534
  198    HA   LYS  23           HA       LYS  23   2.811  -7.361  -8.078
  199   1HB   LYS  23          2HB       LYS  23   2.596  -6.284 -10.363
  200   2HB   LYS  23          1HB       LYS  23   1.079  -6.607  -9.562
  201   1HG   LYS  23          2HG       LYS  23   0.903  -4.514 -10.695
  202   2HG   LYS  23          1HG       LYS  23   0.976  -4.175  -8.971
  203   1HD   LYS  23          2HD       LYS  23   3.313  -3.546  -9.171
  204   2HD   LYS  23          1HD       LYS  23   3.302  -3.987 -10.881
  205   1HE   LYS  23          2HE       LYS  23   1.579  -1.844  -9.640
  206   2HE   LYS  23          1HE       LYS  23   3.090  -1.559 -10.514
  207   1HZ   LYS  23          1HZ       LYS  23   1.111  -1.219 -11.845
  208   2HZ   LYS  23          2HZ       LYS  23   0.653  -2.825 -11.670
  209   3HZ   LYS  23          3HZ       LYS  23   2.075  -2.428 -12.494
  210    HA   PRO  24           HA       PRO  24   6.834  -5.669  -7.850
  211   1HB   PRO  24          2HB       PRO  24   8.055  -6.761 -10.028
  212   2HB   PRO  24          1HB       PRO  24   7.731  -7.689  -8.561
  213   1HG   PRO  24          2HG       PRO  24   6.221  -7.586 -11.127
  214   2HG   PRO  24          1HG       PRO  24   6.595  -9.000 -10.124
  215   1HD   PRO  24          2HD       PRO  24   4.164  -7.800 -10.109
  216   2HD   PRO  24          1HD       PRO  24   4.851  -8.569  -8.665
  217    H    LYS  25           H        LYS  25   7.119  -3.575  -8.289
  218    HA   LYS  25           HA       LYS  25   6.038  -2.258 -10.546
  219   1HB   LYS  25          2HB       LYS  25   6.491  -1.208  -8.349
  220   2HB   LYS  25          1HB       LYS  25   8.208  -1.267  -8.718
  221   1HG   LYS  25          2HG       LYS  25   7.950   0.254 -10.531
  222   2HG   LYS  25          1HG       LYS  25   6.190   0.152 -10.427
  223   1HD   LYS  25          2HD       LYS  25   6.231   1.044  -8.267
  224   2HD   LYS  25          1HD       LYS  25   7.998   1.199  -8.281
  225   1HE   LYS  25          2HE       LYS  25   7.034   3.395  -8.799
  226   2HE   LYS  25          1HE       LYS  25   7.773   2.726 -10.252
  227   1HZ   LYS  25          1HZ       LYS  25   5.532   2.027 -10.978
  228   2HZ   LYS  25          2HZ       LYS  25   5.660   3.682 -10.790
  229   3HZ   LYS  25          3HZ       LYS  25   4.839   2.788  -9.640
  230    H    TYR  26           H        TYR  26   8.962  -3.888  -9.971
  231    HA   TYR  26           HA       TYR  26   9.891  -3.260 -12.658
  232   1HB   TYR  26          2HB       TYR  26  11.581  -3.419 -10.127
  233   2HB   TYR  26          1HB       TYR  26  12.269  -3.591 -11.717
  234    HD1  TYR  26           1HD      TYR  26  12.603  -1.783 -13.113
  235    HD2  TYR  26           2HD      TYR  26  10.557  -1.264  -9.441
  236    HE1  TYR  26           1HE      TYR  26  12.823   0.669 -13.347
  237    HE2  TYR  26           2HE      TYR  26  10.771   1.179  -9.645
  238    HH   TYR  26           HH       TYR  26  12.222   2.753 -10.738
  239    HA   PRO  27           HA       PRO  27   9.602  -7.714 -13.036
  240   1HB   PRO  27          2HB       PRO  27  11.746  -7.442 -15.077
  241   2HB   PRO  27          1HB       PRO  27  10.130  -8.133 -15.238
  242   1HG   PRO  27          2HG       PRO  27  10.712  -5.760 -16.316
  243   2HG   PRO  27          1HG       PRO  27   9.129  -6.079 -15.591
  244   1HD   PRO  27          2HD       PRO  27  11.438  -4.528 -14.484
  245   2HD   PRO  27          1HD       PRO  27   9.691  -4.211 -14.386
  246    H    HIS  28           H        HIS  28  12.553  -6.032 -12.589
  247    HA   HIS  28           HA       HIS  28  14.118  -8.384 -11.848
  248   1HB   HIS  28          2HB       HIS  28  15.992  -6.804 -11.463
  249   2HB   HIS  28          1HB       HIS  28  15.278  -6.557 -13.050
  250    HD1  HIS  28           1HD      HIS  28  15.672  -4.941  -9.665
  251    HD2  HIS  28           2HD      HIS  28  14.207  -3.891 -13.429
  252    HE1  HIS  28           1HE      HIS  28  15.253  -2.479  -9.640
  253    HE2  HIS  28           2HE      HIS  28  14.929  -1.932 -12.034
  254    H    CYS  29           H        CYS  29  11.764  -7.788 -10.228
  255    HA   CYS  29           HA       CYS  29  12.968  -6.950  -7.660
  256   1HB   CYS  29          2HB       CYS  29  11.181  -5.516  -8.694
  257   2HB   CYS  29          1HB       CYS  29  10.094  -6.878  -8.529
  258    H    GLU  30           H        GLU  30  12.351  -8.234  -5.736
  259    HA   GLU  30           HA       GLU  30  11.641 -10.939  -6.354
  260   1HB   GLU  30          2HB       GLU  30  13.507 -10.351  -4.840
  261   2HB   GLU  30          1HB       GLU  30  12.381  -9.497  -3.806
  262   1HG   GLU  30          2HG       GLU  30  11.295 -11.565  -3.373
  263   2HG   GLU  30          1HG       GLU  30  12.494 -12.361  -4.412
  264    H    GLU  31           H        GLU  31   9.607 -11.671  -6.032
  265    HA   GLU  31           HA       GLU  31   7.408 -11.723  -5.672
  266   1HB   GLU  31          2HB       GLU  31   8.438 -10.708  -3.073
  267   2HB   GLU  31          1HB       GLU  31   6.706 -10.873  -3.295
  268   1HG   GLU  31          2HG       GLU  31   7.623 -12.841  -2.211
  269   2HG   GLU  31          1HG       GLU  31   6.996 -13.253  -3.797
  270    H    LYS  32           H        LYS  32   5.459 -10.340  -4.538
  271    HA   LYS  32           HA       LYS  32   5.152  -8.185  -6.445
  272   1HB   LYS  32          2HB       LYS  32   3.200  -9.643  -4.664
  273   2HB   LYS  32          1HB       LYS  32   2.760  -8.162  -5.490
  274   1HG   LYS  32          2HG       LYS  32   2.005 -10.215  -6.643
  275   2HG   LYS  32          1HG       LYS  32   3.057  -9.229  -7.645
  276   1HD   LYS  32          2HD       LYS  32   4.888 -10.591  -7.099
  277   2HD   LYS  32          1HD       LYS  32   3.908 -11.634  -6.063
  278   1HE   LYS  32          2HE       LYS  32   3.544 -11.227  -9.055
  279   2HE   LYS  32          1HE       LYS  32   4.207 -12.670  -8.299
  280   1HZ   LYS  32          1HZ       LYS  32   2.050 -13.038  -7.230
  281   2HZ   LYS  32          2HZ       LYS  32   1.906 -12.995  -8.895
  282   3HZ   LYS  32          3HZ       LYS  32   1.413 -11.670  -7.984
  283    H    MET  33           H        MET  33   5.425  -6.268  -5.986
  284    HA   MET  33           HA       MET  33   5.837  -5.349  -3.228
  285   1HB   MET  33          2HB       MET  33   5.982  -3.776  -5.790
  286   2HB   MET  33          1HB       MET  33   6.334  -3.138  -4.204
  287   1HG   MET  33          2HG       MET  33   7.880  -5.267  -5.671
  288   2HG   MET  33          1HG       MET  33   8.354  -3.592  -5.462
  289   1HE   MET  33          1HE       MET  33   7.146  -6.683  -3.146
  290   2HE   MET  33          2HE       MET  33   8.684  -6.990  -2.359
  291   3HE   MET  33          3HE       MET  33   8.543  -7.176  -4.101
  292    H    VAL  34           H        VAL  34   4.827  -3.483  -2.355
  293    HA   VAL  34           HA       VAL  34   1.981  -3.557  -2.899
  294    HB   VAL  34           HB       VAL  34   3.578  -2.318  -0.661
  295   1HG1  VAL  34          1HG1      VAL  34   1.480  -1.113  -1.053
  296   2HG1  VAL  34          2HG1      VAL  34   1.414  -1.996   0.473
  297   3HG1  VAL  34          3HG1      VAL  34   0.583  -2.625  -0.954
  298   1HG2  VAL  34          1HG2      VAL  34   2.671  -4.139   0.711
  299   2HG2  VAL  34          2HG2      VAL  34   3.634  -4.751  -0.630
  300   3HG2  VAL  34          3HG2      VAL  34   1.873  -4.812  -0.710
  301    H    ILE  35           H        ILE  35   1.316  -2.164  -4.367
  302    HA   ILE  35           HA       ILE  35   2.641   0.425  -4.630
  303    HB   ILE  35           HB       ILE  35   0.574  -0.865  -6.419
  304   1HG1  ILE  35          2HG1      ILE  35   2.558  -2.225  -6.361
  305   2HG1  ILE  35          1HG1      ILE  35   2.417  -1.437  -7.925
  306   1HG2  ILE  35          1HG2      ILE  35   1.334   0.797  -8.075
  307   2HG2  ILE  35          2HG2      ILE  35   2.410   1.490  -6.852
  308   3HG2  ILE  35          3HG2      ILE  35   0.661   1.541  -6.621
  309   1HD1  ILE  35          1HD1      ILE  35   4.134   0.200  -7.232
  310   2HD1  ILE  35          2HD1      ILE  35   4.731  -1.460  -7.164
  311   3HD1  ILE  35          3HD1      ILE  35   4.272  -0.630  -5.681
  312    H    ILE  36           H        ILE  36   1.729   1.936  -3.486
  313    HA   ILE  36           HA       ILE  36  -1.126   1.746  -2.949
  314    HB   ILE  36           HB       ILE  36   1.072   3.148  -1.473
  315   1HG1  ILE  36          2HG1      ILE  36  -0.902   0.989  -0.757
  316   2HG1  ILE  36          1HG1      ILE  36   0.837   0.824  -0.980
  317   1HG2  ILE  36          1HG2      ILE  36  -0.798   4.712  -1.540
  318   2HG2  ILE  36          2HG2      ILE  36  -0.604   4.040   0.080
  319   3HG2  ILE  36          3HG2      ILE  36  -1.887   3.443  -0.976
  320   1HD1  ILE  36          1HD1      ILE  36   0.198   0.806   1.363
  321   2HD1  ILE  36          2HD1      ILE  36  -0.550   2.387   1.116
  322   3HD1  ILE  36          3HD1      ILE  36   1.206   2.222   0.962
  323    H    THR  37           H        THR  37  -2.430   2.953  -3.901
  324    HA   THR  37           HA       THR  37  -1.502   5.341  -5.326
  325    HB   THR  37           HB       THR  37  -4.013   3.698  -5.493
  326    HG1  THR  37           1HG      THR  37  -1.976   3.814  -7.465
  327   1HG2  THR  37          1HG2      THR  37  -3.027   5.857  -7.378
  328   2HG2  THR  37          2HG2      THR  37  -4.379   5.992  -6.226
  329   3HG2  THR  37          3HG2      THR  37  -4.482   4.850  -7.559
  330    H    THR  38           H        THR  38  -2.034   7.261  -4.342
  331    HA   THR  38           HA       THR  38  -3.651   7.104  -1.969
  332    HB   THR  38           HB       THR  38  -2.976   9.507  -1.664
  333    HG1  THR  38           1HG      THR  38  -1.197   9.025  -3.853
  334   1HG2  THR  38          1HG2      THR  38  -0.622   8.952  -1.169
  335   2HG2  THR  38          2HG2      THR  38  -0.775   7.493  -2.152
  336   3HG2  THR  38          3HG2      THR  38  -1.704   7.650  -0.669
  337    H    LYS  39           H        LYS  39  -5.321   8.641  -1.461
  338    HA   LYS  39           HA       LYS  39  -7.299   8.657  -3.555
  339   1HB   LYS  39          2HB       LYS  39  -7.871   8.041  -1.270
  340   2HB   LYS  39          1HB       LYS  39  -7.447   9.653  -0.720
  341   1HG   LYS  39          2HG       LYS  39  -9.264  10.584  -2.074
  342   2HG   LYS  39          1HG       LYS  39  -9.695   8.949  -2.593
  343   1HD   LYS  39          2HD       LYS  39 -10.157   8.326  -0.290
  344   2HD   LYS  39          1HD       LYS  39  -9.677   9.932   0.261
  345   1HE   LYS  39          2HE       LYS  39 -11.496  10.896  -1.099
  346   2HE   LYS  39          1HE       LYS  39 -11.988   9.270  -1.558
  347   1HZ   LYS  39          1HZ       LYS  39 -12.376   8.790   0.795
  348   2HZ   LYS  39          2HZ       LYS  39 -13.342  10.036   0.246
  349   3HZ   LYS  39          3HZ       LYS  39 -11.993  10.382   1.196
  350    H    SER  40           H        SER  40  -5.780  11.282  -1.661
  351    HA   SER  40           HA       SER  40  -5.488  13.176  -3.627
  352   1HB   SER  40          2HB       SER  40  -8.014  12.988  -3.916
  353   2HB   SER  40          1HB       SER  40  -8.188  13.616  -2.282
  354    HG   SER  40           HG       SER  40  -7.886  14.897  -4.544
  355    H    VAL  41           H        VAL  41  -6.679  12.671  -0.323
  356    HA   VAL  41           HA       VAL  41  -5.908  15.097   0.821
  357    HB   VAL  41           HB       VAL  41  -7.387  13.461   1.939
  358   1HG1  VAL  41          1HG1      VAL  41  -6.280  11.399   1.395
  359   2HG1  VAL  41          2HG1      VAL  41  -6.477  11.531   3.144
  360   3HG1  VAL  41          3HG1      VAL  41  -4.904  11.839   2.410
  361   1HG2  VAL  41          1HG2      VAL  41  -6.533  13.714   4.242
  362   2HG2  VAL  41          2HG2      VAL  41  -6.385  15.202   3.309
  363   3HG2  VAL  41          3HG2      VAL  41  -4.967  14.197   3.589
  364    H    SER  42           H        SER  42  -3.990  12.374  -0.024
  365    HA   SER  42           HA       SER  42  -1.713  12.916   1.562
  366   1HB   SER  42          2HB       SER  42  -1.919  11.415  -1.028
  367   2HB   SER  42          1HB       SER  42  -0.753  11.168   0.267
  368    HG   SER  42           HG       SER  42  -2.569  10.544   1.622
  369    H    ARG  43           H        ARG  43   0.371  13.623   0.634
  370    HA   ARG  43           HA       ARG  43   0.122  15.942  -1.002
  371   1HB   ARG  43          2HB       ARG  43   2.581  16.108  -0.854
  372   2HB   ARG  43          1HB       ARG  43   1.807  15.895   0.711
  373   1HG   ARG  43          2HG       ARG  43   2.463  13.557   0.732
  374   2HG   ARG  43          1HG       ARG  43   3.172  13.727  -0.871
  375   1HD   ARG  43          2HD       ARG  43   4.049  15.250   1.585
  376   2HD   ARG  43          1HD       ARG  43   4.853  13.821   0.955
  377    HE   ARG  43           HE       ARG  43   4.597  15.834  -1.030
  378   1HH1  ARG  43          1HH1      ARG  43   6.545  14.996   1.838
  379   2HH1  ARG  43          2HH1      ARG  43   7.933  15.787   1.251
  380   1HH2  ARG  43          1HH2      ARG  43   6.532  16.924  -1.777
  381   2HH2  ARG  43          2HH2      ARG  43   7.930  16.910  -0.804
  382    H    TYR  44           H        TYR  44   0.397  12.741  -1.831
  383    HA   TYR  44           HA       TYR  44   1.778  13.196  -4.305
  384   1HB   TYR  44          2HB       TYR  44   0.642  10.810  -2.975
  385   2HB   TYR  44          1HB       TYR  44   0.996  10.680  -4.676
  386    HD1  TYR  44           1HD      TYR  44   2.453  11.323  -1.348
  387    HD2  TYR  44           2HD      TYR  44   3.253  10.473  -5.425
  388    HE1  TYR  44           1HE      TYR  44   4.786  10.834  -0.792
  389    HE2  TYR  44           2HE      TYR  44   5.590   9.979  -4.872
  390    HH   TYR  44           HH       TYR  44   7.201  10.554  -3.099
  391    H    ARG  45           H        ARG  45  -1.557  12.309  -3.451
  392    HA   ARG  45           HA       ARG  45  -3.520  12.491  -4.541
  393   1HB   ARG  45          2HB       ARG  45  -2.125  14.734  -6.019
  394   2HB   ARG  45          1HB       ARG  45  -3.852  14.426  -6.078
  395   1HG   ARG  45          2HG       ARG  45  -4.023  14.844  -3.692
  396   2HG   ARG  45          1HG       ARG  45  -2.286  15.111  -3.608
  397   1HD   ARG  45          2HD       ARG  45  -2.487  17.033  -5.060
  398   2HD   ARG  45          1HD       ARG  45  -4.218  16.742  -5.248
  399    HE   ARG  45           HE       ARG  45  -3.900  16.925  -2.584
  400   1HH1  ARG  45          1HH1      ARG  45  -2.960  19.078  -5.228
  401   2HH1  ARG  45          2HH1      ARG  45  -3.150  20.503  -4.315
  402   1HH2  ARG  45          1HH2      ARG  45  -4.153  18.874  -1.340
  403   2HH2  ARG  45          2HH2      ARG  45  -3.833  20.394  -2.064
  404    H    GLY  46           H        GLY  46  -3.529  10.471  -5.483
  405   1HA   GLY  46          2HA       GLY  46  -3.889   9.092  -7.284
  406   2HA   GLY  46          1HA       GLY  46  -3.583  10.463  -8.341
  407    H    GLN  47           H        GLN  47  -1.090  10.352  -6.338
  408    HA   GLN  47           HA       GLN  47   0.470   8.771  -8.184
  409   1HB   GLN  47          2HB       GLN  47   1.419  11.051  -6.414
  410   2HB   GLN  47          1HB       GLN  47   2.480  10.040  -7.399
  411   1HG   GLN  47          2HG       GLN  47   1.313  10.788  -9.394
  412   2HG   GLN  47          1HG       GLN  47   0.254  11.785  -8.401
  413   1HE2  GLN  47          1HE2      GLN  47   1.086  13.613  -7.419
  414   2HE2  GLN  47          2HE2      GLN  47   2.556  14.348  -7.922
  415    H    GLU  48           H        GLU  48   2.421   7.712  -7.258
  416    HA   GLU  48           HA       GLU  48   1.212   5.693  -5.563
  417   1HB   GLU  48          2HB       GLU  48   3.767   5.737  -7.097
  418   2HB   GLU  48          1HB       GLU  48   3.071   4.353  -6.284
  419   1HG   GLU  48          2HG       GLU  48   1.275   4.261  -7.802
  420   2HG   GLU  48          1HG       GLU  48   1.674   5.826  -8.491
  421    H    HIS  49           H        HIS  49   2.141   4.748  -3.948
  422    HA   HIS  49           HA       HIS  49   4.665   5.630  -2.745
  423   1HB   HIS  49          2HB       HIS  49   2.066   4.925  -1.430
  424   2HB   HIS  49          1HB       HIS  49   3.596   4.637  -0.619
  425    HD1  HIS  49           1HD      HIS  49   4.807   6.627   0.298
  426    HD2  HIS  49           2HD      HIS  49   1.268   7.575  -1.628
  427    HE1  HIS  49           1HE      HIS  49   4.234   8.949   1.055
  428    HE2  HIS  49           2HE      HIS  49   1.993   9.397   0.073
  429    H    CYS  50           H        CYS  50   5.736   3.794  -1.679
  430    HA   CYS  50           HA       CYS  50   4.600   1.284  -2.578
  431   1HB   CYS  50          2HB       CYS  50   6.835   0.488  -3.317
  432   2HB   CYS  50          1HB       CYS  50   6.163   1.778  -4.304
  433    H    LEU  51           H        LEU  51   4.867  -0.384  -1.336
  434    HA   LEU  51           HA       LEU  51   6.602  -0.108   0.970
  435   1HB   LEU  51          2HB       LEU  51   3.803  -1.218   0.932
  436   2HB   LEU  51          1HB       LEU  51   4.950  -1.623   2.193
  437    HG   LEU  51           HG       LEU  51   4.145   1.151   1.505
  438   1HD1  LEU  51          1HD1      LEU  51   2.704   1.010   3.563
  439   2HD1  LEU  51          2HD1      LEU  51   3.148  -0.688   3.726
  440   3HD1  LEU  51          3HD1      LEU  51   2.188  -0.152   2.345
  441   1HD2  LEU  51          1HD2      LEU  51   6.270   1.013   2.646
  442   2HD2  LEU  51          2HD2      LEU  51   5.561  -0.011   3.895
  443   3HD2  LEU  51          3HD2      LEU  51   5.057   1.669   3.745
  444    H    HIS  52           H        HIS  52   7.565  -1.774   1.604
  445    HA   HIS  52           HA       HIS  52   7.911  -3.842  -0.447
  446   1HB   HIS  52          2HB       HIS  52   9.857  -2.397   0.045
  447   2HB   HIS  52          1HB       HIS  52   9.826  -2.930   1.714
  448    HD1  HIS  52           1HD      HIS  52  11.390  -4.768   2.230
  449    HD2  HIS  52           2HD      HIS  52  10.445  -4.624  -1.812
  450    HE1  HIS  52           1HE      HIS  52  12.729  -6.543   1.189
  451    HE2  HIS  52           2HE      HIS  52  12.139  -6.513  -1.253
  452    HA   PRO  53           HA       PRO  53   5.520  -6.171   2.624
  453   1HB   PRO  53          2HB       PRO  53   5.159  -8.328   1.122
  454   2HB   PRO  53          1HB       PRO  53   4.221  -6.829   0.893
  455   1HG   PRO  53          2HG       PRO  53   6.624  -7.844  -0.580
  456   2HG   PRO  53          1HG       PRO  53   5.144  -7.139  -1.247
  457   1HD   PRO  53          2HD       PRO  53   7.372  -5.717  -1.004
  458   2HD   PRO  53          1HD       PRO  53   5.784  -4.975  -0.695
  459    H    LYS  54           H        LYS  54   8.600  -6.637   2.151
  460    HA   LYS  54           HA       LYS  54   8.774  -9.341   2.961
  461   1HB   LYS  54          2HB       LYS  54  10.816  -7.166   2.746
  462   2HB   LYS  54          1HB       LYS  54  11.219  -8.819   3.210
  463   1HG   LYS  54          2HG       LYS  54   9.772  -8.112   0.669
  464   2HG   LYS  54          1HG       LYS  54  11.519  -8.290   0.812
  465   1HD   LYS  54          2HD       LYS  54  11.334 -10.566   1.374
  466   2HD   LYS  54          1HD       LYS  54   9.589 -10.464   1.584
  467   1HE   LYS  54          2HE       LYS  54   9.243 -10.119  -0.673
  468   2HE   LYS  54          1HE       LYS  54  10.943  -9.944  -1.092
  469   1HZ   LYS  54          1HZ       LYS  54  11.280 -12.231  -0.389
  470   2HZ   LYS  54          2HZ       LYS  54  10.175 -12.214  -1.627
  471   3HZ   LYS  54          3HZ       LYS  54   9.631 -12.412  -0.038
  472    H    LEU  55           H        LEU  55   8.186  -6.358   4.431
  473    HA   LEU  55           HA       LEU  55   9.149  -7.021   7.097
  474   1HB   LEU  55          2HB       LEU  55   7.762  -4.581   5.994
  475   2HB   LEU  55          1HB       LEU  55   8.304  -4.756   7.650
  476    HG   LEU  55           HG       LEU  55  10.097  -4.722   5.223
  477   1HD1  LEU  55          1HD1      LEU  55  10.810  -2.551   6.102
  478   2HD1  LEU  55          2HD1      LEU  55   9.535  -2.631   7.313
  479   3HD1  LEU  55          3HD1      LEU  55   9.121  -2.551   5.599
  480   1HD2  LEU  55          1HD2      LEU  55  10.735  -4.739   8.171
  481   2HD2  LEU  55          2HD2      LEU  55  11.908  -4.547   6.867
  482   3HD2  LEU  55          3HD2      LEU  55  11.018  -6.061   7.045
  483    H    GLN  56           H        GLN  56   7.819  -7.382   8.815
  484    HA   GLN  56           HA       GLN  56   5.371  -8.682   8.331
  485   1HB   GLN  56          2HB       GLN  56   5.187  -8.872  10.776
  486   2HB   GLN  56          1HB       GLN  56   6.769  -9.345  10.184
  487   1HG   GLN  56          2HG       GLN  56   7.634  -7.129  10.837
  488   2HG   GLN  56          1HG       GLN  56   6.052  -6.742  11.500
  489   1HE2  GLN  56          1HE2      GLN  56   8.902  -8.639  11.836
  490   2HE2  GLN  56          2HE2      GLN  56   8.657  -9.124  13.471
  491    H    SER  57           H        SER  57   6.058  -5.378   9.215
  492    HA   SER  57           HA       SER  57   3.486  -4.693  10.169
  493   1HB   SER  57          2HB       SER  57   5.470  -3.289  10.594
  494   2HB   SER  57          1HB       SER  57   5.582  -2.927   8.872
  495    HG   SER  57           HG       SER  57   3.701  -2.105  10.775
  496    H    THR  58           H        THR  58   4.902  -4.887   6.959
  497    HA   THR  58           HA       THR  58   2.946  -3.456   5.601
  498    HB   THR  58           HB       THR  58   4.622  -5.738   4.536
  499    HG1  THR  58           1HG      THR  58   5.212  -3.050   5.214
  500   1HG2  THR  58          1HG2      THR  58   2.852  -4.933   3.023
  501   2HG2  THR  58          2HG2      THR  58   4.440  -4.470   2.412
  502   3HG2  THR  58          3HG2      THR  58   3.430  -3.280   3.226
  503    H    LYS  59           H        LYS  59   3.202  -6.916   6.489
  504    HA   LYS  59           HA       LYS  59   0.970  -7.886   5.078
  505   1HB   LYS  59          2HB       LYS  59   2.155  -8.807   7.682
  506   2HB   LYS  59          1HB       LYS  59   0.760  -9.581   6.955
  507   1HG   LYS  59          2HG       LYS  59   2.669 -10.846   6.410
  508   2HG   LYS  59          1HG       LYS  59   2.132 -10.037   4.953
  509   1HD   LYS  59          2HD       LYS  59   3.871  -8.372   5.189
  510   2HD   LYS  59          1HD       LYS  59   4.398  -9.101   6.702
  511   1HE   LYS  59          2HE       LYS  59   5.850  -9.774   4.870
  512   2HE   LYS  59          1HE       LYS  59   4.973 -11.160   5.512
  513   1HZ   LYS  59          1HZ       LYS  59   4.254  -9.646   3.065
  514   2HZ   LYS  59          2HZ       LYS  59   3.460 -11.029   3.609
  515   3HZ   LYS  59          3HZ       LYS  59   5.054 -11.109   3.082
  516    H    ARG  60           H        ARG  60   1.039  -6.468   8.355
  517    HA   ARG  60           HA       ARG  60  -1.705  -6.798   8.583
  518   1HB   ARG  60          2HB       ARG  60   0.253  -5.175  10.100
  519   2HB   ARG  60          1HB       ARG  60  -1.456  -4.846  10.286
  520   1HG   ARG  60          2HG       ARG  60  -0.914  -6.303  12.012
  521   2HG   ARG  60          1HG       ARG  60  -1.759  -7.253  10.827
  522   1HD   ARG  60          2HD       ARG  60   0.401  -8.037   9.875
  523   2HD   ARG  60          1HD       ARG  60   1.244  -7.197  11.175
  524    HE   ARG  60           HE       ARG  60  -0.753  -9.228  11.808
  525   1HH1  ARG  60          1HH1      ARG  60   2.637  -8.188  11.922
  526   2HH1  ARG  60          2HH1      ARG  60   3.133  -9.519  12.872
  527   1HH2  ARG  60          1HH2      ARG  60  -0.031 -11.035  13.107
  528   2HH2  ARG  60          2HH2      ARG  60   1.605 -11.154  13.550
  529    H    PHE  61           H        PHE  61   0.203  -4.125   7.349
  530    HA   PHE  61           HA       PHE  61  -1.927  -2.310   7.232
  531   1HB   PHE  61          2HB       PHE  61   0.599  -1.897   6.792
  532   2HB   PHE  61          1HB       PHE  61   0.207  -2.483   5.176
  533    HD1  PHE  61           1HD      PHE  61  -1.082  -1.088   3.599
  534    HD2  PHE  61           2HD      PHE  61  -0.258   0.325   7.543
  535    HE1  PHE  61           1HE      PHE  61  -1.758   1.193   2.938
  536    HE2  PHE  61           2HE      PHE  61  -0.961   2.621   6.858
  537    HZ   PHE  61           HZ       PHE  61  -1.683   3.042   4.592
  538    H    ILE  62           H        ILE  62  -0.823  -4.813   5.007
  539    HA   ILE  62           HA       ILE  62  -2.655  -4.212   2.911
  540    HB   ILE  62           HB       ILE  62  -1.313  -6.865   3.498
  541   1HG1  ILE  62          2HG1      ILE  62   0.398  -5.196   3.223
  542   2HG1  ILE  62          1HG1      ILE  62   0.320  -6.146   1.745
  543   1HG2  ILE  62          1HG2      ILE  62  -3.210  -7.051   2.009
  544   2HG2  ILE  62          2HG2      ILE  62  -1.699  -7.365   1.132
  545   3HG2  ILE  62          3HG2      ILE  62  -2.537  -5.813   0.954
  546   1HD1  ILE  62          1HD1      ILE  62  -0.859  -3.439   2.198
  547   2HD1  ILE  62          2HD1      ILE  62  -1.016  -4.369   0.718
  548   3HD1  ILE  62          3HD1      ILE  62   0.576  -3.794   1.235
  549    H    LYS  63           H        LYS  63  -2.623  -6.662   5.426
  550    HA   LYS  63           HA       LYS  63  -5.198  -7.786   4.773
  551   1HB   LYS  63          2HB       LYS  63  -3.503  -7.913   7.254
  552   2HB   LYS  63          1HB       LYS  63  -5.150  -8.479   7.318
  553   1HG   LYS  63          2HG       LYS  63  -3.535 -10.322   7.059
  554   2HG   LYS  63          1HG       LYS  63  -4.645 -10.235   5.711
  555   1HD   LYS  63          2HD       LYS  63  -1.896  -9.018   5.555
  556   2HD   LYS  63          1HD       LYS  63  -2.142 -10.738   5.268
  557   1HE   LYS  63          2HE       LYS  63  -3.490  -8.493   3.755
  558   2HE   LYS  63          1HE       LYS  63  -2.102  -9.421   3.185
  559   1HZ   LYS  63          1HZ       LYS  63  -4.758 -10.609   3.822
  560   2HZ   LYS  63          2HZ       LYS  63  -3.423 -11.398   3.174
  561   3HZ   LYS  63          3HZ       LYS  63  -4.224 -10.226   2.278
  562    H    TRP  64           H        TRP  64  -4.250  -5.139   6.744
  563    HA   TRP  64           HA       TRP  64  -6.754  -4.733   8.052
  564   1HB   TRP  64          2HB       TRP  64  -4.230  -3.945   8.515
  565   2HB   TRP  64          1HB       TRP  64  -4.787  -2.546   7.629
  566    HD1  TRP  64           HD       TRP  64  -4.697  -4.087  10.991
  567    HE1  TRP  64           1HE      TRP  64  -6.036  -2.639  12.664
  568    HE3  TRP  64           3HE      TRP  64  -7.096  -1.000   7.686
  569    HZ2  TRP  64           2HZ      TRP  64  -7.856  -0.482  12.575
  570    HZ3  TRP  64           3HZ      TRP  64  -8.610   0.730   8.566
  571    HH2  TRP  64           HH       TRP  64  -8.979   0.978  10.947
  572    H    TYR  65           H        TYR  65  -5.022  -3.322   5.199
  573    HA   TYR  65           HA       TYR  65  -6.958  -1.397   4.624
  574   1HB   TYR  65          2HB       TYR  65  -4.711  -1.288   3.604
  575   2HB   TYR  65          1HB       TYR  65  -5.081  -2.729   2.657
  576    HD1  TYR  65           1HD      TYR  65  -6.143  -2.517   0.545
  577    HD2  TYR  65           2HD      TYR  65  -6.244   0.753   3.261
  578    HE1  TYR  65           1HE      TYR  65  -7.222  -1.088  -1.182
  579    HE2  TYR  65           2HE      TYR  65  -7.313   2.150   1.519
  580    HH   TYR  65           HH       TYR  65  -8.586   0.853  -1.328
  581    H    ASN  66           H        ASN  66  -6.657  -4.731   3.617
  582    HA   ASN  66           HA       ASN  66  -8.749  -4.691   1.761
  583   1HB   ASN  66          2HB       ASN  66  -7.525  -6.924   3.328
  584   2HB   ASN  66          1HB       ASN  66  -8.964  -7.248   2.377
  585   1HD2  ASN  66          1HD2      ASN  66  -5.577  -6.393   2.278
  586   2HD2  ASN  66          2HD2      ASN  66  -5.391  -6.699   0.583
  587    H    ALA  67           H        ALA  67  -8.900  -5.179   5.228
  588    HA   ALA  67           HA       ALA  67 -11.700  -5.688   5.336
  589   1HB   ALA  67          1HB       ALA  67  -9.869  -4.508   7.432
  590   2HB   ALA  67          2HB       ALA  67 -10.194  -6.224   7.201
  591   3HB   ALA  67          3HB       ALA  67 -11.490  -5.147   7.723
  592    H    TRP  68           H        TRP  68  -9.737  -2.826   5.890
  593    HA   TRP  68           HA       TRP  68 -11.706  -0.917   6.327
  594   1HB   TRP  68          2HB       TRP  68  -9.559  -0.241   6.854
  595   2HB   TRP  68          1HB       TRP  68  -8.884  -0.870   5.363
  596    HD1  TRP  68           HD       TRP  68  -8.372   0.819   3.563
  597    HE1  TRP  68           1HE      TRP  68  -8.880   3.288   3.144
  598    HE3  TRP  68           3HE      TRP  68 -11.661   1.629   7.387
  599    HZ2  TRP  68           2HZ      TRP  68 -10.457   5.299   4.238
  600    HZ3  TRP  68           3HZ      TRP  68 -12.629   3.880   7.608
  601    HH2  TRP  68           HH       TRP  68 -12.016   5.673   6.028
  602    H    ASN  69           H        ASN  69 -10.344  -2.047   3.326
  603    HA   ASN  69           HA       ASN  69 -11.559  -0.162   1.651
  604   1HB   ASN  69          2HB       ASN  69  -9.601  -1.456   0.975
  605   2HB   ASN  69          1HB       ASN  69 -10.546  -2.935   1.030
  606   1HD2  ASN  69          1HD2      ASN  69 -11.794  -3.461  -0.660
  607   2HD2  ASN  69          2HD2      ASN  69 -11.850  -2.554  -2.119
  608    H    GLU  70           H        GLU  70 -12.644  -3.299   2.807
  609    HA   GLU  70           HA       GLU  70 -15.158  -3.112   1.353
  610   1HB   GLU  70          2HB       GLU  70 -14.320  -4.929   3.611
  611   2HB   GLU  70          1HB       GLU  70 -15.817  -5.033   2.695
  612   1HG   GLU  70          2HG       GLU  70 -14.546  -5.498   0.674
  613   2HG   GLU  70          1HG       GLU  70 -13.052  -5.411   1.616
  614    H    LYS  71           H        LYS  71 -13.993  -2.042   4.428
  615    HA   LYS  71           HA       LYS  71 -16.614  -1.583   5.449
  616   1HB   LYS  71          2HB       LYS  71 -14.027  -0.181   6.175
  617   2HB   LYS  71          1HB       LYS  71 -15.528  -0.012   7.062
  618   1HG   LYS  71          2HG       LYS  71 -13.905  -2.537   6.752
  619   2HG   LYS  71          1HG       LYS  71 -14.021  -1.539   8.197
  620   1HD   LYS  71          2HD       LYS  71 -16.308  -3.060   6.913
  621   2HD   LYS  71          1HD       LYS  71 -15.425  -3.558   8.348
  622   1HE   LYS  71          2HE       LYS  71 -16.202  -1.543   9.520
  623   2HE   LYS  71          1HE       LYS  71 -17.070  -1.045   8.071
  624   1HZ   LYS  71          1HZ       LYS  71 -18.526  -2.101   9.661
  625   2HZ   LYS  71          2HZ       LYS  71 -17.619  -3.526   9.618
  626   3HZ   LYS  71          3HZ       LYS  71 -18.441  -2.998   8.243
  627    H    ARG  72           H        ARG  72 -14.637   0.060   3.212
  628    HA   ARG  72           HA       ARG  72 -16.391   2.388   3.255
  629   1HB   ARG  72          2HB       ARG  72 -14.711   3.527   1.904
  630   2HB   ARG  72          1HB       ARG  72 -13.973   2.812   3.328
  631   1HG   ARG  72          2HG       ARG  72 -13.453   0.842   1.754
  632   2HG   ARG  72          1HG       ARG  72 -13.741   2.016   0.473
  633   1HD   ARG  72          2HD       ARG  72 -11.807   2.331   2.737
  634   2HD   ARG  72          1HD       ARG  72 -11.359   1.857   1.087
  635    HE   ARG  72           HE       ARG  72 -12.672   4.421   1.542
  636   1HH1  ARG  72          1HH1      ARG  72  -9.738   2.602   0.733
  637   2HH1  ARG  72          2HH1      ARG  72  -8.790   3.984   0.460
  638   1HH2  ARG  72          1HH2      ARG  72 -11.328   6.328   1.174
  639   2HH2  ARG  72          2HH2      ARG  72  -9.695   6.129   0.703
  640    H    ARG  73           H        ARG  73 -16.347  -0.557   1.752
  641    HA   ARG  73           HA       ARG  73 -18.401   0.015   0.200
  642   1HB   ARG  73          2HB       ARG  73 -17.604  -0.459  -2.121
  643   2HB   ARG  73          1HB       ARG  73 -17.126   1.111  -1.497
  644   1HG   ARG  73          2HG       ARG  73 -15.216   0.442  -2.627
  645   2HG   ARG  73          1HG       ARG  73 -14.940  -0.170  -0.988
  646   1HD   ARG  73          2HD       ARG  73 -15.419  -2.368  -1.580
  647   2HD   ARG  73          1HD       ARG  73 -16.217  -1.888  -3.074
  648    HE   ARG  73           HE       ARG  73 -13.729  -1.056  -3.509
  649   1HH1  ARG  73          1HH1      ARG  73 -14.814  -4.136  -2.163
  650   2HH1  ARG  73          2HH1      ARG  73 -13.614  -5.026  -3.012
  651   1HH2  ARG  73          1HH2      ARG  73 -12.118  -2.355  -4.636
  652   2HH2  ARG  73          2HH2      ARG  73 -12.152  -4.066  -4.387
  653    H    VAL  74           H        VAL  74 -18.798  -1.245   1.549
  654    HA   VAL  74           HA       VAL  74 -18.287  -3.810   2.159
  655    HB   VAL  74           HB       VAL  74 -20.619  -4.150   2.837
  656   1HG1  VAL  74          1HG1      VAL  74 -19.528  -1.414   3.457
  657   2HG1  VAL  74          2HG1      VAL  74 -19.083  -2.905   4.266
  658   3HG1  VAL  74          3HG1      VAL  74 -20.728  -2.278   4.419
  659   1HG2  VAL  74          1HG2      VAL  74 -22.246  -2.344   2.521
  660   2HG2  VAL  74          2HG2      VAL  74 -21.754  -3.074   0.990
  661   3HG2  VAL  74          3HG2      VAL  74 -21.100  -1.508   1.470
  662    H    TYR  75           H        TYR  75 -18.530  -5.748   1.537
  663    HA   TYR  75           HA       TYR  75 -18.665  -7.527   0.280
  664   1HB   TYR  75          2HB       TYR  75 -20.988  -7.393   1.061
  665   2HB   TYR  75          1HB       TYR  75 -21.424  -6.495  -0.384
  666    HD1  TYR  75           1HD      TYR  75 -19.939  -9.721   0.694
  667    HD2  TYR  75           2HD      TYR  75 -22.219  -7.677  -2.249
  668    HE1  TYR  75           1HE      TYR  75 -20.388 -11.855  -0.427
  669    HE2  TYR  75           2HE      TYR  75 -22.676  -9.810  -3.385
  670    HH   TYR  75           HH       TYR  75 -21.968 -12.808  -1.886
  671    H    GLU  76           H        GLU  76 -16.997  -6.943  -1.027
  672    HA   GLU  76           HA       GLU  76 -17.369  -7.467  -3.718
  673   1HB   GLU  76          2HB       GLU  76 -18.199  -5.071  -3.740
  674   2HB   GLU  76          1HB       GLU  76 -16.631  -4.567  -3.140
  675   1HG   GLU  76          2HG       GLU  76 -15.574  -5.409  -5.170
  676   2HG   GLU  76          1HG       GLU  76 -17.144  -5.946  -5.767
  677    H    GLU  77           H        GLU  77 -15.265  -7.821  -4.614
  678    HA   GLU  77           HA       GLU  77 -13.189  -7.701  -2.576
  679   1HB   GLU  77          2HB       GLU  77 -13.763  -9.948  -3.483
  680   2HB   GLU  77          1HB       GLU  77 -13.290  -9.398  -5.082
  681   1HG   GLU  77          2HG       GLU  77 -11.011  -9.062  -4.309
  682   2HG   GLU  77          1HG       GLU  77 -11.475  -9.568  -2.687
  Start of MODEL    9
    1    H    SER   1           H        SER   1  16.850   1.701 -15.045
    2    HA   SER   1           HA       SER   1  15.301   3.080 -13.096
    3   1HB   SER   1          2HB       SER   1  13.447   1.692 -14.121
    4   2HB   SER   1          1HB       SER   1  14.289   2.766 -15.231
    5    HG   SER   1           HG       SER   1  15.124   1.126 -16.247
    6    H    LYS   2           H        LYS   2  15.596   2.478 -11.080
    7    HA   LYS   2           HA       LYS   2  16.044  -0.322 -10.378
    8   1HB   LYS   2          2HB       LYS   2  16.688   0.523  -8.196
    9   2HB   LYS   2          1HB       LYS   2  17.549   1.379  -9.471
   10   1HG   LYS   2          2HG       LYS   2  16.062   3.272  -9.238
   11   2HG   LYS   2          1HG       LYS   2  15.113   2.407  -8.028
   12   1HD   LYS   2          2HD       LYS   2  17.117   2.324  -6.589
   13   2HD   LYS   2          1HD       LYS   2  17.992   3.273  -7.792
   14   1HE   LYS   2          2HE       LYS   2  15.519   4.131  -6.301
   15   2HE   LYS   2          1HE       LYS   2  17.163   4.683  -5.993
   16   1HZ   LYS   2          1HZ       LYS   2  17.202   5.640  -8.228
   17   2HZ   LYS   2          2HZ       LYS   2  15.943   6.287  -7.309
   18   3HZ   LYS   2          3HZ       LYS   2  15.606   5.142  -8.490
   19    H    CYS   3           H        CYS   3  15.074  -0.847  -8.112
   20    HA   CYS   3           HA       CYS   3  12.186  -0.623  -8.210
   21   1HB   CYS   3          2HB       CYS   3  14.019  -1.869  -6.131
   22   2HB   CYS   3          1HB       CYS   3  12.284  -2.121  -6.259
   23    H    LYS   4           H        LYS   4  11.462  -0.357  -5.562
   24    HA   LYS   4           HA       LYS   4  11.269   0.950  -3.733
   25   1HB   LYS   4          2HB       LYS   4  13.990   2.071  -4.503
   26   2HB   LYS   4          1HB       LYS   4  13.119   2.555  -3.069
   27   1HG   LYS   4          2HG       LYS   4  14.916   0.997  -2.538
   28   2HG   LYS   4          1HG       LYS   4  13.357   0.274  -2.163
   29   1HD   LYS   4          2HD       LYS   4  13.467  -1.082  -4.154
   30   2HD   LYS   4          1HD       LYS   4  14.921  -0.249  -4.694
   31   1HE   LYS   4          2HE       LYS   4  14.722  -1.870  -2.163
   32   2HE   LYS   4          1HE       LYS   4  15.325  -2.498  -3.698
   33   1HZ   LYS   4          1HZ       LYS   4  17.126  -1.796  -2.258
   34   2HZ   LYS   4          2HZ       LYS   4  16.520  -0.221  -2.191
   35   3HZ   LYS   4          3HZ       LYS   4  17.067  -0.852  -3.646
   36    H    CYS   5           H        CYS   5   9.974   2.596  -3.468
   37    HA   CYS   5           HA       CYS   5  10.018   4.799  -5.456
   38   1HB   CYS   5          2HB       CYS   5   7.695   4.072  -3.673
   39   2HB   CYS   5          1HB       CYS   5   7.674   4.991  -5.174
   40    H    SER   6           H        SER   6   9.639   3.804  -2.127
   41    HA   SER   6           HA       SER   6  10.210   6.485  -1.156
   42   1HB   SER   6          2HB       SER   6   8.550   5.801   0.672
   43   2HB   SER   6          1HB       SER   6   7.889   6.199  -0.917
   44    HG   SER   6           HG       SER   6   8.273   3.625   0.221
   45    H    ARG   7           H        ARG   7  12.173   4.590  -1.582
   46    HA   ARG   7           HA       ARG   7  13.950   3.585  -0.694
   47   1HB   ARG   7          2HB       ARG   7  13.049   4.743   1.959
   48   2HB   ARG   7          1HB       ARG   7  14.579   3.934   1.708
   49   1HG   ARG   7          2HG       ARG   7  15.044   6.243   1.685
   50   2HG   ARG   7          1HG       ARG   7  15.095   5.735   0.001
   51   1HD   ARG   7          2HD       ARG   7  12.782   6.558  -0.276
   52   2HD   ARG   7          1HD       ARG   7  12.810   7.118   1.395
   53    HE   ARG   7           HE       ARG   7  14.997   8.193   0.107
   54   1HH1  ARG   7          1HH1      ARG   7  11.463   8.502   0.134
   55   2HH1  ARG   7          2HH1      ARG   7  11.456  10.032  -0.624
   56   1HH2  ARG   7          1HH2      ARG   7  14.956  10.352  -0.903
   57   2HH2  ARG   7          2HH2      ARG   7  13.440  11.065  -1.233
   58    H    LYS   8           H        LYS   8  11.538   3.098   1.801
   59    HA   LYS   8           HA       LYS   8  11.931   0.164   1.542
   60   1HB   LYS   8          2HB       LYS   8  13.166   1.062   3.494
   61   2HB   LYS   8          1HB       LYS   8  11.662   1.713   4.113
   62   1HG   LYS   8          2HG       LYS   8  10.774  -0.640   4.086
   63   2HG   LYS   8          1HG       LYS   8  12.417  -1.168   3.753
   64   1HD   LYS   8          2HD       LYS   8  12.140  -1.368   6.095
   65   2HD   LYS   8          1HD       LYS   8  13.103   0.084   5.850
   66   1HE   LYS   8          2HE       LYS   8  10.128   0.080   6.218
   67   2HE   LYS   8          1HE       LYS   8  11.242   0.277   7.578
   68   1HZ   LYS   8          1HZ       LYS   8  12.014   2.357   6.345
   69   2HZ   LYS   8          2HZ       LYS   8  10.496   2.374   6.991
   70   3HZ   LYS   8          3HZ       LYS   8  10.644   2.201   5.344
   71    H    GLY   9           H        GLY   9   9.974   2.785   2.874
   72   1HA   GLY   9          2HA       GLY   9   7.592   2.452   1.908
   73   2HA   GLY   9          1HA       GLY   9   7.702   1.031   2.946
   74    HA   PRO  10           HA       PRO  10   7.373   4.862   5.716
   75   1HB   PRO  10          2HB       PRO  10   5.829   6.812   4.769
   76   2HB   PRO  10          1HB       PRO  10   7.522   6.678   4.284
   77   1HG   PRO  10          2HG       PRO  10   5.063   6.030   2.758
   78   2HG   PRO  10          1HG       PRO  10   6.639   6.581   2.172
   79   1HD   PRO  10          2HD       PRO  10   5.662   3.913   2.219
   80   2HD   PRO  10          1HD       PRO  10   7.300   4.459   1.809
   81    H    LYS  11           H        LYS  11   5.687   5.414   7.208
   82    HA   LYS  11           HA       LYS  11   3.485   3.607   7.107
   83   1HB   LYS  11          2HB       LYS  11   4.182   5.750   9.120
   84   2HB   LYS  11          1HB       LYS  11   2.734   4.770   9.241
   85   1HG   LYS  11          2HG       LYS  11   4.407   3.886  10.715
   86   2HG   LYS  11          1HG       LYS  11   4.161   2.751   9.394
   87   1HD   LYS  11          2HD       LYS  11   6.196   3.616   8.312
   88   2HD   LYS  11          1HD       LYS  11   6.425   4.728   9.661
   89   1HE   LYS  11          2HE       LYS  11   6.399   1.719   9.819
   90   2HE   LYS  11          1HE       LYS  11   7.826   2.753   9.897
   91   1HZ   LYS  11          1HZ       LYS  11   7.163   2.086  12.102
   92   2HZ   LYS  11          2HZ       LYS  11   5.606   2.668  11.889
   93   3HZ   LYS  11          3HZ       LYS  11   6.886   3.730  11.961
   94    H    ILE  12           H        ILE  12   1.983   3.953   5.778
   95    HA   ILE  12           HA       ILE  12   0.839   6.626   5.373
   96    HB   ILE  12           HB       ILE  12   0.339   4.092   3.746
   97   1HG1  ILE  12          2HG1      ILE  12   2.217   6.387   3.142
   98   2HG1  ILE  12          1HG1      ILE  12   2.730   4.790   3.664
   99   1HG2  ILE  12          1HG2      ILE  12  -0.200   6.996   3.136
  100   2HG2  ILE  12          2HG2      ILE  12  -1.412   5.795   3.595
  101   3HG2  ILE  12          3HG2      ILE  12  -0.532   5.627   2.076
  102   1HD1  ILE  12          1HD1      ILE  12   2.977   5.064   1.273
  103   2HD1  ILE  12          2HD1      ILE  12   1.255   5.435   1.132
  104   3HD1  ILE  12          3HD1      ILE  12   1.775   3.832   1.655
  105    H    ARG  13           H        ARG  13  -1.303   6.946   5.731
  106    HA   ARG  13           HA       ARG  13  -2.525   4.984   7.489
  107   1HB   ARG  13          2HB       ARG  13  -4.297   6.616   7.705
  108   2HB   ARG  13          1HB       ARG  13  -2.718   7.299   8.121
  109   1HG   ARG  13          2HG       ARG  13  -2.613   8.312   5.892
  110   2HG   ARG  13          1HG       ARG  13  -4.179   7.626   5.521
  111   1HD   ARG  13          2HD       ARG  13  -5.192   9.010   7.263
  112   2HD   ARG  13          1HD       ARG  13  -3.599   9.693   7.636
  113    HE   ARG  13           HE       ARG  13  -3.686  10.078   5.058
  114   1HH1  ARG  13          1HH1      ARG  13  -6.130  10.928   7.501
  115   2HH1  ARG  13          2HH1      ARG  13  -6.815  12.180   6.579
  116   1HH2  ARG  13          1HH2      ARG  13  -4.623  11.693   3.795
  117   2HH2  ARG  13          2HH2      ARG  13  -5.933  12.641   4.363
  118    H    TYR  14           H        TYR  14  -4.772   4.313   7.039
  119    HA   TYR  14           HA       TYR  14  -4.876   3.131   4.457
  120   1HB   TYR  14          2HB       TYR  14  -7.114   3.301   6.484
  121   2HB   TYR  14          1HB       TYR  14  -6.920   2.098   5.219
  122    HD1  TYR  14           1HD      TYR  14  -6.279   2.919   8.605
  123    HD2  TYR  14           2HD      TYR  14  -4.829   0.538   5.394
  124    HE1  TYR  14           1HE      TYR  14  -5.061   1.532  10.200
  125    HE2  TYR  14           2HE      TYR  14  -3.614  -0.861   6.992
  126    HH   TYR  14           HH       TYR  14  -2.675  -0.631   9.321
  127    H    SER  15           H        SER  15  -6.166   5.977   5.905
  128    HA   SER  15           HA       SER  15  -8.320   6.535   4.218
  129   1HB   SER  15          2HB       SER  15  -6.524   8.466   5.655
  130   2HB   SER  15          1HB       SER  15  -8.153   8.801   5.064
  131    HG   SER  15           HG       SER  15  -9.002   7.599   6.572
  132    H    ASP  16           H        ASP  16  -4.850   7.015   3.712
  133    HA   ASP  16           HA       ASP  16  -5.335   8.870   1.525
  134   1HB   ASP  16          2HB       ASP  16  -2.721   7.686   2.504
  135   2HB   ASP  16          1HB       ASP  16  -2.847   8.705   1.086
  136    H    VAL  17           H        VAL  17  -5.141   5.560   1.933
  137    HA   VAL  17           HA       VAL  17  -4.110   5.080  -0.750
  138    HB   VAL  17           HB       VAL  17  -5.328   3.032   1.080
  139   1HG1  VAL  17          1HG1      VAL  17  -5.111   2.231  -1.115
  140   2HG1  VAL  17          2HG1      VAL  17  -3.867   1.449  -0.137
  141   3HG1  VAL  17          3HG1      VAL  17  -3.441   2.762  -1.225
  142   1HG2  VAL  17          1HG2      VAL  17  -3.050   2.498   1.887
  143   2HG2  VAL  17          2HG2      VAL  17  -3.569   4.117   2.358
  144   3HG2  VAL  17          3HG2      VAL  17  -2.437   3.908   1.023
  145    H    LYS  18           H        LYS  18  -5.391   5.103  -2.419
  146    HA   LYS  18           HA       LYS  18  -8.305   4.812  -2.006
  147   1HB   LYS  18          2HB       LYS  18  -6.973   6.701  -3.341
  148   2HB   LYS  18          1HB       LYS  18  -7.083   5.536  -4.632
  149   1HG   LYS  18          2HG       LYS  18  -9.425   6.797  -3.178
  150   2HG   LYS  18          1HG       LYS  18  -8.894   7.172  -4.807
  151   1HD   LYS  18          2HD       LYS  18 -10.005   4.531  -3.861
  152   2HD   LYS  18          1HD       LYS  18 -10.904   5.750  -4.760
  153   1HE   LYS  18          2HE       LYS  18  -9.372   5.461  -6.653
  154   2HE   LYS  18          1HE       LYS  18  -8.470   4.261  -5.735
  155   1HZ   LYS  18          1HZ       LYS  18 -11.307   4.037  -6.568
  156   2HZ   LYS  18          2HZ       LYS  18 -10.489   2.902  -5.638
  157   3HZ   LYS  18          3HZ       LYS  18 -10.014   3.181  -7.229
  158    H    LYS  19           H        LYS  19  -5.476   3.401  -3.347
  159    HA   LYS  19           HA       LYS  19  -6.871   1.086  -4.269
  160   1HB   LYS  19          2HB       LYS  19  -7.047   2.595  -6.194
  161   2HB   LYS  19          1HB       LYS  19  -5.318   2.854  -6.186
  162   1HG   LYS  19          2HG       LYS  19  -4.962   0.519  -6.740
  163   2HG   LYS  19          1HG       LYS  19  -6.707   0.254  -6.666
  164   1HD   LYS  19          2HD       LYS  19  -7.002   1.899  -8.495
  165   2HD   LYS  19          1HD       LYS  19  -5.250   2.082  -8.583
  166   1HE   LYS  19          2HE       LYS  19  -5.032  -0.281  -9.173
  167   2HE   LYS  19          1HE       LYS  19  -6.783  -0.468  -9.060
  168   1HZ   LYS  19          1HZ       LYS  19  -6.132  -0.194 -11.337
  169   2HZ   LYS  19          2HZ       LYS  19  -5.322   1.249 -11.003
  170   3HZ   LYS  19          3HZ       LYS  19  -6.997   1.165 -10.844
  171    H    LEU  20           H        LEU  20  -5.538  -0.640  -4.222
  172    HA   LEU  20           HA       LEU  20  -2.687  -0.230  -3.662
  173   1HB   LEU  20          2HB       LEU  20  -4.122  -0.319  -1.561
  174   2HB   LEU  20          1HB       LEU  20  -4.582  -1.933  -2.022
  175    HG   LEU  20           HG       LEU  20  -1.759  -1.088  -1.332
  176   1HD1  LEU  20          1HD1      LEU  20  -2.168  -2.228   0.801
  177   2HD1  LEU  20          2HD1      LEU  20  -3.843  -2.510   0.340
  178   3HD1  LEU  20          3HD1      LEU  20  -3.274  -0.875   0.593
  179   1HD2  LEU  20          1HD2      LEU  20  -1.325  -3.489  -1.176
  180   2HD2  LEU  20          2HD2      LEU  20  -1.919  -3.091  -2.787
  181   3HD2  LEU  20          3HD2      LEU  20  -3.000  -3.827  -1.601
  182    H    GLU  21           H        GLU  21  -1.596  -1.554  -5.025
  183    HA   GLU  21           HA       GLU  21  -2.913  -4.029  -5.966
  184   1HB   GLU  21          2HB       GLU  21  -1.057  -2.227  -7.537
  185   2HB   GLU  21          1HB       GLU  21  -1.766  -3.724  -8.101
  186   1HG   GLU  21          2HG       GLU  21  -3.990  -2.680  -7.979
  187   2HG   GLU  21          1HG       GLU  21  -3.224  -1.170  -7.475
  188    H    MET  22           H        MET  22  -1.427  -5.845  -6.157
  189    HA   MET  22           HA       MET  22   1.162  -5.155  -5.085
  190   1HB   MET  22          2HB       MET  22   1.441  -7.444  -4.434
  191   2HB   MET  22          1HB       MET  22  -0.049  -6.841  -3.742
  192   1HG   MET  22          2HG       MET  22  -1.305  -8.067  -5.455
  193   2HG   MET  22          1HG       MET  22   0.210  -8.643  -6.148
  194   1HE   MET  22          1HE       MET  22  -1.081 -11.932  -4.563
  195   2HE   MET  22          2HE       MET  22  -0.323 -11.191  -5.972
  196   3HE   MET  22          3HE       MET  22  -1.952 -10.712  -5.500
  197    H    LYS  23           H        LYS  23   2.586  -4.870  -6.523
  198    HA   LYS  23           HA       LYS  23   3.142  -6.808  -8.526
  199   1HB   LYS  23          2HB       LYS  23   3.068  -5.142 -10.369
  200   2HB   LYS  23          1HB       LYS  23   1.477  -5.449  -9.683
  201   1HG   LYS  23          2HG       LYS  23   1.846  -3.398  -8.272
  202   2HG   LYS  23          1HG       LYS  23   3.231  -3.050  -9.312
  203   1HD   LYS  23          2HD       LYS  23   1.680  -3.146 -11.259
  204   2HD   LYS  23          1HD       LYS  23   0.386  -3.373 -10.057
  205   1HE   LYS  23          2HE       LYS  23   0.864  -1.237  -9.050
  206   2HE   LYS  23          1HE       LYS  23   2.210  -0.967 -10.163
  207   1HZ   LYS  23          1HZ       LYS  23   0.385   0.279 -10.924
  208   2HZ   LYS  23          2HZ       LYS  23  -0.698  -1.023 -10.784
  209   3HZ   LYS  23          3HZ       LYS  23   0.514  -1.041 -11.958
  210    HA   PRO  24           HA       PRO  24   7.048  -5.490  -7.024
  211   1HB   PRO  24          2HB       PRO  24   8.659  -6.306  -9.054
  212   2HB   PRO  24          1HB       PRO  24   7.912  -7.428  -7.902
  213   1HG   PRO  24          2HG       PRO  24   7.092  -6.702 -10.678
  214   2HG   PRO  24          1HG       PRO  24   7.118  -8.292  -9.892
  215   1HD   PRO  24          2HD       PRO  24   4.844  -6.846 -10.200
  216   2HD   PRO  24          1HD       PRO  24   5.100  -7.927  -8.822
  217    H    LYS  25           H        LYS  25   5.619  -4.072  -9.641
  218    HA   LYS  25           HA       LYS  25   5.791  -2.094 -10.720
  219   1HB   LYS  25          2HB       LYS  25   6.491  -1.203  -8.523
  220   2HB   LYS  25          1HB       LYS  25   8.160  -1.534  -8.940
  221   1HG   LYS  25          2HG       LYS  25   8.154   0.119 -10.635
  222   2HG   LYS  25          1HG       LYS  25   6.396   0.310 -10.530
  223   1HD   LYS  25          2HD       LYS  25   6.586   0.998  -8.291
  224   2HD   LYS  25          1HD       LYS  25   8.351   0.874  -8.332
  225   1HE   LYS  25          2HE       LYS  25   6.642   2.757  -9.998
  226   2HE   LYS  25          1HE       LYS  25   7.608   3.233  -8.604
  227   1HZ   LYS  25          1HZ       LYS  25   8.653   2.138 -11.155
  228   2HZ   LYS  25          2HZ       LYS  25   9.586   2.593  -9.809
  229   3HZ   LYS  25          3HZ       LYS  25   8.730   3.744 -10.656
  230    H    TYR  26           H        TYR  26   8.941  -3.577 -10.130
  231    HA   TYR  26           HA       TYR  26   9.454  -3.610 -13.014
  232   1HB   TYR  26          2HB       TYR  26  11.342  -3.148 -10.715
  233   2HB   TYR  26          1HB       TYR  26  11.947  -3.642 -12.269
  234    HD1  TYR  26           1HD      TYR  26  12.011  -2.144 -14.071
  235    HD2  TYR  26           2HD      TYR  26  10.378  -0.965 -10.356
  236    HE1  TYR  26           1HE      TYR  26  12.089   0.224 -14.797
  237    HE2  TYR  26           2HE      TYR  26  10.456   1.395 -11.041
  238    HH   TYR  26           HH       TYR  26  11.768   2.777 -12.646
  239    HA   PRO  27           HA       PRO  27   9.370  -8.054 -12.301
  240   1HB   PRO  27          2HB       PRO  27  11.326  -8.068 -14.552
  241   2HB   PRO  27          1HB       PRO  27   9.832  -8.988 -14.359
  242   1HG   PRO  27          2HG       PRO  27   9.937  -6.910 -16.020
  243   2HG   PRO  27          1HG       PRO  27   8.493  -7.221 -15.043
  244   1HD   PRO  27          2HD       PRO  27  10.610  -5.141 -14.680
  245   2HD   PRO  27          1HD       PRO  27   8.869  -5.071 -14.355
  246    H    HIS  28           H        HIS  28  12.245  -6.159 -12.538
  247    HA   HIS  28           HA       HIS  28  14.007  -8.196 -11.479
  248   1HB   HIS  28          2HB       HIS  28  15.803  -6.499 -11.522
  249   2HB   HIS  28          1HB       HIS  28  14.955  -6.537 -13.063
  250    HD1  HIS  28           1HD      HIS  28  15.195  -4.462  -9.889
  251    HD2  HIS  28           2HD      HIS  28  14.016  -3.933 -13.864
  252    HE1  HIS  28           1HE      HIS  28  14.773  -2.043 -10.212
  253    HE2  HIS  28           2HE      HIS  28  14.585  -1.773 -12.641
  254    H    CYS  29           H        CYS  29  11.649  -6.908  -9.851
  255    HA   CYS  29           HA       CYS  29  13.185  -6.239  -7.446
  256   1HB   CYS  29          2HB       CYS  29  10.301  -5.754  -8.204
  257   2HB   CYS  29          1HB       CYS  29  11.013  -5.185  -6.721
  258    H    GLU  30           H        GLU  30  12.391  -7.367  -5.363
  259    HA   GLU  30           HA       GLU  30  11.809 -10.088  -6.059
  260   1HB   GLU  30          2HB       GLU  30  12.435  -8.749  -3.443
  261   2HB   GLU  30          1HB       GLU  30  12.353 -10.480  -3.720
  262   1HG   GLU  30          2HG       GLU  30  14.163 -10.346  -5.187
  263   2HG   GLU  30          1HG       GLU  30  14.204  -8.586  -4.993
  264    H    GLU  31           H        GLU  31   9.918 -11.005  -5.830
  265    HA   GLU  31           HA       GLU  31   7.787 -11.492  -5.287
  266   1HB   GLU  31          2HB       GLU  31   8.814 -11.433  -2.987
  267   2HB   GLU  31          1HB       GLU  31   8.293  -9.772  -2.838
  268   1HG   GLU  31          2HG       GLU  31   5.985 -10.456  -2.875
  269   2HG   GLU  31          1HG       GLU  31   6.454 -12.136  -3.170
  270    H    LYS  32           H        LYS  32   5.561 -10.274  -4.582
  271    HA   LYS  32           HA       LYS  32   5.284  -8.102  -6.433
  272   1HB   LYS  32          2HB       LYS  32   3.274  -9.342  -4.562
  273   2HB   LYS  32          1HB       LYS  32   2.923  -8.168  -5.813
  274   1HG   LYS  32          2HG       LYS  32   4.087 -10.848  -6.252
  275   2HG   LYS  32          1HG       LYS  32   2.347 -10.477  -6.463
  276   1HD   LYS  32          2HD       LYS  32   3.222  -8.739  -8.151
  277   2HD   LYS  32          1HD       LYS  32   4.764  -9.603  -7.959
  278   1HE   LYS  32          2HE       LYS  32   2.179 -10.851  -8.894
  279   2HE   LYS  32          1HE       LYS  32   3.489 -10.352  -9.953
  280   1HZ   LYS  32          1HZ       LYS  32   4.919 -11.976  -8.887
  281   2HZ   LYS  32          2HZ       LYS  32   3.550 -12.727  -9.475
  282   3HZ   LYS  32          3HZ       LYS  32   3.724 -12.422  -7.823
  283    H    MET  33           H        MET  33   5.951  -6.268  -5.822
  284    HA   MET  33           HA       MET  33   6.082  -5.248  -3.210
  285   1HB   MET  33          2HB       MET  33   6.234  -3.848  -5.837
  286   2HB   MET  33          1HB       MET  33   6.027  -2.899  -4.386
  287   1HG   MET  33          2HG       MET  33   8.352  -3.068  -4.971
  288   2HG   MET  33          1HG       MET  33   8.020  -3.852  -3.429
  289   1HE   MET  33          1HE       MET  33   9.929  -5.199  -3.229
  290   2HE   MET  33          2HE       MET  33  10.658  -4.287  -4.559
  291   3HE   MET  33          3HE       MET  33  10.830  -6.064  -4.495
  292    H    VAL  34           H        VAL  34   4.901  -3.406  -2.391
  293    HA   VAL  34           HA       VAL  34   2.047  -3.683  -2.919
  294    HB   VAL  34           HB       VAL  34   3.555  -2.389  -0.677
  295   1HG1  VAL  34          1HG1      VAL  34   1.398  -1.292  -1.105
  296   2HG1  VAL  34          2HG1      VAL  34   1.374  -2.146   0.439
  297   3HG1  VAL  34          3HG1      VAL  34   0.576  -2.838  -0.980
  298   1HG2  VAL  34          1HG2      VAL  34   2.701  -4.266   0.668
  299   2HG2  VAL  34          2HG2      VAL  34   3.740  -4.803  -0.651
  300   3HG2  VAL  34          3HG2      VAL  34   1.990  -4.961  -0.788
  301    H    ILE  35           H        ILE  35   1.339  -2.297  -4.373
  302    HA   ILE  35           HA       ILE  35   2.649   0.279  -4.641
  303    HB   ILE  35           HB       ILE  35   0.654  -1.129  -6.411
  304   1HG1  ILE  35          2HG1      ILE  35   2.772  -2.257  -6.355
  305   2HG1  ILE  35          1HG1      ILE  35   2.533  -1.475  -7.910
  306   1HG2  ILE  35          1HG2      ILE  35   1.190   0.592  -8.072
  307   2HG2  ILE  35          2HG2      ILE  35   2.219   1.394  -6.887
  308   3HG2  ILE  35          3HG2      ILE  35   0.481   1.287  -6.612
  309   1HD1  ILE  35          1HD1      ILE  35   4.056   0.346  -7.197
  310   2HD1  ILE  35          2HD1      ILE  35   4.832  -1.239  -7.204
  311   3HD1  ILE  35          3HD1      ILE  35   4.328  -0.516  -5.678
  312    H    ILE  36           H        ILE  36   1.833   1.838  -3.582
  313    HA   ILE  36           HA       ILE  36  -0.998   1.783  -2.919
  314    HB   ILE  36           HB       ILE  36   1.315   3.108  -1.544
  315   1HG1  ILE  36          2HG1      ILE  36  -0.646   0.966  -0.732
  316   2HG1  ILE  36          1HG1      ILE  36   1.053   0.750  -1.138
  317   1HG2  ILE  36          1HG2      ILE  36  -0.593   4.656  -1.504
  318   2HG2  ILE  36          2HG2      ILE  36  -0.304   3.973   0.098
  319   3HG2  ILE  36          3HG2      ILE  36  -1.627   3.365  -0.895
  320   1HD1  ILE  36          1HD1      ILE  36   0.605   0.710   1.253
  321   2HD1  ILE  36          2HD1      ILE  36  -0.015   2.373   1.082
  322   3HD1  ILE  36          3HD1      ILE  36   1.689   2.043   0.759
  323    H    THR  37           H        THR  37  -2.175   2.983  -3.882
  324    HA   THR  37           HA       THR  37  -1.202   5.382  -5.274
  325    HB   THR  37           HB       THR  37  -3.686   3.715  -5.690
  326    HG1  THR  37           1HG      THR  37  -1.143   3.498  -6.540
  327   1HG2  THR  37          1HG2      THR  37  -2.579   6.014  -7.336
  328   2HG2  THR  37          2HG2      THR  37  -4.032   6.049  -6.332
  329   3HG2  THR  37          3HG2      THR  37  -3.978   5.021  -7.763
  330    H    THR  38           H        THR  38  -1.903   7.325  -4.474
  331    HA   THR  38           HA       THR  38  -3.550   7.255  -2.142
  332    HB   THR  38           HB       THR  38  -3.078   9.742  -2.114
  333    HG1  THR  38           1HG      THR  38  -2.523   9.608  -4.549
  334   1HG2  THR  38          1HG2      THR  38  -0.719   9.431  -1.441
  335   2HG2  THR  38          2HG2      THR  38  -0.729   7.851  -2.234
  336   3HG2  THR  38          3HG2      THR  38  -1.753   8.131  -0.834
  337    H    LYS  39           H        LYS  39  -5.334   8.697  -1.831
  338    HA   LYS  39           HA       LYS  39  -7.231   8.584  -3.994
  339   1HB   LYS  39          2HB       LYS  39  -7.861   8.335  -1.607
  340   2HB   LYS  39          1HB       LYS  39  -7.423  10.012  -1.336
  341   1HG   LYS  39          2HG       LYS  39  -9.164  10.704  -2.933
  342   2HG   LYS  39          1HG       LYS  39  -9.622   9.012  -3.129
  343   1HD   LYS  39          2HD       LYS  39 -10.095   8.897  -0.710
  344   2HD   LYS  39          1HD       LYS  39  -9.724  10.613  -0.575
  345   1HE   LYS  39          2HE       LYS  39 -11.922   9.369  -2.218
  346   2HE   LYS  39          1HE       LYS  39 -12.118  10.259  -0.712
  347   1HZ   LYS  39          1HZ       LYS  39 -12.647  11.616  -2.602
  348   2HZ   LYS  39          2HZ       LYS  39 -11.160  11.375  -3.304
  349   3HZ   LYS  39          3HZ       LYS  39 -11.277  12.253  -1.869
  350    H    SER  40           H        SER  40  -5.541  11.150  -2.255
  351    HA   SER  40           HA       SER  40  -4.977  12.909  -4.225
  352   1HB   SER  40          2HB       SER  40  -7.517  13.029  -4.533
  353   2HB   SER  40          1HB       SER  40  -7.634  13.572  -2.863
  354    HG   SER  40           HG       SER  40  -6.689  14.901  -5.131
  355    H    VAL  41           H        VAL  41  -5.400  15.287  -2.729
  356    HA   VAL  41           HA       VAL  41  -4.772  16.492  -0.919
  357    HB   VAL  41           HB       VAL  41  -5.019  13.916   0.669
  358   1HG1  VAL  41          1HG1      VAL  41  -5.237  15.364   2.645
  359   2HG1  VAL  41          2HG1      VAL  41  -4.925  16.774   1.631
  360   3HG1  VAL  41          3HG1      VAL  41  -3.669  15.557   1.853
  361   1HG2  VAL  41          1HG2      VAL  41  -7.018  16.145   0.259
  362   2HG2  VAL  41          2HG2      VAL  41  -7.230  14.772   1.343
  363   3HG2  VAL  41          3HG2      VAL  41  -7.123  14.514  -0.401
  364    H    SER  42           H        SER  42  -3.180  13.364  -0.591
  365    HA   SER  42           HA       SER  42  -0.788  14.384   0.429
  366   1HB   SER  42          2HB       SER  42  -1.443  11.765  -0.914
  367   2HB   SER  42          1HB       SER  42   0.091  12.101  -0.111
  368    HG   SER  42           HG       SER  42  -2.361  11.494   1.057
  369    H    ARG  43           H        ARG  43   1.219  14.620  -0.496
  370    HA   ARG  43           HA       ARG  43   1.316  16.312  -2.697
  371   1HB   ARG  43          2HB       ARG  43   3.718  16.254  -2.442
  372   2HB   ARG  43          1HB       ARG  43   2.907  16.365  -0.884
  373   1HG   ARG  43          2HG       ARG  43   3.242  13.945  -0.558
  374   2HG   ARG  43          1HG       ARG  43   4.071  13.883  -2.102
  375   1HD   ARG  43          2HD       ARG  43   5.766  15.406  -1.290
  376   2HD   ARG  43          1HD       ARG  43   4.929  15.522   0.262
  377    HE   ARG  43           HE       ARG  43   5.311  12.926   0.147
  378   1HH1  ARG  43          1HH1      ARG  43   7.589  15.534  -0.627
  379   2HH1  ARG  43          2HH1      ARG  43   8.953  14.624  -0.216
  380   1HH2  ARG  43          1HH2      ARG  43   7.180  11.700   0.686
  381   2HH2  ARG  43          2HH2      ARG  43   8.732  12.386   0.544
  382    H    TYR  44           H        TYR  44   1.393  12.880  -2.849
  383    HA   TYR  44           HA       TYR  44   3.050  12.819  -5.158
  384   1HB   TYR  44          2HB       TYR  44   1.473  10.691  -3.787
  385   2HB   TYR  44          1HB       TYR  44   2.167  10.364  -5.368
  386    HD1  TYR  44           1HD      TYR  44   2.927  11.194  -1.880
  387    HD2  TYR  44           2HD      TYR  44   4.539  10.116  -5.649
  388    HE1  TYR  44           1HE      TYR  44   5.116  10.784  -0.830
  389    HE2  TYR  44           2HE      TYR  44   6.727   9.688  -4.612
  390    HH   TYR  44           HH       TYR  44   7.963  10.434  -2.560
  391    H    ARG  45           H        ARG  45  -0.439  12.437  -4.803
  392    HA   ARG  45           HA       ARG  45  -2.134  12.750  -6.285
  393   1HB   ARG  45          2HB       ARG  45  -0.216  14.863  -7.257
  394   2HB   ARG  45          1HB       ARG  45  -1.925  14.797  -7.665
  395   1HG   ARG  45          2HG       ARG  45  -2.568  15.226  -5.431
  396   2HG   ARG  45          1HG       ARG  45  -0.932  14.952  -4.835
  397   1HD   ARG  45          2HD       ARG  45  -1.483  17.324  -4.903
  398   2HD   ARG  45          1HD       ARG  45  -0.156  16.931  -5.987
  399    HE   ARG  45           HE       ARG  45  -2.610  16.862  -7.359
  400   1HH1  ARG  45          1HH1      ARG  45  -0.297  19.146  -5.958
  401   2HH1  ARG  45          2HH1      ARG  45  -0.667  20.398  -7.041
  402   1HH2  ARG  45          1HH2      ARG  45  -3.112  18.601  -8.848
  403   2HH2  ARG  45          2HH2      ARG  45  -2.280  20.101  -8.702
  404    H    GLY  46           H        GLY  46  -1.898  10.686  -7.329
  405   1HA   GLY  46          2HA       GLY  46  -2.159   9.640  -9.409
  406   2HA   GLY  46          1HA       GLY  46  -1.356  11.004 -10.174
  407    H    GLN  47           H        GLN  47   0.403  10.070  -7.544
  408    HA   GLN  47           HA       GLN  47   2.082   8.254  -9.125
  409   1HB   GLN  47          2HB       GLN  47   2.981  10.308  -7.090
  410   2HB   GLN  47          1HB       GLN  47   4.034   9.160  -7.910
  411   1HG   GLN  47          2HG       GLN  47   3.525  10.212 -10.034
  412   2HG   GLN  47          1HG       GLN  47   2.417  11.322  -9.227
  413   1HE2  GLN  47          1HE2      GLN  47   3.242  12.916  -7.921
  414   2HE2  GLN  47          2HE2      GLN  47   4.890  13.417  -8.003
  415    H    GLU  48           H        GLU  48   3.269   6.660  -7.820
  416    HA   GLU  48           HA       GLU  48   1.501   5.864  -5.626
  417   1HB   GLU  48          2HB       GLU  48   3.347   4.082  -7.214
  418   2HB   GLU  48          1HB       GLU  48   2.207   3.579  -5.988
  419   1HG   GLU  48          2HG       GLU  48   1.199   3.003  -8.018
  420   2HG   GLU  48          1HG       GLU  48   0.399   4.498  -7.549
  421    H    HIS  49           H        HIS  49   2.299   4.886  -3.822
  422    HA   HIS  49           HA       HIS  49   5.155   5.326  -3.085
  423   1HB   HIS  49          2HB       HIS  49   2.811   4.551  -1.290
  424   2HB   HIS  49          1HB       HIS  49   4.442   4.877  -0.770
  425    HD1  HIS  49           1HD      HIS  49   4.855   7.231   0.092
  426    HD2  HIS  49           2HD      HIS  49   1.367   6.948  -2.166
  427    HE1  HIS  49           1HE      HIS  49   3.606   9.303   0.536
  428    HE2  HIS  49           2HE      HIS  49   1.381   8.840  -0.404
  429    H    CYS  50           H        CYS  50   6.185   3.250  -2.088
  430    HA   CYS  50           HA       CYS  50   4.448   1.014  -2.448
  431   1HB   CYS  50          2HB       CYS  50   6.085  -0.335  -3.730
  432   2HB   CYS  50          1HB       CYS  50   5.510   1.060  -4.621
  433    H    LEU  51           H        LEU  51   4.526  -0.380  -0.984
  434    HA   LEU  51           HA       LEU  51   6.538  -0.127   1.102
  435   1HB   LEU  51          2HB       LEU  51   4.022  -1.809   1.026
  436   2HB   LEU  51          1HB       LEU  51   5.174  -1.788   2.331
  437    HG   LEU  51           HG       LEU  51   3.796   0.618   1.377
  438   1HD1  LEU  51          1HD1      LEU  51   2.227   0.249   3.347
  439   2HD1  LEU  51          2HD1      LEU  51   3.041  -1.286   3.653
  440   3HD1  LEU  51          3HD1      LEU  51   2.104  -1.062   2.176
  441   1HD2  LEU  51          1HD2      LEU  51   5.722   1.084   2.689
  442   2HD2  LEU  51          2HD2      LEU  51   5.198  -0.052   3.941
  443   3HD2  LEU  51          3HD2      LEU  51   4.295   1.434   3.666
  444    H    HIS  52           H        HIS  52   7.779  -1.584   1.647
  445    HA   HIS  52           HA       HIS  52   8.500  -3.594  -0.327
  446   1HB   HIS  52          2HB       HIS  52  10.182  -2.186   1.034
  447   2HB   HIS  52          1HB       HIS  52   9.805  -3.250   2.382
  448    HD1  HIS  52           1HD      HIS  52  11.360  -5.205   2.585
  449    HD2  HIS  52           2HD      HIS  52  11.163  -3.738  -1.294
  450    HE1  HIS  52           1HE      HIS  52  12.915  -6.602   1.266
  451    HE2  HIS  52           2HE      HIS  52  13.092  -5.399  -0.926
  452    HA   PRO  53           HA       PRO  53   5.558  -6.308   1.656
  453   1HB   PRO  53          2HB       PRO  53   5.888  -8.455   0.052
  454   2HB   PRO  53          1HB       PRO  53   4.997  -7.009  -0.436
  455   1HG   PRO  53          2HG       PRO  53   7.806  -7.813  -1.081
  456   2HG   PRO  53          1HG       PRO  53   6.564  -7.095  -2.125
  457   1HD   PRO  53          2HD       PRO  53   8.571  -5.637  -1.035
  458   2HD   PRO  53          1HD       PRO  53   6.964  -4.960  -1.358
  459    H    LYS  54           H        LYS  54   8.820  -6.721   1.846
  460    HA   LYS  54           HA       LYS  54   8.818  -9.355   2.873
  461   1HB   LYS  54          2HB       LYS  54  10.965  -7.266   2.957
  462   2HB   LYS  54          1HB       LYS  54  11.189  -8.957   3.413
  463   1HG   LYS  54          2HG       LYS  54  10.292  -7.994   0.714
  464   2HG   LYS  54          1HG       LYS  54  11.921  -8.497   1.164
  465   1HD   LYS  54          2HD       LYS  54  11.298 -10.674   1.494
  466   2HD   LYS  54          1HD       LYS  54   9.562 -10.341   1.474
  467   1HE   LYS  54          2HE       LYS  54   9.699  -9.701  -0.779
  468   2HE   LYS  54          1HE       LYS  54  11.423 -10.019  -0.915
  469   1HZ   LYS  54          1HZ       LYS  54  10.836 -12.382  -0.277
  470   2HZ   LYS  54          2HZ       LYS  54  10.258 -11.900  -1.769
  471   3HZ   LYS  54          3HZ       LYS  54   9.203 -11.983  -0.456
  472    H    LEU  55           H        LEU  55   8.062  -6.324   4.125
  473    HA   LEU  55           HA       LEU  55   8.903  -6.738   6.862
  474   1HB   LEU  55          2HB       LEU  55   7.173  -4.611   5.608
  475   2HB   LEU  55          1HB       LEU  55   7.714  -4.610   7.269
  476    HG   LEU  55           HG       LEU  55   9.518  -4.414   4.858
  477   1HD1  LEU  55          1HD1      LEU  55   9.815  -2.093   5.555
  478   2HD1  LEU  55          2HD1      LEU  55   8.619  -2.316   6.832
  479   3HD1  LEU  55          3HD1      LEU  55   8.133  -2.430   5.139
  480   1HD2  LEU  55          1HD2      LEU  55  10.093  -4.147   7.810
  481   2HD2  LEU  55          2HD2      LEU  55  11.237  -3.833   6.510
  482   3HD2  LEU  55          3HD2      LEU  55  10.626  -5.465   6.762
  483    H    GLN  56           H        GLN  56   7.614  -7.294   8.528
  484    HA   GLN  56           HA       GLN  56   5.258  -8.786   7.978
  485   1HB   GLN  56          2HB       GLN  56   6.388  -7.867  10.632
  486   2HB   GLN  56          1HB       GLN  56   5.134  -9.083  10.428
  487   1HG   GLN  56          2HG       GLN  56   6.698 -10.506   9.202
  488   2HG   GLN  56          1HG       GLN  56   7.955  -9.292   9.394
  489   1HE2  GLN  56          1HE2      GLN  56   6.104 -11.759  10.948
  490   2HE2  GLN  56          2HE2      GLN  56   7.046 -11.849  12.387
  491    H    SER  57           H        SER  57   5.928  -5.566   8.974
  492    HA   SER  57           HA       SER  57   3.506  -4.644   9.972
  493   1HB   SER  57          2HB       SER  57   5.607  -3.350  10.016
  494   2HB   SER  57          1HB       SER  57   5.554  -3.202   8.264
  495    HG   SER  57           HG       SER  57   3.763  -2.121  10.163
  496    H    THR  58           H        THR  58   4.646  -5.091   6.672
  497    HA   THR  58           HA       THR  58   2.666  -3.759   5.300
  498    HB   THR  58           HB       THR  58   4.213  -6.219   4.439
  499    HG1  THR  58           1HG      THR  58   5.728  -4.564   3.663
  500   1HG2  THR  58          1HG2      THR  58   2.399  -5.565   2.919
  501   2HG2  THR  58          2HG2      THR  58   3.972  -5.218   2.196
  502   3HG2  THR  58          3HG2      THR  58   3.014  -3.915   2.897
  503    H    LYS  59           H        LYS  59   2.834  -7.067   6.609
  504    HA   LYS  59           HA       LYS  59   0.554  -8.030   5.292
  505   1HB   LYS  59          2HB       LYS  59   2.026  -9.018   7.707
  506   2HB   LYS  59          1HB       LYS  59   0.563  -9.796   7.126
  507   1HG   LYS  59          2HG       LYS  59   2.465 -10.969   6.281
  508   2HG   LYS  59          1HG       LYS  59   1.639 -10.164   4.955
  509   1HD   LYS  59          2HD       LYS  59   3.333  -8.375   5.010
  510   2HD   LYS  59          1HD       LYS  59   4.169  -9.217   6.311
  511   1HE   LYS  59          2HE       LYS  59   3.693 -10.298   3.532
  512   2HE   LYS  59          1HE       LYS  59   5.209  -9.619   4.118
  513   1HZ   LYS  59          1HZ       LYS  59   5.213 -12.031   4.174
  514   2HZ   LYS  59          2HZ       LYS  59   3.879 -12.046   5.198
  515   3HZ   LYS  59          3HZ       LYS  59   5.338 -11.404   5.737
  516    H    ARG  60           H        ARG  60   0.824  -6.227   8.361
  517    HA   ARG  60           HA       ARG  60  -1.912  -6.676   8.849
  518   1HB   ARG  60          2HB       ARG  60   0.003  -4.635   9.920
  519   2HB   ARG  60          1HB       ARG  60  -1.713  -4.526  10.222
  520   1HG   ARG  60          2HG       ARG  60  -0.921  -5.547  12.103
  521   2HG   ARG  60          1HG       ARG  60  -1.491  -6.896  11.143
  522   1HD   ARG  60          2HD       ARG  60   0.660  -7.488  12.057
  523   2HD   ARG  60          1HD       ARG  60   0.860  -7.215  10.320
  524    HE   ARG  60           HE       ARG  60   1.404  -4.793  11.373
  525   1HH1  ARG  60          1HH1      ARG  60   2.712  -8.009  11.974
  526   2HH1  ARG  60          2HH1      ARG  60   4.182  -7.480  12.605
  527   1HH2  ARG  60          1HH2      ARG  60   3.413  -4.022  12.214
  528   2HH2  ARG  60          2HH2      ARG  60   4.609  -5.116  12.735
  529    H    PHE  61           H        PHE  61  -0.052  -4.066   7.420
  530    HA   PHE  61           HA       PHE  61  -2.135  -2.268   7.083
  531   1HB   PHE  61          2HB       PHE  61   0.380  -1.941   6.768
  532   2HB   PHE  61          1HB       PHE  61   0.090  -2.605   5.158
  533    HD1  PHE  61           1HD      PHE  61  -0.455  -1.133   3.389
  534    HD2  PHE  61           2HD      PHE  61  -1.067   0.128   7.407
  535    HE1  PHE  61           1HE      PHE  61  -1.023   1.140   2.601
  536    HE2  PHE  61           2HE      PHE  61  -1.632   2.403   6.606
  537    HZ   PHE  61           HZ       PHE  61  -1.593   2.916   4.261
  538    H    ILE  62           H        ILE  62  -1.033  -4.839   4.904
  539    HA   ILE  62           HA       ILE  62  -2.802  -4.154   2.783
  540    HB   ILE  62           HB       ILE  62  -1.500  -6.832   3.349
  541   1HG1  ILE  62          2HG1      ILE  62   0.190  -5.139   3.111
  542   2HG1  ILE  62          1HG1      ILE  62   0.150  -6.095   1.632
  543   1HG2  ILE  62          1HG2      ILE  62  -3.399  -6.971   1.819
  544   2HG2  ILE  62          2HG2      ILE  62  -1.878  -7.288   0.966
  545   3HG2  ILE  62          3HG2      ILE  62  -2.690  -5.722   0.805
  546   1HD1  ILE  62          1HD1      ILE  62  -1.030  -3.381   2.071
  547   2HD1  ILE  62          2HD1      ILE  62  -1.191  -4.317   0.585
  548   3HD1  ILE  62          3HD1      ILE  62   0.402  -3.767   1.119
  549    H    LYS  63           H        LYS  63  -2.932  -6.602   5.289
  550    HA   LYS  63           HA       LYS  63  -5.510  -7.622   4.501
  551   1HB   LYS  63          2HB       LYS  63  -3.855  -7.934   6.984
  552   2HB   LYS  63          1HB       LYS  63  -5.522  -8.444   6.993
  553   1HG   LYS  63          2HG       LYS  63  -3.913 -10.306   6.665
  554   2HG   LYS  63          1HG       LYS  63  -5.064 -10.176   5.363
  555   1HD   LYS  63          2HD       LYS  63  -2.297  -8.991   5.167
  556   2HD   LYS  63          1HD       LYS  63  -2.603 -10.690   4.810
  557   1HE   LYS  63          2HE       LYS  63  -3.914  -8.335   3.440
  558   2HE   LYS  63          1HE       LYS  63  -2.593  -9.290   2.784
  559   1HZ   LYS  63          1HZ       LYS  63  -5.318 -10.334   3.416
  560   2HZ   LYS  63          2HZ       LYS  63  -4.059 -11.238   2.829
  561   3HZ   LYS  63          3HZ       LYS  63  -4.732 -10.035   1.877
  562    H    TRP  64           H        TRP  64  -4.454  -5.089   6.557
  563    HA   TRP  64           HA       TRP  64  -6.959  -4.672   7.851
  564   1HB   TRP  64          2HB       TRP  64  -4.438  -3.933   8.432
  565   2HB   TRP  64          1HB       TRP  64  -4.976  -2.476   7.610
  566    HD1  TRP  64           HD       TRP  64  -4.924  -4.106  10.902
  567    HE1  TRP  64           1HE      TRP  64  -6.424  -2.843  12.574
  568    HE3  TRP  64           3HE      TRP  64  -7.485  -1.089   7.646
  569    HZ2  TRP  64           2HZ      TRP  64  -8.411  -0.850  12.525
  570    HZ3  TRP  64           3HZ      TRP  64  -9.158   0.459   8.549
  571    HH2  TRP  64           HH       TRP  64  -9.611   0.570  10.936
  572    H    TYR  65           H        TYR  65  -5.206  -3.276   5.040
  573    HA   TYR  65           HA       TYR  65  -7.091  -1.279   4.545
  574   1HB   TYR  65          2HB       TYR  65  -4.848  -1.248   3.499
  575   2HB   TYR  65          1HB       TYR  65  -5.314  -2.621   2.490
  576    HD1  TYR  65           1HD      TYR  65  -6.162  -2.154   0.341
  577    HD2  TYR  65           2HD      TYR  65  -6.493   0.791   3.394
  578    HE1  TYR  65           1HE      TYR  65  -7.157  -0.546  -1.282
  579    HE2  TYR  65           2HE      TYR  65  -7.476   2.353   1.780
  580    HH   TYR  65           HH       TYR  65  -7.578   2.726  -0.534
  581    H    ASN  66           H        ASN  66  -6.942  -4.622   3.575
  582    HA   ASN  66           HA       ASN  66  -9.149  -4.576   1.809
  583   1HB   ASN  66          2HB       ASN  66  -8.135  -6.866   3.518
  584   2HB   ASN  66          1HB       ASN  66  -9.332  -7.049   2.249
  585   1HD2  ASN  66          1HD2      ASN  66  -6.816  -8.336   2.463
  586   2HD2  ASN  66          2HD2      ASN  66  -5.875  -7.905   1.077
  587    H    ALA  67           H        ALA  67  -8.914  -4.880   5.273
  588    HA   ALA  67           HA       ALA  67 -11.694  -5.355   5.724
  589   1HB   ALA  67          1HB       ALA  67  -9.610  -4.257   7.614
  590   2HB   ALA  67          2HB       ALA  67  -9.987  -5.965   7.387
  591   3HB   ALA  67          3HB       ALA  67 -11.196  -4.876   8.074
  592    H    TRP  68           H        TRP  68  -9.634  -2.511   5.760
  593    HA   TRP  68           HA       TRP  68 -11.498  -0.534   6.426
  594   1HB   TRP  68          2HB       TRP  68  -9.150   0.000   6.331
  595   2HB   TRP  68          1HB       TRP  68  -9.046  -0.517   4.661
  596    HD1  TRP  68           HD       TRP  68  -9.485   1.250   2.830
  597    HE1  TRP  68           1HE      TRP  68  -9.920   3.767   2.833
  598    HE3  TRP  68           3HE      TRP  68 -10.437   1.913   7.818
  599    HZ2  TRP  68           2HZ      TRP  68 -10.580   5.772   4.662
  600    HZ3  TRP  68           3HZ      TRP  68 -10.965   4.191   8.598
  601    HH2  TRP  68           HH       TRP  68 -11.032   6.082   7.016
  602    H    ASN  69           H        ASN  69 -10.635  -1.878   3.298
  603    HA   ASN  69           HA       ASN  69 -12.368  -0.431   1.652
  604   1HB   ASN  69          2HB       ASN  69 -10.510  -1.966   0.909
  605   2HB   ASN  69          1HB       ASN  69 -11.515  -3.331   1.352
  606   1HD2  ASN  69          1HD2      ASN  69 -10.363  -2.678  -1.205
  607   2HD2  ASN  69          2HD2      ASN  69 -11.660  -2.513  -2.319
  608    H    GLU  70           H        GLU  70 -12.810  -3.503   3.380
  609    HA   GLU  70           HA       GLU  70 -15.432  -4.129   2.667
  610   1HB   GLU  70          2HB       GLU  70 -13.986  -5.666   3.944
  611   2HB   GLU  70          1HB       GLU  70 -14.071  -4.595   5.334
  612   1HG   GLU  70          2HG       GLU  70 -16.573  -4.948   5.307
  613   2HG   GLU  70          1HG       GLU  70 -16.294  -6.225   4.132
  614    H    LYS  71           H        LYS  71 -14.208  -2.122   5.324
  615    HA   LYS  71           HA       LYS  71 -16.751  -1.699   6.505
  616   1HB   LYS  71          2HB       LYS  71 -14.311   0.055   6.809
  617   2HB   LYS  71          1HB       LYS  71 -15.693  -0.002   7.890
  618   1HG   LYS  71          2HG       LYS  71 -13.607  -2.121   7.443
  619   2HG   LYS  71          1HG       LYS  71 -13.920  -1.208   8.917
  620   1HD   LYS  71          2HD       LYS  71 -16.110  -2.312   9.125
  621   2HD   LYS  71          1HD       LYS  71 -15.793  -3.194   7.634
  622   1HE   LYS  71          2HE       LYS  71 -13.809  -4.212   8.694
  623   2HE   LYS  71          1HE       LYS  71 -14.230  -3.401  10.200
  624   1HZ   LYS  71          1HZ       LYS  71 -15.026  -5.660  10.194
  625   2HZ   LYS  71          2HZ       LYS  71 -15.859  -5.413   8.760
  626   3HZ   LYS  71          3HZ       LYS  71 -16.356  -4.629  10.177
  627    H    ARG  72           H        ARG  72 -15.044  -0.018   4.009
  628    HA   ARG  72           HA       ARG  72 -16.823   2.238   4.047
  629   1HB   ARG  72          2HB       ARG  72 -14.840   1.373   1.941
  630   2HB   ARG  72          1HB       ARG  72 -15.718   2.895   1.934
  631   1HG   ARG  72          2HG       ARG  72 -14.621   3.522   4.044
  632   2HG   ARG  72          1HG       ARG  72 -13.717   2.005   4.002
  633   1HD   ARG  72          2HD       ARG  72 -12.372   3.831   3.158
  634   2HD   ARG  72          1HD       ARG  72 -12.710   2.669   1.872
  635    HE   ARG  72           HE       ARG  72 -14.334   5.085   2.188
  636   1HH1  ARG  72          1HH1      ARG  72 -12.173   3.129   0.195
  637   2HH1  ARG  72          2HH1      ARG  72 -12.373   4.043  -1.215
  638   1HH2  ARG  72          1HH2      ARG  72 -14.620   6.367   0.248
  639   2HH2  ARG  72          2HH2      ARG  72 -13.797   5.958  -1.184
  640    H    ARG  73           H        ARG  73 -16.714  -0.823   2.426
  641    HA   ARG  73           HA       ARG  73 -18.824  -0.104   0.546
  642   1HB   ARG  73          2HB       ARG  73 -17.416  -2.693   1.103
  643   2HB   ARG  73          1HB       ARG  73 -18.723  -2.534  -0.046
  644   1HG   ARG  73          2HG       ARG  73 -17.350  -0.970  -1.352
  645   2HG   ARG  73          1HG       ARG  73 -16.037  -1.190  -0.185
  646   1HD   ARG  73          2HD       ARG  73 -15.815  -2.652  -2.188
  647   2HD   ARG  73          1HD       ARG  73 -15.923  -3.541  -0.666
  648    HE   ARG  73           HE       ARG  73 -18.486  -3.198  -1.876
  649   1HH1  ARG  73          1HH1      ARG  73 -15.596  -5.223  -2.060
  650   2HH1  ARG  73          2HH1      ARG  73 -16.416  -6.581  -2.678
  651   1HH2  ARG  73          1HH2      ARG  73 -19.569  -4.962  -2.666
  652   2HH2  ARG  73          2HH2      ARG  73 -18.781  -6.445  -3.071
  653    H    VAL  74           H        VAL  74 -18.444  -1.769   3.558
  654    HA   VAL  74           HA       VAL  74 -19.776  -2.808   4.972
  655    HB   VAL  74           HB       VAL  74 -22.071  -2.001   3.123
  656   1HG1  VAL  74          1HG1      VAL  74 -22.665  -4.063   4.316
  657   2HG1  VAL  74          2HG1      VAL  74 -23.602  -2.700   4.931
  658   3HG1  VAL  74          3HG1      VAL  74 -22.222  -3.311   5.848
  659   1HG2  VAL  74          1HG2      VAL  74 -22.681  -0.439   4.916
  660   2HG2  VAL  74          2HG2      VAL  74 -21.051  -0.142   4.305
  661   3HG2  VAL  74          3HG2      VAL  74 -21.275  -0.971   5.842
  662    H    TYR  75           H        TYR  75 -20.467  -4.984   5.189
  663    HA   TYR  75           HA       TYR  75 -19.235  -6.583   3.229
  664   1HB   TYR  75          2HB       TYR  75 -19.402  -7.055   5.704
  665   2HB   TYR  75          1HB       TYR  75 -21.069  -7.535   5.428
  666    HD1  TYR  75           1HD      TYR  75 -21.567  -9.656   4.296
  667    HD2  TYR  75           2HD      TYR  75 -17.563  -8.385   4.953
  668    HE1  TYR  75           1HE      TYR  75 -20.759 -11.932   3.811
  669    HE2  TYR  75           2HE      TYR  75 -16.752 -10.642   4.470
  670    HH   TYR  75           HH       TYR  75 -17.602 -12.872   4.564
  671    H    GLU  76           H        GLU  76 -20.099  -6.672   1.303
  672    HA   GLU  76           HA       GLU  76 -22.963  -7.128   0.915
  673   1HB   GLU  76          2HB       GLU  76 -20.756  -6.555  -1.090
  674   2HB   GLU  76          1HB       GLU  76 -22.452  -6.725  -1.485
  675   1HG   GLU  76          2HG       GLU  76 -22.947  -4.716  -0.159
  676   2HG   GLU  76          1HG       GLU  76 -21.232  -4.551   0.211
  677    H    GLU  77           H        GLU  77 -23.713  -9.098   0.043
  678    HA   GLU  77           HA       GLU  77 -21.617 -11.068  -0.362
  679   1HB   GLU  77          2HB       GLU  77 -23.317 -12.858  -0.018
  680   2HB   GLU  77          1HB       GLU  77 -23.137 -11.819   1.373
  681   1HG   GLU  77          2HG       GLU  77 -25.221 -10.683   0.805
  682   2HG   GLU  77          1HG       GLU  77 -25.383 -11.694  -0.634
  Start of MODEL   10
    1    H    SER   1           H        SER   1  21.037  -1.395  -5.135
    2    HA   SER   1           HA       SER   1  18.932  -0.825  -4.816
    3   1HB   SER   1          2HB       SER   1  18.574  -0.944  -7.214
    4   2HB   SER   1          1HB       SER   1  18.339  -2.685  -7.136
    5    HG   SER   1           HG       SER   1  16.616  -0.631  -6.636
    6    H    LYS   2           H        LYS   2  18.619  -4.293  -5.583
    7    HA   LYS   2           HA       LYS   2  17.725  -6.019  -4.533
    8   1HB   LYS   2          2HB       LYS   2  18.369  -4.463  -2.032
    9   2HB   LYS   2          1HB       LYS   2  17.704  -6.088  -2.002
   10   1HG   LYS   2          2HG       LYS   2  19.665  -6.893  -3.251
   11   2HG   LYS   2          1HG       LYS   2  20.327  -5.259  -3.225
   12   1HD   LYS   2          2HD       LYS   2  20.413  -5.292  -0.805
   13   2HD   LYS   2          1HD       LYS   2  19.639  -6.875  -0.772
   14   1HE   LYS   2          2HE       LYS   2  22.329  -6.260  -1.997
   15   2HE   LYS   2          1HE       LYS   2  22.064  -7.023  -0.430
   16   1HZ   LYS   2          1HZ       LYS   2  21.290  -8.179  -3.081
   17   2HZ   LYS   2          2HZ       LYS   2  20.932  -8.850  -1.586
   18   3HZ   LYS   2          3HZ       LYS   2  22.531  -8.696  -2.057
   19    H    CYS   3           H        CYS   3  16.220  -3.224  -4.746
   20    HA   CYS   3           HA       CYS   3  14.111  -2.559  -4.839
   21   1HB   CYS   3          2HB       CYS   3  13.756  -4.756  -5.979
   22   2HB   CYS   3          1HB       CYS   3  13.319  -5.452  -4.425
   23    H    LYS   4           H        LYS   4  14.316  -1.351  -3.039
   24    HA   LYS   4           HA       LYS   4  12.686  -2.200  -0.771
   25   1HB   LYS   4          2HB       LYS   4  14.378  -1.372   0.818
   26   2HB   LYS   4          1HB       LYS   4  14.979  -2.717  -0.140
   27   1HG   LYS   4          2HG       LYS   4  16.161  -1.078  -1.605
   28   2HG   LYS   4          1HG       LYS   4  15.640   0.207  -0.517
   29   1HD   LYS   4          2HD       LYS   4  17.907  -0.428   0.033
   30   2HD   LYS   4          1HD       LYS   4  16.832  -0.939   1.332
   31   1HE   LYS   4          2HE       LYS   4  16.825  -3.228   0.435
   32   2HE   LYS   4          1HE       LYS   4  17.879  -2.714  -0.881
   33   1HZ   LYS   4          1HZ       LYS   4  19.099  -3.811   0.887
   34   2HZ   LYS   4          2HZ       LYS   4  18.548  -2.703   2.008
   35   3HZ   LYS   4          3HZ       LYS   4  19.592  -2.196   0.788
   36    H    CYS   5           H        CYS   5  12.907  -0.257  -3.169
   37    HA   CYS   5           HA       CYS   5  12.118   1.704  -3.803
   38   1HB   CYS   5          2HB       CYS   5  11.110   1.990  -0.951
   39   2HB   CYS   5          1HB       CYS   5  10.660   3.038  -2.295
   40    H    SER   6           H        SER   6  13.289   2.393  -0.534
   41    HA   SER   6           HA       SER   6  15.649   3.675  -1.468
   42   1HB   SER   6          2HB       SER   6  13.550   5.454  -0.129
   43   2HB   SER   6          1HB       SER   6  15.206   5.919  -0.488
   44    HG   SER   6           HG       SER   6  13.907   4.916  -2.639
   45    H    ARG   7           H        ARG   7  13.418   3.773   1.306
   46    HA   ARG   7           HA       ARG   7  15.191   2.194   2.926
   47   1HB   ARG   7          2HB       ARG   7  16.054   4.555   3.203
   48   2HB   ARG   7          1HB       ARG   7  14.462   5.028   3.763
   49   1HG   ARG   7          2HG       ARG   7  15.940   4.771   5.652
   50   2HG   ARG   7          1HG       ARG   7  14.724   3.491   5.686
   51   1HD   ARG   7          2HD       ARG   7  16.304   1.916   4.774
   52   2HD   ARG   7          1HD       ARG   7  17.513   3.184   4.587
   53    HE   ARG   7           HE       ARG   7  16.691   3.000   7.282
   54   1HH1  ARG   7          1HH1      ARG   7  18.613   1.222   4.899
   55   2HH1  ARG   7          2HH1      ARG   7  19.692   0.565   6.030
   56   1HH2  ARG   7          1HH2      ARG   7  18.174   2.076   8.853
   57   2HH2  ARG   7          2HH2      ARG   7  19.449   1.062   8.320
   58    H    LYS   8           H        LYS   8  13.386   0.809   2.797
   59    HA   LYS   8           HA       LYS   8  11.359  -0.077   3.243
   60   1HB   LYS   8          2HB       LYS   8  11.449   1.924   5.520
   61   2HB   LYS   8          1HB       LYS   8  10.074   0.869   5.286
   62   1HG   LYS   8          2HG       LYS   8  11.476  -0.022   7.006
   63   2HG   LYS   8          1HG       LYS   8  11.575  -1.074   5.606
   64   1HD   LYS   8          2HD       LYS   8  13.724  -0.085   5.020
   65   2HD   LYS   8          1HD       LYS   8  13.612   1.000   6.410
   66   1HE   LYS   8          2HE       LYS   8  13.536  -0.927   7.911
   67   2HE   LYS   8          1HE       LYS   8  13.666  -2.014   6.529
   68   1HZ   LYS   8          1HZ       LYS   8  15.844  -1.047   6.062
   69   2HZ   LYS   8          2HZ       LYS   8  15.773  -1.710   7.608
   70   3HZ   LYS   8          3HZ       LYS   8  15.697  -0.044   7.417
   71    H    GLY   9           H        GLY   9   8.902   0.871   3.882
   72   1HA   GLY   9          2HA       GLY   9   8.504   3.035   1.953
   73   2HA   GLY   9          1HA       GLY   9   7.355   1.742   2.156
   74    HA   PRO  10           HA       PRO  10   7.308   5.363   5.606
   75   1HB   PRO  10          2HB       PRO  10   5.684   6.706   3.480
   76   2HB   PRO  10          1HB       PRO  10   6.673   7.433   4.756
   77   1HG   PRO  10          2HG       PRO  10   7.602   7.325   2.287
   78   2HG   PRO  10          1HG       PRO  10   8.671   6.961   3.658
   79   1HD   PRO  10          2HD       PRO  10   7.403   5.119   1.694
   80   2HD   PRO  10          1HD       PRO  10   8.986   5.010   2.483
   81    H    LYS  11           H        LYS  11   5.590   5.279   6.971
   82    HA   LYS  11           HA       LYS  11   3.606   3.384   6.279
   83   1HB   LYS  11          2HB       LYS  11   4.001   4.924   8.830
   84   2HB   LYS  11          1HB       LYS  11   2.761   3.695   8.604
   85   1HG   LYS  11          2HG       LYS  11   4.542   2.052   8.084
   86   2HG   LYS  11          1HG       LYS  11   5.741   3.293   8.457
   87   1HD   LYS  11          2HD       LYS  11   4.868   3.466  10.713
   88   2HD   LYS  11          1HD       LYS  11   3.652   2.241  10.353
   89   1HE   LYS  11          2HE       LYS  11   5.464   0.628   9.880
   90   2HE   LYS  11          1HE       LYS  11   6.646   1.857  10.325
   91   1HZ   LYS  11          1HZ       LYS  11   6.206   0.344  12.155
   92   2HZ   LYS  11          2HZ       LYS  11   4.565   0.721  12.101
   93   3HZ   LYS  11          3HZ       LYS  11   5.671   1.897  12.558
   94    H    ILE  12           H        ILE  12   2.017   3.705   5.250
   95    HA   ILE  12           HA       ILE  12   0.743   6.284   4.797
   96    HB   ILE  12           HB       ILE  12   0.029   3.598   3.641
   97   1HG1  ILE  12          2HG1      ILE  12   2.032   5.568   2.540
   98   2HG1  ILE  12          1HG1      ILE  12   2.461   4.066   3.347
   99   1HG2  ILE  12          1HG2      ILE  12  -0.274   6.436   2.614
  100   2HG2  ILE  12          2HG2      ILE  12  -1.567   5.439   3.278
  101   3HG2  ILE  12          3HG2      ILE  12  -0.787   4.983   1.764
  102   1HD1  ILE  12          1HD1      ILE  12   2.569   3.831   0.963
  103   2HD1  ILE  12          2HD1      ILE  12   0.894   4.373   0.832
  104   3HD1  ILE  12          3HD1      ILE  12   1.264   2.829   1.612
  105    H    ARG  13           H        ARG  13  -1.388   6.686   5.302
  106    HA   ARG  13           HA       ARG  13  -2.577   4.871   7.241
  107   1HB   ARG  13          2HB       ARG  13  -3.572   7.467   6.118
  108   2HB   ARG  13          1HB       ARG  13  -4.258   6.561   7.464
  109   1HG   ARG  13          2HG       ARG  13  -2.340   7.009   8.835
  110   2HG   ARG  13          1HG       ARG  13  -1.489   7.747   7.477
  111   1HD   ARG  13          2HD       ARG  13  -4.026   8.772   8.738
  112   2HD   ARG  13          1HD       ARG  13  -2.410   9.456   8.952
  113    HE   ARG  13           HE       ARG  13  -3.050   9.292   6.203
  114   1HH1  ARG  13          1HH1      ARG  13  -3.796  11.236   9.058
  115   2HH1  ARG  13          2HH1      ARG  13  -4.224  12.616   8.146
  116   1HH2  ARG  13          1HH2      ARG  13  -3.650  11.118   4.997
  117   2HH2  ARG  13          2HH2      ARG  13  -4.142  12.548   5.803
  118    H    TYR  14           H        TYR  14  -4.731   4.081   6.848
  119    HA   TYR  14           HA       TYR  14  -5.031   2.898   4.265
  120   1HB   TYR  14          2HB       TYR  14  -7.064   3.070   6.499
  121   2HB   TYR  14          1HB       TYR  14  -6.996   1.876   5.200
  122    HD1  TYR  14           1HD      TYR  14  -5.736   2.828   8.459
  123    HD2  TYR  14           2HD      TYR  14  -5.142   0.223   5.154
  124    HE1  TYR  14           1HE      TYR  14  -4.261   1.435   9.834
  125    HE2  TYR  14           2HE      TYR  14  -3.691  -1.175   6.504
  126    HH   TYR  14           HH       TYR  14  -3.471  -0.857   9.890
  127    H    SER  15           H        SER  15  -6.344   5.638   5.869
  128    HA   SER  15           HA       SER  15  -8.508   6.168   4.134
  129   1HB   SER  15          2HB       SER  15  -6.992   8.024   5.939
  130   2HB   SER  15          1HB       SER  15  -8.634   8.255   5.319
  131    HG   SER  15           HG       SER  15  -9.353   7.033   6.862
  132    H    ASP  16           H        ASP  16  -5.115   6.584   3.766
  133    HA   ASP  16           HA       ASP  16  -5.422   8.786   1.872
  134   1HB   ASP  16          2HB       ASP  16  -2.920   7.300   2.725
  135   2HB   ASP  16          1HB       ASP  16  -2.956   8.662   1.627
  136    H    VAL  17           H        VAL  17  -5.462   5.464   1.962
  137    HA   VAL  17           HA       VAL  17  -4.358   5.098  -0.694
  138    HB   VAL  17           HB       VAL  17  -5.721   3.032   0.981
  139   1HG1  VAL  17          1HG1      VAL  17  -5.541   2.314  -1.200
  140   2HG1  VAL  17          2HG1      VAL  17  -4.320   1.452  -0.282
  141   3HG1  VAL  17          3HG1      VAL  17  -3.870   2.804  -1.350
  142   1HG2  VAL  17          1HG2      VAL  17  -3.493   2.344   1.795
  143   2HG2  VAL  17          2HG2      VAL  17  -3.936   3.960   2.342
  144   3HG2  VAL  17          3HG2      VAL  17  -2.798   3.764   1.011
  145    H    LYS  18           H        LYS  18  -5.548   5.175  -2.430
  146    HA   LYS  18           HA       LYS  18  -8.439   4.730  -2.205
  147   1HB   LYS  18          2HB       LYS  18  -6.767   5.701  -4.503
  148   2HB   LYS  18          1HB       LYS  18  -8.451   5.235  -4.676
  149   1HG   LYS  18          2HG       LYS  18  -9.047   6.960  -3.006
  150   2HG   LYS  18          1HG       LYS  18  -7.350   7.433  -2.945
  151   1HD   LYS  18          2HD       LYS  18  -8.668   8.915  -4.417
  152   2HD   LYS  18          1HD       LYS  18  -7.417   8.049  -5.312
  153   1HE   LYS  18          2HE       LYS  18  -9.553   8.126  -6.516
  154   2HE   LYS  18          1HE       LYS  18  -9.082   6.474  -6.147
  155   1HZ   LYS  18          1HZ       LYS  18 -11.101   8.101  -4.684
  156   2HZ   LYS  18          2HZ       LYS  18 -10.647   6.560  -4.236
  157   3HZ   LYS  18          3HZ       LYS  18 -11.423   6.812  -5.705
  158    H    LYS  19           H        LYS  19  -5.592   3.351  -3.474
  159    HA   LYS  19           HA       LYS  19  -6.980   0.865  -4.097
  160   1HB   LYS  19          2HB       LYS  19  -5.359   2.317  -6.198
  161   2HB   LYS  19          1HB       LYS  19  -5.805   0.631  -6.296
  162   1HG   LYS  19          2HG       LYS  19  -8.184   1.311  -6.333
  163   2HG   LYS  19          1HG       LYS  19  -7.660   3.003  -6.333
  164   1HD   LYS  19          2HD       LYS  19  -6.445   2.662  -8.406
  165   2HD   LYS  19          1HD       LYS  19  -6.858   0.948  -8.396
  166   1HE   LYS  19          2HE       LYS  19  -9.240   1.558  -8.583
  167   2HE   LYS  19          1HE       LYS  19  -8.778   3.256  -8.639
  168   1HZ   LYS  19          1HZ       LYS  19  -7.927   1.200 -10.610
  169   2HZ   LYS  19          2HZ       LYS  19  -7.574   2.837 -10.700
  170   3HZ   LYS  19          3HZ       LYS  19  -9.157   2.306 -10.862
  171    H    LEU  20           H        LEU  20  -5.750  -0.891  -3.952
  172    HA   LEU  20           HA       LEU  20  -2.909  -0.563  -3.312
  173   1HB   LEU  20          2HB       LEU  20  -4.424  -1.082  -1.365
  174   2HB   LEU  20          1HB       LEU  20  -4.964  -2.506  -2.201
  175    HG   LEU  20           HG       LEU  20  -2.145  -2.078  -1.156
  176   1HD1  LEU  20          1HD1      LEU  20  -2.806  -3.658   0.590
  177   2HD1  LEU  20          2HD1      LEU  20  -4.445  -3.671  -0.049
  178   3HD1  LEU  20          3HD1      LEU  20  -3.777  -2.190   0.632
  179   1HD2  LEU  20          1HD2      LEU  20  -1.868  -4.487  -1.512
  180   2HD2  LEU  20          2HD2      LEU  20  -2.249  -3.685  -3.036
  181   3HD2  LEU  20          3HD2      LEU  20  -3.499  -4.591  -2.179
  182    H    GLU  21           H        GLU  21  -1.724  -1.640  -4.913
  183    HA   GLU  21           HA       GLU  21  -3.025  -3.949  -6.134
  184   1HB   GLU  21          2HB       GLU  21  -1.549  -1.772  -7.627
  185   2HB   GLU  21          1HB       GLU  21  -2.047  -3.304  -8.319
  186   1HG   GLU  21          2HG       GLU  21  -4.407  -2.681  -7.854
  187   2HG   GLU  21          1HG       GLU  21  -3.821  -1.110  -7.300
  188    H    MET  22           H        MET  22  -1.619  -5.618  -6.556
  189    HA   MET  22           HA       MET  22   1.055  -5.053  -5.584
  190   1HB   MET  22          2HB       MET  22  -0.441  -7.656  -5.795
  191   2HB   MET  22          1HB       MET  22   1.250  -7.515  -5.330
  192   1HG   MET  22          2HG       MET  22   0.594  -6.174  -3.393
  193   2HG   MET  22          1HG       MET  22  -1.097  -6.337  -3.865
  194   1HE   MET  22          1HE       MET  22   0.035  -7.081  -0.959
  195   2HE   MET  22          2HE       MET  22  -0.809  -8.599  -0.658
  196   3HE   MET  22          3HE       MET  22  -1.663  -7.252  -1.406
  197    H    LYS  23           H        LYS  23   2.335  -4.598  -7.064
  198    HA   LYS  23           HA       LYS  23   3.041  -6.420  -9.009
  199   1HB   LYS  23          2HB       LYS  23   2.827  -4.828 -11.025
  200   2HB   LYS  23          1HB       LYS  23   1.364  -5.602 -10.477
  201   1HG   LYS  23          2HG       LYS  23   0.766  -3.398 -11.036
  202   2HG   LYS  23          1HG       LYS  23   0.818  -3.436  -9.279
  203   1HD   LYS  23          2HD       LYS  23   3.057  -2.377  -9.370
  204   2HD   LYS  23          1HD       LYS  23   2.931  -2.336 -11.125
  205   1HE   LYS  23          2HE       LYS  23   0.941  -0.955 -11.010
  206   2HE   LYS  23          1HE       LYS  23   0.981  -0.973  -9.256
  207   1HZ   LYS  23          1HZ       LYS  23   3.201   0.168  -9.446
  208   2HZ   LYS  23          2HZ       LYS  23   1.910   1.079 -10.038
  209   3HZ   LYS  23          3HZ       LYS  23   2.945   0.287 -11.090
  210    HA   PRO  24           HA       PRO  24   6.775  -4.867  -7.721
  211   1HB   PRO  24          2HB       PRO  24   8.461  -5.619  -9.717
  212   2HB   PRO  24          1HB       PRO  24   7.793  -6.728  -8.522
  213   1HG   PRO  24          2HG       PRO  24   6.910  -6.201 -11.303
  214   2HG   PRO  24          1HG       PRO  24   7.043  -7.749 -10.456
  215   1HD   PRO  24          2HD       PRO  24   4.664  -6.485 -10.796
  216   2HD   PRO  24          1HD       PRO  24   5.018  -7.468  -9.364
  217    H    LYS  25           H        LYS  25   7.949  -3.102  -7.699
  218    HA   LYS  25           HA       LYS  25   7.295  -0.962  -9.502
  219   1HB   LYS  25          2HB       LYS  25   7.860  -0.924  -6.857
  220   2HB   LYS  25          1HB       LYS  25   9.499  -0.907  -7.509
  221   1HG   LYS  25          2HG       LYS  25   7.552   1.185  -8.314
  222   2HG   LYS  25          1HG       LYS  25   8.474   1.306  -6.821
  223   1HD   LYS  25          2HD       LYS  25  10.524   1.195  -8.020
  224   2HD   LYS  25          1HD       LYS  25   9.655   0.867  -9.522
  225   1HE   LYS  25          2HE       LYS  25   8.605   3.088  -9.373
  226   2HE   LYS  25          1HE       LYS  25   9.421   3.387  -7.843
  227   1HZ   LYS  25          1HZ       LYS  25  10.744   3.082 -10.496
  228   2HZ   LYS  25          2HZ       LYS  25  11.543   3.356  -9.027
  229   3HZ   LYS  25          3HZ       LYS  25  10.500   4.509  -9.635
  230    H    TYR  26           H        TYR  26   9.856  -3.252  -8.948
  231    HA   TYR  26           HA       TYR  26  11.147  -2.425 -11.421
  232   1HB   TYR  26          2HB       TYR  26  12.394  -3.227  -8.788
  233   2HB   TYR  26          1HB       TYR  26  13.280  -3.492 -10.253
  234    HD1  TYR  26           1HD      TYR  26  14.181  -1.668 -11.492
  235    HD2  TYR  26           2HD      TYR  26  12.022  -1.001  -7.897
  236    HE1  TYR  26           1HE      TYR  26  15.129   0.605 -11.360
  237    HE2  TYR  26           2HE      TYR  26  12.967   1.269  -7.745
  238    HH   TYR  26           HH       TYR  26  14.896   2.481  -8.545
  239    HA   PRO  27           HA       PRO  27  10.147  -6.654 -12.472
  240   1HB   PRO  27          2HB       PRO  27  12.600  -6.701 -14.118
  241   2HB   PRO  27          1HB       PRO  27  10.923  -6.915 -14.610
  242   1HG   PRO  27          2HG       PRO  27  12.273  -4.675 -15.219
  243   2HG   PRO  27          1HG       PRO  27  10.545  -4.645 -14.831
  244   1HD   PRO  27          2HD       PRO  27  12.883  -3.885 -13.125
  245   2HD   PRO  27          1HD       PRO  27  11.282  -3.123 -13.278
  246    H    HIS  28           H        HIS  28  13.134  -5.661 -11.244
  247    HA   HIS  28           HA       HIS  28  14.064  -8.374 -10.657
  248   1HB   HIS  28          2HB       HIS  28  16.157  -7.349  -9.842
  249   2HB   HIS  28          1HB       HIS  28  15.767  -6.769 -11.456
  250    HD1  HIS  28           1HD      HIS  28  15.853  -5.714  -7.875
  251    HD2  HIS  28           2HD      HIS  28  15.509  -3.958 -11.623
  252    HE1  HIS  28           1HE      HIS  28  15.951  -3.234  -7.515
  253    HE2  HIS  28           2HE      HIS  28  16.279  -2.357  -9.807
  254    H    CYS  29           H        CYS  29  11.661  -7.315  -9.329
  255    HA   CYS  29           HA       CYS  29  12.557  -7.250  -6.530
  256   1HB   CYS  29          2HB       CYS  29   9.954  -6.477  -7.848
  257   2HB   CYS  29          1HB       CYS  29  10.187  -6.447  -6.121
  258    H    GLU  30           H        GLU  30  11.470  -8.727  -5.060
  259    HA   GLU  30           HA       GLU  30  10.873 -11.235  -6.306
  260   1HB   GLU  30          2HB       GLU  30  10.315 -10.595  -3.431
  261   2HB   GLU  30          1HB       GLU  30  10.817 -12.129  -4.129
  262   1HG   GLU  30          2HG       GLU  30  12.634 -11.418  -2.894
  263   2HG   GLU  30          1HG       GLU  30  13.001 -10.907  -4.543
  264    H    GLU  31           H        GLU  31   8.867 -11.886  -6.845
  265    HA   GLU  31           HA       GLU  31   6.649 -11.881  -7.232
  266   1HB   GLU  31          2HB       GLU  31   6.727 -11.479  -4.262
  267   2HB   GLU  31          1HB       GLU  31   5.235 -11.842  -5.122
  268   1HG   GLU  31          2HG       GLU  31   7.703 -13.558  -5.024
  269   2HG   GLU  31          1HG       GLU  31   6.174 -13.856  -4.187
  270    H    LYS  32           H        LYS  32   4.549 -10.532  -5.929
  271    HA   LYS  32           HA       LYS  32   4.718  -8.086  -7.428
  272   1HB   LYS  32          2HB       LYS  32   2.406  -9.300  -5.937
  273   2HB   LYS  32          1HB       LYS  32   2.340  -7.967  -7.091
  274   1HG   LYS  32          2HG       LYS  32   3.283 -10.706  -7.696
  275   2HG   LYS  32          1HG       LYS  32   1.621 -10.142  -8.055
  276   1HD   LYS  32          2HD       LYS  32   2.740  -8.408  -9.520
  277   2HD   LYS  32          1HD       LYS  32   4.265  -9.236  -9.151
  278   1HE   LYS  32          2HE       LYS  32   1.896 -10.537 -10.489
  279   2HE   LYS  32          1HE       LYS  32   3.305  -9.906 -11.337
  280   1HZ   LYS  32          1HZ       LYS  32   4.678 -11.518 -10.144
  281   2HZ   LYS  32          2HZ       LYS  32   3.448 -12.278 -10.990
  282   3HZ   LYS  32          3HZ       LYS  32   3.322 -12.108  -9.330
  283    H    MET  33           H        MET  33   5.429  -6.395  -6.536
  284    HA   MET  33           HA       MET  33   5.695  -5.864  -3.772
  285   1HB   MET  33          2HB       MET  33   5.833  -4.075  -6.164
  286   2HB   MET  33          1HB       MET  33   6.334  -3.618  -4.566
  287   1HG   MET  33          2HG       MET  33   7.548  -5.922  -6.086
  288   2HG   MET  33          1HG       MET  33   8.225  -4.293  -6.052
  289   1HE   MET  33          1HE       MET  33   8.992  -3.120  -3.997
  290   2HE   MET  33          2HE       MET  33   9.118  -3.803  -2.367
  291   3HE   MET  33          3HE       MET  33   7.523  -3.505  -3.097
  292    H    VAL  34           H        VAL  34   4.675  -4.176  -2.633
  293    HA   VAL  34           HA       VAL  34   1.857  -3.995  -3.247
  294    HB   VAL  34           HB       VAL  34   3.455  -3.089  -0.867
  295   1HG1  VAL  34          1HG1      VAL  34   1.428  -1.713  -1.201
  296   2HG1  VAL  34          2HG1      VAL  34   1.314  -2.690   0.246
  297   3HG1  VAL  34          3HG1      VAL  34   0.437  -3.175  -1.214
  298   1HG2  VAL  34          1HG2      VAL  34   2.361  -4.972   0.289
  299   2HG2  VAL  34          2HG2      VAL  34   3.355  -5.501  -1.068
  300   3HG2  VAL  34          3HG2      VAL  34   1.601  -5.438  -1.233
  301    H    ILE  35           H        ILE  35   1.154  -2.395  -4.450
  302    HA   ILE  35           HA       ILE  35   2.580   0.160  -4.421
  303    HB   ILE  35           HB       ILE  35   0.614  -0.944  -6.424
  304   1HG1  ILE  35          2HG1      ILE  35   2.629  -2.190  -6.425
  305   2HG1  ILE  35          1HG1      ILE  35   2.503  -1.221  -7.891
  306   1HG2  ILE  35          1HG2      ILE  35   1.323   0.945  -7.831
  307   2HG2  ILE  35          2HG2      ILE  35   2.344   1.524  -6.519
  308   3HG2  ILE  35          3HG2      ILE  35   0.592   1.488  -6.319
  309   1HD1  ILE  35          1HD1      ILE  35   4.110   0.409  -6.932
  310   2HD1  ILE  35          2HD1      ILE  35   4.811  -1.198  -7.078
  311   3HD1  ILE  35          3HD1      ILE  35   4.277  -0.615  -5.503
  312    H    ILE  36           H        ILE  36   1.597   1.792  -3.620
  313    HA   ILE  36           HA       ILE  36  -1.260   1.552  -3.015
  314    HB   ILE  36           HB       ILE  36   0.916   2.901  -1.425
  315   1HG1  ILE  36          2HG1      ILE  36   0.725   0.468  -1.180
  316   2HG1  ILE  36          1HG1      ILE  36   0.357   1.309   0.329
  317   1HG2  ILE  36          1HG2      ILE  36  -1.032   4.334  -1.385
  318   2HG2  ILE  36          2HG2      ILE  36  -0.817   3.533   0.182
  319   3HG2  ILE  36          3HG2      ILE  36  -2.038   2.955  -0.942
  320   1HD1  ILE  36          1HD1      ILE  36  -1.584   0.055  -1.610
  321   2HD1  ILE  36          2HD1      ILE  36  -2.047   0.952  -0.163
  322   3HD1  ILE  36          3HD1      ILE  36  -1.134  -0.551  -0.021
  323    H    THR  37           H        THR  37  -2.467   2.851  -4.087
  324    HA   THR  37           HA       THR  37  -1.363   5.272  -5.299
  325    HB   THR  37           HB       THR  37  -3.995   3.831  -5.732
  326    HG1  THR  37           1HG      THR  37  -1.953   2.796  -6.371
  327   1HG2  THR  37          1HG2      THR  37  -2.685   6.059  -7.318
  328   2HG2  THR  37          2HG2      THR  37  -4.134   6.203  -6.307
  329   3HG2  THR  37          3HG2      THR  37  -4.173   5.214  -7.766
  330    H    THR  38           H        THR  38  -1.907   7.280  -4.452
  331    HA   THR  38           HA       THR  38  -3.390   7.229  -1.997
  332    HB   THR  38           HB       THR  38  -2.466   9.576  -1.851
  333    HG1  THR  38           1HG      THR  38  -2.035   9.955  -4.079
  334   1HG2  THR  38          1HG2      THR  38  -0.149   8.727  -1.456
  335   2HG2  THR  38          2HG2      THR  38  -0.648   7.224  -2.246
  336   3HG2  THR  38          3HG2      THR  38  -1.414   7.708  -0.739
  337    H    LYS  39           H        LYS  39  -4.876   8.816  -1.428
  338    HA   LYS  39           HA       LYS  39  -6.931   9.331  -3.363
  339   1HB   LYS  39          2HB       LYS  39  -7.431   8.673  -1.049
  340   2HB   LYS  39          1HB       LYS  39  -6.719  10.168  -0.474
  341   1HG   LYS  39          2HG       LYS  39  -8.467  11.444  -1.612
  342   2HG   LYS  39          1HG       LYS  39  -9.172   9.942  -2.211
  343   1HD   LYS  39          2HD       LYS  39  -9.530   9.203   0.109
  344   2HD   LYS  39          1HD       LYS  39  -8.856  10.727   0.687
  345   1HE   LYS  39          2HE       LYS  39 -10.658  11.943  -0.443
  346   2HE   LYS  39          1HE       LYS  39 -11.322  10.420  -1.025
  347   1HZ   LYS  39          1HZ       LYS  39 -11.646   9.753   1.299
  348   2HZ   LYS  39          2HZ       LYS  39 -12.515  11.119   0.910
  349   3HZ   LYS  39          3HZ       LYS  39 -11.094  11.262   1.816
  350    H    SER  40           H        SER  40  -4.792  11.405  -1.470
  351    HA   SER  40           HA       SER  40  -4.627  13.432  -3.370
  352   1HB   SER  40          2HB       SER  40  -5.970  15.198  -2.121
  353   2HB   SER  40          1HB       SER  40  -6.931  13.972  -2.949
  354    HG   SER  40           HG       SER  40  -7.781  13.565  -1.123
  355    H    VAL  41           H        VAL  41  -4.767  12.829   0.133
  356    HA   VAL  41           HA       VAL  41  -2.607  14.595   0.718
  357    HB   VAL  41           HB       VAL  41  -3.630  12.271   2.401
  358   1HG1  VAL  41          1HG1      VAL  41  -2.034  14.696   3.213
  359   2HG1  VAL  41          2HG1      VAL  41  -1.464  13.021   3.156
  360   3HG1  VAL  41          3HG1      VAL  41  -2.700  13.490   4.312
  361   1HG2  VAL  41          1HG2      VAL  41  -4.465  15.166   2.456
  362   2HG2  VAL  41          2HG2      VAL  41  -4.971  13.936   3.609
  363   3HG2  VAL  41          3HG2      VAL  41  -5.445  13.805   1.914
  364    H    SER  42           H        SER  42  -1.120  14.002  -0.800
  365    HA   SER  42           HA       SER  42   0.308  11.529  -0.247
  366   1HB   SER  42          2HB       SER  42  -1.049  11.327  -2.283
  367   2HB   SER  42          1HB       SER  42  -0.241  12.741  -2.948
  368    HG   SER  42           HG       SER  42   0.442  10.307  -3.202
  369    H    ARG  43           H        ARG  43   2.448  11.736  -0.055
  370    HA   ARG  43           HA       ARG  43   3.764  14.312  -0.329
  371   1HB   ARG  43          2HB       ARG  43   5.006  11.571   0.065
  372   2HB   ARG  43          1HB       ARG  43   5.794  13.112   0.327
  373   1HG   ARG  43          2HG       ARG  43   3.486  12.026   1.920
  374   2HG   ARG  43          1HG       ARG  43   5.178  11.972   2.405
  375   1HD   ARG  43          2HD       ARG  43   5.245  14.408   2.477
  376   2HD   ARG  43          1HD       ARG  43   3.566  14.484   1.931
  377    HE   ARG  43           HE       ARG  43   3.669  12.849   4.160
  378   1HH1  ARG  43          1HH1      ARG  43   4.248  16.284   3.466
  379   2HH1  ARG  43          2HH1      ARG  43   3.668  16.823   4.965
  380   1HH2  ARG  43          1HH2      ARG  43   2.842  13.599   6.220
  381   2HH2  ARG  43          2HH2      ARG  43   2.848  15.267   6.566
  382    H    TYR  44           H        TYR  44   2.800  11.873  -2.346
  383    HA   TYR  44           HA       TYR  44   5.052  12.018  -4.174
  384   1HB   TYR  44          2HB       TYR  44   2.881   9.989  -3.722
  385   2HB   TYR  44          1HB       TYR  44   3.893   9.893  -5.151
  386    HD1  TYR  44           1HD      TYR  44   6.174   9.216  -4.993
  387    HD2  TYR  44           2HD      TYR  44   3.810   9.689  -1.504
  388    HE1  TYR  44           1HE      TYR  44   7.927   8.094  -3.664
  389    HE2  TYR  44           2HE      TYR  44   5.547   8.564  -0.170
  390    HH   TYR  44           HH       TYR  44   8.665   8.010  -1.353
  391    H    ARG  45           H        ARG  45   1.559  12.585  -4.029
  392    HA   ARG  45           HA       ARG  45   0.100  13.598  -5.322
  393   1HB   ARG  45          2HB       ARG  45   1.682  15.474  -5.099
  394   2HB   ARG  45          1HB       ARG  45   2.490  14.941  -6.571
  395   1HG   ARG  45          2HG       ARG  45   0.305  15.157  -7.716
  396   2HG   ARG  45          1HG       ARG  45  -0.283  15.917  -6.234
  397   1HD   ARG  45          2HD       ARG  45   2.019  16.913  -7.935
  398   2HD   ARG  45          1HD       ARG  45   0.415  17.637  -7.872
  399    HE   ARG  45           HE       ARG  45   1.196  17.664  -5.310
  400   1HH1  ARG  45          1HH1      ARG  45   2.706  18.833  -8.291
  401   2HH1  ARG  45          2HH1      ARG  45   3.541  20.099  -7.507
  402   1HH2  ARG  45          1HH2      ARG  45   2.360  19.413  -4.270
  403   2HH2  ARG  45          2HH2      ARG  45   3.349  20.431  -5.221
  404    H    GLY  46           H        GLY  46  -0.677  11.815  -6.430
  405   1HA   GLY  46          2HA       GLY  46  -1.312  10.726  -8.363
  406   2HA   GLY  46          1HA       GLY  46  -0.341  11.875  -9.276
  407    H    GLN  47           H        GLN  47   1.621  10.686  -7.031
  408    HA   GLN  47           HA       GLN  47   2.617   8.606  -8.772
  409   1HB   GLN  47          2HB       GLN  47   4.031  10.434  -6.851
  410   2HB   GLN  47          1HB       GLN  47   4.817   8.966  -7.470
  411   1HG   GLN  47          2HG       GLN  47   3.741  11.279  -9.072
  412   2HG   GLN  47          1HG       GLN  47   5.427  11.037  -8.619
  413   1HE2  GLN  47          1HE2      GLN  47   6.060  10.990 -10.745
  414   2HE2  GLN  47          2HE2      GLN  47   5.767   9.644 -11.788
  415    H    GLU  48           H        GLU  48   3.662   6.815  -7.702
  416    HA   GLU  48           HA       GLU  48   1.631   5.740  -5.931
  417   1HB   GLU  48          2HB       GLU  48   3.795   4.401  -7.524
  418   2HB   GLU  48          1HB       GLU  48   2.477   3.609  -6.673
  419   1HG   GLU  48          2HG       GLU  48   0.860   4.565  -8.146
  420   2HG   GLU  48          1HG       GLU  48   2.082   5.569  -8.915
  421    H    HIS  49           H        HIS  49   2.125   4.648  -4.109
  422    HA   HIS  49           HA       HIS  49   4.781   5.030  -2.923
  423   1HB   HIS  49          2HB       HIS  49   2.134   4.180  -1.882
  424   2HB   HIS  49          1HB       HIS  49   3.583   3.852  -0.940
  425    HD1  HIS  49           1HD      HIS  49   4.261   5.674   0.574
  426    HD2  HIS  49           2HD      HIS  49   1.501   6.933  -2.240
  427    HE1  HIS  49           1HE      HIS  49   3.431   7.908   1.404
  428    HE2  HIS  49           2HE      HIS  49   1.515   8.396  -0.101
  429    H    CYS  50           H        CYS  50   5.859   3.130  -2.042
  430    HA   CYS  50           HA       CYS  50   4.834   0.654  -3.078
  431   1HB   CYS  50          2HB       CYS  50   7.179   0.010  -3.732
  432   2HB   CYS  50          1HB       CYS  50   6.451   1.257  -4.740
  433    H    LEU  51           H        LEU  51   4.950  -0.936  -1.741
  434    HA   LEU  51           HA       LEU  51   6.594  -0.649   0.649
  435   1HB   LEU  51          2HB       LEU  51   3.809  -1.734   0.370
  436   2HB   LEU  51          1HB       LEU  51   4.834  -2.143   1.740
  437    HG   LEU  51           HG       LEU  51   4.227   0.641   0.951
  438   1HD1  LEU  51          1HD1      LEU  51   2.454   0.561   2.745
  439   2HD1  LEU  51          2HD1      LEU  51   2.773  -1.158   2.956
  440   3HD1  LEU  51          3HD1      LEU  51   2.080  -0.567   1.446
  441   1HD2  LEU  51          1HD2      LEU  51   6.108   0.310   2.426
  442   2HD2  LEU  51          2HD2      LEU  51   5.096  -0.605   3.541
  443   3HD2  LEU  51          3HD2      LEU  51   4.795   1.113   3.284
  444    H    HIS  52           H        HIS  52   7.717  -2.205   1.186
  445    HA   HIS  52           HA       HIS  52   8.038  -4.360  -0.761
  446   1HB   HIS  52          2HB       HIS  52  10.062  -3.032  -0.107
  447   2HB   HIS  52          1HB       HIS  52   9.874  -3.620   1.539
  448    HD1  HIS  52           1HD      HIS  52  11.624  -5.332   1.990
  449    HD2  HIS  52           2HD      HIS  52  10.206  -5.586  -1.918
  450    HE1  HIS  52           1HE      HIS  52  12.741  -7.313   0.988
  451    HE2  HIS  52           2HE      HIS  52  11.929  -7.452  -1.377
  452    HA   PRO  53           HA       PRO  53   5.393  -6.841   1.819
  453   1HB   PRO  53          2HB       PRO  53   5.777  -9.186   0.465
  454   2HB   PRO  53          1HB       PRO  53   4.663  -7.906  -0.043
  455   1HG   PRO  53          2HG       PRO  53   7.455  -8.480  -0.962
  456   2HG   PRO  53          1HG       PRO  53   6.035  -8.040  -1.926
  457   1HD   PRO  53          2HD       PRO  53   7.912  -6.265  -1.343
  458   2HD   PRO  53          1HD       PRO  53   6.198  -5.798  -1.352
  459    H    LYS  54           H        LYS  54   8.671  -7.086   1.900
  460    HA   LYS  54           HA       LYS  54   8.782  -9.505   3.385
  461   1HB   LYS  54          2HB       LYS  54  10.827  -7.540   2.514
  462   2HB   LYS  54          1HB       LYS  54  11.233  -8.651   3.817
  463   1HG   LYS  54          2HG       LYS  54  11.942  -9.478   1.640
  464   2HG   LYS  54          1HG       LYS  54  10.780 -10.547   2.391
  465   1HD   LYS  54          2HD       LYS  54   9.007  -9.425   0.989
  466   2HD   LYS  54          1HD       LYS  54  10.309  -8.597   0.140
  467   1HE   LYS  54          2HE       LYS  54  11.264 -10.717  -0.525
  468   2HE   LYS  54          1HE       LYS  54   9.990 -11.516   0.462
  469   1HZ   LYS  54          1HZ       LYS  54   9.470 -11.562  -1.885
  470   2HZ   LYS  54          2HZ       LYS  54   9.528  -9.883  -1.993
  471   3HZ   LYS  54          3HZ       LYS  54   8.346 -10.660  -1.056
  472    H    LEU  55           H        LEU  55   8.056  -6.263   3.993
  473    HA   LEU  55           HA       LEU  55   9.079  -6.030   6.690
  474   1HB   LEU  55          2HB       LEU  55   7.228  -4.262   5.095
  475   2HB   LEU  55          1HB       LEU  55   7.923  -3.863   6.650
  476    HG   LEU  55           HG       LEU  55   9.505  -4.275   4.105
  477   1HD1  LEU  55          1HD1      LEU  55   9.808  -1.853   4.158
  478   2HD1  LEU  55          2HD1      LEU  55   8.749  -1.745   5.561
  479   3HD1  LEU  55          3HD1      LEU  55   8.104  -2.272   4.008
  480   1HD2  LEU  55          1HD2      LEU  55  10.322  -3.240   6.820
  481   2HD2  LEU  55          2HD2      LEU  55  11.354  -3.333   5.393
  482   3HD2  LEU  55          3HD2      LEU  55  10.746  -4.813   6.143
  483    H    GLN  56           H        GLN  56   7.955  -6.426   8.507
  484    HA   GLN  56           HA       GLN  56   5.533  -7.869   8.465
  485   1HB   GLN  56          2HB       GLN  56   5.542  -7.683  10.894
  486   2HB   GLN  56          1HB       GLN  56   7.124  -8.138  10.287
  487   1HG   GLN  56          2HG       GLN  56   7.909  -5.855  10.605
  488   2HG   GLN  56          1HG       GLN  56   6.308  -5.368  11.159
  489   1HE2  GLN  56          1HE2      GLN  56   5.599  -6.057  13.171
  490   2HE2  GLN  56          2HE2      GLN  56   6.666  -6.686  14.366
  491    H    SER  57           H        SER  57   6.173  -4.487   8.742
  492    HA   SER  57           HA       SER  57   3.699  -3.635   9.773
  493   1HB   SER  57          2HB       SER  57   5.678  -2.180   9.756
  494   2HB   SER  57          1HB       SER  57   5.691  -2.187   7.996
  495    HG   SER  57           HG       SER  57   3.702  -1.086   9.702
  496    H    THR  58           H        THR  58   4.863  -4.332   6.523
  497    HA   THR  58           HA       THR  58   2.757  -3.243   5.090
  498    HB   THR  58           HB       THR  58   4.567  -5.565   4.370
  499    HG1  THR  58           1HG      THR  58   4.870  -2.766   4.414
  500   1HG2  THR  58          1HG2      THR  58   2.626  -5.318   2.853
  501   2HG2  THR  58          2HG2      THR  58   4.132  -4.874   2.048
  502   3HG2  THR  58          3HG2      THR  58   3.035  -3.619   2.623
  503    H    LYS  59           H        LYS  59   3.190  -6.476   6.563
  504    HA   LYS  59           HA       LYS  59   0.922  -7.687   5.440
  505   1HB   LYS  59          2HB       LYS  59   2.339  -8.231   8.030
  506   2HB   LYS  59          1HB       LYS  59   0.900  -9.115   7.555
  507   1HG   LYS  59          2HG       LYS  59   2.777 -10.427   6.963
  508   2HG   LYS  59          1HG       LYS  59   2.073  -9.789   5.489
  509   1HD   LYS  59          2HD       LYS  59   3.806  -8.063   5.401
  510   2HD   LYS  59          1HD       LYS  59   4.527  -8.719   6.872
  511   1HE   LYS  59          2HE       LYS  59   4.206 -10.191   4.256
  512   2HE   LYS  59          1HE       LYS  59   5.702  -9.482   4.857
  513   1HZ   LYS  59          1HZ       LYS  59   5.651 -11.831   5.273
  514   2HZ   LYS  59          2HZ       LYS  59   4.206 -11.731   6.127
  515   3HZ   LYS  59          3HZ       LYS  59   5.622 -11.033   6.724
  516    H    ARG  60           H        ARG  60   1.058  -5.814   8.510
  517    HA   ARG  60           HA       ARG  60  -1.675  -6.220   8.910
  518   1HB   ARG  60          2HB       ARG  60   0.222  -4.164   9.964
  519   2HB   ARG  60          1HB       ARG  60  -1.497  -4.039  10.246
  520   1HG   ARG  60          2HG       ARG  60  -0.622  -5.021  12.163
  521   2HG   ARG  60          1HG       ARG  60  -1.386  -6.296  11.266
  522   1HD   ARG  60          2HD       ARG  60   0.734  -7.067  10.351
  523   2HD   ARG  60          1HD       ARG  60   1.589  -5.763  11.169
  524    HE   ARG  60           HE       ARG  60   0.132  -7.295  13.018
  525   1HH1  ARG  60          1HH1      ARG  60   3.071  -7.444  11.046
  526   2HH1  ARG  60          2HH1      ARG  60   3.894  -8.533  12.076
  527   1HH2  ARG  60          1HH2      ARG  60   1.278  -8.774  14.457
  528   2HH2  ARG  60          2HH2      ARG  60   2.848  -9.290  14.084
  529    H    PHE  61           H        PHE  61   0.142  -3.722   7.261
  530    HA   PHE  61           HA       PHE  61  -1.960  -1.965   6.868
  531   1HB   PHE  61          2HB       PHE  61   0.505  -1.623   6.404
  532   2HB   PHE  61          1HB       PHE  61   0.186  -2.514   4.907
  533    HD1  PHE  61           1HD      PHE  61  -0.208  -1.237   2.987
  534    HD2  PHE  61           2HD      PHE  61  -1.229   0.383   6.783
  535    HE1  PHE  61           1HE      PHE  61  -0.911   0.877   1.915
  536    HE2  PHE  61           2HE      PHE  61  -1.925   2.488   5.707
  537    HZ   PHE  61           HZ       PHE  61  -1.758   2.752   3.325
  538    H    ILE  62           H        ILE  62  -0.904  -4.738   4.956
  539    HA   ILE  62           HA       ILE  62  -2.785  -4.403   2.842
  540    HB   ILE  62           HB       ILE  62  -1.394  -6.932   3.752
  541   1HG1  ILE  62          2HG1      ILE  62   0.237  -5.275   3.127
  542   2HG1  ILE  62          1HG1      ILE  62   0.131  -6.469   1.835
  543   1HG2  ILE  62          1HG2      ILE  62  -3.346  -7.423   2.434
  544   2HG2  ILE  62          2HG2      ILE  62  -1.887  -7.778   1.495
  545   3HG2  ILE  62          3HG2      ILE  62  -2.820  -6.311   1.170
  546   1HD1  ILE  62          1HD1      ILE  62  -1.158  -3.770   1.875
  547   2HD1  ILE  62          2HD1      ILE  62  -1.263  -4.956   0.565
  548   3HD1  ILE  62          3HD1      ILE  62   0.295  -4.217   0.971
  549    H    LYS  63           H        LYS  63  -2.722  -6.554   5.598
  550    HA   LYS  63           HA       LYS  63  -5.345  -7.480   4.948
  551   1HB   LYS  63          2HB       LYS  63  -3.631  -8.058   7.316
  552   2HB   LYS  63          1HB       LYS  63  -5.344  -8.424   7.414
  553   1HG   LYS  63          2HG       LYS  63  -4.286 -10.450   6.707
  554   2HG   LYS  63          1HG       LYS  63  -5.100  -9.792   5.309
  555   1HD   LYS  63          2HD       LYS  63  -2.989 -10.611   4.600
  556   2HD   LYS  63          1HD       LYS  63  -2.882  -8.851   4.592
  557   1HE   LYS  63          2HE       LYS  63  -0.876  -9.865   5.552
  558   2HE   LYS  63          1HE       LYS  63  -1.735  -8.893   6.734
  559   1HZ   LYS  63          1HZ       LYS  63  -2.678 -10.940   7.657
  560   2HZ   LYS  63          2HZ       LYS  63  -1.011 -10.969   7.689
  561   3HZ   LYS  63          3HZ       LYS  63  -1.831 -11.861   6.525
  562    H    TRP  64           H        TRP  64  -4.292  -4.897   6.878
  563    HA   TRP  64           HA       TRP  64  -6.835  -4.516   8.144
  564   1HB   TRP  64          2HB       TRP  64  -4.340  -3.682   8.725
  565   2HB   TRP  64          1HB       TRP  64  -4.899  -2.288   7.823
  566    HD1  TRP  64           HD       TRP  64  -4.843  -3.762  11.184
  567    HE1  TRP  64           1HE      TRP  64  -6.343  -2.410  12.802
  568    HE3  TRP  64           3HE      TRP  64  -7.395  -0.892   7.785
  569    HZ2  TRP  64           2HZ      TRP  64  -8.328  -0.406  12.653
  570    HZ3  TRP  64           3HZ      TRP  64  -9.067   0.711   8.610
  571    HH2  TRP  64           HH       TRP  64  -9.520   0.947  10.987
  572    H    TYR  65           H        TYR  65  -5.125  -3.321   5.169
  573    HA   TYR  65           HA       TYR  65  -7.020  -1.386   4.503
  574   1HB   TYR  65          2HB       TYR  65  -4.922  -1.473   3.264
  575   2HB   TYR  65          1HB       TYR  65  -5.315  -3.074   2.629
  576    HD1  TYR  65           1HD      TYR  65  -6.904  -3.317   0.787
  577    HD2  TYR  65           2HD      TYR  65  -6.050   0.535   2.390
  578    HE1  TYR  65           1HE      TYR  65  -8.029  -2.271  -1.141
  579    HE2  TYR  65           2HE      TYR  65  -7.171   1.581   0.448
  580    HH   TYR  65           HH       TYR  65  -7.744   0.976  -1.922
  581    H    ASN  66           H        ASN  66  -6.974  -4.828   4.010
  582    HA   ASN  66           HA       ASN  66  -9.303  -4.979   2.447
  583   1HB   ASN  66          2HB       ASN  66  -8.049  -7.006   4.297
  584   2HB   ASN  66          1HB       ASN  66  -9.555  -7.356   3.459
  585   1HD2  ASN  66          1HD2      ASN  66  -6.104  -6.819   3.065
  586   2HD2  ASN  66          2HD2      ASN  66  -6.045  -7.402   1.444
  587    H    ALA  67           H        ALA  67  -8.918  -4.863   5.935
  588    HA   ALA  67           HA       ALA  67 -11.666  -5.147   6.563
  589   1HB   ALA  67          1HB       ALA  67  -9.511  -3.683   8.106
  590   2HB   ALA  67          2HB       ALA  67  -9.892  -5.397   8.260
  591   3HB   ALA  67          3HB       ALA  67 -11.077  -4.183   8.747
  592    H    TRP  68           H        TRP  68  -9.613  -2.364   5.969
  593    HA   TRP  68           HA       TRP  68 -11.483  -0.299   6.269
  594   1HB   TRP  68          2HB       TRP  68  -9.148   0.218   6.196
  595   2HB   TRP  68          1HB       TRP  68  -8.964  -0.578   4.645
  596    HD1  TRP  68           HD       TRP  68  -8.774   1.014   2.678
  597    HE1  TRP  68           1HE      TRP  68  -9.419   3.447   2.195
  598    HE3  TRP  68           3HE      TRP  68 -11.248   2.087   7.023
  599    HZ2  TRP  68           2HZ      TRP  68 -10.811   5.533   3.447
  600    HZ3  TRP  68           3HZ      TRP  68 -12.217   4.335   7.282
  601    HH2  TRP  68           HH       TRP  68 -11.996   6.015   5.524
  602    H    ASN  69           H        ASN  69 -10.588  -2.209   3.468
  603    HA   ASN  69           HA       ASN  69 -12.201  -0.929   1.561
  604   1HB   ASN  69          2HB       ASN  69 -10.372  -2.420   0.923
  605   2HB   ASN  69          1HB       ASN  69 -11.210  -3.784   1.655
  606   1HD2  ASN  69          1HD2      ASN  69 -12.884  -4.799   0.526
  607   2HD2  ASN  69          2HD2      ASN  69 -13.250  -4.372  -1.090
  608    H    GLU  70           H        GLU  70 -12.817  -3.708   3.653
  609    HA   GLU  70           HA       GLU  70 -15.443  -4.122   2.683
  610   1HB   GLU  70          2HB       GLU  70 -14.197  -4.964   5.299
  611   2HB   GLU  70          1HB       GLU  70 -15.744  -5.536   4.690
  612   1HG   GLU  70          2HG       GLU  70 -13.051  -5.975   3.419
  613   2HG   GLU  70          1HG       GLU  70 -14.007  -7.171   4.284
  614    H    LYS  71           H        LYS  71 -14.058  -2.042   5.125
  615    HA   LYS  71           HA       LYS  71 -16.403  -1.416   6.533
  616   1HB   LYS  71          2HB       LYS  71 -14.103  -1.043   7.369
  617   2HB   LYS  71          1HB       LYS  71 -13.863   0.158   6.123
  618   1HG   LYS  71          2HG       LYS  71 -14.268   1.208   8.246
  619   2HG   LYS  71          1HG       LYS  71 -15.577   1.552   7.107
  620   1HD   LYS  71          2HD       LYS  71 -16.466   1.062   9.349
  621   2HD   LYS  71          1HD       LYS  71 -16.976  -0.159   8.188
  622   1HE   LYS  71          2HE       LYS  71 -16.290  -1.197  10.292
  623   2HE   LYS  71          1HE       LYS  71 -15.208  -1.654   8.988
  624   1HZ   LYS  71          1HZ       LYS  71 -13.626   0.045   9.803
  625   2HZ   LYS  71          2HZ       LYS  71 -13.949  -1.103  10.967
  626   3HZ   LYS  71          3HZ       LYS  71 -14.667   0.405  11.062
  627    H    ARG  72           H        ARG  72 -15.107  -0.367   3.520
  628    HA   ARG  72           HA       ARG  72 -16.743   2.017   3.352
  629   1HB   ARG  72          2HB       ARG  72 -15.062   0.637   1.244
  630   2HB   ARG  72          1HB       ARG  72 -15.826   2.208   1.053
  631   1HG   ARG  72          2HG       ARG  72 -14.463   3.087   2.898
  632   2HG   ARG  72          1HG       ARG  72 -13.691   1.513   3.062
  633   1HD   ARG  72          2HD       ARG  72 -13.589   3.285   0.620
  634   2HD   ARG  72          1HD       ARG  72 -12.299   3.094   1.807
  635    HE   ARG  72           HE       ARG  72 -13.171   0.648   0.553
  636   1HH1  ARG  72          1HH1      ARG  72 -10.993   3.401   0.249
  637   2HH1  ARG  72          2HH1      ARG  72  -9.836   2.603  -0.713
  638   1HH2  ARG  72          1HH2      ARG  72 -11.567  -0.498  -0.837
  639   2HH2  ARG  72          2HH2      ARG  72 -10.168   0.331  -1.315
  640    H    ARG  73           H        ARG  73 -17.329  -1.207   3.064
  641    HA   ARG  73           HA       ARG  73 -19.475  -0.843   1.125
  642   1HB   ARG  73          2HB       ARG  73 -17.587  -2.368   0.520
  643   2HB   ARG  73          1HB       ARG  73 -17.962  -3.347   1.916
  644   1HG   ARG  73          2HG       ARG  73 -19.859  -2.895  -0.362
  645   2HG   ARG  73          1HG       ARG  73 -18.685  -4.210  -0.329
  646   1HD   ARG  73          2HD       ARG  73 -19.732  -4.995   1.769
  647   2HD   ARG  73          1HD       ARG  73 -20.944  -3.722   1.594
  648    HE   ARG  73           HE       ARG  73 -21.369  -4.890  -0.658
  649   1HH1  ARG  73          1HH1      ARG  73 -20.426  -6.617   2.306
  650   2HH1  ARG  73          2HH1      ARG  73 -21.362  -7.984   1.966
  651   1HH2  ARG  73          1HH2      ARG  73 -22.577  -6.801  -1.145
  652   2HH2  ARG  73          2HH2      ARG  73 -22.586  -8.128  -0.064
  653    H    VAL  74           H        VAL  74 -18.600  -2.664   4.143
  654    HA   VAL  74           HA       VAL  74 -21.333  -2.278   5.052
  655    HB   VAL  74           HB       VAL  74 -21.071  -4.370   6.349
  656   1HG1  VAL  74          1HG1      VAL  74 -20.951  -4.719   3.360
  657   2HG1  VAL  74          2HG1      VAL  74 -22.399  -4.401   4.313
  658   3HG1  VAL  74          3HG1      VAL  74 -21.544  -5.929   4.493
  659   1HG2  VAL  74          1HG2      VAL  74 -18.661  -4.582   6.325
  660   2HG2  VAL  74          2HG2      VAL  74 -18.675  -4.849   4.581
  661   3HG2  VAL  74          3HG2      VAL  74 -19.400  -6.038   5.667
  662    H    TYR  75           H        TYR  75 -21.411  -2.564   7.468
  663    HA   TYR  75           HA       TYR  75 -19.010  -1.403   8.651
  664   1HB   TYR  75          2HB       TYR  75 -21.902  -0.889   9.374
  665   2HB   TYR  75          1HB       TYR  75 -20.522  -0.297  10.300
  666    HD1  TYR  75           1HD      TYR  75 -19.062   1.435   9.390
  667    HD2  TYR  75           2HD      TYR  75 -22.482   0.099   7.247
  668    HE1  TYR  75           1HE      TYR  75 -18.891   3.385   7.911
  669    HE2  TYR  75           2HE      TYR  75 -22.320   2.043   5.764
  670    HH   TYR  75           HH       TYR  75 -19.570   4.014   5.675
  671    H    GLU  76           H        GLU  76 -18.552  -1.990  10.797
  672    HA   GLU  76           HA       GLU  76 -19.763  -4.489  11.706
  673   1HB   GLU  76          2HB       GLU  76 -17.780  -4.980  10.223
  674   2HB   GLU  76          1HB       GLU  76 -16.769  -4.095  11.345
  675   1HG   GLU  76          2HG       GLU  76 -16.521  -6.422  11.775
  676   2HG   GLU  76          1HG       GLU  76 -17.455  -5.735  13.104
  677    H    GLU  77           H        GLU  77 -16.867  -2.925  12.551
  678    HA   GLU  77           HA       GLU  77 -17.993  -1.416  14.706
  679   1HB   GLU  77          2HB       GLU  77 -17.709  -3.736  15.681
  680   2HB   GLU  77          1HB       GLU  77 -15.986  -3.598  15.364
  681   1HG   GLU  77          2HG       GLU  77 -16.459  -3.095  17.687
  682   2HG   GLU  77          1HG       GLU  77 -15.878  -1.646  16.856
  Start of MODEL   11
    1    H    SER   1           H        SER   1  19.973  -1.628  -3.101
    2    HA   SER   1           HA       SER   1  17.275  -0.536  -2.892
    3   1HB   SER   1          2HB       SER   1  19.782   1.082  -3.355
    4   2HB   SER   1          1HB       SER   1  18.134   1.704  -3.426
    5    HG   SER   1           HG       SER   1  17.878   0.992  -1.271
    6    H    LYS   2           H        LYS   2  18.926  -2.500  -4.679
    7    HA   LYS   2           HA       LYS   2  18.933  -1.186  -7.187
    8   1HB   LYS   2          2HB       LYS   2  19.300  -4.082  -6.497
    9   2HB   LYS   2          1HB       LYS   2  19.261  -3.511  -8.159
   10   1HG   LYS   2          2HG       LYS   2  21.161  -2.053  -7.705
   11   2HG   LYS   2          1HG       LYS   2  21.220  -2.631  -6.044
   12   1HD   LYS   2          2HD       LYS   2  21.659  -4.884  -6.819
   13   2HD   LYS   2          1HD       LYS   2  21.527  -4.355  -8.500
   14   1HE   LYS   2          2HE       LYS   2  23.449  -2.882  -8.180
   15   2HE   LYS   2          1HE       LYS   2  23.564  -3.393  -6.498
   16   1HZ   LYS   2          1HZ       LYS   2  23.932  -5.125  -8.880
   17   2HZ   LYS   2          2HZ       LYS   2  23.966  -5.655  -7.293
   18   3HZ   LYS   2          3HZ       LYS   2  25.146  -4.595  -7.834
   19    H    CYS   3           H        CYS   3  16.444  -2.444  -5.423
   20    HA   CYS   3           HA       CYS   3  14.727  -2.941  -7.733
   21   1HB   CYS   3          2HB       CYS   3  14.372  -4.393  -5.829
   22   2HB   CYS   3          1HB       CYS   3  14.238  -3.013  -4.749
   23    H    LYS   4           H        LYS   4  15.822  -0.340  -5.926
   24    HA   LYS   4           HA       LYS   4  15.249   1.772  -5.565
   25   1HB   LYS   4          2HB       LYS   4  12.983   1.282  -7.535
   26   2HB   LYS   4          1HB       LYS   4  13.335   2.850  -6.827
   27   1HG   LYS   4          2HG       LYS   4  15.173   1.259  -8.612
   28   2HG   LYS   4          1HG       LYS   4  14.234   2.679  -9.083
   29   1HD   LYS   4          2HD       LYS   4  15.439   4.006  -7.403
   30   2HD   LYS   4          1HD       LYS   4  16.399   2.589  -6.986
   31   1HE   LYS   4          2HE       LYS   4  17.274   2.533  -9.266
   32   2HE   LYS   4          1HE       LYS   4  16.317   3.957  -9.664
   33   1HZ   LYS   4          1HZ       LYS   4  17.536   5.189  -7.986
   34   2HZ   LYS   4          2HZ       LYS   4  18.601   4.521  -9.129
   35   3HZ   LYS   4          3HZ       LYS   4  18.446   3.821  -7.609
   36    H    CYS   5           H        CYS   5  13.588   3.125  -4.495
   37    HA   CYS   5           HA       CYS   5  12.180   3.483  -2.786
   38   1HB   CYS   5          2HB       CYS   5  11.015   0.771  -3.478
   39   2HB   CYS   5          1HB       CYS   5  10.333   1.862  -2.280
   40    H    SER   6           H        SER   6  13.009   0.029  -2.559
   41    HA   SER   6           HA       SER   6  13.791  -1.282  -0.918
   42   1HB   SER   6          2HB       SER   6  15.006   1.271   0.210
   43   2HB   SER   6          1HB       SER   6  15.473  -0.377   0.641
   44    HG   SER   6           HG       SER   6  16.414  -0.645  -1.221
   45    H    ARG   7           H        ARG   7  13.369   1.542   1.077
   46    HA   ARG   7           HA       ARG   7  10.818   0.741   2.120
   47   1HB   ARG   7          2HB       ARG   7  11.568   0.641   4.473
   48   2HB   ARG   7          1HB       ARG   7  12.272  -0.653   3.515
   49   1HG   ARG   7          2HG       ARG   7  14.384   0.467   3.425
   50   2HG   ARG   7          1HG       ARG   7  13.703   1.913   4.167
   51   1HD   ARG   7          2HD       ARG   7  13.896  -0.792   5.481
   52   2HD   ARG   7          1HD       ARG   7  14.996   0.562   5.751
   53    HE   ARG   7           HE       ARG   7  12.237   1.214   6.202
   54   1HH1  ARG   7          1HH1      ARG   7  15.138  -0.129   7.716
   55   2HH1  ARG   7          2HH1      ARG   7  14.673   0.315   9.299
   56   1HH2  ARG   7          1HH2      ARG   7  11.626   1.829   8.350
   57   2HH2  ARG   7          2HH2      ARG   7  12.615   1.441   9.675
   58    H    LYS   8           H        LYS   8  12.649   2.970   0.863
   59    HA   LYS   8           HA       LYS   8  12.273   4.965   2.901
   60   1HB   LYS   8          2HB       LYS   8  14.535   4.763   1.936
   61   2HB   LYS   8          1HB       LYS   8  13.880   5.102   0.341
   62   1HG   LYS   8          2HG       LYS   8  14.955   7.070   1.329
   63   2HG   LYS   8          1HG       LYS   8  13.228   7.332   1.066
   64   1HD   LYS   8          2HD       LYS   8  12.786   6.856   3.418
   65   2HD   LYS   8          1HD       LYS   8  14.500   6.542   3.684
   66   1HE   LYS   8          2HE       LYS   8  15.014   8.843   3.131
   67   2HE   LYS   8          1HE       LYS   8  13.315   9.165   2.790
   68   1HZ   LYS   8          1HZ       LYS   8  12.793   8.679   5.078
   69   2HZ   LYS   8          2HZ       LYS   8  13.987   9.896   5.010
   70   3HZ   LYS   8          3HZ       LYS   8  14.407   8.314   5.407
   71    H    GLY   9           H        GLY   9  10.209   5.451   2.777
   72   1HA   GLY   9          2HA       GLY   9   9.429   7.197   0.698
   73   2HA   GLY   9          1HA       GLY   9   8.480   5.706   0.764
   74    HA   PRO  10           HA       PRO  10   7.176   8.665   4.227
   75   1HB   PRO  10          2HB       PRO  10   4.843   9.279   2.545
   76   2HB   PRO  10          1HB       PRO  10   5.896  10.383   3.436
   77   1HG   PRO  10          2HG       PRO  10   5.958  10.270   0.759
   78   2HG   PRO  10          1HG       PRO  10   7.431  10.525   1.718
   79   1HD   PRO  10          2HD       PRO  10   6.415   8.006   0.449
   80   2HD   PRO  10          1HD       PRO  10   8.062   8.676   0.471
   81    H    LYS  11           H        LYS  11   5.802   7.808   5.722
   82    HA   LYS  11           HA       LYS  11   4.701   5.276   5.179
   83   1HB   LYS  11          2HB       LYS  11   4.478   6.995   7.638
   84   2HB   LYS  11          1HB       LYS  11   3.877   5.349   7.508
   85   1HG   LYS  11          2HG       LYS  11   6.186   4.589   7.013
   86   2HG   LYS  11          1HG       LYS  11   6.750   6.239   7.287
   87   1HD   LYS  11          2HD       LYS  11   7.081   4.871   9.280
   88   2HD   LYS  11          1HD       LYS  11   5.886   6.133   9.585
   89   1HE   LYS  11          2HE       LYS  11   4.077   4.522   9.281
   90   2HE   LYS  11          1HE       LYS  11   5.238   3.263   8.880
   91   1HZ   LYS  11          1HZ       LYS  11   6.119   3.414  11.095
   92   2HZ   LYS  11          2HZ       LYS  11   4.449   3.138  11.158
   93   3HZ   LYS  11          3HZ       LYS  11   5.058   4.687  11.460
   94    H    ILE  12           H        ILE  12   2.572   4.605   5.584
   95    HA   ILE  12           HA       ILE  12   0.661   6.555   4.440
   96    HB   ILE  12           HB       ILE  12   0.623   3.587   4.009
   97   1HG1  ILE  12          2HG1      ILE  12   1.953   5.643   2.241
   98   2HG1  ILE  12          1HG1      ILE  12   2.794   4.444   3.217
   99   1HG2  ILE  12          1HG2      ILE  12  -0.482   5.930   2.451
  100   2HG2  ILE  12          2HG2      ILE  12  -1.411   4.886   3.531
  101   3HG2  ILE  12          3HG2      ILE  12  -0.707   4.228   2.053
  102   1HD1  ILE  12          1HD1      ILE  12   2.704   3.735   0.958
  103   2HD1  ILE  12          2HD1      ILE  12   0.957   3.953   0.913
  104   3HD1  ILE  12          3HD1      ILE  12   1.666   2.674   1.913
  105    H    ARG  13           H        ARG  13  -1.360   6.583   5.350
  106    HA   ARG  13           HA       ARG  13  -1.897   4.594   7.409
  107   1HB   ARG  13          2HB       ARG  13  -3.241   7.235   6.823
  108   2HB   ARG  13          1HB       ARG  13  -3.725   6.120   8.083
  109   1HG   ARG  13          2HG       ARG  13  -1.493   6.459   9.137
  110   2HG   ARG  13          1HG       ARG  13  -1.176   7.705   7.926
  111   1HD   ARG  13          2HD       ARG  13  -2.030   8.709   9.983
  112   2HD   ARG  13          1HD       ARG  13  -3.187   8.908   8.662
  113    HE   ARG  13           HE       ARG  13  -3.535   6.596  10.371
  114   1HH1  ARG  13          1HH1      ARG  13  -4.653   9.882   9.587
  115   2HH1  ARG  13          2HH1      ARG  13  -6.114   9.713  10.422
  116   1HH2  ARG  13          1HH2      ARG  13  -5.508   6.384  11.491
  117   2HH2  ARG  13          2HH2      ARG  13  -6.635   7.667  11.545
  118    H    TYR  14           H        TYR  14  -4.251   3.932   7.353
  119    HA   TYR  14           HA       TYR  14  -4.789   2.786   4.827
  120   1HB   TYR  14          2HB       TYR  14  -6.697   3.134   7.142
  121   2HB   TYR  14          1HB       TYR  14  -6.833   1.957   5.836
  122    HD1  TYR  14           1HD      TYR  14  -5.571   2.568   9.100
  123    HD2  TYR  14           2HD      TYR  14  -4.898   0.272   5.588
  124    HE1  TYR  14           1HE      TYR  14  -4.209   0.991  10.396
  125    HE2  TYR  14           2HE      TYR  14  -3.557  -1.295   6.849
  126    HH   TYR  14           HH       TYR  14  -2.210  -1.293   8.929
  127    H    SER  15           H        SER  15  -5.772   5.715   6.362
  128    HA   SER  15           HA       SER  15  -7.986   6.466   4.871
  129   1HB   SER  15          2HB       SER  15  -5.858   8.138   6.140
  130   2HB   SER  15          1HB       SER  15  -7.514   8.643   5.783
  131    HG   SER  15           HG       SER  15  -7.639   8.061   7.828
  132    H    ASP  16           H        ASP  16  -4.588   6.398   4.071
  133    HA   ASP  16           HA       ASP  16  -4.690   8.535   2.119
  134   1HB   ASP  16          2HB       ASP  16  -2.538   6.541   2.781
  135   2HB   ASP  16          1HB       ASP  16  -2.383   7.764   1.539
  136    H    VAL  17           H        VAL  17  -5.301   5.208   2.184
  137    HA   VAL  17           HA       VAL  17  -4.365   4.794  -0.555
  138    HB   VAL  17           HB       VAL  17  -5.795   2.742   1.086
  139   1HG1  VAL  17          1HG1      VAL  17  -5.579   2.089  -1.135
  140   2HG1  VAL  17          2HG1      VAL  17  -4.437   1.147  -0.192
  141   3HG1  VAL  17          3HG1      VAL  17  -3.877   2.500  -1.195
  142   1HG2  VAL  17          1HG2      VAL  17  -3.610   1.951   1.924
  143   2HG2  VAL  17          2HG2      VAL  17  -4.005   3.566   2.511
  144   3HG2  VAL  17          3HG2      VAL  17  -2.846   3.371   1.205
  145    H    LYS  18           H        LYS  18  -5.621   4.488  -2.319
  146    HA   LYS  18           HA       LYS  18  -8.577   4.578  -1.996
  147   1HB   LYS  18          2HB       LYS  18  -7.316   6.246  -3.636
  148   2HB   LYS  18          1HB       LYS  18  -7.090   4.820  -4.579
  149   1HG   LYS  18          2HG       LYS  18  -9.449   4.404  -4.801
  150   2HG   LYS  18          1HG       LYS  18  -9.822   5.793  -3.783
  151   1HD   LYS  18          2HD       LYS  18 -10.151   6.391  -6.092
  152   2HD   LYS  18          1HD       LYS  18  -8.742   7.252  -5.478
  153   1HE   LYS  18          2HE       LYS  18  -7.269   5.609  -6.547
  154   2HE   LYS  18          1HE       LYS  18  -8.681   4.727  -7.137
  155   1HZ   LYS  18          1HZ       LYS  18  -7.960   7.511  -7.831
  156   2HZ   LYS  18          2HZ       LYS  18  -9.295   6.690  -8.428
  157   3HZ   LYS  18          3HZ       LYS  18  -7.744   6.187  -8.844
  158    H    LYS  19           H        LYS  19  -5.831   2.951  -3.339
  159    HA   LYS  19           HA       LYS  19  -7.294   0.529  -3.773
  160   1HB   LYS  19          2HB       LYS  19  -7.594   1.812  -5.863
  161   2HB   LYS  19          1HB       LYS  19  -5.850   1.949  -6.014
  162   1HG   LYS  19          2HG       LYS  19  -5.660  -0.451  -6.230
  163   2HG   LYS  19          1HG       LYS  19  -7.404  -0.601  -5.998
  164   1HD   LYS  19          2HD       LYS  19  -7.757   0.770  -7.999
  165   2HD   LYS  19          1HD       LYS  19  -6.010   0.822  -8.255
  166   1HE   LYS  19          2HE       LYS  19  -5.964  -1.610  -8.478
  167   2HE   LYS  19          1HE       LYS  19  -7.699  -1.674  -8.192
  168   1HZ   LYS  19          1HZ       LYS  19  -7.163  -1.811 -10.526
  169   2HZ   LYS  19          2HZ       LYS  19  -6.382  -0.318 -10.468
  170   3HZ   LYS  19          3HZ       LYS  19  -8.048  -0.409 -10.198
  171    H    LEU  20           H        LEU  20  -5.933  -1.204  -3.744
  172    HA   LEU  20           HA       LEU  20  -3.138  -0.662  -3.015
  173   1HB   LEU  20          2HB       LEU  20  -4.739  -1.379  -1.215
  174   2HB   LEU  20          1HB       LEU  20  -5.064  -2.824  -2.123
  175    HG   LEU  20           HG       LEU  20  -2.401  -2.140  -0.856
  176   1HD1  LEU  20          1HD1      LEU  20  -3.055  -3.779   0.851
  177   2HD1  LEU  20          2HD1      LEU  20  -4.619  -3.971   0.070
  178   3HD1  LEU  20          3HD1      LEU  20  -4.192  -2.436   0.805
  179   1HD2  LEU  20          1HD2      LEU  20  -1.883  -4.522  -1.231
  180   2HD2  LEU  20          2HD2      LEU  20  -2.227  -3.716  -2.761
  181   3HD2  LEU  20          3HD2      LEU  20  -3.450  -4.739  -2.014
  182    H    GLU  21           H        GLU  21  -1.707  -1.555  -4.564
  183    HA   GLU  21           HA       GLU  21  -2.819  -3.687  -6.205
  184   1HB   GLU  21          2HB       GLU  21  -1.198  -1.289  -6.988
  185   2HB   GLU  21          1HB       GLU  21  -1.301  -2.720  -8.002
  186   1HG   GLU  21          2HG       GLU  21  -3.665  -1.201  -7.021
  187   2HG   GLU  21          1HG       GLU  21  -2.867  -0.860  -8.573
  188    H    MET  22           H        MET  22  -1.593  -5.432  -6.378
  189    HA   MET  22           HA       MET  22   1.109  -5.162  -5.340
  190   1HB   MET  22          2HB       MET  22  -0.646  -7.588  -5.534
  191   2HB   MET  22          1HB       MET  22   1.063  -7.657  -5.146
  192   1HG   MET  22          2HG       MET  22   0.622  -6.208  -3.188
  193   2HG   MET  22          1HG       MET  22  -1.098  -6.287  -3.566
  194   1HE   MET  22          1HE       MET  22   0.144  -7.063  -0.746
  195   2HE   MET  22          2HE       MET  22  -0.774  -8.521  -0.375
  196   3HE   MET  22          3HE       MET  22  -1.579  -7.133  -1.112
  197    H    LYS  23           H        LYS  23   2.514  -4.894  -6.779
  198    HA   LYS  23           HA       LYS  23   2.960  -6.799  -8.720
  199   1HB   LYS  23          2HB       LYS  23   2.973  -5.282 -10.757
  200   2HB   LYS  23          1HB       LYS  23   1.383  -5.670 -10.163
  201   1HG   LYS  23          2HG       LYS  23   1.314  -3.411 -10.849
  202   2HG   LYS  23          1HG       LYS  23   1.374  -3.362  -9.094
  203   1HD   LYS  23          2HD       LYS  23   3.737  -2.802  -9.166
  204   2HD   LYS  23          1HD       LYS  23   3.748  -2.992 -10.920
  205   1HE   LYS  23          2HE       LYS  23   2.107  -0.923  -9.422
  206   2HE   LYS  23          1HE       LYS  23   3.642  -0.614 -10.224
  207   1HZ   LYS  23          1HZ       LYS  23   1.770   0.034 -11.585
  208   2HZ   LYS  23          2HZ       LYS  23   1.125  -1.510 -11.546
  209   3HZ   LYS  23          3HZ       LYS  23   2.590  -1.224 -12.326
  210    HA   PRO  24           HA       PRO  24   6.932  -5.973  -7.436
  211   1HB   PRO  24          2HB       PRO  24   8.409  -6.434  -9.688
  212   2HB   PRO  24          1HB       PRO  24   7.764  -7.687  -8.623
  213   1HG   PRO  24          2HG       PRO  24   6.669  -6.634 -11.201
  214   2HG   PRO  24          1HG       PRO  24   6.766  -8.309 -10.629
  215   1HD   PRO  24          2HD       PRO  24   4.467  -6.964 -10.532
  216   2HD   PRO  24          1HD       PRO  24   4.947  -8.073  -9.232
  217    H    LYS  25           H        LYS  25   5.657  -4.074  -9.919
  218    HA   LYS  25           HA       LYS  25   6.008  -1.936 -10.645
  219   1HB   LYS  25          2HB       LYS  25   6.472  -1.482  -8.241
  220   2HB   LYS  25          1HB       LYS  25   8.171  -1.776  -8.556
  221   1HG   LYS  25          2HG       LYS  25   8.299   0.134  -9.991
  222   2HG   LYS  25          1HG       LYS  25   6.547   0.370  -9.900
  223   1HD   LYS  25          2HD       LYS  25   6.653   0.671  -7.608
  224   2HD   LYS  25          1HD       LYS  25   8.407   0.423  -7.559
  225   1HE   LYS  25          2HE       LYS  25   8.033   2.825  -7.477
  226   2HE   LYS  25          1HE       LYS  25   8.612   2.403  -9.091
  227   1HZ   LYS  25          1HZ       LYS  25   6.316   2.530  -9.899
  228   2HZ   LYS  25          2HZ       LYS  25   6.800   3.966  -9.233
  229   3HZ   LYS  25          3HZ       LYS  25   5.746   2.974  -8.380
  230    H    TYR  26           H        TYR  26   9.055  -3.586  -9.907
  231    HA   TYR  26           HA       TYR  26   9.862  -3.274 -12.685
  232   1HB   TYR  26          2HB       TYR  26  11.512  -2.906 -10.183
  233   2HB   TYR  26          1HB       TYR  26  12.245  -3.262 -11.732
  234    HD1  TYR  26           1HD      TYR  26  12.253  -1.691 -13.471
  235    HD2  TYR  26           2HD      TYR  26  10.498  -0.739  -9.740
  236    HE1  TYR  26           1HE      TYR  26  12.249   0.722 -14.094
  237    HE2  TYR  26           2HE      TYR  26  10.492   1.650 -10.318
  238    HH   TYR  26           HH       TYR  26  11.688   3.138 -11.788
  239    HA   PRO  27           HA       PRO  27  10.076  -7.725 -12.484
  240   1HB   PRO  27          2HB       PRO  27  11.910  -8.171 -14.460
  241   2HB   PRO  27          1HB       PRO  27  10.231  -7.725 -14.794
  242   1HG   PRO  27          2HG       PRO  27  12.667  -5.984 -14.701
  243   2HG   PRO  27          1HG       PRO  27  11.374  -6.031 -15.911
  244   1HD   PRO  27          2HD       PRO  27  11.417  -4.150 -14.017
  245   2HD   PRO  27          1HD       PRO  27   9.883  -4.881 -14.543
  246    H    HIS  28           H        HIS  28  12.747  -5.698 -12.094
  247    HA   HIS  28           HA       HIS  28  14.561  -7.794 -11.210
  248   1HB   HIS  28          2HB       HIS  28  16.238  -5.956 -10.901
  249   2HB   HIS  28          1HB       HIS  28  15.601  -6.051 -12.533
  250    HD1  HIS  28           1HD      HIS  28  15.669  -3.853  -9.481
  251    HD2  HIS  28           2HD      HIS  28  14.153  -3.648 -13.369
  252    HE1  HIS  28           1HE      HIS  28  15.014  -1.495  -9.889
  253    HE2  HIS  28           2HE      HIS  28  14.621  -1.418 -12.340
  254    H    CYS  29           H        CYS  29  12.052  -7.022  -9.751
  255    HA   CYS  29           HA       CYS  29  13.203  -6.565  -7.092
  256   1HB   CYS  29          2HB       CYS  29  10.554  -5.934  -8.334
  257   2HB   CYS  29          1HB       CYS  29  10.765  -5.774  -6.616
  258    H    GLU  30           H        GLU  30  12.295  -7.996  -5.331
  259    HA   GLU  30           HA       GLU  30  11.526 -10.469  -6.469
  260   1HB   GLU  30          2HB       GLU  30  11.728 -10.861  -3.753
  261   2HB   GLU  30          1HB       GLU  30  12.928 -11.242  -4.977
  262   1HG   GLU  30          2HG       GLU  30  13.835 -10.148  -3.195
  263   2HG   GLU  30          1HG       GLU  30  13.926  -9.127  -4.614
  264    H    GLU  31           H        GLU  31   9.616 -11.457  -6.317
  265    HA   GLU  31           HA       GLU  31   7.443 -11.873  -5.879
  266   1HB   GLU  31          2HB       GLU  31   8.280 -12.050  -3.577
  267   2HB   GLU  31          1HB       GLU  31   8.106 -10.328  -3.363
  268   1HG   GLU  31          2HG       GLU  31   5.684 -10.599  -3.397
  269   2HG   GLU  31          1HG       GLU  31   5.883 -12.337  -3.664
  270    H    LYS  32           H        LYS  32   5.285 -10.541  -5.162
  271    HA   LYS  32           HA       LYS  32   5.253  -8.245  -6.882
  272   1HB   LYS  32          2HB       LYS  32   3.140  -9.955  -5.641
  273   2HB   LYS  32          1HB       LYS  32   2.706  -8.355  -6.248
  274   1HG   LYS  32          2HG       LYS  32   2.244 -10.194  -7.843
  275   2HG   LYS  32          1HG       LYS  32   3.361  -8.989  -8.467
  276   1HD   LYS  32          2HD       LYS  32   5.215 -10.407  -7.953
  277   2HD   LYS  32          1HD       LYS  32   4.140 -11.645  -7.290
  278   1HE   LYS  32          2HE       LYS  32   3.074 -11.902  -9.503
  279   2HE   LYS  32          1HE       LYS  32   4.122 -10.645 -10.155
  280   1HZ   LYS  32          1HZ       LYS  32   6.030 -12.083  -9.786
  281   2HZ   LYS  32          2HZ       LYS  32   4.895 -12.903 -10.714
  282   3HZ   LYS  32          3HZ       LYS  32   5.056 -13.258  -9.081
  283    H    MET  33           H        MET  33   5.857  -6.456  -6.131
  284    HA   MET  33           HA       MET  33   6.056  -5.681  -3.482
  285   1HB   MET  33          2HB       MET  33   6.089  -4.181  -6.069
  286   2HB   MET  33          1HB       MET  33   6.518  -3.459  -4.535
  287   1HG   MET  33          2HG       MET  33   7.908  -5.885  -5.670
  288   2HG   MET  33          1HG       MET  33   8.466  -4.232  -5.935
  289   1HE   MET  33          1HE       MET  33   9.300  -2.708  -4.180
  290   2HE   MET  33          2HE       MET  33   9.366  -3.031  -2.434
  291   3HE   MET  33          3HE       MET  33   7.803  -2.912  -3.269
  292    H    VAL  34           H        VAL  34   5.045  -3.800  -2.544
  293    HA   VAL  34           HA       VAL  34   2.179  -3.878  -2.989
  294    HB   VAL  34           HB       VAL  34   3.819  -2.832  -0.678
  295   1HG1  VAL  34          1HG1      VAL  34   1.732  -1.549  -0.980
  296   2HG1  VAL  34          2HG1      VAL  34   1.692  -2.521   0.492
  297   3HG1  VAL  34          3HG1      VAL  34   0.812  -3.054  -0.941
  298   1HG2  VAL  34          1HG2      VAL  34   2.836  -4.721   0.554
  299   2HG2  VAL  34          2HG2      VAL  34   3.805  -5.254  -0.818
  300   3HG2  VAL  34          3HG2      VAL  34   2.043  -5.260  -0.925
  301    H    ILE  35           H        ILE  35   1.374  -2.378  -4.219
  302    HA   ILE  35           HA       ILE  35   2.699   0.222  -4.441
  303    HB   ILE  35           HB       ILE  35   0.638  -1.045  -6.231
  304   1HG1  ILE  35          2HG1      ILE  35   2.594  -2.395  -6.122
  305   2HG1  ILE  35          1HG1      ILE  35   2.416  -1.710  -7.722
  306   1HG2  ILE  35          1HG2      ILE  35   1.410   0.631  -7.869
  307   2HG2  ILE  35          2HG2      ILE  35   2.511   1.284  -6.651
  308   3HG2  ILE  35          3HG2      ILE  35   0.765   1.365  -6.397
  309   1HD1  ILE  35          1HD1      ILE  35   4.170  -0.018  -7.134
  310   2HD1  ILE  35          2HD1      ILE  35   4.765  -1.676  -7.064
  311   3HD1  ILE  35          3HD1      ILE  35   4.374  -0.815  -5.573
  312    H    ILE  36           H        ILE  36   1.679   1.719  -3.354
  313    HA   ILE  36           HA       ILE  36  -1.158   1.300  -2.756
  314    HB   ILE  36           HB       ILE  36   0.913   2.921  -1.289
  315   1HG1  ILE  36          2HG1      ILE  36   1.024   0.489  -0.980
  316   2HG1  ILE  36          1HG1      ILE  36   0.579   1.308   0.520
  317   1HG2  ILE  36          1HG2      ILE  36  -1.191   4.109  -1.204
  318   2HG2  ILE  36          2HG2      ILE  36  -0.865   3.362   0.367
  319   3HG2  ILE  36          3HG2      ILE  36  -2.019   2.627  -0.730
  320   1HD1  ILE  36          1HD1      ILE  36  -1.226  -0.195  -1.368
  321   2HD1  ILE  36          2HD1      ILE  36  -1.763   0.671   0.078
  322   3HD1  ILE  36          3HD1      ILE  36  -0.693  -0.722   0.227
  323    H    THR  37           H        THR  37  -2.483   2.393  -3.956
  324    HA   THR  37           HA       THR  37  -1.603   4.857  -5.241
  325    HB   THR  37           HB       THR  37  -4.161   3.239  -5.579
  326    HG1  THR  37           1HG      THR  37  -1.743   2.546  -6.170
  327   1HG2  THR  37          1HG2      THR  37  -2.818   5.299  -7.347
  328   2HG2  THR  37          2HG2      THR  37  -4.276   5.560  -6.381
  329   3HG2  THR  37          3HG2      THR  37  -4.305   4.416  -7.727
  330    H    THR  38           H        THR  38  -2.436   6.830  -4.514
  331    HA   THR  38           HA       THR  38  -3.745   6.559  -2.004
  332    HB   THR  38           HB       THR  38  -3.350   9.051  -1.766
  333    HG1  THR  38           1HG      THR  38  -1.602   8.730  -4.005
  334   1HG2  THR  38          1HG2      THR  38  -0.924   8.722  -1.356
  335   2HG2  THR  38          2HG2      THR  38  -0.994   7.222  -2.278
  336   3HG2  THR  38          3HG2      THR  38  -1.876   7.365  -0.767
  337    H    LYS  39           H        LYS  39  -5.348   8.050  -1.244
  338    HA   LYS  39           HA       LYS  39  -7.834   7.387  -2.330
  339   1HB   LYS  39          2HB       LYS  39  -7.076   8.036   0.045
  340   2HB   LYS  39          1HB       LYS  39  -7.298   9.690  -0.466
  341   1HG   LYS  39          2HG       LYS  39  -9.465   7.586  -0.401
  342   2HG   LYS  39          1HG       LYS  39  -9.169   8.762   0.865
  343   1HD   LYS  39          2HD       LYS  39  -9.679  10.563  -0.753
  344   2HD   LYS  39          1HD       LYS  39 -10.034   9.333  -1.972
  345   1HE   LYS  39          2HE       LYS  39 -11.793   8.416  -0.530
  346   2HE   LYS  39          1HE       LYS  39 -11.436   9.644   0.678
  347   1HZ   LYS  39          1HZ       LYS  39 -13.331  10.258  -0.648
  348   2HZ   LYS  39          2HZ       LYS  39 -12.434  10.133  -2.061
  349   3HZ   LYS  39          3HZ       LYS  39 -12.083  11.333  -0.923
  350    H    SER  40           H        SER  40  -6.195  10.500  -2.278
  351    HA   SER  40           HA       SER  40  -6.539  11.443  -4.785
  352   1HB   SER  40          2HB       SER  40  -8.875  12.386  -3.049
  353   2HB   SER  40          1HB       SER  40  -8.357  13.240  -4.498
  354    HG   SER  40           HG       SER  40  -9.033  10.516  -4.535
  355    H    VAL  41           H        VAL  41  -7.438  13.058  -1.731
  356    HA   VAL  41           HA       VAL  41  -5.355  14.935  -2.222
  357    HB   VAL  41           HB       VAL  41  -6.211  16.139  -0.172
  358   1HG1  VAL  41          1HG1      VAL  41  -6.952  16.728  -2.415
  359   2HG1  VAL  41          2HG1      VAL  41  -8.274  16.904  -1.263
  360   3HG1  VAL  41          3HG1      VAL  41  -8.217  15.501  -2.335
  361   1HG2  VAL  41          1HG2      VAL  41  -8.401  15.464   0.734
  362   2HG2  VAL  41          2HG2      VAL  41  -7.192  14.207   1.010
  363   3HG2  VAL  41          3HG2      VAL  41  -8.378  14.021  -0.281
  364    H    SER  42           H        SER  42  -3.587  13.751  -2.052
  365    HA   SER  42           HA       SER  42  -2.622  13.384   0.689
  366   1HB   SER  42          2HB       SER  42  -1.146  11.588  -0.230
  367   2HB   SER  42          1HB       SER  42  -2.857  11.177  -0.400
  368    HG   SER  42           HG       SER  42  -2.211  10.811  -2.398
  369    H    ARG  43           H        ARG  43  -0.018  13.595   0.512
  370    HA   ARG  43           HA       ARG  43   0.358  15.963  -1.011
  371   1HB   ARG  43          2HB       ARG  43   2.778  15.948  -0.285
  372   2HB   ARG  43          1HB       ARG  43   1.617  15.982   1.014
  373   1HG   ARG  43          2HG       ARG  43   3.490  14.580   1.596
  374   2HG   ARG  43          1HG       ARG  43   2.054  13.591   1.427
  375   1HD   ARG  43          2HD       ARG  43   4.096  12.566   0.459
  376   2HD   ARG  43          1HD       ARG  43   2.799  12.782  -0.707
  377    HE   ARG  43           HE       ARG  43   4.078  14.843  -1.415
  378   1HH1  ARG  43          1HH1      ARG  43   5.840  12.140   0.084
  379   2HH1  ARG  43          2HH1      ARG  43   7.236  12.383  -0.866
  380   1HH2  ARG  43          1HH2      ARG  43   5.959  15.096  -2.704
  381   2HH2  ARG  43          2HH2      ARG  43   7.306  14.068  -2.474
  382    H    TYR  44           H        TYR  44   0.337  12.881  -1.921
  383    HA   TYR  44           HA       TYR  44   2.130  13.195  -4.199
  384   1HB   TYR  44          2HB       TYR  44   0.464  10.962  -3.120
  385   2HB   TYR  44          1HB       TYR  44   1.027  10.864  -4.767
  386    HD1  TYR  44           1HD      TYR  44   2.018  10.863  -1.227
  387    HD2  TYR  44           2HD      TYR  44   3.344  10.425  -5.238
  388    HE1  TYR  44           1HE      TYR  44   4.118   9.891  -0.430
  389    HE2  TYR  44           2HE      TYR  44   5.456   9.450  -4.441
  390    HH   TYR  44           HH       TYR  44   6.813   9.407  -2.454
  391    H    ARG  45           H        ARG  45  -1.310  12.648  -3.548
  392    HA   ARG  45           HA       ARG  45  -3.189  13.044  -4.637
  393   1HB   ARG  45          2HB       ARG  45  -1.576  15.098  -6.146
  394   2HB   ARG  45          1HB       ARG  45  -3.317  14.910  -6.311
  395   1HG   ARG  45          2HG       ARG  45  -3.614  15.441  -3.965
  396   2HG   ARG  45          1HG       ARG  45  -1.865  15.565  -3.761
  397   1HD   ARG  45          2HD       ARG  45  -3.521  17.253  -5.606
  398   2HD   ARG  45          1HD       ARG  45  -2.978  17.760  -4.002
  399    HE   ARG  45           HE       ARG  45  -0.728  16.992  -5.426
  400   1HH1  ARG  45          1HH1      ARG  45  -3.227  19.495  -5.649
  401   2HH1  ARG  45          2HH1      ARG  45  -2.213  20.607  -6.444
  402   1HH2  ARG  45          1HH2      ARG  45   0.654  18.558  -6.522
  403   2HH2  ARG  45          2HH2      ARG  45  -0.009  20.066  -6.945
  404    H    GLY  46           H        GLY  46  -3.239  10.975  -5.371
  405   1HA   GLY  46          2HA       GLY  46  -3.947   9.566  -7.067
  406   2HA   GLY  46          1HA       GLY  46  -3.506  10.794  -8.241
  407    H    GLN  47           H        GLN  47  -0.903  10.490  -6.374
  408    HA   GLN  47           HA       GLN  47   0.304   8.527  -8.144
  409   1HB   GLN  47          2HB       GLN  47   1.535  10.761  -6.535
  410   2HB   GLN  47          1HB       GLN  47   2.521   9.406  -7.061
  411   1HG   GLN  47          2HG       GLN  47   2.719  11.350  -8.520
  412   2HG   GLN  47          1HG       GLN  47   2.047   9.971  -9.372
  413   1HE2  GLN  47          1HE2      GLN  47   1.433  13.122  -8.106
  414   2HE2  GLN  47          2HE2      GLN  47  -0.076  13.375  -8.902
  415    H    GLU  48           H        GLU  48   1.869   7.031  -7.279
  416    HA   GLU  48           HA       GLU  48   0.651   5.878  -4.975
  417   1HB   GLU  48          2HB       GLU  48   1.801   3.753  -5.832
  418   2HB   GLU  48          1HB       GLU  48   0.317   4.352  -6.538
  419   1HG   GLU  48          2HG       GLU  48   1.647   3.596  -8.171
  420   2HG   GLU  48          1HG       GLU  48   1.623   5.333  -8.366
  421    H    HIS  49           H        HIS  49   1.724   4.707  -3.449
  422    HA   HIS  49           HA       HIS  49   4.495   5.578  -2.857
  423   1HB   HIS  49          2HB       HIS  49   2.426   4.257  -1.068
  424   2HB   HIS  49          1HB       HIS  49   4.077   4.564  -0.588
  425    HD1  HIS  49           1HD      HIS  49   4.182   6.514   1.022
  426    HD2  HIS  49           2HD      HIS  49   1.084   6.918  -1.751
  427    HE1  HIS  49           1HE      HIS  49   2.959   8.574   1.675
  428    HE2  HIS  49           2HE      HIS  49   0.936   8.582   0.258
  429    H    CYS  50           H        CYS  50   5.980   3.831  -2.198
  430    HA   CYS  50           HA       CYS  50   5.073   1.256  -3.205
  431   1HB   CYS  50          2HB       CYS  50   7.524   0.950  -3.839
  432   2HB   CYS  50          1HB       CYS  50   6.571   2.067  -4.815
  433    H    LEU  51           H        LEU  51   5.133  -0.351  -1.836
  434    HA   LEU  51           HA       LEU  51   6.841  -0.123   0.521
  435   1HB   LEU  51          2HB       LEU  51   4.047  -1.166   0.276
  436   2HB   LEU  51          1HB       LEU  51   5.090  -1.679   1.592
  437    HG   LEU  51           HG       LEU  51   4.451   1.163   0.989
  438   1HD1  LEU  51          1HD1      LEU  51   2.812   0.974   2.886
  439   2HD1  LEU  51          2HD1      LEU  51   3.170  -0.747   2.998
  440   3HD1  LEU  51          3HD1      LEU  51   2.365  -0.104   1.565
  441   1HD2  LEU  51          1HD2      LEU  51   6.451   0.813   2.335
  442   2HD2  LEU  51          2HD2      LEU  51   5.514  -0.196   3.448
  443   3HD2  LEU  51          3HD2      LEU  51   5.165   1.524   3.314
  444    H    HIS  52           H        HIS  52   7.820  -1.797   1.191
  445    HA   HIS  52           HA       HIS  52   8.208  -3.912  -0.809
  446   1HB   HIS  52          2HB       HIS  52  10.194  -2.553  -0.140
  447   2HB   HIS  52          1HB       HIS  52  10.018  -3.158   1.501
  448    HD1  HIS  52           1HD      HIS  52  11.525  -5.049   2.002
  449    HD2  HIS  52           2HD      HIS  52  10.656  -4.823  -2.051
  450    HE1  HIS  52           1HE      HIS  52  12.781  -6.916   0.949
  451    HE2  HIS  52           2HE      HIS  52  12.142  -6.846  -1.499
  452    HA   PRO  53           HA       PRO  53   5.556  -6.281   1.908
  453   1HB   PRO  53          2HB       PRO  53   5.692  -8.582   0.510
  454   2HB   PRO  53          1HB       PRO  53   4.636  -7.222   0.065
  455   1HG   PRO  53          2HG       PRO  53   7.308  -8.031  -1.024
  456   2HG   PRO  53          1HG       PRO  53   5.886  -7.432  -1.896
  457   1HD   PRO  53          2HD       PRO  53   7.985  -5.867  -1.366
  458   2HD   PRO  53          1HD       PRO  53   6.325  -5.231  -1.352
  459    H    LYS  54           H        LYS  54   8.728  -6.590   1.988
  460    HA   LYS  54           HA       LYS  54   8.819  -9.186   3.162
  461   1HB   LYS  54          2HB       LYS  54  10.894  -7.183   2.514
  462   2HB   LYS  54          1HB       LYS  54  11.273  -8.401   3.730
  463   1HG   LYS  54          2HG       LYS  54  11.965  -9.056   1.463
  464   2HG   LYS  54          1HG       LYS  54  10.817 -10.178   2.173
  465   1HD   LYS  54          2HD       LYS  54   9.009  -8.999   0.873
  466   2HD   LYS  54          1HD       LYS  54  10.280  -8.068   0.079
  467   1HE   LYS  54          2HE       LYS  54  11.246 -10.044  -0.837
  468   2HE   LYS  54          1HE       LYS  54  10.077 -11.028   0.139
  469   1HZ   LYS  54          1HZ       LYS  54   9.518 -10.891  -2.144
  470   2HZ   LYS  54          2HZ       LYS  54   9.513  -9.217  -2.158
  471   3HZ   LYS  54          3HZ       LYS  54   8.327 -10.090  -1.275
  472    H    LEU  55           H        LEU  55   8.092  -6.083   4.238
  473    HA   LEU  55           HA       LEU  55   8.980  -6.436   6.979
  474   1HB   LEU  55          2HB       LEU  55   7.325  -4.254   5.702
  475   2HB   LEU  55          1HB       LEU  55   7.954  -4.228   7.332
  476    HG   LEU  55           HG       LEU  55   9.620  -4.173   4.813
  477   1HD1  LEU  55          1HD1      LEU  55  10.120  -1.868   5.469
  478   2HD1  LEU  55          2HD1      LEU  55   9.002  -2.009   6.822
  479   3HD1  LEU  55          3HD1      LEU  55   8.397  -2.102   5.169
  480   1HD2  LEU  55          1HD2      LEU  55  10.433  -3.933   7.714
  481   2HD2  LEU  55          2HD2      LEU  55  11.497  -3.714   6.326
  482   3HD2  LEU  55          3HD2      LEU  55  10.788  -5.294   6.652
  483    H    GLN  56           H        GLN  56   7.675  -7.001   8.643
  484    HA   GLN  56           HA       GLN  56   5.280  -8.384   8.059
  485   1HB   GLN  56          2HB       GLN  56   6.556  -7.683  10.700
  486   2HB   GLN  56          1HB       GLN  56   5.073  -8.611  10.575
  487   1HG   GLN  56          2HG       GLN  56   6.922 -10.119  10.905
  488   2HG   GLN  56          1HG       GLN  56   6.288 -10.330   9.283
  489   1HE2  GLN  56          1HE2      GLN  56   8.158 -11.248   8.549
  490   2HE2  GLN  56          2HE2      GLN  56   9.618 -10.372   8.283
  491    H    SER  57           H        SER  57   5.896  -5.153   9.106
  492    HA   SER  57           HA       SER  57   3.333  -4.556  10.075
  493   1HB   SER  57          2HB       SER  57   4.069  -2.166   9.562
  494   2HB   SER  57          1HB       SER  57   5.105  -3.097  10.649
  495    HG   SER  57           HG       SER  57   5.563  -2.249   8.026
  496    H    THR  58           H        THR  58   4.689  -4.719   6.876
  497    HA   THR  58           HA       THR  58   2.695  -3.313   5.487
  498    HB   THR  58           HB       THR  58   4.442  -5.586   4.510
  499    HG1  THR  58           1HG      THR  58   4.974  -2.936   5.223
  500   1HG2  THR  58          1HG2      THR  58   2.659  -4.880   2.951
  501   2HG2  THR  58          2HG2      THR  58   4.255  -4.429   2.345
  502   3HG2  THR  58          3HG2      THR  58   3.212  -3.212   3.084
  503    H    LYS  59           H        LYS  59   2.973  -6.675   6.593
  504    HA   LYS  59           HA       LYS  59   0.726  -7.620   5.136
  505   1HB   LYS  59          2HB       LYS  59   2.030  -8.724   7.611
  506   2HB   LYS  59          1HB       LYS  59   0.632  -9.477   6.849
  507   1HG   LYS  59          2HG       LYS  59   2.529 -10.639   6.094
  508   2HG   LYS  59          1HG       LYS  59   1.997  -9.628   4.761
  509   1HD   LYS  59          2HD       LYS  59   3.726  -7.961   5.365
  510   2HD   LYS  59          1HD       LYS  59   4.258  -9.062   6.641
  511   1HE   LYS  59          2HE       LYS  59   4.261  -9.660   3.693
  512   2HE   LYS  59          1HE       LYS  59   5.666  -9.209   4.646
  513   1HZ   LYS  59          1HZ       LYS  59   5.608 -11.556   4.358
  514   2HZ   LYS  59          2HZ       LYS  59   4.059 -11.696   4.964
  515   3HZ   LYS  59          3HZ       LYS  59   5.345 -11.242   5.961
  516    H    ARG  60           H        ARG  60   0.891  -6.291   8.449
  517    HA   ARG  60           HA       ARG  60  -1.857  -6.570   8.798
  518   1HB   ARG  60          2HB       ARG  60   0.190  -4.834  10.054
  519   2HB   ARG  60          1HB       ARG  60  -1.492  -4.399  10.251
  520   1HG   ARG  60          2HG       ARG  60  -0.984  -5.650  12.137
  521   2HG   ARG  60          1HG       ARG  60  -1.863  -6.708  11.087
  522   1HD   ARG  60          2HD       ARG  60   0.169  -7.762  10.266
  523   2HD   ARG  60          1HD       ARG  60   1.145  -6.728  11.308
  524    HE   ARG  60           HE       ARG  60  -0.823  -8.082  12.788
  525   1HH1  ARG  60          1HH1      ARG  60   2.356  -8.564  11.324
  526   2HH1  ARG  60          2HH1      ARG  60   2.755  -9.927  12.269
  527   1HH2  ARG  60          1HH2      ARG  60  -0.281  -9.942  14.092
  528   2HH2  ARG  60          2HH2      ARG  60   1.203 -10.742  13.881
  529    H    PHE  61           H        PHE  61   0.083  -4.013   7.427
  530    HA   PHE  61           HA       PHE  61  -1.891  -2.130   7.126
  531   1HB   PHE  61          2HB       PHE  61   0.560  -1.822   6.731
  532   2HB   PHE  61          1HB       PHE  61   0.318  -2.675   5.207
  533    HD1  PHE  61           1HD      PHE  61  -0.144  -1.447   3.272
  534    HD2  PHE  61           2HD      PHE  61  -0.924   0.291   7.074
  535    HE1  PHE  61           1HE      PHE  61  -0.704   0.691   2.190
  536    HE2  PHE  61           2HE      PHE  61  -1.473   2.421   6.002
  537    HZ   PHE  61           HZ       PHE  61  -1.364   2.637   3.575
  538    H    ILE  62           H        ILE  62  -1.055  -4.882   5.025
  539    HA   ILE  62           HA       ILE  62  -2.829  -4.098   2.926
  540    HB   ILE  62           HB       ILE  62  -1.614  -6.793   3.537
  541   1HG1  ILE  62          2HG1      ILE  62   0.154  -5.226   3.184
  542   2HG1  ILE  62          1HG1      ILE  62  -0.010  -6.173   1.709
  543   1HG2  ILE  62          1HG2      ILE  62  -3.550  -6.985   2.125
  544   2HG2  ILE  62          2HG2      ILE  62  -2.082  -7.354   1.215
  545   3HG2  ILE  62          3HG2      ILE  62  -2.893  -5.800   0.996
  546   1HD1  ILE  62          1HD1      ILE  62  -1.124  -3.433   2.164
  547   2HD1  ILE  62          2HD1      ILE  62  -1.178  -4.354   0.650
  548   3HD1  ILE  62          3HD1      ILE  62   0.369  -3.798   1.300
  549    H    LYS  63           H        LYS  63  -2.904  -6.454   5.449
  550    HA   LYS  63           HA       LYS  63  -5.401  -7.513   4.665
  551   1HB   LYS  63          2HB       LYS  63  -3.923  -7.804   7.245
  552   2HB   LYS  63          1HB       LYS  63  -5.303  -8.799   6.743
  553   1HG   LYS  63          2HG       LYS  63  -4.174  -9.573   4.840
  554   2HG   LYS  63          1HG       LYS  63  -2.876  -8.419   5.085
  555   1HD   LYS  63          2HD       LYS  63  -2.362  -9.607   7.210
  556   2HD   LYS  63          1HD       LYS  63  -3.534 -10.841   6.702
  557   1HE   LYS  63          2HE       LYS  63  -1.395  -9.798   5.034
  558   2HE   LYS  63          1HE       LYS  63  -1.118 -11.269   6.015
  559   1HZ   LYS  63          1HZ       LYS  63  -3.080 -12.202   4.723
  560   2HZ   LYS  63          2HZ       LYS  63  -1.738 -11.903   3.752
  561   3HZ   LYS  63          3HZ       LYS  63  -3.047 -10.852   3.745
  562    H    TRP  64           H        TRP  64  -4.455  -5.042   6.859
  563    HA   TRP  64           HA       TRP  64  -7.001  -4.771   8.139
  564   1HB   TRP  64          2HB       TRP  64  -4.545  -3.998   8.844
  565   2HB   TRP  64          1HB       TRP  64  -5.004  -2.547   7.975
  566    HD1  TRP  64           HD       TRP  64  -5.181  -4.162  11.279
  567    HE1  TRP  64           1HE      TRP  64  -6.704  -2.817  12.876
  568    HE3  TRP  64           3HE      TRP  64  -7.410  -1.006   7.905
  569    HZ2  TRP  64           2HZ      TRP  64  -8.570  -0.727  12.733
  570    HZ3  TRP  64           3HZ      TRP  64  -9.046   0.634   8.741
  571    HH2  TRP  64           HH       TRP  64  -9.607   0.760  11.100
  572    H    TYR  65           H        TYR  65  -5.246  -3.333   5.310
  573    HA   TYR  65           HA       TYR  65  -7.146  -1.347   4.834
  574   1HB   TYR  65          2HB       TYR  65  -4.924  -1.280   3.741
  575   2HB   TYR  65          1HB       TYR  65  -5.386  -2.672   2.755
  576    HD1  TYR  65           1HD      TYR  65  -6.358  -2.277   0.636
  577    HD2  TYR  65           2HD      TYR  65  -6.597   0.735   3.631
  578    HE1  TYR  65           1HE      TYR  65  -7.473  -0.746  -0.971
  579    HE2  TYR  65           2HE      TYR  65  -7.704   2.230   2.037
  580    HH   TYR  65           HH       TYR  65  -8.983   1.182  -0.876
  581    H    ASN  66           H        ASN  66  -6.989  -4.679   3.886
  582    HA   ASN  66           HA       ASN  66  -9.094  -4.738   2.070
  583   1HB   ASN  66          2HB       ASN  66  -8.119  -6.830   3.990
  584   2HB   ASN  66          1HB       ASN  66  -9.541  -7.132   3.009
  585   1HD2  ASN  66          1HD2      ASN  66  -6.061  -6.696   2.973
  586   2HD2  ASN  66          2HD2      ASN  66  -5.844  -7.269   1.365
  587    H    ALA  67           H        ALA  67  -9.282  -4.867   5.583
  588    HA   ALA  67           HA       ALA  67 -12.119  -5.131   5.673
  589   1HB   ALA  67          1HB       ALA  67 -10.232  -4.048   7.770
  590   2HB   ALA  67          2HB       ALA  67 -10.676  -5.742   7.559
  591   3HB   ALA  67          3HB       ALA  67 -11.899  -4.562   8.040
  592    H    TRP  68           H        TRP  68  -9.932  -2.421   6.059
  593    HA   TRP  68           HA       TRP  68 -11.767  -0.330   6.457
  594   1HB   TRP  68          2HB       TRP  68  -9.418  -0.042   6.913
  595   2HB   TRP  68          1HB       TRP  68  -8.997  -0.453   5.273
  596    HD1  TRP  68           HD       TRP  68  -8.965   1.454   3.515
  597    HE1  TRP  68           1HE      TRP  68  -9.100   4.032   3.674
  598    HE3  TRP  68           3HE      TRP  68 -10.648   1.925   8.319
  599    HZ2  TRP  68           2HZ      TRP  68  -9.834   5.960   5.513
  600    HZ3  TRP  68           3HZ      TRP  68 -11.040   4.189   9.188
  601    HH2  TRP  68           HH       TRP  68 -10.622   6.178   7.770
  602    H    ASN  69           H        ASN  69 -10.378  -1.494   3.421
  603    HA   ASN  69           HA       ASN  69 -11.667   0.380   1.762
  604   1HB   ASN  69          2HB       ASN  69  -9.694  -0.985   1.091
  605   2HB   ASN  69          1HB       ASN  69 -10.706  -2.413   1.073
  606   1HD2  ASN  69          1HD2      ASN  69 -12.102  -2.743  -0.662
  607   2HD2  ASN  69          2HD2      ASN  69 -12.044  -1.752  -2.085
  608    H    GLU  70           H        GLU  70 -12.631  -2.762   2.999
  609    HA   GLU  70           HA       GLU  70 -14.995  -3.083   1.443
  610   1HB   GLU  70          2HB       GLU  70 -13.902  -4.933   2.692
  611   2HB   GLU  70          1HB       GLU  70 -14.336  -4.144   4.197
  612   1HG   GLU  70          2HG       GLU  70 -16.724  -4.384   3.574
  613   2HG   GLU  70          1HG       GLU  70 -16.219  -5.306   2.156
  614    H    LYS  71           H        LYS  71 -14.319  -1.539   4.577
  615    HA   LYS  71           HA       LYS  71 -17.070  -1.025   5.159
  616   1HB   LYS  71          2HB       LYS  71 -14.640   0.451   6.166
  617   2HB   LYS  71          1HB       LYS  71 -16.228   0.525   6.878
  618   1HG   LYS  71          2HG       LYS  71 -14.286  -1.793   6.912
  619   2HG   LYS  71          1HG       LYS  71 -14.798  -0.801   8.264
  620   1HD   LYS  71          2HD       LYS  71 -16.004  -2.776   8.597
  621   2HD   LYS  71          1HD       LYS  71 -17.167  -1.769   7.742
  622   1HE   LYS  71          2HE       LYS  71 -16.592  -2.893   5.632
  623   2HE   LYS  71          1HE       LYS  71 -15.388  -3.845   6.478
  624   1HZ   LYS  71          1HZ       LYS  71 -17.218  -4.822   7.809
  625   2HZ   LYS  71          2HZ       LYS  71 -17.267  -5.154   6.185
  626   3HZ   LYS  71          3HZ       LYS  71 -18.340  -4.021   6.821
  627    H    ARG  72           H        ARG  72 -14.695   0.537   3.252
  628    HA   ARG  72           HA       ARG  72 -16.110   3.034   3.030
  629   1HB   ARG  72          2HB       ARG  72 -13.699   1.927   1.632
  630   2HB   ARG  72          1HB       ARG  72 -14.359   3.526   1.301
  631   1HG   ARG  72          2HG       ARG  72 -13.946   4.244   3.518
  632   2HG   ARG  72          1HG       ARG  72 -13.520   2.614   4.028
  633   1HD   ARG  72          2HD       ARG  72 -11.583   4.064   3.696
  634   2HD   ARG  72          1HD       ARG  72 -11.564   2.645   2.660
  635    HE   ARG  72           HE       ARG  72 -12.682   5.023   1.487
  636   1HH1  ARG  72          1HH1      ARG  72  -9.778   3.056   1.984
  637   2HH1  ARG  72          2HH1      ARG  72  -8.927   3.724   0.667
  638   1HH2  ARG  72          1HH2      ARG  72 -11.520   5.878  -0.365
  639   2HH2  ARG  72          2HH2      ARG  72  -9.925   5.340  -0.692
  640    H    ARG  73           H        ARG  73 -15.653   0.178   0.999
  641    HA   ARG  73           HA       ARG  73 -17.223   1.031  -1.199
  642   1HB   ARG  73          2HB       ARG  73 -16.864  -1.731  -0.031
  643   2HB   ARG  73          1HB       ARG  73 -17.694  -1.411  -1.537
  644   1HG   ARG  73          2HG       ARG  73 -15.610  -0.554  -2.486
  645   2HG   ARG  73          1HG       ARG  73 -14.788  -0.893  -0.959
  646   1HD   ARG  73          2HD       ARG  73 -14.441  -2.695  -2.594
  647   2HD   ARG  73          1HD       ARG  73 -15.310  -3.244  -1.157
  648    HE   ARG  73           HE       ARG  73 -17.145  -2.467  -3.163
  649   1HH1  ARG  73          1HH1      ARG  73 -14.956  -5.138  -2.386
  650   2HH1  ARG  73          2HH1      ARG  73 -15.813  -6.290  -3.276
  651   1HH2  ARG  73          1HH2      ARG  73 -18.345  -4.037  -4.338
  652   2HH2  ARG  73          2HH2      ARG  73 -17.833  -5.662  -4.422
  653    H    VAL  74           H        VAL  74 -17.852  -0.238   1.897
  654    HA   VAL  74           HA       VAL  74 -19.598  -0.508   3.231
  655    HB   VAL  74           HB       VAL  74 -21.241   0.911   1.218
  656   1HG1  VAL  74          1HG1      VAL  74 -22.728   1.515   3.189
  657   2HG1  VAL  74          2HG1      VAL  74 -21.660   0.554   4.210
  658   3HG1  VAL  74          3HG1      VAL  74 -22.584  -0.227   2.930
  659   1HG2  VAL  74          1HG2      VAL  74 -20.912   3.029   2.534
  660   2HG2  VAL  74          2HG2      VAL  74 -19.441   2.409   1.777
  661   3HG2  VAL  74          3HG2      VAL  74 -19.712   2.168   3.501
  662    H    TYR  75           H        TYR  75 -19.142  -2.443   2.449
  663    HA   TYR  75           HA       TYR  75 -21.018  -3.764   0.649
  664   1HB   TYR  75          2HB       TYR  75 -18.633  -4.329   0.432
  665   2HB   TYR  75          1HB       TYR  75 -18.596  -4.840   2.113
  666    HD1  TYR  75           1HD      TYR  75 -19.061  -7.053   2.679
  667    HD2  TYR  75           2HD      TYR  75 -20.184  -5.606  -1.155
  668    HE1  TYR  75           1HE      TYR  75 -19.670  -9.334   2.007
  669    HE2  TYR  75           2HE      TYR  75 -20.800  -7.879  -1.845
  670    HH   TYR  75           HH       TYR  75 -21.120 -10.416   0.370
  671    H    GLU  76           H        GLU  76 -22.831  -4.435   1.435
  672    HA   GLU  76           HA       GLU  76 -24.455  -5.244   2.728
  673   1HB   GLU  76          2HB       GLU  76 -23.001  -7.168   3.112
  674   2HB   GLU  76          1HB       GLU  76 -22.246  -6.318   4.464
  675   1HG   GLU  76          2HG       GLU  76 -24.493  -6.219   5.534
  676   2HG   GLU  76          1HG       GLU  76 -25.075  -7.282   4.255
  677    H    GLU  77           H        GLU  77 -25.708  -4.117   3.932
  678    HA   GLU  77           HA       GLU  77 -24.546  -2.162   5.720
  679   1HB   GLU  77          2HB       GLU  77 -26.900  -1.252   5.796
  680   2HB   GLU  77          1HB       GLU  77 -26.146  -1.239   4.213
  681   1HG   GLU  77          2HG       GLU  77 -27.371  -3.254   3.607
  682   2HG   GLU  77          1HG       GLU  77 -28.147  -3.267   5.193
  Start of MODEL   12
    1    H    SER   1           H        SER   1  19.553  -8.178  -7.375
    2    HA   SER   1           HA       SER   1  16.840  -7.152  -7.365
    3   1HB   SER   1          2HB       SER   1  17.754  -9.806  -6.277
    4   2HB   SER   1          1HB       SER   1  16.131  -9.140  -6.078
    5    HG   SER   1           HG       SER   1  16.105  -8.972  -8.408
    6    H    LYS   2           H        LYS   2  17.616  -5.336  -6.385
    7    HA   LYS   2           HA       LYS   2  17.452  -5.566  -3.453
    8   1HB   LYS   2          2HB       LYS   2  19.702  -4.651  -4.136
    9   2HB   LYS   2          1HB       LYS   2  18.875  -3.380  -5.025
   10   1HG   LYS   2          2HG       LYS   2  17.847  -2.622  -2.911
   11   2HG   LYS   2          1HG       LYS   2  18.806  -3.824  -2.052
   12   1HD   LYS   2          2HD       LYS   2  20.851  -2.755  -2.835
   13   2HD   LYS   2          1HD       LYS   2  19.898  -1.558  -3.718
   14   1HE   LYS   2          2HE       LYS   2  18.854  -0.888  -1.570
   15   2HE   LYS   2          1HE       LYS   2  19.930  -2.004  -0.743
   16   1HZ   LYS   2          1HZ       LYS   2  20.791   0.319  -2.370
   17   2HZ   LYS   2          2HZ       LYS   2  21.823  -0.729  -1.541
   18   3HZ   LYS   2          3HZ       LYS   2  20.756   0.261  -0.687
   19    H    CYS   3           H        CYS   3  17.060  -3.624  -6.320
   20    HA   CYS   3           HA       CYS   3  15.310  -2.672  -7.313
   21   1HB   CYS   3          2HB       CYS   3  14.000  -4.598  -6.394
   22   2HB   CYS   3          1HB       CYS   3  13.618  -3.610  -4.993
   23    H    LYS   4           H        LYS   4  14.116  -0.710  -7.282
   24    HA   LYS   4           HA       LYS   4  15.131   1.318  -5.614
   25   1HB   LYS   4          2HB       LYS   4  12.607   1.283  -7.279
   26   2HB   LYS   4          1HB       LYS   4  13.314   2.715  -6.555
   27   1HG   LYS   4          2HG       LYS   4  15.329   2.380  -7.923
   28   2HG   LYS   4          1HG       LYS   4  14.552   0.983  -8.672
   29   1HD   LYS   4          2HD       LYS   4  12.790   2.397  -9.562
   30   2HD   LYS   4          1HD       LYS   4  13.467   3.801  -8.737
   31   1HE   LYS   4          2HE       LYS   4  14.807   2.198 -10.913
   32   2HE   LYS   4          1HE       LYS   4  14.080   3.790 -11.097
   33   1HZ   LYS   4          1HZ       LYS   4  16.480   3.936 -10.843
   34   2HZ   LYS   4          2HZ       LYS   4  16.396   3.160  -9.354
   35   3HZ   LYS   4          3HZ       LYS   4  15.700   4.678  -9.543
   36    H    CYS   5           H        CYS   5  12.334  -0.704  -5.506
   37    HA   CYS   5           HA       CYS   5  11.405   0.608  -3.104
   38   1HB   CYS   5          2HB       CYS   5   9.800   0.007  -4.924
   39   2HB   CYS   5          1HB       CYS   5  10.196  -1.683  -4.674
   40    H    SER   6           H        SER   6  13.433  -0.070  -2.121
   41    HA   SER   6           HA       SER   6  13.553  -2.867  -1.319
   42   1HB   SER   6          2HB       SER   6  15.775  -2.133  -0.354
   43   2HB   SER   6          1HB       SER   6  15.640  -1.959  -2.107
   44    HG   SER   6           HG       SER   6  15.902   0.114  -1.893
   45    H    ARG   7           H        ARG   7  13.849   0.295   0.177
   46    HA   ARG   7           HA       ARG   7  11.675  -0.157   1.889
   47   1HB   ARG   7          2HB       ARG   7  13.458  -1.403   3.148
   48   2HB   ARG   7          1HB       ARG   7  14.398   0.077   3.212
   49   1HG   ARG   7          2HG       ARG   7  12.765   1.139   4.590
   50   2HG   ARG   7          1HG       ARG   7  11.647  -0.217   4.398
   51   1HD   ARG   7          2HD       ARG   7  12.772  -0.305   6.547
   52   2HD   ARG   7          1HD       ARG   7  13.217  -1.676   5.542
   53    HE   ARG   7           HE       ARG   7  15.029   0.488   5.273
   54   1HH1  ARG   7          1HH1      ARG   7  14.173  -2.237   7.342
   55   2HH1  ARG   7          2HH1      ARG   7  15.725  -2.434   8.003
   56   1HH2  ARG   7          1HH2      ARG   7  17.179   0.250   6.178
   57   2HH2  ARG   7          2HH2      ARG   7  17.514  -0.971   7.307
   58    H    LYS   8           H        LYS   8  11.034   1.502   0.745
   59    HA   LYS   8           HA       LYS   8  12.207   4.168   1.267
   60   1HB   LYS   8          2HB       LYS   8  13.047   3.207  -0.870
   61   2HB   LYS   8          1HB       LYS   8  11.387   2.997  -1.398
   62   1HG   LYS   8          2HG       LYS   8  11.043   5.368  -1.323
   63   2HG   LYS   8          1HG       LYS   8  12.681   5.610  -0.716
   64   1HD   LYS   8          2HD       LYS   8  13.600   4.789  -2.770
   65   2HD   LYS   8          1HD       LYS   8  11.988   4.354  -3.357
   66   1HE   LYS   8          2HE       LYS   8  12.655   6.495  -4.311
   67   2HE   LYS   8          1HE       LYS   8  11.303   6.590  -3.158
   68   1HZ   LYS   8          1HZ       LYS   8  12.941   8.395  -2.877
   69   2HZ   LYS   8          2HZ       LYS   8  14.100   7.263  -2.453
   70   3HZ   LYS   8          3HZ       LYS   8  12.727   7.470  -1.493
   71    H    GLY   9           H        GLY   9   9.836   2.458   2.133
   72   1HA   GLY   9          2HA       GLY   9   7.594   3.893   0.960
   73   2HA   GLY   9          1HA       GLY   9   7.492   2.511   2.017
   74    HA   PRO  10           HA       PRO  10   7.594   6.717   4.532
   75   1HB   PRO  10          2HB       PRO  10   5.280   7.826   3.098
   76   2HB   PRO  10          1HB       PRO  10   6.779   8.628   3.565
   77   1HG   PRO  10          2HG       PRO  10   6.213   8.055   1.007
   78   2HG   PRO  10          1HG       PRO  10   7.868   8.000   1.635
   79   1HD   PRO  10          2HD       PRO  10   5.987   5.727   1.084
   80   2HD   PRO  10          1HD       PRO  10   7.736   5.869   0.802
   81    H    LYS  11           H        LYS  11   5.959   7.194   6.138
   82    HA   LYS  11           HA       LYS  11   4.275   4.990   6.715
   83   1HB   LYS  11          2HB       LYS  11   4.354   7.744   7.977
   84   2HB   LYS  11          1HB       LYS  11   3.369   6.429   8.565
   85   1HG   LYS  11          2HG       LYS  11   5.305   6.635   9.957
   86   2HG   LYS  11          1HG       LYS  11   5.446   5.145   9.038
   87   1HD   LYS  11          2HD       LYS  11   7.044   6.179   7.542
   88   2HD   LYS  11          1HD       LYS  11   6.808   7.743   8.323
   89   1HE   LYS  11          2HE       LYS  11   7.922   5.271   9.655
   90   2HE   LYS  11          1HE       LYS  11   8.875   6.635   9.074
   91   1HZ   LYS  11          1HZ       LYS  11   8.481   6.841  11.440
   92   2HZ   LYS  11          2HZ       LYS  11   6.808   6.749  11.215
   93   3HZ   LYS  11          3HZ       LYS  11   7.649   8.064  10.621
   94    H    ILE  12           H        ILE  12   2.526   4.557   5.680
   95    HA   ILE  12           HA       ILE  12   0.801   6.707   4.614
   96    HB   ILE  12           HB       ILE  12   0.944   3.774   3.828
   97   1HG1  ILE  12          2HG1      ILE  12   2.037   6.199   2.385
   98   2HG1  ILE  12          1HG1      ILE  12   3.001   4.989   3.219
   99   1HG2  ILE  12          1HG2      ILE  12  -0.463   6.109   2.510
  100   2HG2  ILE  12          2HG2      ILE  12  -1.246   4.832   3.448
  101   3HG2  ILE  12          3HG2      ILE  12  -0.434   4.440   1.938
  102   1HD1  ILE  12          1HD1      ILE  12   3.014   4.649   0.828
  103   2HD1  ILE  12          2HD1      ILE  12   1.259   4.525   0.818
  104   3HD1  ILE  12          3HD1      ILE  12   2.223   3.295   1.643
  105    H    ARG  13           H        ARG  13  -1.364   6.704   5.112
  106    HA   ARG  13           HA       ARG  13  -2.109   4.733   7.111
  107   1HB   ARG  13          2HB       ARG  13  -3.214   7.517   6.666
  108   2HB   ARG  13          1HB       ARG  13  -3.906   6.286   7.719
  109   1HG   ARG  13          2HG       ARG  13  -2.684   7.873   9.066
  110   2HG   ARG  13          1HG       ARG  13  -1.864   6.318   9.086
  111   1HD   ARG  13          2HD       ARG  13  -0.282   7.188   7.389
  112   2HD   ARG  13          1HD       ARG  13  -1.101   8.747   7.475
  113    HE   ARG  13           HE       ARG  13  -0.305   7.876  10.033
  114   1HH1  ARG  13          1HH1      ARG  13   0.959   9.317   7.069
  115   2HH1  ARG  13          2HH1      ARG  13   2.297  10.069   7.800
  116   1HH2  ARG  13          1HH2      ARG  13   1.563   8.920  11.086
  117   2HH2  ARG  13          2HH2      ARG  13   2.635   9.848  10.133
  118    H    TYR  14           H        TYR  14  -4.504   4.274   7.025
  119    HA   TYR  14           HA       TYR  14  -4.932   3.114   4.466
  120   1HB   TYR  14          2HB       TYR  14  -6.847   3.278   6.797
  121   2HB   TYR  14          1HB       TYR  14  -6.900   2.122   5.465
  122    HD1  TYR  14           1HD      TYR  14  -5.690   2.717   8.764
  123    HD2  TYR  14           2HD      TYR  14  -4.803   0.578   5.175
  124    HE1  TYR  14           1HE      TYR  14  -4.203   1.221  10.011
  125    HE2  TYR  14           2HE      TYR  14  -3.343  -0.902   6.419
  126    HH   TYR  14           HH       TYR  14  -3.311  -1.056   9.786
  127    H    SER  15           H        SER  15  -5.942   5.982   6.021
  128    HA   SER  15           HA       SER  15  -8.162   6.609   4.439
  129   1HB   SER  15          2HB       SER  15  -6.277   8.346   5.970
  130   2HB   SER  15          1HB       SER  15  -7.868   8.858   5.374
  131    HG   SER  15           HG       SER  15  -8.806   7.778   6.910
  132    H    ASP  16           H        ASP  16  -4.737   6.688   3.801
  133    HA   ASP  16           HA       ASP  16  -4.748   8.839   1.836
  134   1HB   ASP  16          2HB       ASP  16  -2.656   6.760   2.538
  135   2HB   ASP  16          1HB       ASP  16  -2.449   7.931   1.262
  136    H    VAL  17           H        VAL  17  -5.276   5.492   1.964
  137    HA   VAL  17           HA       VAL  17  -4.347   5.029  -0.756
  138    HB   VAL  17           HB       VAL  17  -5.662   2.989   0.986
  139   1HG1  VAL  17          1HG1      VAL  17  -5.495   2.259  -1.216
  140   2HG1  VAL  17          2HG1      VAL  17  -4.300   1.389  -0.272
  141   3HG1  VAL  17          3HG1      VAL  17  -3.807   2.712  -1.342
  142   1HG2  VAL  17          1HG2      VAL  17  -3.421   2.304   1.770
  143   2HG2  VAL  17          2HG2      VAL  17  -3.861   3.922   2.319
  144   3HG2  VAL  17          3HG2      VAL  17  -2.732   3.719   0.982
  145    H    LYS  18           H        LYS  18  -5.606   5.248  -2.409
  146    HA   LYS  18           HA       LYS  18  -8.527   4.773  -2.204
  147   1HB   LYS  18          2HB       LYS  18  -6.825   5.783  -4.450
  148   2HB   LYS  18          1HB       LYS  18  -8.479   5.256  -4.692
  149   1HG   LYS  18          2HG       LYS  18  -9.224   6.950  -3.100
  150   2HG   LYS  18          1HG       LYS  18  -7.546   7.447  -2.893
  151   1HD   LYS  18          2HD       LYS  18  -8.800   8.906  -4.500
  152   2HD   LYS  18          1HD       LYS  18  -7.404   8.111  -5.233
  153   1HE   LYS  18          2HE       LYS  18  -9.367   8.102  -6.692
  154   2HE   LYS  18          1HE       LYS  18  -8.878   6.469  -6.271
  155   1HZ   LYS  18          1HZ       LYS  18 -11.113   7.985  -5.026
  156   2HZ   LYS  18          2HZ       LYS  18 -10.701   6.401  -4.641
  157   3HZ   LYS  18          3HZ       LYS  18 -11.286   6.782  -6.168
  158    H    LYS  19           H        LYS  19  -5.673   3.357  -3.437
  159    HA   LYS  19           HA       LYS  19  -7.081   1.001  -4.270
  160   1HB   LYS  19          2HB       LYS  19  -7.160   2.481  -6.224
  161   2HB   LYS  19          1HB       LYS  19  -5.416   2.664  -6.164
  162   1HG   LYS  19          2HG       LYS  19  -5.196   0.230  -6.544
  163   2HG   LYS  19          1HG       LYS  19  -6.955   0.168  -6.689
  164   1HD   LYS  19          2HD       LYS  19  -5.118   1.799  -8.451
  165   2HD   LYS  19          1HD       LYS  19  -5.830   0.253  -8.901
  166   1HE   LYS  19          2HE       LYS  19  -8.065   1.228  -8.706
  167   2HE   LYS  19          1HE       LYS  19  -7.352   2.765  -8.220
  168   1HZ   LYS  19          1HZ       LYS  19  -6.930   1.439 -10.835
  169   2HZ   LYS  19          2HZ       LYS  19  -6.305   2.935 -10.391
  170   3HZ   LYS  19          3HZ       LYS  19  -7.973   2.724 -10.550
  171    H    LEU  20           H        LEU  20  -5.772  -0.692  -4.032
  172    HA   LEU  20           HA       LEU  20  -2.940  -0.197  -3.450
  173   1HB   LEU  20          2HB       LEU  20  -4.470  -0.668  -1.457
  174   2HB   LEU  20          1HB       LEU  20  -4.798  -2.222  -2.166
  175    HG   LEU  20           HG       LEU  20  -2.092  -1.307  -1.157
  176   1HD1  LEU  20          1HD1      LEU  20  -2.543  -2.792   0.743
  177   2HD1  LEU  20          2HD1      LEU  20  -4.142  -3.139   0.094
  178   3HD1  LEU  20          3HD1      LEU  20  -3.756  -1.521   0.641
  179   1HD2  LEU  20          1HD2      LEU  20  -1.456  -3.664  -1.336
  180   2HD2  LEU  20          2HD2      LEU  20  -1.968  -3.064  -2.913
  181   3HD2  LEU  20          3HD2      LEU  20  -3.058  -4.061  -1.951
  182    H    GLU  21           H        GLU  21  -1.755  -1.274  -4.964
  183    HA   GLU  21           HA       GLU  21  -2.970  -3.598  -6.286
  184   1HB   GLU  21          2HB       GLU  21  -1.121  -1.531  -7.502
  185   2HB   GLU  21          1HB       GLU  21  -1.756  -2.948  -8.313
  186   1HG   GLU  21          2HG       GLU  21  -4.026  -2.034  -8.093
  187   2HG   GLU  21          1HG       GLU  21  -3.346  -0.605  -7.316
  188    H    MET  22           H        MET  22  -1.637  -5.364  -6.381
  189    HA   MET  22           HA       MET  22   0.954  -4.890  -5.125
  190   1HB   MET  22          2HB       MET  22  -0.593  -6.337  -3.899
  191   2HB   MET  22          1HB       MET  22  -0.698  -7.411  -5.278
  192   1HG   MET  22          2HG       MET  22   1.575  -8.049  -5.026
  193   2HG   MET  22          1HG       MET  22   1.832  -6.870  -3.727
  194   1HE   MET  22          1HE       MET  22   0.646  -7.061  -1.350
  195   2HE   MET  22          2HE       MET  22  -0.420  -8.387  -0.891
  196   3HE   MET  22          3HE       MET  22  -0.948  -7.216  -2.090
  197    H    LYS  23           H        LYS  23   2.470  -4.674  -6.565
  198    HA   LYS  23           HA       LYS  23   3.227  -6.769  -8.197
  199   1HB   LYS  23          2HB       LYS  23   3.259  -5.527 -10.433
  200   2HB   LYS  23          1HB       LYS  23   1.689  -6.056  -9.882
  201   1HG   LYS  23          2HG       LYS  23   1.415  -3.929 -10.868
  202   2HG   LYS  23          1HG       LYS  23   1.292  -3.683  -9.133
  203   1HD   LYS  23          2HD       LYS  23   3.567  -2.833  -9.080
  204   2HD   LYS  23          1HD       LYS  23   3.754  -3.171 -10.800
  205   1HE   LYS  23          2HE       LYS  23   1.710  -1.268  -9.638
  206   2HE   LYS  23          1HE       LYS  23   3.252  -0.782 -10.348
  207   1HZ   LYS  23          1HZ       LYS  23   2.481  -1.716 -12.452
  208   2HZ   LYS  23          2HZ       LYS  23   1.404  -0.552 -11.884
  209   3HZ   LYS  23          3HZ       LYS  23   1.035  -2.191 -11.758
  210    HA   PRO  24           HA       PRO  24   7.027  -5.319  -6.928
  211   1HB   PRO  24          2HB       PRO  24   8.767  -6.360  -8.634
  212   2HB   PRO  24          1HB       PRO  24   7.769  -7.379  -7.585
  213   1HG   PRO  24          2HG       PRO  24   7.364  -6.639 -10.460
  214   2HG   PRO  24          1HG       PRO  24   7.263  -8.236  -9.691
  215   1HD   PRO  24          2HD       PRO  24   5.059  -6.766 -10.232
  216   2HD   PRO  24          1HD       PRO  24   5.198  -7.838  -8.820
  217    H    LYS  25           H        LYS  25   5.829  -3.737  -9.505
  218    HA   LYS  25           HA       LYS  25   6.378  -1.964 -10.720
  219   1HB   LYS  25          2HB       LYS  25   8.716  -1.718  -8.785
  220   2HB   LYS  25          1HB       LYS  25   8.548  -0.688 -10.207
  221   1HG   LYS  25          2HG       LYS  25   6.341  -0.913  -8.235
  222   2HG   LYS  25          1HG       LYS  25   7.688   0.216  -8.007
  223   1HD   LYS  25          2HD       LYS  25   7.286   1.209 -10.139
  224   2HD   LYS  25          1HD       LYS  25   6.025   0.042 -10.500
  225   1HE   LYS  25          2HE       LYS  25   4.657   0.967  -8.720
  226   2HE   LYS  25          1HE       LYS  25   5.958   2.068  -8.242
  227   1HZ   LYS  25          1HZ       LYS  25   4.463   2.082 -10.813
  228   2HZ   LYS  25          2HZ       LYS  25   5.712   3.148 -10.425
  229   3HZ   LYS  25          3HZ       LYS  25   4.279   3.171  -9.552
  230    H    TYR  26           H        TYR  26   9.452  -3.648 -10.051
  231    HA   TYR  26           HA       TYR  26   9.900  -3.920 -12.927
  232   1HB   TYR  26          2HB       TYR  26  11.860  -3.479 -10.669
  233   2HB   TYR  26          1HB       TYR  26  12.387  -4.108 -12.204
  234    HD1  TYR  26           1HD      TYR  26  12.696  -2.742 -14.019
  235    HD2  TYR  26           2HD      TYR  26  10.845  -1.195 -10.542
  236    HE1  TYR  26           1HE      TYR  26  12.901  -0.445 -14.942
  237    HE2  TYR  26           2HE      TYR  26  11.053   1.098 -11.419
  238    HH   TYR  26           HH       TYR  26  12.327   2.338 -13.004
  239    HA   PRO  27           HA       PRO  27   9.553  -8.321 -12.163
  240   1HB   PRO  27          2HB       PRO  27  11.420  -8.593 -14.452
  241   2HB   PRO  27          1HB       PRO  27   9.802  -9.268 -14.247
  242   1HG   PRO  27          2HG       PRO  27  10.219  -7.240 -15.918
  243   2HG   PRO  27          1HG       PRO  27   8.755  -7.310 -14.922
  244   1HD   PRO  27          2HD       PRO  27  11.224  -5.660 -14.541
  245   2HD   PRO  27          1HD       PRO  27   9.511  -5.231 -14.316
  246    H    HIS  28           H        HIS  28  12.458  -6.597 -12.172
  247    HA   HIS  28           HA       HIS  28  14.048  -8.883 -11.274
  248   1HB   HIS  28          2HB       HIS  28  16.030  -7.363 -11.337
  249   2HB   HIS  28          1HB       HIS  28  15.220  -7.483 -12.888
  250    HD1  HIS  28           1HD      HIS  28  15.963  -5.132 -10.084
  251    HD2  HIS  28           2HD      HIS  28  14.155  -4.981 -13.835
  252    HE1  HIS  28           1HE      HIS  28  15.552  -2.703 -10.621
  253    HE2  HIS  28           2HE      HIS  28  15.054  -2.767 -13.038
  254    H    CYS  29           H        CYS  29  11.895  -7.365  -9.709
  255    HA   CYS  29           HA       CYS  29  13.450  -6.783  -7.294
  256   1HB   CYS  29          2HB       CYS  29  10.649  -6.058  -8.178
  257   2HB   CYS  29          1HB       CYS  29  11.279  -5.553  -6.637
  258    H    GLU  30           H        GLU  30  12.551  -7.857  -5.254
  259    HA   GLU  30           HA       GLU  30  11.774 -10.533  -5.973
  260   1HB   GLU  30          2HB       GLU  30  12.413  -9.287  -3.298
  261   2HB   GLU  30          1HB       GLU  30  12.143 -10.993  -3.584
  262   1HG   GLU  30          2HG       GLU  30  14.065 -11.042  -4.965
  263   2HG   GLU  30          1HG       GLU  30  14.299  -9.310  -4.679
  264    H    GLU  31           H        GLU  31   9.846 -11.322  -5.827
  265    HA   GLU  31           HA       GLU  31   7.643 -11.602  -5.541
  266   1HB   GLU  31          2HB       GLU  31   8.434 -11.877  -3.193
  267   2HB   GLU  31          1HB       GLU  31   8.140 -10.175  -2.919
  268   1HG   GLU  31          2HG       GLU  31   5.788 -10.492  -3.210
  269   2HG   GLU  31          1HG       GLU  31   6.022 -12.184  -3.636
  270    H    LYS  32           H        LYS  32   5.458 -10.312  -4.975
  271    HA   LYS  32           HA       LYS  32   5.576  -7.956  -6.608
  272   1HB   LYS  32          2HB       LYS  32   3.265  -9.470  -5.392
  273   2HB   LYS  32          1HB       LYS  32   3.083  -7.879  -6.134
  274   1HG   LYS  32          2HG       LYS  32   2.461  -9.805  -7.565
  275   2HG   LYS  32          1HG       LYS  32   3.646  -8.750  -8.291
  276   1HD   LYS  32          2HD       LYS  32   5.381 -10.237  -7.613
  277   2HD   LYS  32          1HD       LYS  32   4.207 -11.338  -6.878
  278   1HE   LYS  32          2HE       LYS  32   4.348 -10.581  -9.824
  279   2HE   LYS  32          1HE       LYS  32   4.847 -12.130  -9.146
  280   1HZ   LYS  32          1HZ       LYS  32   2.566 -12.548  -8.487
  281   2HZ   LYS  32          2HZ       LYS  32   2.629 -12.230 -10.138
  282   3HZ   LYS  32          3HZ       LYS  32   2.064 -11.061  -9.057
  283    H    MET  33           H        MET  33   5.830  -6.125  -5.955
  284    HA   MET  33           HA       MET  33   6.076  -5.417  -3.227
  285   1HB   MET  33          2HB       MET  33   6.196  -3.693  -5.696
  286   2HB   MET  33          1HB       MET  33   6.489  -3.080  -4.076
  287   1HG   MET  33          2HG       MET  33   8.030  -5.327  -5.340
  288   2HG   MET  33          1HG       MET  33   8.553  -3.639  -5.282
  289   1HE   MET  33          1HE       MET  33   9.726  -6.443  -4.218
  290   2HE   MET  33          2HE       MET  33  10.646  -5.918  -2.801
  291   3HE   MET  33          3HE       MET  33  10.729  -4.978  -4.320
  292    H    VAL  34           H        VAL  34   4.924  -3.387  -2.339
  293    HA   VAL  34           HA       VAL  34   2.081  -3.591  -2.922
  294    HB   VAL  34           HB       VAL  34   3.576  -2.321  -0.634
  295   1HG1  VAL  34          1HG1      VAL  34   1.475  -1.158  -1.099
  296   2HG1  VAL  34          2HG1      VAL  34   1.378  -2.027   0.431
  297   3HG1  VAL  34          3HG1      VAL  34   0.594  -2.678  -1.015
  298   1HG2  VAL  34          1HG2      VAL  34   2.657  -4.167   0.697
  299   2HG2  VAL  34          2HG2      VAL  34   3.679  -4.738  -0.620
  300   3HG2  VAL  34          3HG2      VAL  34   1.927  -4.843  -0.760
  301    H    ILE  35           H        ILE  35   1.294  -2.163  -4.315
  302    HA   ILE  35           HA       ILE  35   2.621   0.425  -4.612
  303    HB   ILE  35           HB       ILE  35   0.546  -0.882  -6.373
  304   1HG1  ILE  35          2HG1      ILE  35   2.508  -2.289  -6.295
  305   2HG1  ILE  35          1HG1      ILE  35   2.364  -1.539  -7.869
  306   1HG2  ILE  35          1HG2      ILE  35   1.331   0.715  -8.060
  307   2HG2  ILE  35          2HG2      ILE  35   2.446   1.398  -6.880
  308   3HG2  ILE  35          3HG2      ILE  35   0.706   1.532  -6.626
  309   1HD1  ILE  35          1HD1      ILE  35   4.093   0.133  -7.111
  310   2HD1  ILE  35          2HD1      ILE  35   4.650  -1.508  -7.312
  311   3HD1  ILE  35          3HD1      ILE  35   4.339  -0.879  -5.678
  312    H    ILE  36           H        ILE  36   1.636   2.076  -3.692
  313    HA   ILE  36           HA       ILE  36  -1.228   1.833  -3.129
  314    HB   ILE  36           HB       ILE  36   0.920   3.032  -1.423
  315   1HG1  ILE  36          2HG1      ILE  36  -1.186   0.916  -0.987
  316   2HG1  ILE  36          1HG1      ILE  36   0.546   0.670  -1.175
  317   1HG2  ILE  36          1HG2      ILE  36  -0.848   4.679  -1.449
  318   2HG2  ILE  36          2HG2      ILE  36  -0.810   3.844   0.102
  319   3HG2  ILE  36          3HG2      ILE  36  -2.048   3.440  -1.089
  320   1HD1  ILE  36          1HD1      ILE  36  -0.189   0.478   1.133
  321   2HD1  ILE  36          2HD1      ILE  36  -0.802   2.144   1.019
  322   3HD1  ILE  36          3HD1      ILE  36   0.932   1.839   0.906
  323    H    THR  37           H        THR  37  -2.479   3.122  -3.985
  324    HA   THR  37           HA       THR  37  -1.528   5.557  -5.337
  325    HB   THR  37           HB       THR  37  -4.196   4.134  -5.471
  326    HG1  THR  37           1HG      THR  37  -1.834   3.453  -6.432
  327   1HG2  THR  37          1HG2      THR  37  -2.973   6.245  -7.275
  328   2HG2  THR  37          2HG2      THR  37  -4.325   6.467  -6.157
  329   3HG2  THR  37          3HG2      THR  37  -4.509   5.411  -7.555
  330    H    THR  38           H        THR  38  -2.162   7.588  -4.601
  331    HA   THR  38           HA       THR  38  -3.545   7.579  -2.067
  332    HB   THR  38           HB       THR  38  -2.720   9.990  -1.953
  333    HG1  THR  38           1HG      THR  38  -0.965   9.107  -4.042
  334   1HG2  THR  38          1HG2      THR  38  -0.448   9.200  -1.312
  335   2HG2  THR  38          2HG2      THR  38  -0.796   7.683  -2.160
  336   3HG2  THR  38          3HG2      THR  38  -1.729   8.116  -0.751
  337    H    LYS  39           H        LYS  39  -5.005   9.379  -1.492
  338    HA   LYS  39           HA       LYS  39  -7.177   9.199  -3.349
  339   1HB   LYS  39          2HB       LYS  39  -7.403   8.840  -0.895
  340   2HB   LYS  39          1HB       LYS  39  -7.069  10.531  -0.650
  341   1HG   LYS  39          2HG       LYS  39  -9.468   9.533  -2.183
  342   2HG   LYS  39          1HG       LYS  39  -9.484   9.797  -0.449
  343   1HD   LYS  39          2HD       LYS  39  -8.921  12.177  -0.857
  344   2HD   LYS  39          1HD       LYS  39  -9.004  11.872  -2.592
  345   1HE   LYS  39          2HE       LYS  39 -11.100  12.832  -1.794
  346   2HE   LYS  39          1HE       LYS  39 -11.354  11.181  -2.349
  347   1HZ   LYS  39          1HZ       LYS  39 -11.297  10.461   0.015
  348   2HZ   LYS  39          2HZ       LYS  39 -12.505  11.587  -0.278
  349   3HZ   LYS  39          3HZ       LYS  39 -11.091  12.058   0.479
  350    H    SER  40           H        SER  40  -5.474  12.033  -2.023
  351    HA   SER  40           HA       SER  40  -5.691  13.442  -4.448
  352   1HB   SER  40          2HB       SER  40  -7.721  14.290  -2.354
  353   2HB   SER  40          1HB       SER  40  -7.198  15.345  -3.659
  354    HG   SER  40           HG       SER  40  -7.948  12.844  -4.438
  355    H    VAL  41           H        VAL  41  -6.000  14.777  -1.122
  356    HA   VAL  41           HA       VAL  41  -3.779  16.447  -1.798
  357    HB   VAL  41           HB       VAL  41  -5.356  16.442   0.799
  358   1HG1  VAL  41          1HG1      VAL  41  -3.442  18.498  -0.317
  359   2HG1  VAL  41          2HG1      VAL  41  -3.151  17.451   1.070
  360   3HG1  VAL  41          3HG1      VAL  41  -4.413  18.679   1.147
  361   1HG2  VAL  41          1HG2      VAL  41  -6.499  18.407  -0.131
  362   2HG2  VAL  41          2HG2      VAL  41  -6.769  16.971  -1.123
  363   3HG2  VAL  41          3HG2      VAL  41  -5.614  18.201  -1.642
  364    H    SER  42           H        SER  42  -2.489  14.639  -2.034
  365    HA   SER  42           HA       SER  42  -0.867  14.220   0.352
  366   1HB   SER  42          2HB       SER  42  -1.363  12.299  -1.953
  367   2HB   SER  42          1HB       SER  42  -0.224  12.019  -0.643
  368    HG   SER  42           HG       SER  42  -1.835  11.732   0.751
  369    H    ARG  43           H        ARG  43   1.460  14.226  -0.207
  370    HA   ARG  43           HA       ARG  43   2.077  16.247  -2.057
  371   1HB   ARG  43          2HB       ARG  43   4.447  15.758  -1.621
  372   2HB   ARG  43          1HB       ARG  43   3.513  15.878  -0.142
  373   1HG   ARG  43          2HG       ARG  43   3.521  13.489   0.120
  374   2HG   ARG  43          1HG       ARG  43   4.293  13.282  -1.454
  375   1HD   ARG  43          2HD       ARG  43   5.492  14.674   0.942
  376   2HD   ARG  43          1HD       ARG  43   5.912  13.062   0.360
  377    HE   ARG  43           HE       ARG  43   6.198  15.212  -1.564
  378   1HH1  ARG  43          1HH1      ARG  43   7.857  13.259   0.868
  379   2HH1  ARG  43          2HH1      ARG  43   9.402  13.497   0.183
  380   1HH2  ARG  43          1HH2      ARG  43   8.266  15.562  -2.460
  381   2HH2  ARG  43          2HH2      ARG  43   9.645  14.852  -1.749
  382    H    TYR  44           H        TYR  44   1.862  12.866  -2.463
  383    HA   TYR  44           HA       TYR  44   3.243  12.859  -4.958
  384   1HB   TYR  44          2HB       TYR  44   1.619  10.808  -3.505
  385   2HB   TYR  44          1HB       TYR  44   2.143  10.470  -5.138
  386    HD1  TYR  44           1HD      TYR  44   3.164  10.926  -1.694
  387    HD2  TYR  44           2HD      TYR  44   4.523  10.204  -5.638
  388    HE1  TYR  44           1HE      TYR  44   5.370  10.288  -0.805
  389    HE2  TYR  44           2HE      TYR  44   6.732   9.550  -4.771
  390    HH   TYR  44           HH       TYR  44   8.048  10.112  -2.689
  391    H    ARG  45           H        ARG  45  -0.180  12.749  -4.017
  392    HA   ARG  45           HA       ARG  45  -2.073  13.150  -5.062
  393   1HB   ARG  45          2HB       ARG  45  -0.842  15.402  -4.890
  394   2HB   ARG  45          1HB       ARG  45  -0.535  15.234  -6.603
  395   1HG   ARG  45          2HG       ARG  45  -3.222  15.269  -5.329
  396   2HG   ARG  45          1HG       ARG  45  -2.444  16.708  -5.992
  397   1HD   ARG  45          2HD       ARG  45  -3.319  14.225  -7.500
  398   2HD   ARG  45          1HD       ARG  45  -4.100  15.804  -7.560
  399    HE   ARG  45           HE       ARG  45  -1.372  15.954  -8.320
  400   1HH1  ARG  45          1HH1      ARG  45  -4.575  15.008  -9.512
  401   2HH1  ARG  45          2HH1      ARG  45  -4.172  15.250 -11.151
  402   1HH2  ARG  45          1HH2      ARG  45  -0.835  16.250 -10.628
  403   2HH2  ARG  45          2HH2      ARG  45  -2.050  15.948 -11.780
  404    H    GLY  46           H        GLY  46  -2.524  11.335  -6.210
  405   1HA   GLY  46          2HA       GLY  46  -3.100  10.223  -8.125
  406   2HA   GLY  46          1HA       GLY  46  -2.446  11.568  -9.050
  407    H    GLN  47           H        GLN  47  -0.245  10.470  -6.828
  408    HA   GLN  47           HA       GLN  47   0.989   8.651  -8.745
  409   1HB   GLN  47          2HB       GLN  47   2.386  10.634  -6.925
  410   2HB   GLN  47          1HB       GLN  47   3.224   9.363  -7.806
  411   1HG   GLN  47          2HG       GLN  47   2.471  10.395  -9.896
  412   2HG   GLN  47          1HG       GLN  47   1.657  11.649  -8.962
  413   1HE2  GLN  47          1HE2      GLN  47   2.884  13.140  -7.852
  414   2HE2  GLN  47          2HE2      GLN  47   4.544  13.449  -8.209
  415    H    GLU  48           H        GLU  48   2.378   7.031  -7.757
  416    HA   GLU  48           HA       GLU  48   0.921   5.993  -5.467
  417   1HB   GLU  48          2HB       GLU  48   2.588   4.498  -7.485
  418   2HB   GLU  48          1HB       GLU  48   1.730   3.780  -6.139
  419   1HG   GLU  48          2HG       GLU  48   0.445   3.351  -8.071
  420   2HG   GLU  48          1HG       GLU  48  -0.399   4.625  -7.202
  421    H    HIS  49           H        HIS  49   1.960   4.835  -3.920
  422    HA   HIS  49           HA       HIS  49   4.803   5.500  -3.386
  423   1HB   HIS  49          2HB       HIS  49   2.659   4.448  -1.515
  424   2HB   HIS  49          1HB       HIS  49   4.323   4.752  -1.079
  425    HD1  HIS  49           1HD      HIS  49   4.763   6.943  -0.084
  426    HD2  HIS  49           2HD      HIS  49   1.189   6.915  -2.149
  427    HE1  HIS  49           1HE      HIS  49   3.573   9.020   0.638
  428    HE2  HIS  49           2HE      HIS  49   1.299   8.736  -0.308
  429    H    CYS  50           H        CYS  50   6.130   3.636  -2.682
  430    HA   CYS  50           HA       CYS  50   4.802   1.093  -3.194
  431   1HB   CYS  50          2HB       CYS  50   6.447   1.565  -4.966
  432   2HB   CYS  50          1HB       CYS  50   7.709   1.740  -3.744
  433    H    LEU  51           H        LEU  51   4.806  -0.258  -1.603
  434    HA   LEU  51           HA       LEU  51   6.561   0.296   0.676
  435   1HB   LEU  51          2HB       LEU  51   4.164   0.707   1.147
  436   2HB   LEU  51          1HB       LEU  51   3.775  -0.918   0.672
  437    HG   LEU  51           HG       LEU  51   4.997  -1.787   2.616
  438   1HD1  LEU  51          1HD1      LEU  51   5.813  -0.251   4.320
  439   2HD1  LEU  51          2HD1      LEU  51   5.436   1.123   3.279
  440   3HD1  LEU  51          3HD1      LEU  51   6.688  -0.029   2.808
  441   1HD2  LEU  51          1HD2      LEU  51   3.447  -0.976   4.319
  442   2HD2  LEU  51          2HD2      LEU  51   2.610  -1.245   2.791
  443   3HD2  LEU  51          3HD2      LEU  51   3.021   0.392   3.290
  444    H    HIS  52           H        HIS  52   7.661  -1.417   1.558
  445    HA   HIS  52           HA       HIS  52   8.106  -3.576  -0.306
  446   1HB   HIS  52          2HB       HIS  52   9.940  -2.261   0.825
  447   2HB   HIS  52          1HB       HIS  52   9.496  -3.060   2.328
  448    HD1  HIS  52           1HD      HIS  52  10.938  -5.031   2.816
  449    HD2  HIS  52           2HD      HIS  52  10.623  -4.275  -1.249
  450    HE1  HIS  52           1HE      HIS  52  12.328  -6.780   1.695
  451    HE2  HIS  52           2HE      HIS  52  12.539  -5.846  -0.628
  452    HA   PRO  53           HA       PRO  53   5.087  -6.041   1.953
  453   1HB   PRO  53          2HB       PRO  53   5.135  -8.166   0.392
  454   2HB   PRO  53          1HB       PRO  53   4.387  -6.648  -0.144
  455   1HG   PRO  53          2HG       PRO  53   7.093  -7.774  -0.766
  456   2HG   PRO  53          1HG       PRO  53   5.924  -7.028  -1.871
  457   1HD   PRO  53          2HD       PRO  53   8.043  -5.698  -0.878
  458   2HD   PRO  53          1HD       PRO  53   6.515  -4.882  -1.233
  459    H    LYS  54           H        LYS  54   8.241  -6.498   2.131
  460    HA   LYS  54           HA       LYS  54   8.145  -9.209   2.940
  461   1HB   LYS  54          2HB       LYS  54  10.410  -7.315   2.744
  462   2HB   LYS  54          1HB       LYS  54  10.621  -8.759   3.728
  463   1HG   LYS  54          2HG       LYS  54  11.416  -9.111   1.480
  464   2HG   LYS  54          1HG       LYS  54  10.053 -10.158   1.814
  465   1HD   LYS  54          2HD       LYS  54   8.632  -8.414   0.668
  466   2HD   LYS  54          1HD       LYS  54  10.131  -7.656   0.149
  467   1HE   LYS  54          2HE       LYS  54   9.113 -10.401  -0.454
  468   2HE   LYS  54          1HE       LYS  54   9.351  -9.078  -1.617
  469   1HZ   LYS  54          1HZ       LYS  54  11.737  -9.254  -1.282
  470   2HZ   LYS  54          2HZ       LYS  54  11.100 -10.759  -1.756
  471   3HZ   LYS  54          3HZ       LYS  54  11.517 -10.500  -0.166
  472    H    LEU  55           H        LEU  55   7.640  -6.237   4.416
  473    HA   LEU  55           HA       LEU  55   8.489  -6.927   7.086
  474   1HB   LEU  55          2HB       LEU  55   6.883  -4.590   6.067
  475   2HB   LEU  55          1HB       LEU  55   7.573  -4.736   7.668
  476    HG   LEU  55           HG       LEU  55   9.139  -4.509   5.097
  477   1HD1  LEU  55          1HD1      LEU  55   9.744  -2.291   5.933
  478   2HD1  LEU  55          2HD1      LEU  55   8.671  -2.529   7.310
  479   3HD1  LEU  55          3HD1      LEU  55   8.007  -2.437   5.677
  480   1HD2  LEU  55          1HD2      LEU  55  10.058  -4.568   7.971
  481   2HD2  LEU  55          2HD2      LEU  55  11.083  -4.242   6.572
  482   3HD2  LEU  55          3HD2      LEU  55  10.328  -5.822   6.765
  483    H    GLN  56           H        GLN  56   7.122  -7.449   8.747
  484    HA   GLN  56           HA       GLN  56   4.700  -8.779   8.094
  485   1HB   GLN  56          2HB       GLN  56   5.750  -7.969  10.806
  486   2HB   GLN  56          1HB       GLN  56   4.433  -9.099  10.521
  487   1HG   GLN  56          2HG       GLN  56   5.971 -10.588   9.354
  488   2HG   GLN  56          1HG       GLN  56   7.296  -9.471   9.676
  489   1HE2  GLN  56          1HE2      GLN  56   7.011 -12.213  10.463
  490   2HE2  GLN  56          2HE2      GLN  56   7.064 -12.268  12.180
  491    H    SER  57           H        SER  57   5.463  -5.627   9.400
  492    HA   SER  57           HA       SER  57   2.851  -4.813  10.072
  493   1HB   SER  57          2HB       SER  57   5.184  -3.142   9.104
  494   2HB   SER  57          1HB       SER  57   3.799  -2.570  10.038
  495    HG   SER  57           HG       SER  57   4.458  -4.080  11.666
  496    H    THR  58           H        THR  58   4.522  -5.115   7.015
  497    HA   THR  58           HA       THR  58   2.710  -3.485   5.592
  498    HB   THR  58           HB       THR  58   4.586  -5.621   4.539
  499    HG1  THR  58           1HG      THR  58   4.937  -2.991   5.456
  500   1HG2  THR  58          1HG2      THR  58   2.913  -4.901   2.884
  501   2HG2  THR  58          2HG2      THR  58   4.500  -4.237   2.477
  502   3HG2  THR  58          3HG2      THR  58   3.296  -3.212   3.237
  503    H    LYS  59           H        LYS  59   3.025  -7.041   6.149
  504    HA   LYS  59           HA       LYS  59   0.726  -7.809   4.675
  505   1HB   LYS  59          2HB       LYS  59   1.869  -9.022   7.183
  506   2HB   LYS  59          1HB       LYS  59   0.458  -9.671   6.375
  507   1HG   LYS  59          2HG       LYS  59   2.232 -10.985   5.691
  508   2HG   LYS  59          1HG       LYS  59   1.897  -9.916   4.349
  509   1HD   LYS  59          2HD       LYS  59   3.771  -8.503   4.945
  510   2HD   LYS  59          1HD       LYS  59   4.099  -9.514   6.359
  511   1HE   LYS  59          2HE       LYS  59   5.588 -10.072   4.519
  512   2HE   LYS  59          1HE       LYS  59   4.516 -11.422   4.908
  513   1HZ   LYS  59          1HZ       LYS  59   4.186  -9.497   2.693
  514   2HZ   LYS  59          2HZ       LYS  59   3.113 -10.760   3.042
  515   3HZ   LYS  59          3HZ       LYS  59   4.680 -11.099   2.539
  516    H    ARG  60           H        ARG  60   1.136  -6.623   7.927
  517    HA   ARG  60           HA       ARG  60  -1.452  -6.861   8.860
  518   1HB   ARG  60          2HB       ARG  60   0.591  -6.207  10.176
  519   2HB   ARG  60          1HB       ARG  60   0.508  -4.634   9.389
  520   1HG   ARG  60          2HG       ARG  60  -0.412  -4.449  11.549
  521   2HG   ARG  60          1HG       ARG  60  -1.727  -4.332  10.364
  522   1HD   ARG  60          2HD       ARG  60  -2.402  -5.740  12.198
  523   2HD   ARG  60          1HD       ARG  60  -2.211  -6.701  10.725
  524    HE   ARG  60           HE       ARG  60   0.154  -6.656  12.302
  525   1HH1  ARG  60          1HH1      ARG  60  -2.947  -8.329  11.959
  526   2HH1  ARG  60          2HH1      ARG  60  -2.471  -9.685  12.859
  527   1HH2  ARG  60          1HH2      ARG  60   0.805  -8.523  13.506
  528   2HH2  ARG  60          2HH2      ARG  60  -0.275  -9.815  13.746
  529    H    PHE  61           H        PHE  61   0.167  -4.153   7.230
  530    HA   PHE  61           HA       PHE  61  -1.987  -2.371   7.166
  531   1HB   PHE  61          2HB       PHE  61   0.500  -1.954   6.711
  532   2HB   PHE  61          1HB       PHE  61   0.147  -2.585   5.103
  533    HD1  PHE  61           1HD      PHE  61  -1.213  -1.243   3.498
  534    HD2  PHE  61           2HD      PHE  61  -0.259   0.259   7.370
  535    HE1  PHE  61           1HE      PHE  61  -1.846   1.029   2.785
  536    HE2  PHE  61           2HE      PHE  61  -0.914   2.537   6.636
  537    HZ   PHE  61           HZ       PHE  61  -1.674   2.922   4.386
  538    H    ILE  62           H        ILE  62  -0.914  -4.814   4.806
  539    HA   ILE  62           HA       ILE  62  -2.774  -4.105   2.783
  540    HB   ILE  62           HB       ILE  62  -1.556  -6.848   3.232
  541   1HG1  ILE  62          2HG1      ILE  62   0.229  -5.228   3.048
  542   2HG1  ILE  62          1HG1      ILE  62   0.126  -6.134   1.543
  543   1HG2  ILE  62          1HG2      ILE  62  -3.461  -6.841   1.733
  544   2HG2  ILE  62          2HG2      ILE  62  -1.971  -7.171   0.831
  545   3HG2  ILE  62          3HG2      ILE  62  -2.729  -5.569   0.767
  546   1HD1  ILE  62          1HD1      ILE  62  -0.945  -3.381   2.045
  547   2HD1  ILE  62          2HD1      ILE  62  -1.079  -4.283   0.531
  548   3HD1  ILE  62          3HD1      ILE  62   0.509  -3.792   1.132
  549    H    LYS  63           H        LYS  63  -2.805  -6.623   5.224
  550    HA   LYS  63           HA       LYS  63  -5.427  -7.576   4.582
  551   1HB   LYS  63          2HB       LYS  63  -3.631  -7.904   6.955
  552   2HB   LYS  63          1HB       LYS  63  -5.310  -8.351   7.115
  553   1HG   LYS  63          2HG       LYS  63  -3.834 -10.281   6.676
  554   2HG   LYS  63          1HG       LYS  63  -5.053 -10.084   5.436
  555   1HD   LYS  63          2HD       LYS  63  -2.238  -9.055   5.085
  556   2HD   LYS  63          1HD       LYS  63  -2.658 -10.732   4.748
  557   1HE   LYS  63          2HE       LYS  63  -3.896  -8.300   3.443
  558   2HE   LYS  63          1HE       LYS  63  -2.684  -9.344   2.719
  559   1HZ   LYS  63          1HZ       LYS  63  -5.429 -10.197   3.507
  560   2HZ   LYS  63          2HZ       LYS  63  -4.253 -11.187   2.818
  561   3HZ   LYS  63          3HZ       LYS  63  -4.905  -9.910   1.943
  562    H    TRP  64           H        TRP  64  -4.246  -5.044   6.561
  563    HA   TRP  64           HA       TRP  64  -6.626  -4.502   7.990
  564   1HB   TRP  64          2HB       TRP  64  -3.997  -3.697   8.077
  565   2HB   TRP  64          1HB       TRP  64  -4.824  -2.268   7.487
  566    HD1  TRP  64           HD       TRP  64  -4.002  -4.130  10.565
  567    HE1  TRP  64           1HE      TRP  64  -5.158  -3.060  12.601
  568    HE3  TRP  64           3HE      TRP  64  -7.231  -1.026   8.111
  569    HZ2  TRP  64           2HZ      TRP  64  -7.176  -1.133  13.093
  570    HZ3  TRP  64           3HZ      TRP  64  -8.731   0.399   9.428
  571    HH2  TRP  64           HH       TRP  64  -8.709   0.353  11.856
  572    H    TYR  65           H        TYR  65  -5.045  -3.060   5.070
  573    HA   TYR  65           HA       TYR  65  -7.049  -1.152   4.681
  574   1HB   TYR  65          2HB       TYR  65  -4.847  -0.866   3.626
  575   2HB   TYR  65          1HB       TYR  65  -5.178  -2.244   2.573
  576    HD1  TYR  65           1HD      TYR  65  -6.107  -1.833   0.464
  577    HD2  TYR  65           2HD      TYR  65  -6.695   1.002   3.574
  578    HE1  TYR  65           1HE      TYR  65  -7.322  -0.323  -1.118
  579    HE2  TYR  65           2HE      TYR  65  -7.897   2.476   2.022
  580    HH   TYR  65           HH       TYR  65  -8.049   2.882  -0.307
  581    H    ASN  66           H        ASN  66  -6.676  -4.375   3.411
  582    HA   ASN  66           HA       ASN  66  -8.912  -4.216   1.685
  583   1HB   ASN  66          2HB       ASN  66  -7.493  -6.573   2.893
  584   2HB   ASN  66          1HB       ASN  66  -8.934  -6.806   1.914
  585   1HD2  ASN  66          1HD2      ASN  66  -5.592  -5.803   1.910
  586   2HD2  ASN  66          2HD2      ASN  66  -5.390  -5.845   0.191
  587    H    ALA  67           H        ALA  67  -8.626  -5.159   5.052
  588    HA   ALA  67           HA       ALA  67 -11.344  -5.814   5.402
  589   1HB   ALA  67          1HB       ALA  67  -9.366  -4.756   7.428
  590   2HB   ALA  67          2HB       ALA  67  -9.606  -6.453   7.021
  591   3HB   ALA  67          3HB       ALA  67 -10.904  -5.538   7.790
  592    H    TRP  68           H        TRP  68  -9.527  -2.863   5.933
  593    HA   TRP  68           HA       TRP  68 -11.542  -1.127   6.753
  594   1HB   TRP  68          2HB       TRP  68  -9.321  -0.402   6.991
  595   2HB   TRP  68          1HB       TRP  68  -8.909  -0.846   5.353
  596    HD1  TRP  68           HD       TRP  68  -9.694   0.912   3.420
  597    HE1  TRP  68           1HE      TRP  68  -9.872   3.462   3.505
  598    HE3  TRP  68           3HE      TRP  68  -9.944   1.586   8.495
  599    HZ2  TRP  68           2HZ      TRP  68 -10.080   5.477   5.385
  600    HZ3  TRP  68           3HZ      TRP  68 -10.115   3.899   9.338
  601    HH2  TRP  68           HH       TRP  68 -10.178   5.812   7.766
  602    H    ASN  69           H        ASN  69 -10.454  -1.819   3.447
  603    HA   ASN  69           HA       ASN  69 -12.247  -0.064   2.212
  604   1HB   ASN  69          2HB       ASN  69 -10.394  -0.961   0.922
  605   2HB   ASN  69          1HB       ASN  69 -10.992  -2.603   1.123
  606   1HD2  ASN  69          1HD2      ASN  69 -11.455   0.444  -0.573
  607   2HD2  ASN  69          2HD2      ASN  69 -12.532  -0.161  -1.757
  608    H    GLU  70           H        GLU  70 -12.587  -3.518   3.011
  609    HA   GLU  70           HA       GLU  70 -15.177  -3.636   1.884
  610   1HB   GLU  70          2HB       GLU  70 -13.923  -5.509   3.893
  611   2HB   GLU  70          1HB       GLU  70 -15.408  -5.823   2.999
  612   1HG   GLU  70          2HG       GLU  70 -14.079  -5.622   0.891
  613   2HG   GLU  70          1HG       GLU  70 -12.634  -5.524   1.885
  614    H    LYS  71           H        LYS  71 -14.029  -2.679   5.038
  615    HA   LYS  71           HA       LYS  71 -16.588  -2.790   6.272
  616   1HB   LYS  71          2HB       LYS  71 -14.088  -1.369   7.011
  617   2HB   LYS  71          1HB       LYS  71 -15.558  -1.355   7.987
  618   1HG   LYS  71          2HG       LYS  71 -15.494  -3.852   7.939
  619   2HG   LYS  71          1HG       LYS  71 -13.883  -3.719   7.228
  620   1HD   LYS  71          2HD       LYS  71 -14.832  -2.474   9.654
  621   2HD   LYS  71          1HD       LYS  71 -13.969  -4.026   9.690
  622   1HE   LYS  71          2HE       LYS  71 -12.022  -2.808   8.562
  623   2HE   LYS  71          1HE       LYS  71 -12.910  -1.305   8.805
  624   1HZ   LYS  71          1HZ       LYS  71 -11.256  -1.645  10.535
  625   2HZ   LYS  71          2HZ       LYS  71 -11.934  -3.117  10.943
  626   3HZ   LYS  71          3HZ       LYS  71 -12.803  -1.694  11.200
  627    H    ARG  72           H        ARG  72 -14.963  -0.513   4.277
  628    HA   ARG  72           HA       ARG  72 -16.845   1.631   4.877
  629   1HB   ARG  72          2HB       ARG  72 -14.660   1.415   2.825
  630   2HB   ARG  72          1HB       ARG  72 -15.675   2.821   3.053
  631   1HG   ARG  72          2HG       ARG  72 -14.744   3.089   5.317
  632   2HG   ARG  72          1HG       ARG  72 -13.700   1.687   5.023
  633   1HD   ARG  72          2HD       ARG  72 -12.537   3.815   4.558
  634   2HD   ARG  72          1HD       ARG  72 -12.682   2.790   3.136
  635    HE   ARG  72           HE       ARG  72 -14.776   4.739   3.526
  636   1HH1  ARG  72          1HH1      ARG  72 -11.695   4.071   1.881
  637   2HH1  ARG  72          2HH1      ARG  72 -11.993   5.086   0.568
  638   1HH2  ARG  72          1HH2      ARG  72 -15.190   6.150   1.703
  639   2HH2  ARG  72          2HH2      ARG  72 -14.047   6.312   0.469
  640    H    ARG  73           H        ARG  73 -15.906  -0.359   2.136
  641    HA   ARG  73           HA       ARG  73 -17.722   0.770   0.292
  642   1HB   ARG  73          2HB       ARG  73 -15.508  -0.215  -0.197
  643   2HB   ARG  73          1HB       ARG  73 -16.141  -1.780   0.249
  644   1HG   ARG  73          2HG       ARG  73 -17.704  -1.665  -1.629
  645   2HG   ARG  73          1HG       ARG  73 -17.016  -0.099  -2.083
  646   1HD   ARG  73          2HD       ARG  73 -14.782  -1.184  -2.214
  647   2HD   ARG  73          1HD       ARG  73 -15.561  -2.728  -1.925
  648    HE   ARG  73           HE       ARG  73 -16.641  -1.245  -4.117
  649   1HH1  ARG  73          1HH1      ARG  73 -14.213  -3.610  -3.098
  650   2HH1  ARG  73          2HH1      ARG  73 -13.941  -4.232  -4.669
  651   1HH2  ARG  73          1HH2      ARG  73 -16.250  -2.077  -6.270
  652   2HH2  ARG  73          2HH2      ARG  73 -15.114  -3.328  -6.525
  653    H    VAL  74           H        VAL  74 -17.461  -2.271   2.004
  654    HA   VAL  74           HA       VAL  74 -18.847  -4.031   2.371
  655    HB   VAL  74           HB       VAL  74 -21.100  -2.026   2.058
  656   1HG1  VAL  74          1HG1      VAL  74 -21.054  -4.711   3.452
  657   2HG1  VAL  74          2HG1      VAL  74 -21.887  -4.336   1.943
  658   3HG1  VAL  74          3HG1      VAL  74 -22.415  -3.588   3.448
  659   1HG2  VAL  74          1HG2      VAL  74 -21.056  -1.827   4.512
  660   2HG2  VAL  74          2HG2      VAL  74 -19.543  -1.294   3.782
  661   3HG2  VAL  74          3HG2      VAL  74 -19.635  -2.872   4.560
  662    H    TYR  75           H        TYR  75 -20.926  -2.441   0.300
  663    HA   TYR  75           HA       TYR  75 -20.334  -4.105  -1.981
  664   1HB   TYR  75          2HB       TYR  75 -21.887  -5.482  -0.580
  665   2HB   TYR  75          1HB       TYR  75 -23.050  -4.168  -0.635
  666    HD1  TYR  75           1HD      TYR  75 -21.600  -6.960  -2.395
  667    HD2  TYR  75           2HD      TYR  75 -24.159  -3.631  -2.707
  668    HE1  TYR  75           1HE      TYR  75 -22.541  -7.915  -4.459
  669    HE2  TYR  75           2HE      TYR  75 -25.146  -4.566  -4.792
  670    HH   TYR  75           HH       TYR  75 -24.312  -6.100  -6.564
  671    H    GLU  76           H        GLU  76 -20.907  -2.961  -3.824
  672    HA   GLU  76           HA       GLU  76 -22.362  -0.413  -3.450
  673   1HB   GLU  76          2HB       GLU  76 -20.163  -1.079  -5.404
  674   2HB   GLU  76          1HB       GLU  76 -21.068   0.420  -5.393
  675   1HG   GLU  76          2HG       GLU  76 -20.134   1.012  -3.255
  676   2HG   GLU  76          1HG       GLU  76 -19.323  -0.554  -3.146
  677    H    GLU  77           H        GLU  77 -21.396  -2.564  -5.891
  678    HA   GLU  77           HA       GLU  77 -24.037  -2.889  -6.972
  679   1HB   GLU  77          2HB       GLU  77 -23.330  -2.117  -9.257
  680   2HB   GLU  77          1HB       GLU  77 -23.444  -0.827  -8.073
  681   1HG   GLU  77          2HG       GLU  77 -20.996  -0.906  -7.796
  682   2HG   GLU  77          1HG       GLU  77 -20.915  -2.152  -9.036
  Start of MODEL   13
    1    H    SER   1           H        SER   1  17.792  -4.131  -0.853
    2    HA   SER   1           HA       SER   1  18.813  -3.514  -2.729
    3   1HB   SER   1          2HB       SER   1  20.720  -5.805  -2.153
    4   2HB   SER   1          1HB       SER   1  21.002  -4.508  -3.320
    5    HG   SER   1           HG       SER   1  20.394  -3.257  -1.201
    6    H    LYS   2           H        LYS   2  19.639  -4.442  -5.013
    7    HA   LYS   2           HA       LYS   2  19.132  -5.408  -6.950
    8   1HB   LYS   2          2HB       LYS   2  19.701  -7.535  -5.770
    9   2HB   LYS   2          1HB       LYS   2  18.028  -7.697  -5.270
   10   1HG   LYS   2          2HG       LYS   2  17.378  -7.877  -7.650
   11   2HG   LYS   2          1HG       LYS   2  19.084  -7.795  -8.090
   12   1HD   LYS   2          2HD       LYS   2  19.519  -9.831  -6.838
   13   2HD   LYS   2          1HD       LYS   2  17.826  -9.910  -6.341
   14   1HE   LYS   2          2HE       LYS   2  17.174 -10.062  -8.719
   15   2HE   LYS   2          1HE       LYS   2  18.880 -10.058  -9.159
   16   1HZ   LYS   2          1HZ       LYS   2  19.162 -12.118  -7.932
   17   2HZ   LYS   2          2HZ       LYS   2  17.960 -12.284  -9.106
   18   3HZ   LYS   2          3HZ       LYS   2  17.531 -12.101  -7.493
   19    H    CYS   3           H        CYS   3  17.022  -4.056  -5.059
   20    HA   CYS   3           HA       CYS   3  14.977  -3.879  -7.021
   21   1HB   CYS   3          2HB       CYS   3  14.260  -5.926  -5.798
   22   2HB   CYS   3          1HB       CYS   3  14.308  -5.021  -4.288
   23    H    LYS   4           H        LYS   4  13.406  -2.227  -6.300
   24    HA   LYS   4           HA       LYS   4  14.749  -0.313  -4.548
   25   1HB   LYS   4          2HB       LYS   4  14.745   0.349  -6.898
   26   2HB   LYS   4          1HB       LYS   4  13.003   0.170  -6.971
   27   1HG   LYS   4          2HG       LYS   4  12.731   2.037  -5.418
   28   2HG   LYS   4          1HG       LYS   4  14.480   2.190  -5.273
   29   1HD   LYS   4          2HD       LYS   4  12.909   2.552  -7.839
   30   2HD   LYS   4          1HD       LYS   4  13.504   3.852  -6.821
   31   1HE   LYS   4          2HE       LYS   4  15.807   3.115  -7.186
   32   2HE   LYS   4          1HE       LYS   4  15.230   1.779  -8.175
   33   1HZ   LYS   4          1HZ       LYS   4  16.026   3.675  -9.456
   34   2HZ   LYS   4          2HZ       LYS   4  14.756   4.637  -8.850
   35   3HZ   LYS   4          3HZ       LYS   4  14.437   3.268  -9.792
   36    H    CYS   5           H        CYS   5  13.418   0.965  -3.242
   37    HA   CYS   5           HA       CYS   5  11.730   1.578  -1.982
   38   1HB   CYS   5          2HB       CYS   5   9.976  -0.241  -3.636
   39   2HB   CYS   5          1HB       CYS   5   9.382   0.801  -2.349
   40    H    SER   6           H        SER   6  11.416   1.182  -0.021
   41    HA   SER   6           HA       SER   6  10.854  -1.432   1.027
   42   1HB   SER   6          2HB       SER   6  13.397  -1.216   0.991
   43   2HB   SER   6          1HB       SER   6  13.231   0.241   1.968
   44    HG   SER   6           HG       SER   6  13.560  -1.301   3.421
   45    H    ARG   7           H        ARG   7  11.064  -0.476   3.765
   46    HA   ARG   7           HA       ARG   7   8.952   1.478   3.465
   47   1HB   ARG   7          2HB       ARG   7   8.589  -0.429   5.052
   48   2HB   ARG   7          1HB       ARG   7   9.802   0.288   6.111
   49   1HG   ARG   7          2HG       ARG   7   8.443   2.318   6.289
   50   2HG   ARG   7          1HG       ARG   7   7.234   1.597   5.236
   51   1HD   ARG   7          2HD       ARG   7   6.984  -0.233   6.918
   52   2HD   ARG   7          1HD       ARG   7   8.049   0.689   7.986
   53    HE   ARG   7           HE       ARG   7   5.900   2.263   7.016
   54   1HH1  ARG   7          1HH1      ARG   7   6.775  -0.069   9.514
   55   2HH1  ARG   7          2HH1      ARG   7   5.447   0.254  10.521
   56   1HH2  ARG   7          1HH2      ARG   7   4.027   2.735   8.385
   57   2HH2  ARG   7          2HH2      ARG   7   3.856   1.903   9.860
   58    H    LYS   8           H        LYS   8  10.503   2.916   2.623
   59    HA   LYS   8           HA       LYS   8  11.324   4.735   4.747
   60   1HB   LYS   8          2HB       LYS   8  12.948   3.985   2.312
   61   2HB   LYS   8          1HB       LYS   8  13.212   5.492   3.178
   62   1HG   LYS   8          2HG       LYS   8  13.708   4.245   5.217
   63   2HG   LYS   8          1HG       LYS   8  13.432   2.730   4.362
   64   1HD   LYS   8          2HD       LYS   8  15.311   3.126   2.928
   65   2HD   LYS   8          1HD       LYS   8  15.502   4.764   3.551
   66   1HE   LYS   8          2HE       LYS   8  17.160   3.238   4.521
   67   2HE   LYS   8          1HE       LYS   8  16.073   3.897   5.738
   68   1HZ   LYS   8          1HZ       LYS   8  15.821   1.178   4.539
   69   2HZ   LYS   8          2HZ       LYS   8  14.893   1.801   5.809
   70   3HZ   LYS   8          3HZ       LYS   8  16.529   1.532   6.015
   71    H    GLY   9           H        GLY   9   9.161   4.210   2.692
   72   1HA   GLY   9          2HA       GLY   9   9.020   6.867   1.517
   73   2HA   GLY   9          1HA       GLY   9   7.910   5.523   1.198
   74    HA   PRO  10           HA       PRO  10   6.678   8.673   4.864
   75   1HB   PRO  10          2HB       PRO  10   4.792   9.358   2.644
   76   2HB   PRO  10          1HB       PRO  10   5.397  10.377   3.954
   77   1HG   PRO  10          2HG       PRO  10   6.421  10.564   1.519
   78   2HG   PRO  10          1HG       PRO  10   7.459  10.676   2.952
   79   1HD   PRO  10          2HD       PRO  10   7.210   8.474   0.973
   80   2HD   PRO  10          1HD       PRO  10   8.576   8.938   1.993
   81    H    LYS  11           H        LYS  11   5.097   8.032   6.193
   82    HA   LYS  11           HA       LYS  11   3.766   5.608   5.691
   83   1HB   LYS  11          2HB       LYS  11   2.785   5.902   7.925
   84   2HB   LYS  11          1HB       LYS  11   4.526   6.133   7.918
   85   1HG   LYS  11          2HG       LYS  11   4.131   8.583   7.872
   86   2HG   LYS  11          1HG       LYS  11   2.405   8.259   8.058
   87   1HD   LYS  11          2HD       LYS  11   2.848   7.084  10.148
   88   2HD   LYS  11          1HD       LYS  11   4.576   7.401   9.966
   89   1HE   LYS  11          2HE       LYS  11   4.081   9.824   9.989
   90   2HE   LYS  11          1HE       LYS  11   2.389   9.442  10.302
   91   1HZ   LYS  11          1HZ       LYS  11   4.686   8.762  12.045
   92   2HZ   LYS  11          2HZ       LYS  11   3.086   8.346  12.373
   93   3HZ   LYS  11          3HZ       LYS  11   3.544   9.961  12.333
   94    H    ILE  12           H        ILE  12   1.488   5.257   5.999
   95    HA   ILE  12           HA       ILE  12  -0.138   7.337   4.652
   96    HB   ILE  12           HB       ILE  12  -0.517   4.408   4.141
   97   1HG1  ILE  12          2HG1      ILE  12   1.249   6.228   2.510
   98   2HG1  ILE  12          1HG1      ILE  12   1.829   4.928   3.548
   99   1HG2  ILE  12          1HG2      ILE  12  -1.126   6.905   2.550
  100   2HG2  ILE  12          2HG2      ILE  12  -2.281   5.965   3.499
  101   3HG2  ILE  12          3HG2      ILE  12  -1.527   5.261   2.066
  102   1HD1  ILE  12          1HD1      ILE  12   1.759   4.249   1.227
  103   2HD1  ILE  12          2HD1      ILE  12   0.042   4.663   1.186
  104   3HD1  ILE  12          3HD1      ILE  12   0.600   3.321   2.200
  105    H    ARG  13           H        ARG  13  -2.195   7.426   5.414
  106    HA   ARG  13           HA       ARG  13  -2.903   5.535   7.504
  107   1HB   ARG  13          2HB       ARG  13  -4.845   6.886   7.860
  108   2HB   ARG  13          1HB       ARG  13  -3.413   7.891   7.949
  109   1HG   ARG  13          2HG       ARG  13  -3.883   8.726   5.672
  110   2HG   ARG  13          1HG       ARG  13  -5.317   7.699   5.607
  111   1HD   ARG  13          2HD       ARG  13  -6.190   8.894   7.592
  112   2HD   ARG  13          1HD       ARG  13  -4.816   9.994   7.495
  113    HE   ARG  13           HE       ARG  13  -5.875  10.188   5.040
  114   1HH1  ARG  13          1HH1      ARG  13  -7.327  10.418   8.260
  115   2HH1  ARG  13          2HH1      ARG  13  -8.593  11.431   7.768
  116   1HH2  ARG  13          1HH2      ARG  13  -7.666  11.608   4.372
  117   2HH2  ARG  13          2HH2      ARG  13  -8.783  12.124   5.553
  118    H    TYR  14           H        TYR  14  -4.918   4.345   7.260
  119    HA   TYR  14           HA       TYR  14  -5.101   3.096   4.742
  120   1HB   TYR  14          2HB       TYR  14  -7.141   3.073   6.979
  121   2HB   TYR  14          1HB       TYR  14  -7.061   1.932   5.647
  122    HD1  TYR  14           1HD      TYR  14  -5.850   2.775   8.923
  123    HD2  TYR  14           2HD      TYR  14  -5.037   0.389   5.486
  124    HE1  TYR  14           1HE      TYR  14  -4.366   1.349  10.251
  125    HE2  TYR  14           2HE      TYR  14  -3.593  -1.016   6.797
  126    HH   TYR  14           HH       TYR  14  -2.238  -0.818   8.844
  127    H    SER  15           H        SER  15  -6.758   5.762   6.159
  128    HA   SER  15           HA       SER  15  -8.991   5.916   4.444
  129   1HB   SER  15          2HB       SER  15  -7.593   8.081   5.967
  130   2HB   SER  15          1HB       SER  15  -9.254   8.128   5.362
  131    HG   SER  15           HG       SER  15  -9.702   7.334   7.253
  132    H    ASP  16           H        ASP  16  -5.629   6.634   3.867
  133    HA   ASP  16           HA       ASP  16  -6.361   8.525   1.734
  134   1HB   ASP  16          2HB       ASP  16  -4.448   9.151   3.329
  135   2HB   ASP  16          1HB       ASP  16  -3.537   7.836   2.589
  136    H    VAL  17           H        VAL  17  -5.908   5.328   2.154
  137    HA   VAL  17           HA       VAL  17  -4.654   4.914  -0.451
  138    HB   VAL  17           HB       VAL  17  -5.878   2.820   1.315
  139   1HG1  VAL  17          1HG1      VAL  17  -5.603   1.989  -0.820
  140   2HG1  VAL  17          2HG1      VAL  17  -4.248   1.322   0.107
  141   3HG1  VAL  17          3HG1      VAL  17  -4.017   2.693  -0.993
  142   1HG2  VAL  17          1HG2      VAL  17  -3.633   2.368   2.208
  143   2HG2  VAL  17          2HG2      VAL  17  -4.189   3.991   2.622
  144   3HG2  VAL  17          3HG2      VAL  17  -3.013   3.768   1.329
  145    H    LYS  18           H        LYS  18  -5.833   4.912  -2.205
  146    HA   LYS  18           HA       LYS  18  -8.753   4.477  -2.019
  147   1HB   LYS  18          2HB       LYS  18  -7.046   5.357  -4.296
  148   2HB   LYS  18          1HB       LYS  18  -8.765   5.063  -4.425
  149   1HG   LYS  18          2HG       LYS  18  -9.015   6.880  -2.637
  150   2HG   LYS  18          1HG       LYS  18  -7.305   7.233  -2.919
  151   1HD   LYS  18          2HD       LYS  18  -9.524   7.338  -4.975
  152   2HD   LYS  18          1HD       LYS  18  -8.696   8.720  -4.267
  153   1HE   LYS  18          2HE       LYS  18  -6.609   8.039  -5.317
  154   2HE   LYS  18          1HE       LYS  18  -7.378   6.585  -5.948
  155   1HZ   LYS  18          1HZ       LYS  18  -8.132   9.362  -6.674
  156   2HZ   LYS  18          2HZ       LYS  18  -8.832   7.963  -7.278
  157   3HZ   LYS  18          3HZ       LYS  18  -7.230   8.312  -7.628
  158    H    LYS  19           H        LYS  19  -5.921   3.051  -3.123
  159    HA   LYS  19           HA       LYS  19  -7.226   0.645  -3.969
  160   1HB   LYS  19          2HB       LYS  19  -7.355   1.999  -5.998
  161   2HB   LYS  19          1HB       LYS  19  -5.633   2.335  -5.906
  162   1HG   LYS  19          2HG       LYS  19  -5.174  -0.052  -6.213
  163   2HG   LYS  19          1HG       LYS  19  -6.920  -0.317  -6.320
  164   1HD   LYS  19          2HD       LYS  19  -7.029   1.077  -8.322
  165   2HD   LYS  19          1HD       LYS  19  -5.308   1.440  -8.183
  166   1HE   LYS  19          2HE       LYS  19  -4.800  -0.951  -8.504
  167   2HE   LYS  19          1HE       LYS  19  -6.522  -1.281  -8.677
  168   1HZ   LYS  19          1HZ       LYS  19  -5.403  -1.101 -10.822
  169   2HZ   LYS  19          2HZ       LYS  19  -4.904   0.452 -10.459
  170   3HZ   LYS  19          3HZ       LYS  19  -6.541   0.130 -10.643
  171    H    LEU  20           H        LEU  20  -5.891  -1.026  -3.707
  172    HA   LEU  20           HA       LEU  20  -3.047  -0.527  -3.157
  173   1HB   LEU  20          2HB       LEU  20  -4.589  -1.114  -1.193
  174   2HB   LEU  20          1HB       LEU  20  -4.887  -2.634  -1.985
  175    HG   LEU  20           HG       LEU  20  -2.215  -1.734  -0.881
  176   1HD1  LEU  20          1HD1      LEU  20  -2.674  -3.343   0.904
  177   2HD1  LEU  20          2HD1      LEU  20  -4.252  -3.675   0.201
  178   3HD1  LEU  20          3HD1      LEU  20  -3.902  -2.086   0.857
  179   1HD2  LEU  20          1HD2      LEU  20  -1.549  -4.089  -1.179
  180   2HD2  LEU  20          2HD2      LEU  20  -1.978  -3.360  -2.728
  181   3HD2  LEU  20          3HD2      LEU  20  -3.113  -4.437  -1.920
  182    H    GLU  21           H        GLU  21  -1.808  -1.611  -4.750
  183    HA   GLU  21           HA       GLU  21  -3.113  -3.874  -6.065
  184   1HB   GLU  21          2HB       GLU  21  -3.387  -1.769  -7.366
  185   2HB   GLU  21          1HB       GLU  21  -1.640  -1.627  -7.443
  186   1HG   GLU  21          2HG       GLU  21  -2.555  -2.535  -9.505
  187   2HG   GLU  21          1HG       GLU  21  -1.504  -3.699  -8.690
  188    H    MET  22           H        MET  22  -1.662  -5.494  -6.672
  189    HA   MET  22           HA       MET  22   1.014  -5.081  -5.614
  190   1HB   MET  22          2HB       MET  22  -0.492  -7.632  -6.112
  191   2HB   MET  22          1HB       MET  22   1.125  -7.504  -5.442
  192   1HG   MET  22          2HG       MET  22   0.251  -6.285  -3.535
  193   2HG   MET  22          1HG       MET  22  -1.375  -6.399  -4.203
  194   1HE   MET  22          1HE       MET  22  -0.745  -7.292  -1.261
  195   2HE   MET  22          2HE       MET  22  -1.669  -8.802  -1.225
  196   3HE   MET  22          3HE       MET  22  -2.317  -7.397  -2.059
  197    H    LYS  23           H        LYS  23   2.420  -4.637  -7.058
  198    HA   LYS  23           HA       LYS  23   2.914  -6.406  -9.162
  199   1HB   LYS  23          2HB       LYS  23   2.845  -4.799 -11.051
  200   2HB   LYS  23          1HB       LYS  23   1.258  -5.023 -10.365
  201   1HG   LYS  23          2HG       LYS  23   1.398  -2.722 -10.895
  202   2HG   LYS  23          1HG       LYS  23   1.672  -2.782  -9.154
  203   1HD   LYS  23          2HD       LYS  23   4.091  -2.601  -9.528
  204   2HD   LYS  23          1HD       LYS  23   3.834  -2.603 -11.271
  205   1HE   LYS  23          2HE       LYS  23   2.878  -0.454  -9.336
  206   2HE   LYS  23          1HE       LYS  23   4.237  -0.349 -10.435
  207   1HZ   LYS  23          1HZ       LYS  23   2.312   0.764 -11.280
  208   2HZ   LYS  23          2HZ       LYS  23   1.385  -0.626 -11.258
  209   3HZ   LYS  23          3HZ       LYS  23   2.734  -0.499 -12.291
  210    HA   PRO  24           HA       PRO  24   6.789  -5.078  -7.753
  211   1HB   PRO  24          2HB       PRO  24   8.414  -6.040  -9.690
  212   2HB   PRO  24          1HB       PRO  24   7.624  -7.083  -8.514
  213   1HG   PRO  24          2HG       PRO  24   6.825  -6.497 -11.329
  214   2HG   PRO  24          1HG       PRO  24   6.823  -8.049 -10.469
  215   1HD   PRO  24          2HD       PRO  24   4.573  -6.552 -10.839
  216   2HD   PRO  24          1HD       PRO  24   4.806  -7.607  -9.437
  217    H    LYS  25           H        LYS  25   7.861  -3.216  -7.862
  218    HA   LYS  25           HA       LYS  25   7.217  -1.279  -9.822
  219   1HB   LYS  25          2HB       LYS  25   8.198  -1.029  -7.280
  220   2HB   LYS  25          1HB       LYS  25   9.697  -1.118  -8.209
  221   1HG   LYS  25          2HG       LYS  25   7.648   0.960  -8.815
  222   2HG   LYS  25          1HG       LYS  25   8.899   1.184  -7.593
  223   1HD   LYS  25          2HD       LYS  25  10.596   0.816  -9.212
  224   2HD   LYS  25          1HD       LYS  25   9.390   0.418 -10.428
  225   1HE   LYS  25          2HE       LYS  25   9.755   3.092  -9.040
  226   2HE   LYS  25          1HE       LYS  25  10.295   2.746 -10.679
  227   1HZ   LYS  25          1HZ       LYS  25   7.956   2.420 -11.304
  228   2HZ   LYS  25          2HZ       LYS  25   8.211   3.960 -10.664
  229   3HZ   LYS  25          3HZ       LYS  25   7.471   2.793  -9.732
  230    H    TYR  26           H        TYR  26   9.875  -3.533  -9.275
  231    HA   TYR  26           HA       TYR  26  10.701  -3.124 -12.031
  232   1HB   TYR  26          2HB       TYR  26  12.451  -3.651  -9.600
  233   2HB   TYR  26          1HB       TYR  26  12.999  -3.954 -11.226
  234    HD1  TYR  26           1HD      TYR  26  13.634  -2.220 -12.656
  235    HD2  TYR  26           2HD      TYR  26  12.004  -1.344  -8.847
  236    HE1  TYR  26           1HE      TYR  26  14.380   0.142 -12.883
  237    HE2  TYR  26           2HE      TYR  26  12.742   0.986  -9.046
  238    HH   TYR  26           HH       TYR  26  13.838   2.281 -11.997
  239    HA   PRO  27           HA       PRO  27   9.396  -7.406 -12.364
  240   1HB   PRO  27          2HB       PRO  27  11.450  -7.479 -14.520
  241   2HB   PRO  27          1HB       PRO  27   9.745  -7.938 -14.588
  242   1HG   PRO  27          2HG       PRO  27  10.569  -5.667 -15.703
  243   2HG   PRO  27          1HG       PRO  27   9.025  -5.751 -14.838
  244   1HD   PRO  27          2HD       PRO  27  11.625  -4.562 -13.953
  245   2HD   PRO  27          1HD       PRO  27   9.957  -4.004 -13.684
  246    H    HIS  28           H        HIS  28  12.617  -6.333 -12.058
  247    HA   HIS  28           HA       HIS  28  13.699  -8.965 -11.443
  248   1HB   HIS  28          2HB       HIS  28  15.887  -7.859 -11.168
  249   2HB   HIS  28          1HB       HIS  28  15.144  -7.429 -12.699
  250    HD1  HIS  28           1HD      HIS  28  16.035  -5.999  -9.326
  251    HD2  HIS  28           2HD      HIS  28  14.742  -4.626 -13.043
  252    HE1  HIS  28           1HE      HIS  28  16.239  -3.522  -9.295
  253    HE2  HIS  28           2HE      HIS  28  15.974  -2.915 -11.703
  254    H    CYS  29           H        CYS  29  11.633  -7.735  -9.723
  255    HA   CYS  29           HA       CYS  29  13.055  -7.655  -7.162
  256   1HB   CYS  29          2HB       CYS  29  10.414  -6.584  -8.096
  257   2HB   CYS  29          1HB       CYS  29  10.762  -6.625  -6.397
  258    H    GLU  30           H        GLU  30  12.140  -8.945  -5.412
  259    HA   GLU  30           HA       GLU  30  11.048 -11.415  -6.420
  260   1HB   GLU  30          2HB       GLU  30  11.830 -10.615  -3.612
  261   2HB   GLU  30          1HB       GLU  30  11.289 -12.209  -4.094
  262   1HG   GLU  30          2HG       GLU  30  13.208 -12.357  -5.522
  263   2HG   GLU  30          1HG       GLU  30  13.722 -10.773  -4.913
  264    H    GLU  31           H        GLU  31   9.023 -12.000  -6.319
  265    HA   GLU  31           HA       GLU  31   6.835 -12.126  -5.877
  266   1HB   GLU  31          2HB       GLU  31   7.667 -12.593  -3.603
  267   2HB   GLU  31          1HB       GLU  31   7.682 -10.888  -3.241
  268   1HG   GLU  31          2HG       GLU  31   5.305 -10.810  -3.184
  269   2HG   GLU  31          1HG       GLU  31   5.182 -12.441  -3.849
  270    H    LYS  32           H        LYS  32   4.810 -10.627  -5.159
  271    HA   LYS  32           HA       LYS  32   5.128  -8.324  -6.865
  272   1HB   LYS  32          2HB       LYS  32   2.631  -9.342  -5.526
  273   2HB   LYS  32          1HB       LYS  32   2.725  -8.094  -6.763
  274   1HG   LYS  32          2HG       LYS  32   3.494 -10.956  -7.081
  275   2HG   LYS  32          1HG       LYS  32   2.002 -10.194  -7.697
  276   1HD   LYS  32          2HD       LYS  32   3.365  -8.780  -9.106
  277   2HD   LYS  32          1HD       LYS  32   4.837  -9.571  -8.487
  278   1HE   LYS  32          2HE       LYS  32   2.605 -10.862 -10.080
  279   2HE   LYS  32          1HE       LYS  32   4.206 -10.463 -10.680
  280   1HZ   LYS  32          1HZ       LYS  32   5.165 -12.127  -9.183
  281   2HZ   LYS  32          2HZ       LYS  32   3.920 -12.809 -10.089
  282   3HZ   LYS  32          3HZ       LYS  32   3.638 -12.396  -8.501
  283    H    MET  33           H        MET  33   5.569  -6.474  -6.230
  284    HA   MET  33           HA       MET  33   5.836  -5.648  -3.571
  285   1HB   MET  33          2HB       MET  33   5.702  -4.091  -6.123
  286   2HB   MET  33          1HB       MET  33   6.280  -3.468  -4.605
  287   1HG   MET  33          2HG       MET  33   7.557  -5.823  -5.996
  288   2HG   MET  33          1HG       MET  33   8.090  -4.154  -6.220
  289   1HE   MET  33          1HE       MET  33   9.088  -2.728  -4.459
  290   2HE   MET  33          2HE       MET  33   9.339  -3.155  -2.747
  291   3HE   MET  33          3HE       MET  33   7.702  -2.999  -3.409
  292    H    VAL  34           H        VAL  34   4.643  -3.963  -2.547
  293    HA   VAL  34           HA       VAL  34   1.904  -3.935  -3.383
  294    HB   VAL  34           HB       VAL  34   1.710  -2.886  -0.939
  295   1HG1  VAL  34          1HG1      VAL  34   0.628  -4.996  -1.753
  296   2HG1  VAL  34          2HG1      VAL  34   1.301  -5.236  -0.140
  297   3HG1  VAL  34          3HG1      VAL  34   2.170  -5.835  -1.551
  298   1HG2  VAL  34          1HG2      VAL  34   3.243  -3.974   0.603
  299   2HG2  VAL  34          2HG2      VAL  34   4.106  -2.926  -0.522
  300   3HG2  VAL  34          3HG2      VAL  34   4.120  -4.675  -0.758
  301    H    ILE  35           H        ILE  35   1.208  -2.359  -4.444
  302    HA   ILE  35           HA       ILE  35   2.539   0.239  -4.340
  303    HB   ILE  35           HB       ILE  35   0.495  -0.845  -6.279
  304   1HG1  ILE  35          2HG1      ILE  35   2.486  -2.170  -6.296
  305   2HG1  ILE  35          1HG1      ILE  35   2.317  -1.297  -7.802
  306   1HG2  ILE  35          1HG2      ILE  35   1.243   1.004  -7.738
  307   2HG2  ILE  35          2HG2      ILE  35   2.301   1.585  -6.458
  308   3HG2  ILE  35          3HG2      ILE  35   0.560   1.593  -6.230
  309   1HD1  ILE  35          1HD1      ILE  35   4.021   0.348  -6.968
  310   2HD1  ILE  35          2HD1      ILE  35   4.654  -1.288  -7.107
  311   3HD1  ILE  35          3HD1      ILE  35   4.215  -0.648  -5.523
  312    H    ILE  36           H        ILE  36   1.503   1.804  -3.367
  313    HA   ILE  36           HA       ILE  36  -1.322   1.363  -2.815
  314    HB   ILE  36           HB       ILE  36   0.736   2.698  -1.078
  315   1HG1  ILE  36          2HG1      ILE  36  -0.962   0.222  -0.787
  316   2HG1  ILE  36          1HG1      ILE  36   0.780   0.288  -1.004
  317   1HG2  ILE  36          1HG2      ILE  36  -1.403   3.943  -1.019
  318   2HG2  ILE  36          2HG2      ILE  36  -1.061   3.104   0.502
  319   3HG2  ILE  36          3HG2      ILE  36  -2.212   2.416  -0.625
  320   1HD1  ILE  36          1HD1      ILE  36   0.133  -0.182   1.292
  321   2HD1  ILE  36          2HD1      ILE  36  -0.774   1.335   1.272
  322   3HD1  ILE  36          3HD1      ILE  36   0.994   1.378   1.142
  323    H    THR  37           H        THR  37  -2.631   2.658  -3.610
  324    HA   THR  37           HA       THR  37  -1.702   5.087  -4.967
  325    HB   THR  37           HB       THR  37  -4.404   3.740  -5.095
  326    HG1  THR  37           1HG      THR  37  -2.130   3.420  -6.840
  327   1HG2  THR  37          1HG2      THR  37  -3.035   5.701  -6.952
  328   2HG2  THR  37          2HG2      THR  37  -4.359   6.067  -5.844
  329   3HG2  THR  37          3HG2      THR  37  -4.623   4.972  -7.200
  330    H    THR  38           H        THR  38  -2.236   7.092  -4.162
  331    HA   THR  38           HA       THR  38  -3.705   7.061  -1.669
  332    HB   THR  38           HB       THR  38  -2.626   9.255  -1.316
  333    HG1  THR  38           1HG      THR  38  -0.782   8.781  -3.373
  334   1HG2  THR  38          1HG2      THR  38  -0.385   8.278  -0.984
  335   2HG2  THR  38          2HG2      THR  38  -0.868   6.920  -2.009
  336   3HG2  THR  38          3HG2      THR  38  -1.681   7.191  -0.473
  337    H    LYS  39           H        LYS  39  -5.061   8.779  -1.125
  338    HA   LYS  39           HA       LYS  39  -6.876   9.563  -3.184
  339   1HB   LYS  39          2HB       LYS  39  -7.496   8.874  -0.846
  340   2HB   LYS  39          1HB       LYS  39  -6.738  10.329  -0.258
  341   1HG   LYS  39          2HG       LYS  39  -9.120  10.307  -2.110
  342   2HG   LYS  39          1HG       LYS  39  -9.244  10.357  -0.361
  343   1HD   LYS  39          2HD       LYS  39  -7.977  12.493  -0.381
  344   2HD   LYS  39          1HD       LYS  39  -7.971  12.428  -2.146
  345   1HE   LYS  39          2HE       LYS  39 -10.409  12.457  -2.173
  346   2HE   LYS  39          1HE       LYS  39 -10.437  12.462  -0.417
  347   1HZ   LYS  39          1HZ       LYS  39  -9.357  14.604  -0.429
  348   2HZ   LYS  39          2HZ       LYS  39 -10.795  14.638  -1.312
  349   3HZ   LYS  39          3HZ       LYS  39  -9.309  14.617  -2.123
  350    H    SER  40           H        SER  40  -4.639  11.212  -0.926
  351    HA   SER  40           HA       SER  40  -3.491  13.043  -2.639
  352   1HB   SER  40          2HB       SER  40  -5.748  13.904  -3.151
  353   2HB   SER  40          1HB       SER  40  -5.999  14.269  -1.449
  354    HG   SER  40           HG       SER  40  -5.343  16.130  -2.487
  355    H    VAL  41           H        VAL  41  -4.428  12.226   0.663
  356    HA   VAL  41           HA       VAL  41  -3.414  14.721   1.646
  357    HB   VAL  41           HB       VAL  41  -3.959  14.081   3.887
  358   1HG1  VAL  41          1HG1      VAL  41  -6.368  13.748   3.680
  359   2HG1  VAL  41          2HG1      VAL  41  -6.147  13.371   1.970
  360   3HG1  VAL  41          3HG1      VAL  41  -5.736  14.973   2.582
  361   1HG2  VAL  41          1HG2      VAL  41  -4.654  11.354   2.803
  362   2HG2  VAL  41          2HG2      VAL  41  -4.982  11.915   4.445
  363   3HG2  VAL  41          3HG2      VAL  41  -3.320  11.742   3.887
  364    H    SER  42           H        SER  42  -1.983  11.638   1.178
  365    HA   SER  42           HA       SER  42   0.058  12.086   3.093
  366   1HB   SER  42          2HB       SER  42   1.227  10.175   1.976
  367   2HB   SER  42          1HB       SER  42  -0.425   9.808   2.470
  368    HG   SER  42           HG       SER  42  -1.083   9.811   0.495
  369    H    ARG  43           H        ARG  43   2.428  12.021   2.358
  370    HA   ARG  43           HA       ARG  43   2.899  14.554   1.233
  371   1HB   ARG  43          2HB       ARG  43   4.868  12.385   1.944
  372   2HB   ARG  43          1HB       ARG  43   5.285  14.063   1.598
  373   1HG   ARG  43          2HG       ARG  43   3.916  14.801   3.468
  374   2HG   ARG  43          1HG       ARG  43   3.472  13.136   3.800
  375   1HD   ARG  43          2HD       ARG  43   5.833  12.619   4.278
  376   2HD   ARG  43          1HD       ARG  43   6.251  14.311   3.974
  377    HE   ARG  43           HE       ARG  43   4.194  14.227   5.840
  378   1HH1  ARG  43          1HH1      ARG  43   7.634  13.345   5.719
  379   2HH1  ARG  43          2HH1      ARG  43   7.873  13.626   7.386
  380   1HH2  ARG  43          1HH2      ARG  43   4.552  14.586   8.098
  381   2HH2  ARG  43          2HH2      ARG  43   6.090  14.341   8.773
  382    H    TYR  44           H        TYR  44   2.382  11.737  -0.380
  383    HA   TYR  44           HA       TYR  44   4.043  12.407  -2.677
  384   1HB   TYR  44          2HB       TYR  44   2.063  10.211  -2.188
  385   2HB   TYR  44          1HB       TYR  44   2.703  10.491  -3.789
  386    HD1  TYR  44           1HD      TYR  44   3.512   9.543  -0.386
  387    HD2  TYR  44           2HD      TYR  44   4.902   9.749  -4.364
  388    HE1  TYR  44           1HE      TYR  44   5.407   8.097   0.217
  389    HE2  TYR  44           2HE      TYR  44   6.813   8.292  -3.794
  390    HH   TYR  44           HH       TYR  44   8.078   7.592  -1.830
  391    H    ARG  45           H        ARG  45   0.750  12.826  -1.604
  392    HA   ARG  45           HA       ARG  45  -1.068  13.698  -2.412
  393   1HB   ARG  45          2HB       ARG  45   0.610  15.648  -2.252
  394   2HB   ARG  45          1HB       ARG  45   0.701  15.562  -3.997
  395   1HG   ARG  45          2HG       ARG  45  -1.807  15.978  -2.447
  396   2HG   ARG  45          1HG       ARG  45  -0.837  17.317  -3.064
  397   1HD   ARG  45          2HD       ARG  45  -1.259  16.489  -5.366
  398   2HD   ARG  45          1HD       ARG  45  -2.233  15.175  -4.704
  399    HE   ARG  45           HE       ARG  45  -3.193  17.641  -3.778
  400   1HH1  ARG  45          1HH1      ARG  45  -3.112  15.752  -6.806
  401   2HH1  ARG  45          2HH1      ARG  45  -4.556  16.417  -7.392
  402   1HH2  ARG  45          1HH2      ARG  45  -5.150  18.484  -4.574
  403   2HH2  ARG  45          2HH2      ARG  45  -5.778  17.987  -6.094
  404    H    GLY  46           H        GLY  46  -1.688  11.832  -3.565
  405   1HA   GLY  46          2HA       GLY  46  -2.846  11.058  -5.382
  406   2HA   GLY  46          1HA       GLY  46  -2.246  12.409  -6.329
  407    H    GLN  47           H        GLN  47   0.385  11.158  -4.981
  408    HA   GLN  47           HA       GLN  47   0.849   9.361  -7.203
  409   1HB   GLN  47          2HB       GLN  47   2.773  10.991  -5.573
  410   2HB   GLN  47          1HB       GLN  47   3.359   9.515  -6.336
  411   1HG   GLN  47          2HG       GLN  47   3.882  11.450  -7.669
  412   2HG   GLN  47          1HG       GLN  47   2.708  10.456  -8.512
  413   1HE2  GLN  47          1HE2      GLN  47   0.659  11.271  -8.849
  414   2HE2  GLN  47          2HE2      GLN  47   0.268  12.937  -8.631
  415    H    GLU  48           H        GLU  48   2.140   7.408  -6.790
  416    HA   GLU  48           HA       GLU  48   0.752   6.089  -4.610
  417   1HB   GLU  48          2HB       GLU  48   2.395   4.880  -6.834
  418   2HB   GLU  48          1HB       GLU  48   1.335   4.024  -5.723
  419   1HG   GLU  48          2HG       GLU  48  -0.587   5.267  -6.648
  420   2HG   GLU  48          1HG       GLU  48   0.521   6.036  -7.781
  421    H    HIS  49           H        HIS  49   1.744   4.785  -3.172
  422    HA   HIS  49           HA       HIS  49   4.551   5.451  -2.542
  423   1HB   HIS  49          2HB       HIS  49   2.453   4.044  -0.854
  424   2HB   HIS  49          1HB       HIS  49   4.091   4.376  -0.330
  425    HD1  HIS  49           1HD      HIS  49   3.917   6.180   1.454
  426    HD2  HIS  49           2HD      HIS  49   1.312   6.829  -1.728
  427    HE1  HIS  49           1HE      HIS  49   2.693   8.257   2.018
  428    HE2  HIS  49           2HE      HIS  49   0.987   8.541   0.202
  429    H    CYS  50           H        CYS  50   6.043   3.716  -2.227
  430    HA   CYS  50           HA       CYS  50   5.032   1.201  -3.278
  431   1HB   CYS  50          2HB       CYS  50   7.400   0.852  -4.106
  432   2HB   CYS  50          1HB       CYS  50   6.485   2.102  -4.935
  433    H    LEU  51           H        LEU  51   5.153  -0.464  -1.985
  434    HA   LEU  51           HA       LEU  51   6.973  -0.307   0.268
  435   1HB   LEU  51          2HB       LEU  51   4.127  -1.037   0.130
  436   2HB   LEU  51          1HB       LEU  51   5.063  -1.833   1.362
  437    HG   LEU  51           HG       LEU  51   4.724   1.120   0.985
  438   1HD1  LEU  51          1HD1      LEU  51   3.332   0.971   3.055
  439   2HD1  LEU  51          2HD1      LEU  51   3.564  -0.778   3.060
  440   3HD1  LEU  51          3HD1      LEU  51   2.657  -0.013   1.755
  441   1HD2  LEU  51          1HD2      LEU  51   6.851   0.637   2.039
  442   2HD2  LEU  51          2HD2      LEU  51   6.055  -0.416   3.209
  443   3HD2  LEU  51          3HD2      LEU  51   5.748   1.317   3.227
  444    H    HIS  52           H        HIS  52   7.917  -2.008   0.907
  445    HA   HIS  52           HA       HIS  52   8.097  -4.174  -1.060
  446   1HB   HIS  52          2HB       HIS  52  10.190  -2.932  -0.309
  447   2HB   HIS  52          1HB       HIS  52   9.977  -3.676   1.274
  448    HD1  HIS  52           1HD      HIS  52  11.433  -5.671   1.537
  449    HD2  HIS  52           2HD      HIS  52  10.342  -5.072  -2.421
  450    HE1  HIS  52           1HE      HIS  52  12.399  -7.586   0.269
  451    HE2  HIS  52           2HE      HIS  52  12.104  -6.898  -2.141
  452    HA   PRO  53           HA       PRO  53   5.298  -6.351   1.639
  453   1HB   PRO  53          2HB       PRO  53   5.208  -8.664   0.285
  454   2HB   PRO  53          1HB       PRO  53   4.386  -7.190  -0.272
  455   1HG   PRO  53          2HG       PRO  53   7.019  -8.354  -1.119
  456   2HG   PRO  53          1HG       PRO  53   5.724  -7.682  -2.128
  457   1HD   PRO  53          2HD       PRO  53   7.928  -6.263  -1.514
  458   2HD   PRO  53          1HD       PRO  53   6.332  -5.495  -1.666
  459    H    LYS  54           H        LYS  54   8.495  -7.023   1.596
  460    HA   LYS  54           HA       LYS  54   8.324  -9.602   2.765
  461   1HB   LYS  54          2HB       LYS  54  10.699  -7.810   2.460
  462   2HB   LYS  54          1HB       LYS  54  10.773  -9.469   3.056
  463   1HG   LYS  54          2HG       LYS  54   9.757  -8.610   0.362
  464   2HG   LYS  54          1HG       LYS  54  11.318  -9.337   0.733
  465   1HD   LYS  54          2HD       LYS  54  10.347 -11.356   1.369
  466   2HD   LYS  54          1HD       LYS  54   8.696 -10.705   1.310
  467   1HE   LYS  54          2HE       LYS  54   8.916 -10.294  -0.956
  468   2HE   LYS  54          1HE       LYS  54  10.570 -10.942  -1.034
  469   1HZ   LYS  54          1HZ       LYS  54   9.458 -13.107  -0.207
  470   2HZ   LYS  54          2HZ       LYS  54   9.075 -12.653  -1.797
  471   3HZ   LYS  54          3HZ       LYS  54   7.991 -12.336  -0.575
  472    H    LEU  55           H        LEU  55   8.065  -6.441   3.934
  473    HA   LEU  55           HA       LEU  55   9.217  -6.881   6.555
  474   1HB   LEU  55          2HB       LEU  55   7.737  -4.533   5.403
  475   2HB   LEU  55          1HB       LEU  55   8.425  -4.577   7.010
  476    HG   LEU  55           HG       LEU  55   9.990  -4.800   4.448
  477   1HD1  LEU  55          1HD1      LEU  55  10.800  -2.564   5.029
  478   2HD1  LEU  55          2HD1      LEU  55   9.707  -2.530   6.411
  479   3HD1  LEU  55          3HD1      LEU  55   9.053  -2.577   4.776
  480   1HD2  LEU  55          1HD2      LEU  55  10.864  -4.618   7.325
  481   2HD2  LEU  55          2HD2      LEU  55  11.925  -4.509   5.931
  482   3HD2  LEU  55          3HD2      LEU  55  11.061  -6.010   6.256
  483    H    GLN  56           H        GLN  56   8.186  -7.118   8.418
  484    HA   GLN  56           HA       GLN  56   5.744  -8.500   8.521
  485   1HB   GLN  56          2HB       GLN  56   7.524  -8.708  10.196
  486   2HB   GLN  56          1HB       GLN  56   7.226  -7.059  10.717
  487   1HG   GLN  56          2HG       GLN  56   4.940  -7.729  11.382
  488   2HG   GLN  56          1HG       GLN  56   5.340  -9.392  10.952
  489   1HE2  GLN  56          1HE2      GLN  56   5.017 -10.095  13.054
  490   2HE2  GLN  56          2HE2      GLN  56   6.112  -9.742  14.327
  491    H    SER  57           H        SER  57   6.448  -5.079   9.163
  492    HA   SER  57           HA       SER  57   3.844  -4.548  10.200
  493   1HB   SER  57          2HB       SER  57   5.895  -3.166  10.700
  494   2HB   SER  57          1HB       SER  57   5.789  -2.545   9.050
  495    HG   SER  57           HG       SER  57   3.587  -1.848   9.651
  496    H    THR  58           H        THR  58   5.171  -4.658   6.994
  497    HA   THR  58           HA       THR  58   3.232  -3.181   5.663
  498    HB   THR  58           HB       THR  58   4.759  -5.613   4.655
  499    HG1  THR  58           1HG      THR  58   6.215  -3.862   3.904
  500   1HG2  THR  58          1HG2      THR  58   2.969  -4.834   3.157
  501   2HG2  THR  58          2HG2      THR  58   4.558  -4.497   2.469
  502   3HG2  THR  58          3HG2      THR  58   3.629  -3.200   3.218
  503    H    LYS  59           H        LYS  59   3.351  -6.540   6.839
  504    HA   LYS  59           HA       LYS  59   1.141  -7.546   5.505
  505   1HB   LYS  59          2HB       LYS  59   2.458  -8.353   8.059
  506   2HB   LYS  59          1HB       LYS  59   0.958  -9.126   7.549
  507   1HG   LYS  59          2HG       LYS  59   2.792 -10.466   6.865
  508   2HG   LYS  59          1HG       LYS  59   2.077  -9.717   5.443
  509   1HD   LYS  59          2HD       LYS  59   3.840  -8.045   5.430
  510   2HD   LYS  59          1HD       LYS  59   4.572  -8.802   6.843
  511   1HE   LYS  59          2HE       LYS  59   5.710  -9.506   4.827
  512   2HE   LYS  59          1HE       LYS  59   4.865 -10.865   5.566
  513   1HZ   LYS  59          1HZ       LYS  59   3.850  -9.278   3.271
  514   2HZ   LYS  59          2HZ       LYS  59   3.105 -10.630   3.944
  515   3HZ   LYS  59          3HZ       LYS  59   4.581 -10.788   3.164
  516    H    ARG  60           H        ARG  60   1.145  -5.851   8.701
  517    HA   ARG  60           HA       ARG  60  -1.597  -6.295   8.894
  518   1HB   ARG  60          2HB       ARG  60   0.131  -4.269  10.232
  519   2HB   ARG  60          1HB       ARG  60  -1.601  -4.337  10.455
  520   1HG   ARG  60          2HG       ARG  60  -0.776  -5.428  12.288
  521   2HG   ARG  60          1HG       ARG  60  -1.202  -6.737  11.200
  522   1HD   ARG  60          2HD       ARG  60   0.991  -7.154  12.194
  523   2HD   ARG  60          1HD       ARG  60   1.162  -6.867  10.459
  524    HE   ARG  60           HE       ARG  60   1.577  -4.430  11.303
  525   1HH1  ARG  60          1HH1      ARG  60   2.765  -7.402  12.781
  526   2HH1  ARG  60          2HH1      ARG  60   4.137  -6.694  13.473
  527   1HH2  ARG  60          1HH2      ARG  60   3.497  -3.427  12.206
  528   2HH2  ARG  60          2HH2      ARG  60   4.572  -4.370  13.114
  529    H    PHE  61           H        PHE  61   0.266  -3.505   7.749
  530    HA   PHE  61           HA       PHE  61  -1.961  -1.862   7.448
  531   1HB   PHE  61          2HB       PHE  61   0.480  -1.192   7.207
  532   2HB   PHE  61          1HB       PHE  61   0.340  -1.857   5.571
  533    HD1  PHE  61           1HD      PHE  61  -0.871  -0.657   3.819
  534    HD2  PHE  61           2HD      PHE  61  -0.765   0.898   7.786
  535    HE1  PHE  61           1HE      PHE  61  -1.776   1.487   3.014
  536    HE2  PHE  61           2HE      PHE  61  -1.682   3.055   6.950
  537    HZ   PHE  61           HZ       PHE  61  -2.172   3.337   4.599
  538    H    ILE  62           H        ILE  62  -0.559  -4.151   5.169
  539    HA   ILE  62           HA       ILE  62  -2.338  -3.556   3.045
  540    HB   ILE  62           HB       ILE  62  -0.704  -6.042   3.586
  541   1HG1  ILE  62          2HG1      ILE  62   0.713  -4.126   3.341
  542   2HG1  ILE  62          1HG1      ILE  62   0.819  -5.066   1.860
  543   1HG2  ILE  62          1HG2      ILE  62  -2.553  -6.536   2.108
  544   2HG2  ILE  62          2HG2      ILE  62  -1.011  -6.639   1.246
  545   3HG2  ILE  62          3HG2      ILE  62  -2.074  -5.239   1.024
  546   1HD1  ILE  62          1HD1      ILE  62  -0.823  -2.582   2.269
  547   2HD1  ILE  62          2HD1      ILE  62  -0.669  -3.483   0.755
  548   3HD1  ILE  62          3HD1      ILE  62   0.731  -2.657   1.439
  549    H    LYS  63           H        LYS  63  -2.338  -6.114   5.452
  550    HA   LYS  63           HA       LYS  63  -4.797  -7.155   4.443
  551   1HB   LYS  63          2HB       LYS  63  -2.968  -7.959   6.597
  552   2HB   LYS  63          1HB       LYS  63  -4.653  -8.348   6.876
  553   1HG   LYS  63          2HG       LYS  63  -3.432 -10.191   5.760
  554   2HG   LYS  63          1HG       LYS  63  -4.802  -9.594   4.830
  555   1HD   LYS  63          2HD       LYS  63  -3.041  -9.944   3.287
  556   2HD   LYS  63          1HD       LYS  63  -3.129  -8.203   3.525
  557   1HE   LYS  63          2HE       LYS  63  -0.831  -8.868   3.521
  558   2HE   LYS  63          1HE       LYS  63  -1.273  -8.409   5.164
  559   1HZ   LYS  63          1HZ       LYS  63  -1.499 -10.759   5.732
  560   2HZ   LYS  63          2HZ       LYS  63   0.019 -10.505   5.056
  561   3HZ   LYS  63          3HZ       LYS  63  -1.199 -11.194   4.159
  562    H    TRP  64           H        TRP  64  -4.037  -4.874   6.812
  563    HA   TRP  64           HA       TRP  64  -6.604  -4.848   8.077
  564   1HB   TRP  64          2HB       TRP  64  -4.214  -3.896   8.818
  565   2HB   TRP  64          1HB       TRP  64  -4.799  -2.461   8.000
  566    HD1  TRP  64           HD       TRP  64  -4.912  -4.288  11.214
  567    HE1  TRP  64           1HE      TRP  64  -6.497  -3.100  12.871
  568    HE3  TRP  64           3HE      TRP  64  -7.210  -1.030   7.994
  569    HZ2  TRP  64           2HZ      TRP  64  -8.448  -1.063  12.817
  570    HZ3  TRP  64           3HZ      TRP  64  -8.914   0.498   8.883
  571    HH2  TRP  64           HH       TRP  64  -9.518   0.481  11.242
  572    H    TYR  65           H        TYR  65  -4.943  -3.142   5.342
  573    HA   TYR  65           HA       TYR  65  -7.013  -1.343   4.868
  574   1HB   TYR  65          2HB       TYR  65  -4.811  -1.038   3.786
  575   2HB   TYR  65          1HB       TYR  65  -5.085  -2.493   2.824
  576    HD1  TYR  65           1HD      TYR  65  -6.139  -2.293   0.706
  577    HD2  TYR  65           2HD      TYR  65  -6.611   0.806   3.569
  578    HE1  TYR  65           1HE      TYR  65  -7.401  -0.943  -0.953
  579    HE2  TYR  65           2HE      TYR  65  -7.868   2.137   1.917
  580    HH   TYR  65           HH       TYR  65  -8.119   2.330  -0.449
  581    H    ASN  66           H        ASN  66  -6.506  -4.637   3.874
  582    HA   ASN  66           HA       ASN  66  -8.537  -4.812   1.976
  583   1HB   ASN  66          2HB       ASN  66  -7.567  -6.962   3.856
  584   2HB   ASN  66          1HB       ASN  66  -8.650  -7.256   2.499
  585   1HD2  ASN  66          1HD2      ASN  66  -6.016  -8.367   2.949
  586   2HD2  ASN  66          2HD2      ASN  66  -5.043  -7.865   1.616
  587    H    ALA  67           H        ALA  67  -8.789  -4.948   5.456
  588    HA   ALA  67           HA       ALA  67 -11.568  -5.674   5.493
  589   1HB   ALA  67          1HB       ALA  67  -9.867  -4.411   7.653
  590   2HB   ALA  67          2HB       ALA  67 -10.086  -6.140   7.400
  591   3HB   ALA  67          3HB       ALA  67 -11.455  -5.141   7.886
  592    H    TRP  68           H        TRP  68  -9.776  -2.681   6.073
  593    HA   TRP  68           HA       TRP  68 -11.943  -0.939   6.335
  594   1HB   TRP  68          2HB       TRP  68  -9.929  -0.053   7.057
  595   2HB   TRP  68          1HB       TRP  68  -9.054  -0.625   5.647
  596    HD1  TRP  68           HD       TRP  68  -8.631   1.036   3.801
  597    HE1  TRP  68           1HE      TRP  68  -9.262   3.439   3.298
  598    HE3  TRP  68           3HE      TRP  68 -12.128   1.717   7.456
  599    HZ2  TRP  68           2HZ      TRP  68 -11.012   5.388   4.269
  600    HZ3  TRP  68           3HZ      TRP  68 -13.242   3.914   7.582
  601    HH2  TRP  68           HH       TRP  68 -12.655   5.721   5.974
  602    H    ASN  69           H        ASN  69 -10.299  -2.106   3.507
  603    HA   ASN  69           HA       ASN  69 -11.333  -0.367   1.596
  604   1HB   ASN  69          2HB       ASN  69  -9.466  -2.057   1.300
  605   2HB   ASN  69          1HB       ASN  69 -10.713  -3.291   1.171
  606   1HD2  ASN  69          1HD2      ASN  69 -10.271  -3.821  -0.912
  607   2HD2  ASN  69          2HD2      ASN  69 -10.539  -2.784  -2.259
  608    H    GLU  70           H        GLU  70 -12.517  -3.467   2.834
  609    HA   GLU  70           HA       GLU  70 -14.902  -3.565   1.249
  610   1HB   GLU  70          2HB       GLU  70 -14.324  -4.794   3.951
  611   2HB   GLU  70          1HB       GLU  70 -15.651  -5.221   2.891
  612   1HG   GLU  70          2HG       GLU  70 -14.101  -6.113   1.265
  613   2HG   GLU  70          1HG       GLU  70 -12.740  -5.603   2.271
  614    H    LYS  71           H        LYS  71 -14.062  -2.096   4.303
  615    HA   LYS  71           HA       LYS  71 -16.675  -1.528   5.147
  616   1HB   LYS  71          2HB       LYS  71 -14.748  -1.557   6.661
  617   2HB   LYS  71          1HB       LYS  71 -14.036  -0.219   5.789
  618   1HG   LYS  71          2HG       LYS  71 -15.015   0.498   7.892
  619   2HG   LYS  71          1HG       LYS  71 -15.801   1.245   6.499
  620   1HD   LYS  71          2HD       LYS  71 -17.452   0.546   8.178
  621   2HD   LYS  71          1HD       LYS  71 -17.656  -0.346   6.675
  622   1HE   LYS  71          2HE       LYS  71 -16.414  -2.237   7.662
  623   2HE   LYS  71          1HE       LYS  71 -16.259  -1.329   9.163
  624   1HZ   LYS  71          1HZ       LYS  71 -18.678  -1.312   9.330
  625   2HZ   LYS  71          2HZ       LYS  71 -18.103  -2.898   9.248
  626   3HZ   LYS  71          3HZ       LYS  71 -18.799  -2.189   7.908
  627    H    ARG  72           H        ARG  72 -14.475   0.069   2.990
  628    HA   ARG  72           HA       ARG  72 -16.249   2.372   2.859
  629   1HB   ARG  72          2HB       ARG  72 -14.522   3.426   1.436
  630   2HB   ARG  72          1HB       ARG  72 -13.970   2.997   3.050
  631   1HG   ARG  72          2HG       ARG  72 -12.776   1.125   2.194
  632   2HG   ARG  72          1HG       ARG  72 -13.463   1.364   0.582
  633   1HD   ARG  72          2HD       ARG  72 -11.804   3.367   2.043
  634   2HD   ARG  72          1HD       ARG  72 -11.142   2.237   0.844
  635    HE   ARG  72           HE       ARG  72 -13.330   3.636  -0.248
  636   1HH1  ARG  72          1HH1      ARG  72  -9.963   4.171   0.632
  637   2HH1  ARG  72          2HH1      ARG  72  -9.739   5.462  -0.422
  638   1HH2  ARG  72          1HH2      ARG  72 -13.016   5.376  -1.760
  639   2HH2  ARG  72          2HH2      ARG  72 -11.515   6.150  -1.844
  640    H    ARG  73           H        ARG  73 -15.442  -0.422   0.919
  641    HA   ARG  73           HA       ARG  73 -17.053   0.787  -1.227
  642   1HB   ARG  73          2HB       ARG  73 -15.811  -0.340  -2.895
  643   2HB   ARG  73          1HB       ARG  73 -14.666   0.446  -1.822
  644   1HG   ARG  73          2HG       ARG  73 -14.108  -1.672  -0.831
  645   2HG   ARG  73          1HG       ARG  73 -15.349  -2.482  -1.801
  646   1HD   ARG  73          2HD       ARG  73 -13.269  -2.795  -2.925
  647   2HD   ARG  73          1HD       ARG  73 -14.250  -1.603  -3.802
  648    HE   ARG  73           HE       ARG  73 -12.084  -0.853  -1.975
  649   1HH1  ARG  73          1HH1      ARG  73 -13.770  -0.361  -5.029
  650   2HH1  ARG  73          2HH1      ARG  73 -12.703   0.850  -5.573
  651   1HH2  ARG  73          1HH2      ARG  73 -10.626   0.745  -2.702
  652   2HH2  ARG  73          2HH2      ARG  73 -10.799   1.490  -4.200
  653    H    VAL  74           H        VAL  74 -17.849  -0.771   1.058
  654    HA   VAL  74           HA       VAL  74 -18.560  -3.313   1.085
  655    HB   VAL  74           HB       VAL  74 -20.761  -1.319   1.092
  656   1HG1  VAL  74          1HG1      VAL  74 -20.465  -3.903   2.607
  657   2HG1  VAL  74          2HG1      VAL  74 -21.546  -3.568   1.257
  658   3HG1  VAL  74          3HG1      VAL  74 -21.803  -2.769   2.808
  659   1HG2  VAL  74          1HG2      VAL  74 -20.348  -0.949   3.510
  660   2HG2  VAL  74          2HG2      VAL  74 -19.032  -0.375   2.484
  661   3HG2  VAL  74          3HG2      VAL  74 -18.866  -1.892   3.368
  662    H    TYR  75           H        TYR  75 -18.879  -4.598  -0.449
  663    HA   TYR  75           HA       TYR  75 -19.695  -3.901  -3.046
  664   1HB   TYR  75          2HB       TYR  75 -19.338  -6.640  -1.847
  665   2HB   TYR  75          1HB       TYR  75 -19.627  -6.335  -3.556
  666    HD1  TYR  75           1HD      TYR  75 -17.164  -6.340  -0.892
  667    HD2  TYR  75           2HD      TYR  75 -17.934  -5.084  -4.882
  668    HE1  TYR  75           1HE      TYR  75 -14.758  -6.001  -1.243
  669    HE2  TYR  75           2HE      TYR  75 -15.534  -4.749  -5.245
  670    HH   TYR  75           HH       TYR  75 -13.187  -5.923  -3.090
  671    H    GLU  76           H        GLU  76 -21.458  -3.934  -4.099
  672    HA   GLU  76           HA       GLU  76 -23.593  -3.988  -4.648
  673   1HB   GLU  76          2HB       GLU  76 -23.919  -6.123  -2.527
  674   2HB   GLU  76          1HB       GLU  76 -25.126  -5.683  -3.729
  675   1HG   GLU  76          2HG       GLU  76 -23.649  -6.414  -5.509
  676   2HG   GLU  76          1HG       GLU  76 -22.410  -6.828  -4.323
  677    H    GLU  77           H        GLU  77 -24.730  -2.324  -4.281
  678    HA   GLU  77           HA       GLU  77 -24.827  -1.048  -1.738
  679   1HB   GLU  77          2HB       GLU  77 -26.277  -0.413  -4.318
  680   2HB   GLU  77          1HB       GLU  77 -26.186   0.648  -2.919
  681   1HG   GLU  77          2HG       GLU  77 -23.775   0.822  -3.176
  682   2HG   GLU  77          1HG       GLU  77 -23.827  -0.282  -4.548
  Start of MODEL   14
    1    H    SER   1           H        SER   1  20.202  -4.124  -8.881
    2    HA   SER   1           HA       SER   1  17.748  -4.935 -10.124
    3   1HB   SER   1          2HB       SER   1  20.015  -6.580  -8.996
    4   2HB   SER   1          1HB       SER   1  18.671  -7.213  -9.951
    5    HG   SER   1           HG       SER   1  20.093  -5.054 -10.976
    6    H    LYS   2           H        LYS   2  18.903  -4.526  -6.923
    7    HA   LYS   2           HA       LYS   2  16.803  -6.134  -5.765
    8   1HB   LYS   2          2HB       LYS   2  19.002  -5.998  -4.618
    9   2HB   LYS   2          1HB       LYS   2  18.805  -4.262  -4.488
   10   1HG   LYS   2          2HG       LYS   2  18.333  -5.287  -2.361
   11   2HG   LYS   2          1HG       LYS   2  16.870  -4.578  -3.021
   12   1HD   LYS   2          2HD       LYS   2  16.408  -6.755  -2.012
   13   2HD   LYS   2          1HD       LYS   2  16.127  -6.811  -3.751
   14   1HE   LYS   2          2HE       LYS   2  18.302  -7.885  -4.074
   15   2HE   LYS   2          1HE       LYS   2  18.624  -7.759  -2.351
   16   1HZ   LYS   2          1HZ       LYS   2  16.360  -9.291  -3.514
   17   2HZ   LYS   2          2HZ       LYS   2  16.880  -9.322  -1.897
   18   3HZ   LYS   2          3HZ       LYS   2  17.835  -9.972  -3.102
   19    H    CYS   3           H        CYS   3  14.889  -5.275  -6.093
   20    HA   CYS   3           HA       CYS   3  14.314  -2.508  -6.321
   21   1HB   CYS   3          2HB       CYS   3  12.439  -4.784  -5.715
   22   2HB   CYS   3          1HB       CYS   3  12.013  -3.221  -6.399
   23    H    LYS   4           H        LYS   4  14.222  -1.121  -4.660
   24    HA   LYS   4           HA       LYS   4  13.653  -2.210  -1.972
   25   1HB   LYS   4          2HB       LYS   4  15.324   0.204  -2.623
   26   2HB   LYS   4          1HB       LYS   4  15.156  -0.585  -1.066
   27   1HG   LYS   4          2HG       LYS   4  16.334  -2.528  -1.902
   28   2HG   LYS   4          1HG       LYS   4  16.444  -1.793  -3.500
   29   1HD   LYS   4          2HD       LYS   4  17.701   0.095  -2.445
   30   2HD   LYS   4          1HD       LYS   4  17.735  -0.835  -0.949
   31   1HE   LYS   4          2HE       LYS   4  19.805  -1.180  -2.139
   32   2HE   LYS   4          1HE       LYS   4  18.865  -2.671  -2.168
   33   1HZ   LYS   4          1HZ       LYS   4  19.047  -0.692  -4.360
   34   2HZ   LYS   4          2HZ       LYS   4  18.145  -2.094  -4.457
   35   3HZ   LYS   4          3HZ       LYS   4  19.838  -2.166  -4.335
   36    H    CYS   5           H        CYS   5  13.487   0.668  -4.061
   37    HA   CYS   5           HA       CYS   5  12.131   2.439  -4.217
   38   1HB   CYS   5          2HB       CYS   5  10.360   0.991  -2.223
   39   2HB   CYS   5          1HB       CYS   5   9.956   2.551  -2.916
   40    H    SER   6           H        SER   6  12.353   1.403  -0.861
   41    HA   SER   6           HA       SER   6  13.952   3.571  -0.084
   42   1HB   SER   6          2HB       SER   6  11.647   4.665  -0.196
   43   2HB   SER   6          1HB       SER   6  11.090   3.479   0.975
   44    HG   SER   6           HG       SER   6  12.479   5.758   1.322
   45    H    ARG   7           H        ARG   7  14.174   3.203   2.455
   46    HA   ARG   7           HA       ARG   7  14.485   0.414   2.815
   47   1HB   ARG   7          2HB       ARG   7  15.902   2.090   4.005
   48   2HB   ARG   7          1HB       ARG   7  14.506   2.550   4.971
   49   1HG   ARG   7          2HG       ARG   7  15.963   1.044   6.199
   50   2HG   ARG   7          1HG       ARG   7  14.393   0.291   5.889
   51   1HD   ARG   7          2HD       ARG   7  15.355  -0.889   3.963
   52   2HD   ARG   7          1HD       ARG   7  16.923  -0.164   4.307
   53    HE   ARG   7           HE       ARG   7  16.152  -1.453   6.593
   54   1HH1  ARG   7          1HH1      ARG   7  16.728  -2.359   3.203
   55   2HH1  ARG   7          2HH1      ARG   7  17.237  -3.941   3.598
   56   1HH2  ARG   7          1HH2      ARG   7  16.847  -3.647   7.074
   57   2HH2  ARG   7          2HH2      ARG   7  17.313  -4.676   5.769
   58    H    LYS   8           H        LYS   8  12.208   2.795   3.917
   59    HA   LYS   8           HA       LYS   8  10.172   0.738   4.163
   60   1HB   LYS   8          2HB       LYS   8  10.663   2.878   6.255
   61   2HB   LYS   8          1HB       LYS   8   9.259   1.835   6.194
   62   1HG   LYS   8          2HG       LYS   8  10.747  -0.113   6.560
   63   2HG   LYS   8          1HG       LYS   8  12.107   1.000   6.716
   64   1HD   LYS   8          2HD       LYS   8  11.009   2.090   8.600
   65   2HD   LYS   8          1HD       LYS   8   9.632   1.003   8.433
   66   1HE   LYS   8          2HE       LYS   8  11.114  -0.905   8.893
   67   2HE   LYS   8          1HE       LYS   8  12.461   0.212   9.109
   68   1HZ   LYS   8          1HZ       LYS   8   9.988   0.144  10.737
   69   2HZ   LYS   8          2HZ       LYS   8  11.265   1.226  10.956
   70   3HZ   LYS   8          3HZ       LYS   8  11.497  -0.420  11.229
   71    H    GLY   9           H        GLY   9   8.627   1.356   2.790
   72   1HA   GLY   9          2HA       GLY   9   8.370   3.981   1.753
   73   2HA   GLY   9          1HA       GLY   9   7.148   2.736   1.615
   74    HA   PRO  10           HA       PRO  10   6.815   5.970   5.433
   75   1HB   PRO  10          2HB       PRO  10   5.239   7.531   3.437
   76   2HB   PRO  10          1HB       PRO  10   6.210   8.107   4.801
   77   1HG   PRO  10          2HG       PRO  10   7.160   8.268   2.335
   78   2HG   PRO  10          1HG       PRO  10   8.213   7.785   3.680
   79   1HD   PRO  10          2HD       PRO  10   7.024   6.114   1.518
   80   2HD   PRO  10          1HD       PRO  10   8.587   5.957   2.347
   81    H    LYS  11           H        LYS  11   5.157   5.694   6.743
   82    HA   LYS  11           HA       LYS  11   3.052   4.026   5.867
   83   1HB   LYS  11          2HB       LYS  11   3.701   5.175   8.574
   84   2HB   LYS  11          1HB       LYS  11   2.304   4.138   8.290
   85   1HG   LYS  11          2HG       LYS  11   3.764   2.334   7.513
   86   2HG   LYS  11          1HG       LYS  11   5.170   3.364   7.738
   87   1HD   LYS  11          2HD       LYS  11   3.300   2.540   9.961
   88   2HD   LYS  11          1HD       LYS  11   4.780   1.672   9.558
   89   1HE   LYS  11          2HE       LYS  11   6.080   3.698  10.013
   90   2HE   LYS  11          1HE       LYS  11   4.595   4.559  10.404
   91   1HZ   LYS  11          1HZ       LYS  11   5.654   2.193  11.861
   92   2HZ   LYS  11          2HZ       LYS  11   4.265   3.036  12.292
   93   3HZ   LYS  11          3HZ       LYS  11   5.793   3.750  12.397
   94    H    ILE  12           H        ILE  12   0.932   4.339   5.875
   95    HA   ILE  12           HA       ILE  12  -0.042   7.086   5.559
   96    HB   ILE  12           HB       ILE  12  -0.466   4.774   3.638
   97   1HG1  ILE  12          2HG1      ILE  12   1.190   7.251   3.211
   98   2HG1  ILE  12          1HG1      ILE  12   1.866   5.689   3.661
   99   1HG2  ILE  12          1HG2      ILE  12  -1.194   7.709   3.445
  100   2HG2  ILE  12          2HG2      ILE  12  -2.331   6.377   3.693
  101   3HG2  ILE  12          3HG2      ILE  12  -1.429   6.509   2.178
  102   1HD1  ILE  12          1HD1      ILE  12   2.019   6.164   1.285
  103   2HD1  ILE  12          2HD1      ILE  12   0.262   6.260   1.213
  104   3HD1  ILE  12          3HD1      ILE  12   1.056   4.727   1.635
  105    H    ARG  13           H        ARG  13  -2.252   7.221   6.059
  106    HA   ARG  13           HA       ARG  13  -3.263   4.939   7.496
  107   1HB   ARG  13          2HB       ARG  13  -5.178   6.207   7.945
  108   2HB   ARG  13          1HB       ARG  13  -3.727   7.089   8.390
  109   1HG   ARG  13          2HG       ARG  13  -3.956   8.422   6.264
  110   2HG   ARG  13          1HG       ARG  13  -5.469   7.578   5.960
  111   1HD   ARG  13          2HD       ARG  13  -6.402   8.482   8.032
  112   2HD   ARG  13          1HD       ARG  13  -4.872   9.308   8.338
  113    HE   ARG  13           HE       ARG  13  -5.811  10.080   5.824
  114   1HH1  ARG  13          1HH1      ARG  13  -6.628  10.557   9.264
  115   2HH1  ARG  13          2HH1      ARG  13  -7.405  12.034   8.989
  116   1HH2  ARG  13          1HH2      ARG  13  -6.856  12.153   5.502
  117   2HH2  ARG  13          2HH2      ARG  13  -7.522  12.971   6.837
  118    H    TYR  14           H        TYR  14  -5.237   3.923   7.050
  119    HA   TYR  14           HA       TYR  14  -5.394   2.953   4.415
  120   1HB   TYR  14          2HB       TYR  14  -7.486   2.750   6.590
  121   2HB   TYR  14          1HB       TYR  14  -7.285   1.674   5.212
  122    HD1  TYR  14           1HD      TYR  14  -6.231   2.443   8.578
  123    HD2  TYR  14           2HD      TYR  14  -5.254   0.210   5.095
  124    HE1  TYR  14           1HE      TYR  14  -4.714   1.047   9.907
  125    HE2  TYR  14           2HE      TYR  14  -3.758  -1.185   6.405
  126    HH   TYR  14           HH       TYR  14  -3.758  -1.254   9.759
  127    H    SER  15           H        SER  15  -7.060   5.444   6.144
  128    HA   SER  15           HA       SER  15  -9.281   5.771   4.444
  129   1HB   SER  15          2HB       SER  15  -7.953   7.777   6.229
  130   2HB   SER  15          1HB       SER  15  -9.619   7.843   5.639
  131    HG   SER  15           HG       SER  15 -10.029   6.814   7.419
  132    H    ASP  16           H        ASP  16  -5.990   6.774   4.140
  133    HA   ASP  16           HA       ASP  16  -6.714   8.832   2.209
  134   1HB   ASP  16          2HB       ASP  16  -4.886   9.269   3.886
  135   2HB   ASP  16          1HB       ASP  16  -3.949   7.998   3.109
  136    H    VAL  17           H        VAL  17  -5.759   5.584   2.413
  137    HA   VAL  17           HA       VAL  17  -4.458   5.550  -0.160
  138    HB   VAL  17           HB       VAL  17  -5.444   3.160   1.386
  139   1HG1  VAL  17          1HG1      VAL  17  -5.068   2.594  -0.873
  140   2HG1  VAL  17          2HG1      VAL  17  -3.737   1.929   0.075
  141   3HG1  VAL  17          3HG1      VAL  17  -3.510   3.401  -0.879
  142   1HG2  VAL  17          1HG2      VAL  17  -3.144   2.924   2.207
  143   2HG2  VAL  17          2HG2      VAL  17  -3.882   4.432   2.752
  144   3HG2  VAL  17          3HG2      VAL  17  -2.720   4.447   1.426
  145    H    LYS  18           H        LYS  18  -5.355   5.502  -1.948
  146    HA   LYS  18           HA       LYS  18  -8.238   5.182  -2.246
  147   1HB   LYS  18          2HB       LYS  18  -6.048   6.005  -4.105
  148   2HB   LYS  18          1HB       LYS  18  -7.735   5.903  -4.565
  149   1HG   LYS  18          2HG       LYS  18  -8.303   7.651  -2.979
  150   2HG   LYS  18          1HG       LYS  18  -6.655   7.651  -2.350
  151   1HD   LYS  18          2HD       LYS  18  -7.052   9.539  -3.843
  152   2HD   LYS  18          1HD       LYS  18  -5.823   8.459  -4.504
  153   1HE   LYS  18          2HE       LYS  18  -7.533   7.499  -5.987
  154   2HE   LYS  18          1HE       LYS  18  -8.730   8.609  -5.311
  155   1HZ   LYS  18          1HZ       LYS  18  -7.368  10.456  -6.118
  156   2HZ   LYS  18          2HZ       LYS  18  -7.837   9.445  -7.390
  157   3HZ   LYS  18          3HZ       LYS  18  -6.269   9.377  -6.778
  158    H    LYS  19           H        LYS  19  -5.296   3.595  -3.054
  159    HA   LYS  19           HA       LYS  19  -6.735   1.376  -4.253
  160   1HB   LYS  19          2HB       LYS  19  -6.319   2.967  -6.098
  161   2HB   LYS  19          1HB       LYS  19  -4.603   2.898  -5.743
  162   1HG   LYS  19          2HG       LYS  19  -4.636   0.493  -6.197
  163   2HG   LYS  19          1HG       LYS  19  -6.340   0.671  -6.646
  164   1HD   LYS  19          2HD       LYS  19  -4.000   2.056  -7.972
  165   2HD   LYS  19          1HD       LYS  19  -4.840   0.658  -8.633
  166   1HE   LYS  19          2HE       LYS  19  -6.041   3.391  -8.130
  167   2HE   LYS  19          1HE       LYS  19  -5.563   2.745  -9.693
  168   1HZ   LYS  19          1HZ       LYS  19  -7.713   1.651  -7.949
  169   2HZ   LYS  19          2HZ       LYS  19  -7.210   0.997  -9.418
  170   3HZ   LYS  19          3HZ       LYS  19  -7.919   2.524  -9.383
  171    H    LEU  20           H        LEU  20  -5.670  -0.490  -4.010
  172    HA   LEU  20           HA       LEU  20  -2.897  -0.471  -3.056
  173   1HB   LEU  20          2HB       LEU  20  -4.293  -0.957  -1.169
  174   2HB   LEU  20          1HB       LEU  20  -5.264  -2.072  -2.105
  175    HG   LEU  20           HG       LEU  20  -3.384  -3.638  -2.205
  176   1HD1  LEU  20          1HD1      LEU  20  -1.563  -2.041  -2.129
  177   2HD1  LEU  20          2HD1      LEU  20  -1.396  -3.278  -0.881
  178   3HD1  LEU  20          3HD1      LEU  20  -1.967  -1.671  -0.447
  179   1HD2  LEU  20          1HD2      LEU  20  -4.088  -2.716   0.590
  180   2HD2  LEU  20          2HD2      LEU  20  -3.372  -4.275   0.176
  181   3HD2  LEU  20          3HD2      LEU  20  -4.978  -3.859  -0.399
  182    H    GLU  21           H        GLU  21  -1.650  -1.558  -4.480
  183    HA   GLU  21           HA       GLU  21  -2.876  -3.864  -5.842
  184   1HB   GLU  21          2HB       GLU  21  -0.978  -1.859  -7.048
  185   2HB   GLU  21          1HB       GLU  21  -1.423  -3.384  -7.777
  186   1HG   GLU  21          2HG       GLU  21  -3.736  -2.595  -7.933
  187   2HG   GLU  21          1HG       GLU  21  -3.225  -1.040  -7.253
  188    H    MET  22           H        MET  22  -1.669  -5.698  -5.476
  189    HA   MET  22           HA       MET  22   1.088  -5.146  -4.845
  190   1HB   MET  22          2HB       MET  22   1.182  -7.502  -4.054
  191   2HB   MET  22          1HB       MET  22   0.084  -6.512  -3.117
  192   1HG   MET  22          2HG       MET  22  -0.705  -8.500  -5.256
  193   2HG   MET  22          1HG       MET  22  -0.751  -8.801  -3.526
  194   1HE   MET  22          1HE       MET  22  -1.860  -5.972  -2.435
  195   2HE   MET  22          2HE       MET  22  -2.432  -7.535  -1.853
  196   3HE   MET  22          3HE       MET  22  -3.585  -6.310  -2.374
  197    H    LYS  23           H        LYS  23   2.264  -5.094  -6.463
  198    HA   LYS  23           HA       LYS  23   2.597  -7.213  -8.214
  199   1HB   LYS  23          2HB       LYS  23   2.183  -5.858 -10.377
  200   2HB   LYS  23          1HB       LYS  23   0.779  -6.469  -9.539
  201   1HG   LYS  23          2HG       LYS  23   0.244  -4.288 -10.313
  202   2HG   LYS  23          1HG       LYS  23   0.476  -4.163  -8.575
  203   1HD   LYS  23          2HD       LYS  23   2.708  -3.234  -8.950
  204   2HD   LYS  23          1HD       LYS  23   2.488  -3.403 -10.694
  205   1HE   LYS  23          2HE       LYS  23   0.805  -1.689  -8.860
  206   2HE   LYS  23          1HE       LYS  23   2.049  -1.086  -9.962
  207   1HZ   LYS  23          1HZ       LYS  23  -0.056  -0.770 -10.940
  208   2HZ   LYS  23          2HZ       LYS  23  -0.587  -2.310 -10.644
  209   3HZ   LYS  23          3HZ       LYS  23   0.632  -2.031 -11.793
  210    HA   PRO  24           HA       PRO  24   6.556  -5.645  -7.818
  211   1HB   PRO  24          2HB       PRO  24   7.896  -6.682  -9.908
  212   2HB   PRO  24          1HB       PRO  24   7.280  -7.685  -8.594
  213   1HG   PRO  24          2HG       PRO  24   6.071  -7.204 -11.292
  214   2HG   PRO  24          1HG       PRO  24   6.254  -8.732 -10.408
  215   1HD   PRO  24          2HD       PRO  24   3.920  -7.330 -10.447
  216   2HD   PRO  24          1HD       PRO  24   4.435  -8.319  -9.068
  217    H    LYS  25           H        LYS  25   7.656  -3.883  -8.225
  218    HA   LYS  25           HA       LYS  25   6.726  -1.908 -10.028
  219   1HB   LYS  25          2HB       LYS  25   7.805  -1.400  -7.934
  220   2HB   LYS  25          1HB       LYS  25   9.357  -2.081  -8.477
  221   1HG   LYS  25          2HG       LYS  25   9.527   0.261  -8.582
  222   2HG   LYS  25          1HG       LYS  25   9.206  -0.230 -10.248
  223   1HD   LYS  25          2HD       LYS  25   6.813   0.168  -9.837
  224   2HD   LYS  25          1HD       LYS  25   7.207   0.778  -8.252
  225   1HE   LYS  25          2HE       LYS  25   8.626   2.532  -9.207
  226   2HE   LYS  25          1HE       LYS  25   8.233   1.967 -10.830
  227   1HZ   LYS  25          1HZ       LYS  25   5.914   2.533 -10.405
  228   2HZ   LYS  25          2HZ       LYS  25   6.908   3.880 -10.204
  229   3HZ   LYS  25          3HZ       LYS  25   6.306   3.068  -8.859
  230    H    TYR  26           H        TYR  26   9.393  -4.160  -9.981
  231    HA   TYR  26           HA       TYR  26   9.866  -3.829 -12.840
  232   1HB   TYR  26          2HB       TYR  26  11.826  -3.984 -10.562
  233   2HB   TYR  26          1HB       TYR  26  12.354  -4.468 -12.144
  234    HD1  TYR  26           1HD      TYR  26  12.870  -2.870 -13.776
  235    HD2  TYR  26           2HD      TYR  26  11.187  -1.646 -10.081
  236    HE1  TYR  26           1HE      TYR  26  13.442  -0.506 -14.302
  237    HE2  TYR  26           2HE      TYR  26  11.756   0.694 -10.570
  238    HH   TYR  26           HH       TYR  26  13.358   1.917 -11.951
  239    HA   PRO  27           HA       PRO  27   9.211  -8.239 -12.815
  240   1HB   PRO  27          2HB       PRO  27  10.959  -9.055 -14.778
  241   2HB   PRO  27          1HB       PRO  27   9.395  -8.305 -15.113
  242   1HG   PRO  27          2HG       PRO  27  12.117  -7.064 -15.076
  243   2HG   PRO  27          1HG       PRO  27  10.794  -6.816 -16.229
  244   1HD   PRO  27          2HD       PRO  27  11.319  -5.039 -14.280
  245   2HD   PRO  27          1HD       PRO  27   9.658  -5.379 -14.807
  246    H    HIS  28           H        HIS  28  12.296  -6.887 -12.407
  247    HA   HIS  28           HA       HIS  28  13.605  -9.355 -11.546
  248   1HB   HIS  28          2HB       HIS  28  15.668  -7.993 -11.353
  249   2HB   HIS  28          1HB       HIS  28  14.930  -7.829 -12.944
  250    HD1  HIS  28           1HD      HIS  28  15.389  -5.946  -9.695
  251    HD2  HIS  28           2HD      HIS  28  14.367  -5.112 -13.656
  252    HE1  HIS  28           1HE      HIS  28  15.362  -3.468  -9.936
  253    HE2  HIS  28           2HE      HIS  28  15.277  -3.120 -12.378
  254    H    CYS  29           H        CYS  29  11.405  -8.224  -9.941
  255    HA   CYS  29           HA       CYS  29  12.813  -7.444  -7.488
  256   1HB   CYS  29          2HB       CYS  29   9.935  -7.210  -8.329
  257   2HB   CYS  29          1HB       CYS  29  10.537  -6.677  -6.787
  258    H    GLU  30           H        GLU  30  12.260  -8.654  -5.477
  259    HA   GLU  30           HA       GLU  30  11.208 -11.280  -5.999
  260   1HB   GLU  30          2HB       GLU  30  12.257  -9.987  -3.464
  261   2HB   GLU  30          1HB       GLU  30  11.650 -11.633  -3.540
  262   1HG   GLU  30          2HG       GLU  30  14.009 -11.722  -3.506
  263   2HG   GLU  30          1HG       GLU  30  13.469 -12.063  -5.146
  264    H    GLU  31           H        GLU  31   9.193 -11.940  -5.477
  265    HA   GLU  31           HA       GLU  31   7.037 -11.882  -4.962
  266   1HB   GLU  31          2HB       GLU  31   8.019  -9.993  -2.872
  267   2HB   GLU  31          1HB       GLU  31   6.340 -10.488  -2.940
  268   1HG   GLU  31          2HG       GLU  31   7.130 -12.839  -2.690
  269   2HG   GLU  31          1HG       GLU  31   8.760 -12.203  -2.477
  270    H    LYS  32           H        LYS  32   5.207 -10.107  -4.320
  271    HA   LYS  32           HA       LYS  32   5.189  -8.253  -6.556
  272   1HB   LYS  32          2HB       LYS  32   3.014  -9.002  -4.604
  273   2HB   LYS  32          1HB       LYS  32   2.817  -8.103  -6.100
  274   1HG   LYS  32          2HG       LYS  32   3.747 -10.926  -5.882
  275   2HG   LYS  32          1HG       LYS  32   2.079 -10.430  -6.290
  276   1HD   LYS  32          2HD       LYS  32   2.975  -9.321  -8.276
  277   2HD   LYS  32          1HD       LYS  32   4.603  -9.866  -7.787
  278   1HE   LYS  32          2HE       LYS  32   2.291 -11.693  -8.452
  279   2HE   LYS  32          1HE       LYS  32   3.555 -11.255  -9.596
  280   1HZ   LYS  32          1HZ       LYS  32   5.183 -12.289  -8.069
  281   2HZ   LYS  32          2HZ       LYS  32   4.029 -13.352  -8.639
  282   3HZ   LYS  32          3HZ       LYS  32   3.916 -12.802  -7.065
  283    H    MET  33           H        MET  33   5.383  -6.174  -6.213
  284    HA   MET  33           HA       MET  33   5.900  -5.198  -3.577
  285   1HB   MET  33          2HB       MET  33   5.956  -3.848  -6.225
  286   2HB   MET  33          1HB       MET  33   5.885  -2.880  -4.776
  287   1HG   MET  33          2HG       MET  33   8.164  -3.201  -5.512
  288   2HG   MET  33          1HG       MET  33   7.880  -3.889  -3.919
  289   1HE   MET  33          1HE       MET  33  10.406  -6.397  -4.888
  290   2HE   MET  33          2HE       MET  33   9.635  -5.371  -3.673
  291   3HE   MET  33          3HE       MET  33  10.411  -4.628  -5.074
  292    H    VAL  34           H        VAL  34   4.894  -3.507  -2.627
  293    HA   VAL  34           HA       VAL  34   2.006  -3.637  -2.977
  294    HB   VAL  34           HB       VAL  34   3.711  -2.689  -0.677
  295   1HG1  VAL  34          1HG1      VAL  34   1.610  -1.428  -0.770
  296   2HG1  VAL  34          2HG1      VAL  34   1.613  -2.533   0.601
  297   3HG1  VAL  34          3HG1      VAL  34   0.701  -2.938  -0.855
  298   1HG2  VAL  34          1HG2      VAL  34   2.824  -4.683   0.465
  299   2HG2  VAL  34          2HG2      VAL  34   3.759  -5.093  -0.972
  300   3HG2  VAL  34          3HG2      VAL  34   1.999  -5.144  -1.021
  301    H    ILE  35           H        ILE  35   1.246  -2.131  -4.230
  302    HA   ILE  35           HA       ILE  35   2.563   0.472  -4.353
  303    HB   ILE  35           HB       ILE  35   0.472  -0.740  -6.170
  304   1HG1  ILE  35          2HG1      ILE  35   2.538  -1.989  -6.268
  305   2HG1  ILE  35          1HG1      ILE  35   2.288  -1.107  -7.767
  306   1HG2  ILE  35          1HG2      ILE  35   1.077   1.068  -7.727
  307   2HG2  ILE  35          2HG2      ILE  35   2.156   1.746  -6.505
  308   3HG2  ILE  35          3HG2      ILE  35   0.418   1.688  -6.212
  309   1HD1  ILE  35          1HD1      ILE  35   3.922   0.586  -7.005
  310   2HD1  ILE  35          2HD1      ILE  35   4.621  -1.021  -7.137
  311   3HD1  ILE  35          3HD1      ILE  35   4.203  -0.373  -5.550
  312    H    ILE  36           H        ILE  36   1.647   2.104  -3.466
  313    HA   ILE  36           HA       ILE  36  -1.150   1.899  -2.558
  314    HB   ILE  36           HB       ILE  36   1.204   3.214  -1.189
  315   1HG1  ILE  36          2HG1      ILE  36   1.036   0.741  -1.020
  316   2HG1  ILE  36          1HG1      ILE  36   0.926   1.544   0.555
  317   1HG2  ILE  36          1HG2      ILE  36  -0.798   4.572  -0.891
  318   2HG2  ILE  36          2HG2      ILE  36  -0.340   3.776   0.622
  319   3HG2  ILE  36          3HG2      ILE  36  -1.666   3.136  -0.326
  320   1HD1  ILE  36          1HD1      ILE  36  -1.300   0.369  -1.098
  321   2HD1  ILE  36          2HD1      ILE  36  -1.531   1.232   0.425
  322   3HD1  ILE  36          3HD1      ILE  36  -0.623  -0.279   0.396
  323    H    THR  37           H        THR  37  -2.378   3.297  -3.568
  324    HA   THR  37           HA       THR  37  -1.269   5.769  -4.696
  325    HB   THR  37           HB       THR  37  -4.048   4.563  -4.906
  326    HG1  THR  37           1HG      THR  37  -1.802   3.709  -5.930
  327   1HG2  THR  37          1HG2      THR  37  -2.679   6.680  -6.580
  328   2HG2  THR  37          2HG2      THR  37  -3.963   6.971  -5.408
  329   3HG2  THR  37          3HG2      THR  37  -4.293   6.027  -6.860
  330    H    THR  38           H        THR  38  -1.598   7.688  -3.602
  331    HA   THR  38           HA       THR  38  -3.178   7.485  -1.135
  332    HB   THR  38           HB       THR  38  -1.855   9.437  -0.381
  333    HG1  THR  38           1HG      THR  38  -1.106   9.359  -3.037
  334   1HG2  THR  38          1HG2      THR  38   0.279   8.245  -0.208
  335   2HG2  THR  38          2HG2      THR  38  -0.254   7.149  -1.480
  336   3HG2  THR  38          3HG2      THR  38  -1.108   7.162   0.060
  337    H    LYS  39           H        LYS  39  -4.409   9.290  -0.446
  338    HA   LYS  39           HA       LYS  39  -5.887  10.516  -2.589
  339   1HB   LYS  39          2HB       LYS  39  -7.025   9.588  -0.626
  340   2HB   LYS  39          1HB       LYS  39  -6.198  10.735   0.399
  341   1HG   LYS  39          2HG       LYS  39  -7.394  12.570  -0.666
  342   2HG   LYS  39          1HG       LYS  39  -8.185  11.429  -1.760
  343   1HD   LYS  39          2HD       LYS  39  -9.166  10.269   0.171
  344   2HD   LYS  39          1HD       LYS  39  -8.402  11.435   1.244
  345   1HE   LYS  39          2HE       LYS  39 -10.452  12.075  -0.877
  346   2HE   LYS  39          1HE       LYS  39 -10.780  11.908   0.846
  347   1HZ   LYS  39          1HZ       LYS  39  -9.292  13.824   1.235
  348   2HZ   LYS  39          2HZ       LYS  39 -10.605  14.181   0.239
  349   3HZ   LYS  39          3HZ       LYS  39  -9.095  13.986  -0.444
  350    H    SER  40           H        SER  40  -3.935  11.630   0.162
  351    HA   SER  40           HA       SER  40  -2.644  13.695  -1.166
  352   1HB   SER  40          2HB       SER  40  -3.885  15.715  -0.263
  353   2HB   SER  40          1HB       SER  40  -4.662  14.847  -1.587
  354    HG   SER  40           HG       SER  40  -6.210  14.322  -0.366
  355    H    VAL  41           H        VAL  41  -3.803  12.496   1.987
  356    HA   VAL  41           HA       VAL  41  -2.367  14.544   3.418
  357    HB   VAL  41           HB       VAL  41  -4.442  13.371   4.316
  358   1HG1  VAL  41          1HG1      VAL  41  -2.500  11.209   5.031
  359   2HG1  VAL  41          2HG1      VAL  41  -3.840  11.095   3.894
  360   3HG1  VAL  41          3HG1      VAL  41  -4.161  11.333   5.617
  361   1HG2  VAL  41          1HG2      VAL  41  -2.051  13.550   6.145
  362   2HG2  VAL  41          2HG2      VAL  41  -3.730  13.480   6.676
  363   3HG2  VAL  41          3HG2      VAL  41  -3.160  14.859   5.733
  364    H    SER  42           H        SER  42  -1.454  11.635   2.049
  365    HA   SER  42           HA       SER  42   0.694  10.900   3.709
  366   1HB   SER  42          2HB       SER  42  -0.178   9.429   1.923
  367   2HB   SER  42          1HB       SER  42   0.375  10.577   0.705
  368    HG   SER  42           HG       SER  42   2.005   9.211   2.566
  369    H    ARG  43           H        ARG  43   2.798  11.622   3.776
  370    HA   ARG  43           HA       ARG  43   3.399  14.280   3.139
  371   1HB   ARG  43          2HB       ARG  43   5.733  13.730   3.717
  372   2HB   ARG  43          1HB       ARG  43   4.592  13.106   4.895
  373   1HG   ARG  43          2HG       ARG  43   4.793  10.876   3.931
  374   2HG   ARG  43          1HG       ARG  43   5.892  11.500   2.701
  375   1HD   ARG  43          2HD       ARG  43   7.089  10.377   4.517
  376   2HD   ARG  43          1HD       ARG  43   7.510  12.082   4.420
  377    HE   ARG  43           HE       ARG  43   5.560  12.105   6.247
  378   1HH1  ARG  43          1HH1      ARG  43   8.419  10.030   5.977
  379   2HH1  ARG  43          2HH1      ARG  43   8.622   9.844   7.650
  380   1HH2  ARG  43          1HH2      ARG  43   5.851  11.884   8.546
  381   2HH2  ARG  43          2HH2      ARG  43   7.124  10.945   9.157
  382    H    TYR  44           H        TYR  44   3.544  11.504   1.123
  383    HA   TYR  44           HA       TYR  44   5.475  12.513  -0.707
  384   1HB   TYR  44          2HB       TYR  44   5.039  10.125  -0.047
  385   2HB   TYR  44          1HB       TYR  44   3.529  10.225  -0.920
  386    HD1  TYR  44           1HD      TYR  44   3.728   8.810  -2.671
  387    HD2  TYR  44           2HD      TYR  44   6.879  11.421  -1.760
  388    HE1  TYR  44           1HE      TYR  44   4.916   8.039  -4.718
  389    HE2  TYR  44           2HE      TYR  44   8.117  10.701  -3.805
  390    HH   TYR  44           HH       TYR  44   8.163   8.738  -5.234
  391    H    ARG  45           H        ARG  45   2.200  12.986  -0.057
  392    HA   ARG  45           HA       ARG  45   0.516  14.108  -0.907
  393   1HB   ARG  45          2HB       ARG  45   2.697  15.526  -2.377
  394   2HB   ARG  45          1HB       ARG  45   1.037  16.087  -2.279
  395   1HG   ARG  45          2HG       ARG  45   1.231  16.305   0.126
  396   2HG   ARG  45          1HG       ARG  45   2.878  15.665   0.061
  397   1HD   ARG  45          2HD       ARG  45   1.914  18.165  -1.308
  398   2HD   ARG  45          1HD       ARG  45   2.846  18.116   0.189
  399    HE   ARG  45           HE       ARG  45   4.403  16.727  -1.451
  400   1HH1  ARG  45          1HH1      ARG  45   2.802  19.837  -1.966
  401   2HH1  ARG  45          2HH1      ARG  45   4.043  20.454  -2.967
  402   1HH2  ARG  45          1HH2      ARG  45   6.104  17.595  -2.822
  403   2HH2  ARG  45          2HH2      ARG  45   5.922  19.173  -3.455
  404    H    GLY  46           H        GLY  46  -0.453  12.278  -1.976
  405   1HA   GLY  46          2HA       GLY  46  -1.829  11.673  -3.686
  406   2HA   GLY  46          1HA       GLY  46  -1.403  13.176  -4.480
  407    H    GLN  47           H        GLN  47   1.028  10.887  -3.633
  408    HA   GLN  47           HA       GLN  47   1.276  10.154  -6.452
  409   1HB   GLN  47          2HB       GLN  47   3.529  10.545  -4.473
  410   2HB   GLN  47          1HB       GLN  47   3.709  10.067  -6.148
  411   1HG   GLN  47          2HG       GLN  47   2.695  12.713  -5.142
  412   2HG   GLN  47          1HG       GLN  47   4.285  12.388  -5.820
  413   1HE2  GLN  47          1HE2      GLN  47   2.237  14.230  -6.621
  414   2HE2  GLN  47          2HE2      GLN  47   1.869  13.895  -8.272
  415    H    GLU  48           H        GLU  48   2.376   8.036  -6.755
  416    HA   GLU  48           HA       GLU  48   1.105   6.206  -4.898
  417   1HB   GLU  48          2HB       GLU  48   2.395   5.674  -7.591
  418   2HB   GLU  48          1HB       GLU  48   1.630   4.458  -6.594
  419   1HG   GLU  48          2HG       GLU  48   0.134   5.049  -8.368
  420   2HG   GLU  48          1HG       GLU  48  -0.527   5.666  -6.861
  421    H    HIS  49           H        HIS  49   2.102   4.985  -3.595
  422    HA   HIS  49           HA       HIS  49   5.022   5.156  -3.269
  423   1HB   HIS  49          2HB       HIS  49   2.857   4.163  -1.444
  424   2HB   HIS  49          1HB       HIS  49   4.557   4.019  -1.081
  425    HD1  HIS  49           1HD      HIS  49   5.621   5.952  -0.000
  426    HD2  HIS  49           2HD      HIS  49   1.845   6.830  -1.455
  427    HE1  HIS  49           1HE      HIS  49   4.983   8.126   1.070
  428    HE2  HIS  49           2HE      HIS  49   2.588   8.467   0.393
  429    H    CYS  50           H        CYS  50   6.225   3.270  -2.829
  430    HA   CYS  50           HA       CYS  50   4.838   0.806  -3.314
  431   1HB   CYS  50          2HB       CYS  50   6.941  -0.059  -4.488
  432   2HB   CYS  50          1HB       CYS  50   5.954   1.059  -5.407
  433    H    LEU  51           H        LEU  51   5.117  -0.579  -1.826
  434    HA   LEU  51           HA       LEU  51   7.112   0.010   0.228
  435   1HB   LEU  51          2HB       LEU  51   4.744   0.275   0.935
  436   2HB   LEU  51          1HB       LEU  51   4.421  -1.355   0.450
  437    HG   LEU  51           HG       LEU  51   5.756  -2.220   2.286
  438   1HD1  LEU  51          1HD1      LEU  51   6.712  -0.701   3.943
  439   2HD1  LEU  51          2HD1      LEU  51   6.264   0.684   2.951
  440   3HD1  LEU  51          3HD1      LEU  51   7.473  -0.463   2.365
  441   1HD2  LEU  51          1HD2      LEU  51   4.382  -1.420   4.124
  442   2HD2  LEU  51          2HD2      LEU  51   3.403  -1.641   2.673
  443   3HD2  LEU  51          3HD2      LEU  51   3.894  -0.024   3.166
  444    H    HIS  52           H        HIS  52   8.414  -1.546   0.920
  445    HA   HIS  52           HA       HIS  52   8.832  -3.752  -0.870
  446   1HB   HIS  52          2HB       HIS  52  10.666  -2.272  -0.038
  447   2HB   HIS  52          1HB       HIS  52  10.387  -2.876   1.582
  448    HD1  HIS  52           1HD      HIS  52  12.077  -4.554   2.216
  449    HD2  HIS  52           2HD      HIS  52  11.308  -4.617  -1.861
  450    HE1  HIS  52           1HE      HIS  52  13.511  -6.357   1.303
  451    HE2  HIS  52           2HE      HIS  52  13.011  -6.433  -1.160
  452    HA   PRO  53           HA       PRO  53   6.120  -6.303   1.679
  453   1HB   PRO  53          2HB       PRO  53   6.497  -8.604   0.293
  454   2HB   PRO  53          1HB       PRO  53   5.399  -7.300  -0.202
  455   1HG   PRO  53          2HG       PRO  53   8.155  -7.942  -1.168
  456   2HG   PRO  53          1HG       PRO  53   6.726  -7.393  -2.069
  457   1HD   PRO  53          2HD       PRO  53   8.743  -5.737  -1.414
  458   2HD   PRO  53          1HD       PRO  53   7.061  -5.195  -1.525
  459    H    LYS  54           H        LYS  54   9.358  -6.479   1.855
  460    HA   LYS  54           HA       LYS  54   9.573  -8.989   3.191
  461   1HB   LYS  54          2HB       LYS  54  11.462  -6.808   2.541
  462   2HB   LYS  54          1HB       LYS  54  11.894  -7.882   3.866
  463   1HG   LYS  54          2HG       LYS  54  12.808  -8.564   1.677
  464   2HG   LYS  54          1HG       LYS  54  11.814  -9.795   2.436
  465   1HD   LYS  54          2HD       LYS  54   9.915  -9.039   0.991
  466   2HD   LYS  54          1HD       LYS  54  11.045  -7.963   0.171
  467   1HE   LYS  54          2HE       LYS  54  12.358  -9.808  -0.584
  468   2HE   LYS  54          1HE       LYS  54  11.388 -10.881   0.492
  469   1HZ   LYS  54          1HZ       LYS  54  10.818 -11.075  -1.823
  470   2HZ   LYS  54          2HZ       LYS  54  10.354  -9.430  -1.886
  471   3HZ   LYS  54          3HZ       LYS  54   9.545 -10.547  -0.893
  472    H    LEU  55           H        LEU  55   8.551  -5.878   4.021
  473    HA   LEU  55           HA       LEU  55   9.361  -5.908   6.803
  474   1HB   LEU  55          2HB       LEU  55   7.585  -4.021   5.259
  475   2HB   LEU  55          1HB       LEU  55   8.126  -3.777   6.906
  476    HG   LEU  55           HG       LEU  55   9.924  -3.860   4.479
  477   1HD1  LEU  55          1HD1      LEU  55  10.188  -1.467   4.867
  478   2HD1  LEU  55          2HD1      LEU  55   8.989  -1.539   6.159
  479   3HD1  LEU  55          3HD1      LEU  55   8.517  -1.886   4.496
  480   1HD2  LEU  55          1HD2      LEU  55  10.519  -3.199   7.366
  481   2HD2  LEU  55          2HD2      LEU  55  11.651  -3.042   6.023
  482   3HD2  LEU  55          3HD2      LEU  55  11.062  -4.635   6.500
  483    H    GLN  56           H        GLN  56   7.907  -5.988   8.548
  484    HA   GLN  56           HA       GLN  56   5.677  -7.774   8.081
  485   1HB   GLN  56          2HB       GLN  56   6.712  -6.603  10.670
  486   2HB   GLN  56          1HB       GLN  56   5.502  -7.872  10.536
  487   1HG   GLN  56          2HG       GLN  56   7.201  -9.309   9.449
  488   2HG   GLN  56          1HG       GLN  56   8.395  -8.040   9.711
  489   1HE2  GLN  56          1HE2      GLN  56   9.660  -9.345  11.036
  490   2HE2  GLN  56          2HE2      GLN  56   9.168  -9.786  12.635
  491    H    SER  57           H        SER  57   6.175  -4.418   8.778
  492    HA   SER  57           HA       SER  57   3.667  -3.636   9.724
  493   1HB   SER  57          2HB       SER  57   5.478  -2.093   7.849
  494   2HB   SER  57          1HB       SER  57   4.288  -1.416   8.964
  495    HG   SER  57           HG       SER  57   5.701  -2.772  10.545
  496    H    THR  58           H        THR  58   4.835  -4.335   6.496
  497    HA   THR  58           HA       THR  58   2.823  -3.282   4.886
  498    HB   THR  58           HB       THR  58   4.462  -5.782   4.447
  499    HG1  THR  58           1HG      THR  58   5.250  -3.128   3.820
  500   1HG2  THR  58          1HG2      THR  58   2.744  -5.254   2.738
  501   2HG2  THR  58          2HG2      THR  58   4.382  -5.073   2.104
  502   3HG2  THR  58          3HG2      THR  58   3.450  -3.648   2.550
  503    H    LYS  59           H        LYS  59   3.135  -6.423   6.527
  504    HA   LYS  59           HA       LYS  59   0.911  -7.601   5.284
  505   1HB   LYS  59          2HB       LYS  59   2.431  -8.279   7.772
  506   2HB   LYS  59          1HB       LYS  59   1.002  -9.191   7.285
  507   1HG   LYS  59          2HG       LYS  59   2.970 -10.323   6.541
  508   2HG   LYS  59          1HG       LYS  59   2.102  -9.703   5.149
  509   1HD   LYS  59          2HD       LYS  59   3.687  -7.796   5.062
  510   2HD   LYS  59          1HD       LYS  59   4.582  -8.517   6.398
  511   1HE   LYS  59          2HE       LYS  59   5.652  -9.041   4.272
  512   2HE   LYS  59          1HE       LYS  59   5.014 -10.509   5.011
  513   1HZ   LYS  59          1HZ       LYS  59   3.717  -8.975   2.807
  514   2HZ   LYS  59          2HZ       LYS  59   3.085 -10.347   3.518
  515   3HZ   LYS  59          3HZ       LYS  59   4.521 -10.439   2.647
  516    H    ARG  60           H        ARG  60   1.026  -5.892   8.435
  517    HA   ARG  60           HA       ARG  60  -1.714  -6.344   8.762
  518   1HB   ARG  60          2HB       ARG  60   0.182  -4.427  10.009
  519   2HB   ARG  60          1HB       ARG  60  -1.540  -4.185  10.206
  520   1HG   ARG  60          2HG       ARG  60  -0.861  -5.368  12.096
  521   2HG   ARG  60          1HG       ARG  60  -1.654  -6.520  11.067
  522   1HD   ARG  60          2HD       ARG  60   0.517  -7.287  10.181
  523   2HD   ARG  60          1HD       ARG  60   1.337  -6.195  11.296
  524    HE   ARG  60           HE       ARG  60  -0.504  -8.122  12.427
  525   1HH1  ARG  60          1HH1      ARG  60   2.870  -7.170  11.907
  526   2HH1  ARG  60          2HH1      ARG  60   3.486  -8.345  12.962
  527   1HH2  ARG  60          1HH2      ARG  60   0.342  -9.702  13.854
  528   2HH2  ARG  60          2HH2      ARG  60   2.034  -9.825  14.098
  529    H    PHE  61           H        PHE  61   0.097  -3.879   7.120
  530    HA   PHE  61           HA       PHE  61  -2.028  -2.077   6.879
  531   1HB   PHE  61          2HB       PHE  61   0.494  -1.728   6.477
  532   2HB   PHE  61          1HB       PHE  61   0.150  -2.413   4.888
  533    HD1  PHE  61           1HD      PHE  61   0.098  -0.758   3.219
  534    HD2  PHE  61           2HD      PHE  61  -1.513   0.147   7.060
  535    HE1  PHE  61           1HE      PHE  61  -0.517   1.508   2.443
  536    HE2  PHE  61           2HE      PHE  61  -2.121   2.423   6.274
  537    HZ   PHE  61           HZ       PHE  61  -1.622   3.098   4.014
  538    H    ILE  62           H        ILE  62  -0.982  -4.870   4.894
  539    HA   ILE  62           HA       ILE  62  -2.864  -4.368   2.791
  540    HB   ILE  62           HB       ILE  62  -1.527  -6.966   3.580
  541   1HG1  ILE  62          2HG1      ILE  62   0.153  -5.345   3.018
  542   2HG1  ILE  62          1HG1      ILE  62  -0.007  -6.451   1.657
  543   1HG2  ILE  62          1HG2      ILE  62  -3.535  -7.351   2.213
  544   2HG2  ILE  62          2HG2      ILE  62  -2.084  -7.732   1.292
  545   3HG2  ILE  62          3HG2      ILE  62  -2.939  -6.216   1.007
  546   1HD1  ILE  62          1HD1      ILE  62  -1.255  -3.741   1.870
  547   2HD1  ILE  62          2HD1      ILE  62  -1.367  -4.834   0.496
  548   3HD1  ILE  62          3HD1      ILE  62   0.203  -4.135   0.936
  549    H    LYS  63           H        LYS  63  -2.739  -6.489   5.510
  550    HA   LYS  63           HA       LYS  63  -5.149  -7.786   4.902
  551   1HB   LYS  63          2HB       LYS  63  -3.681  -7.656   7.504
  552   2HB   LYS  63          1HB       LYS  63  -5.009  -8.772   7.160
  553   1HG   LYS  63          2HG       LYS  63  -3.857  -9.776   5.412
  554   2HG   LYS  63          1HG       LYS  63  -2.615  -8.529   5.417
  555   1HD   LYS  63          2HD       LYS  63  -2.063  -9.328   7.744
  556   2HD   LYS  63          1HD       LYS  63  -3.096 -10.727   7.388
  557   1HE   LYS  63          2HE       LYS  63  -1.001  -9.721   5.629
  558   2HE   LYS  63          1HE       LYS  63  -0.617 -10.995   6.826
  559   1HZ   LYS  63          1HZ       LYS  63  -2.393 -12.322   5.626
  560   2HZ   LYS  63          2HZ       LYS  63  -1.039 -12.013   4.693
  561   3HZ   LYS  63          3HZ       LYS  63  -2.447 -11.122   4.438
  562    H    TRP  64           H        TRP  64  -4.427  -4.984   6.749
  563    HA   TRP  64           HA       TRP  64  -6.982  -4.759   8.023
  564   1HB   TRP  64          2HB       TRP  64  -4.537  -3.792   8.574
  565   2HB   TRP  64          1HB       TRP  64  -5.191  -2.432   7.683
  566    HD1  TRP  64           HD       TRP  64  -4.980  -3.876  11.033
  567    HE1  TRP  64           1HE      TRP  64  -6.553  -2.648  12.659
  568    HE3  TRP  64           3HE      TRP  64  -7.822  -1.268   7.661
  569    HZ2  TRP  64           2HZ      TRP  64  -8.707  -0.843  12.544
  570    HZ3  TRP  64           3HZ      TRP  64  -9.615   0.184   8.504
  571    HH2  TRP  64           HH       TRP  64 -10.046   0.394  10.895
  572    H    TYR  65           H        TYR  65  -5.236  -3.255   5.187
  573    HA   TYR  65           HA       TYR  65  -7.289  -1.466   4.490
  574   1HB   TYR  65          2HB       TYR  65  -4.970  -1.307   3.601
  575   2HB   TYR  65          1HB       TYR  65  -5.254  -2.770   2.675
  576    HD1  TYR  65           1HD      TYR  65  -6.574  -2.726   0.642
  577    HD2  TYR  65           2HD      TYR  65  -6.101   0.803   2.961
  578    HE1  TYR  65           1HE      TYR  65  -7.436  -1.376  -1.234
  579    HE2  TYR  65           2HE      TYR  65  -6.980   2.140   1.056
  580    HH   TYR  65           HH       TYR  65  -7.094   1.943  -1.351
  581    H    ASN  66           H        ASN  66  -6.628  -4.752   3.791
  582    HA   ASN  66           HA       ASN  66  -8.353  -5.366   1.702
  583   1HB   ASN  66          2HB       ASN  66  -6.571  -6.751   3.062
  584   2HB   ASN  66          1HB       ASN  66  -7.956  -7.209   4.036
  585   1HD2  ASN  66          1HD2      ASN  66  -6.313  -7.495   1.092
  586   2HD2  ASN  66          2HD2      ASN  66  -7.185  -8.784   0.390
  587    H    ALA  67           H        ALA  67  -8.941  -5.324   5.202
  588    HA   ALA  67           HA       ALA  67 -11.721  -5.992   4.987
  589   1HB   ALA  67          1HB       ALA  67 -10.183  -4.820   7.303
  590   2HB   ALA  67          2HB       ALA  67 -10.416  -6.539   6.992
  591   3HB   ALA  67          3HB       ALA  67 -11.801  -5.517   7.385
  592    H    TRP  68           H        TRP  68  -9.866  -3.069   5.515
  593    HA   TRP  68           HA       TRP  68 -11.907  -1.232   5.916
  594   1HB   TRP  68          2HB       TRP  68  -9.723  -0.505   6.391
  595   2HB   TRP  68          1HB       TRP  68  -9.134  -1.009   4.816
  596    HD1  TRP  68           HD       TRP  68  -8.806   0.839   3.127
  597    HE1  TRP  68           1HE      TRP  68  -9.582   3.268   2.867
  598    HE3  TRP  68           3HE      TRP  68 -12.014   1.121   7.101
  599    HZ2  TRP  68           2HZ      TRP  68 -11.308   5.053   4.120
  600    HZ3  TRP  68           3HZ      TRP  68 -13.191   3.247   7.486
  601    HH2  TRP  68           HH       TRP  68 -12.825   5.178   5.992
  602    H    ASN  69           H        ASN  69 -10.419  -2.210   2.870
  603    HA   ASN  69           HA       ASN  69 -11.776  -0.488   1.132
  604   1HB   ASN  69          2HB       ASN  69  -9.826  -1.934   0.492
  605   2HB   ASN  69          1HB       ASN  69 -10.856  -3.343   0.609
  606   1HD2  ASN  69          1HD2      ASN  69  -9.300  -2.269  -1.642
  607   2HD2  ASN  69          2HD2      ASN  69 -10.415  -2.058  -2.937
  608    H    GLU  70           H        GLU  70 -12.687  -3.607   2.425
  609    HA   GLU  70           HA       GLU  70 -15.107  -3.831   0.967
  610   1HB   GLU  70          2HB       GLU  70 -13.932  -5.749   1.919
  611   2HB   GLU  70          1HB       GLU  70 -14.225  -5.134   3.533
  612   1HG   GLU  70          2HG       GLU  70 -16.616  -5.437   3.237
  613   2HG   GLU  70          1HG       GLU  70 -16.349  -6.012   1.593
  614    H    LYS  71           H        LYS  71 -14.362  -2.791   4.293
  615    HA   LYS  71           HA       LYS  71 -17.091  -2.310   4.914
  616   1HB   LYS  71          2HB       LYS  71 -14.578  -1.918   6.406
  617   2HB   LYS  71          1HB       LYS  71 -15.981  -0.995   6.922
  618   1HG   LYS  71          2HG       LYS  71 -15.854  -3.016   8.178
  619   2HG   LYS  71          1HG       LYS  71 -17.250  -3.020   7.090
  620   1HD   LYS  71          2HD       LYS  71 -15.979  -4.471   5.531
  621   2HD   LYS  71          1HD       LYS  71 -14.652  -4.514   6.693
  622   1HE   LYS  71          2HE       LYS  71 -16.179  -5.489   8.372
  623   2HE   LYS  71          1HE       LYS  71 -17.461  -5.491   7.171
  624   1HZ   LYS  71          1HZ       LYS  71 -14.933  -7.022   7.027
  625   2HZ   LYS  71          2HZ       LYS  71 -16.101  -7.022   5.815
  626   3HZ   LYS  71          3HZ       LYS  71 -16.466  -7.648   7.324
  627    H    ARG  72           H        ARG  72 -14.757  -0.322   3.573
  628    HA   ARG  72           HA       ARG  72 -16.254   2.112   4.088
  629   1HB   ARG  72          2HB       ARG  72 -14.710   3.271   2.593
  630   2HB   ARG  72          1HB       ARG  72 -13.794   2.191   3.633
  631   1HG   ARG  72          2HG       ARG  72 -13.638   0.588   1.820
  632   2HG   ARG  72          1HG       ARG  72 -14.599   1.650   0.799
  633   1HD   ARG  72          2HD       ARG  72 -12.875   3.376   0.992
  634   2HD   ARG  72          1HD       ARG  72 -11.910   2.293   1.989
  635    HE   ARG  72           HE       ARG  72 -12.653   1.093  -0.490
  636   1HH1  ARG  72          1HH1      ARG  72 -10.333   3.378   0.846
  637   2HH1  ARG  72          2HH1      ARG  72  -9.098   3.007  -0.250
  638   1HH2  ARG  72          1HH2      ARG  72 -10.977   0.580  -2.039
  639   2HH2  ARG  72          2HH2      ARG  72  -9.467   1.350  -1.894
  640    H    ARG  73           H        ARG  73 -16.528  -0.453   1.921
  641    HA   ARG  73           HA       ARG  73 -18.085   1.094  -0.022
  642   1HB   ARG  73          2HB       ARG  73 -16.348  -0.373  -0.930
  643   2HB   ARG  73          1HB       ARG  73 -17.053  -1.746  -0.101
  644   1HG   ARG  73          2HG       ARG  73 -19.025  -1.609  -1.506
  645   2HG   ARG  73          1HG       ARG  73 -18.382  -0.167  -2.295
  646   1HD   ARG  73          2HD       ARG  73 -16.505  -1.408  -3.153
  647   2HD   ARG  73          1HD       ARG  73 -17.013  -2.853  -2.288
  648    HE   ARG  73           HE       ARG  73 -19.132  -2.215  -3.859
  649   1HH1  ARG  73          1HH1      ARG  73 -15.702  -2.801  -4.542
  650   2HH1  ARG  73          2HH1      ARG  73 -15.983  -3.521  -6.062
  651   1HH2  ARG  73          1HH2      ARG  73 -19.501  -3.209  -5.921
  652   2HH2  ARG  73          2HH2      ARG  73 -18.177  -3.773  -6.859
  653    H    VAL  74           H        VAL  74 -18.308  -2.037   1.665
  654    HA   VAL  74           HA       VAL  74 -21.124  -1.476   1.946
  655    HB   VAL  74           HB       VAL  74 -20.872  -3.427   0.636
  656   1HG1  VAL  74          1HG1      VAL  74 -19.725  -5.485   1.423
  657   2HG1  VAL  74          2HG1      VAL  74 -19.178  -4.608   2.852
  658   3HG1  VAL  74          3HG1      VAL  74 -18.608  -4.130   1.252
  659   1HG2  VAL  74          1HG2      VAL  74 -22.714  -3.497   2.172
  660   2HG2  VAL  74          2HG2      VAL  74 -21.690  -4.170   3.437
  661   3HG2  VAL  74          3HG2      VAL  74 -22.062  -5.128   2.002
  662    H    TYR  75           H        TYR  75 -21.647  -0.888   3.707
  663    HA   TYR  75           HA       TYR  75 -19.863  -1.075   5.967
  664   1HB   TYR  75          2HB       TYR  75 -22.548   0.306   5.744
  665   2HB   TYR  75          1HB       TYR  75 -21.436   0.457   7.097
  666    HD1  TYR  75           1HD      TYR  75 -19.426   1.817   6.904
  667    HD2  TYR  75           2HD      TYR  75 -22.063   1.376   3.596
  668    HE1  TYR  75           1HE      TYR  75 -18.304   3.687   5.761
  669    HE2  TYR  75           2HE      TYR  75 -20.949   3.244   2.452
  670    HH   TYR  75           HH       TYR  75 -17.984   4.489   3.496
  671    H    GLU  76           H        GLU  76 -19.871  -3.098   6.663
  672    HA   GLU  76           HA       GLU  76 -22.286  -4.006   8.006
  673   1HB   GLU  76          2HB       GLU  76 -21.839  -6.334   7.275
  674   2HB   GLU  76          1HB       GLU  76 -22.237  -5.283   5.927
  675   1HG   GLU  76          2HG       GLU  76 -19.897  -5.162   5.291
  676   2HG   GLU  76          1HG       GLU  76 -19.449  -6.113   6.707
  677    H    GLU  77           H        GLU  77 -21.854  -5.143   9.901
  678    HA   GLU  77           HA       GLU  77 -19.128  -5.746  10.552
  679   1HB   GLU  77          2HB       GLU  77 -19.380  -3.389  11.300
  680   2HB   GLU  77          1HB       GLU  77 -20.749  -3.856  12.288
  681   1HG   GLU  77          2HG       GLU  77 -19.318  -5.261  13.653
  682   2HG   GLU  77          1HG       GLU  77 -17.939  -4.881  12.629
  Start of MODEL   15
    1    H    SER   1           H        SER   1  20.074  -4.588 -10.578
    2    HA   SER   1           HA       SER   1  17.183  -4.176 -10.596
    3   1HB   SER   1          2HB       SER   1  18.793  -6.281  -9.149
    4   2HB   SER   1          1HB       SER   1  17.050  -6.054  -8.997
    5    HG   SER   1           HG       SER   1  18.557  -6.913 -11.221
    6    H    LYS   2           H        LYS   2  16.866  -2.336  -9.550
    7    HA   LYS   2           HA       LYS   2  18.334  -1.905  -7.085
    8   1HB   LYS   2          2HB       LYS   2  18.106   0.028  -8.637
    9   2HB   LYS   2          1HB       LYS   2  16.360  -0.085  -8.503
   10   1HG   LYS   2          2HG       LYS   2  17.241   1.722  -7.122
   11   2HG   LYS   2          1HG       LYS   2  16.487   0.474  -6.129
   12   1HD   LYS   2          2HD       LYS   2  18.714  -0.481  -5.672
   13   2HD   LYS   2          1HD       LYS   2  19.451   0.807  -6.625
   14   1HE   LYS   2          2HE       LYS   2  18.588   2.463  -5.071
   15   2HE   LYS   2          1HE       LYS   2  17.767   1.199  -4.158
   16   1HZ   LYS   2          1HZ       LYS   2  20.724   1.469  -4.463
   17   2HZ   LYS   2          2HZ       LYS   2  19.929   0.237  -3.624
   18   3HZ   LYS   2          3HZ       LYS   2  19.814   1.809  -3.083
   19    H    CYS   3           H        CYS   3  14.989  -1.815  -8.254
   20    HA   CYS   3           HA       CYS   3  13.048  -2.535  -7.478
   21   1HB   CYS   3          2HB       CYS   3  14.757  -4.338  -5.788
   22   2HB   CYS   3          1HB       CYS   3  13.001  -4.478  -5.910
   23    H    LYS   4           H        LYS   4  15.102  -2.035  -4.644
   24    HA   LYS   4           HA       LYS   4  12.847  -1.165  -3.158
   25   1HB   LYS   4          2HB       LYS   4  14.491  -0.603  -1.358
   26   2HB   LYS   4          1HB       LYS   4  14.556  -2.272  -1.887
   27   1HG   LYS   4          2HG       LYS   4  16.551  -1.668  -3.284
   28   2HG   LYS   4          1HG       LYS   4  16.506  -0.065  -2.553
   29   1HD   LYS   4          2HD       LYS   4  16.866  -2.679  -1.067
   30   2HD   LYS   4          1HD       LYS   4  18.143  -1.534  -1.455
   31   1HE   LYS   4          2HE       LYS   4  17.103   0.148  -0.045
   32   2HE   LYS   4          1HE       LYS   4  15.754  -0.931   0.309
   33   1HZ   LYS   4          1HZ       LYS   4  17.385  -0.947   2.120
   34   2HZ   LYS   4          2HZ       LYS   4  18.602  -1.442   1.075
   35   3HZ   LYS   4          3HZ       LYS   4  17.303  -2.439   1.385
   36    H    CYS   5           H        CYS   5  12.005   0.385  -4.339
   37    HA   CYS   5           HA       CYS   5  13.351   2.829  -4.964
   38   1HB   CYS   5          2HB       CYS   5  10.924   3.555  -5.404
   39   2HB   CYS   5          1HB       CYS   5  11.580   2.259  -6.406
   40    H    SER   6           H        SER   6  11.107   1.682  -2.517
   41    HA   SER   6           HA       SER   6  12.091   3.623  -0.690
   42   1HB   SER   6          2HB       SER   6  10.126   4.718  -1.849
   43   2HB   SER   6          1HB       SER   6   9.126   3.375  -1.302
   44    HG   SER   6           HG       SER   6   9.942   5.575   0.011
   45    H    ARG   7           H        ARG   7  11.620   2.889   1.416
   46    HA   ARG   7           HA       ARG   7  11.310   0.006   1.511
   47   1HB   ARG   7          2HB       ARG   7  11.827   1.942   3.778
   48   2HB   ARG   7          1HB       ARG   7  11.985   0.190   3.839
   49   1HG   ARG   7          2HG       ARG   7  13.784   0.298   2.176
   50   2HG   ARG   7          1HG       ARG   7  13.635   2.051   2.145
   51   1HD   ARG   7          2HD       ARG   7  14.176   2.093   4.561
   52   2HD   ARG   7          1HD       ARG   7  14.438   0.348   4.495
   53    HE   ARG   7           HE       ARG   7  15.921   1.921   2.603
   54   1HH1  ARG   7          1HH1      ARG   7  15.956   0.261   5.744
   55   2HH1  ARG   7          2HH1      ARG   7  17.642   0.306   5.895
   56   1HH2  ARG   7          1HH2      ARG   7  18.275   1.989   2.844
   57   2HH2  ARG   7          2HH2      ARG   7  18.981   1.303   4.223
   58    H    LYS   8           H        LYS   8   9.801   2.866   2.852
   59    HA   LYS   8           HA       LYS   8   7.278   1.416   2.987
   60   1HB   LYS   8          2HB       LYS   8   8.328   3.219   5.182
   61   2HB   LYS   8          1HB       LYS   8   6.687   2.606   5.110
   62   1HG   LYS   8          2HG       LYS   8   7.572   0.312   5.292
   63   2HG   LYS   8          1HG       LYS   8   9.198   0.982   5.435
   64   1HD   LYS   8          2HD       LYS   8   8.544   2.172   7.465
   65   2HD   LYS   8          1HD       LYS   8   6.901   1.551   7.309
   66   1HE   LYS   8          2HE       LYS   8   7.755  -0.739   7.523
   67   2HE   LYS   8          1HE       LYS   8   9.393  -0.106   7.723
   68   1HZ   LYS   8          1HZ       LYS   8   8.624   1.013   9.746
   69   2HZ   LYS   8          2HZ       LYS   8   8.417  -0.650   9.824
   70   3HZ   LYS   8          3HZ       LYS   8   7.086   0.343   9.529
   71    H    GLY   9           H        GLY   9   9.005   4.458   2.976
   72   1HA   GLY   9          2HA       GLY   9   8.537   6.282   1.615
   73   2HA   GLY   9          1HA       GLY   9   6.912   5.649   1.375
   74    HA   PRO  10           HA       PRO  10   6.654   9.158   4.576
   75   1HB   PRO  10          2HB       PRO  10   4.344   9.687   2.758
   76   2HB   PRO  10          1HB       PRO  10   5.440  10.834   3.526
   77   1HG   PRO  10          2HG       PRO  10   5.665  10.301   0.933
   78   2HG   PRO  10          1HG       PRO  10   7.103  10.527   1.942
   79   1HD   PRO  10          2HD       PRO  10   5.914   8.004   0.877
   80   2HD   PRO  10          1HD       PRO  10   7.617   8.443   1.091
   81    H    LYS  11           H        LYS  11   4.777   9.354   6.036
   82    HA   LYS  11           HA       LYS  11   3.843   6.783   6.692
   83   1HB   LYS  11          2HB       LYS  11   4.298   8.476   8.394
   84   2HB   LYS  11          1HB       LYS  11   2.969   9.446   7.795
   85   1HG   LYS  11          2HG       LYS  11   2.336   8.262   9.828
   86   2HG   LYS  11          1HG       LYS  11   1.365   7.749   8.456
   87   1HD   LYS  11          2HD       LYS  11   1.912   5.787   9.720
   88   2HD   LYS  11          1HD       LYS  11   2.863   5.731   8.251
   89   1HE   LYS  11          2HE       LYS  11   3.880   6.627  10.963
   90   2HE   LYS  11          1HE       LYS  11   4.090   5.016  10.304
   91   1HZ   LYS  11          1HZ       LYS  11   5.455   6.067   8.482
   92   2HZ   LYS  11          2HZ       LYS  11   6.070   6.236  10.011
   93   3HZ   LYS  11          3HZ       LYS  11   5.345   7.545   9.311
   94    H    ILE  12           H        ILE  12   2.203   5.676   6.143
   95    HA   ILE  12           HA       ILE  12   0.014   6.936   4.624
   96    HB   ILE  12           HB       ILE  12   0.797   4.022   4.618
   97   1HG1  ILE  12          2HG1      ILE  12   1.627   6.129   2.615
   98   2HG1  ILE  12          1HG1      ILE  12   2.701   5.410   3.811
   99   1HG2  ILE  12          1HG2      ILE  12  -0.754   5.709   2.640
  100   2HG2  ILE  12          2HG2      ILE  12  -1.478   4.664   3.869
  101   3HG2  ILE  12          3HG2      ILE  12  -0.503   3.960   2.591
  102   1HD1  ILE  12          1HD1      ILE  12   2.981   4.398   1.617
  103   2HD1  ILE  12          2HD1      ILE  12   1.268   3.959   1.620
  104   3HD1  ILE  12          3HD1      ILE  12   2.365   3.220   2.789
  105    H    ARG  13           H        ARG  13  -1.926   6.842   5.597
  106    HA   ARG  13           HA       ARG  13  -2.390   4.678   7.478
  107   1HB   ARG  13          2HB       ARG  13  -3.810   7.350   7.252
  108   2HB   ARG  13          1HB       ARG  13  -4.226   6.035   8.352
  109   1HG   ARG  13          2HG       ARG  13  -1.621   7.541   8.381
  110   2HG   ARG  13          1HG       ARG  13  -2.972   7.816   9.485
  111   1HD   ARG  13          2HD       ARG  13  -2.764   5.513  10.298
  112   2HD   ARG  13          1HD       ARG  13  -1.434   5.232   9.178
  113    HE   ARG  13           HE       ARG  13  -0.779   7.434  10.709
  114   1HH1  ARG  13          1HH1      ARG  13  -1.347   3.969  11.230
  115   2HH1  ARG  13          2HH1      ARG  13  -0.304   3.848  12.548
  116   1HH2  ARG  13          1HH2      ARG  13   0.683   7.258  12.543
  117   2HH2  ARG  13          2HH2      ARG  13   0.858   5.761  13.334
  118    H    TYR  14           H        TYR  14  -4.798   4.024   7.373
  119    HA   TYR  14           HA       TYR  14  -5.094   2.956   4.772
  120   1HB   TYR  14          2HB       TYR  14  -7.130   2.987   7.002
  121   2HB   TYR  14          1HB       TYR  14  -7.058   1.864   5.645
  122    HD1  TYR  14           1HD      TYR  14  -5.995   2.493   8.984
  123    HD2  TYR  14           2HD      TYR  14  -4.955   0.379   5.438
  124    HE1  TYR  14           1HE      TYR  14  -4.524   1.032  10.287
  125    HE2  TYR  14           2HE      TYR  14  -3.498  -1.070   6.721
  126    HH   TYR  14           HH       TYR  14  -2.238  -0.974   8.859
  127    H    SER  15           H        SER  15  -6.388   5.703   6.389
  128    HA   SER  15           HA       SER  15  -8.493   6.262   4.595
  129   1HB   SER  15          2HB       SER  15  -6.959   8.069   6.409
  130   2HB   SER  15          1HB       SER  15  -8.545   8.405   5.693
  131    HG   SER  15           HG       SER  15  -8.978   6.182   6.774
  132    H    ASP  16           H        ASP  16  -5.064   6.559   4.342
  133    HA   ASP  16           HA       ASP  16  -5.005   8.840   2.543
  134   1HB   ASP  16          2HB       ASP  16  -2.851   6.890   3.428
  135   2HB   ASP  16          1HB       ASP  16  -2.577   8.069   2.178
  136    H    VAL  17           H        VAL  17  -5.433   5.493   2.378
  137    HA   VAL  17           HA       VAL  17  -4.277   5.252  -0.285
  138    HB   VAL  17           HB       VAL  17  -5.743   3.105   1.197
  139   1HG1  VAL  17          1HG1      VAL  17  -5.423   2.542  -1.028
  140   2HG1  VAL  17          2HG1      VAL  17  -4.282   1.601  -0.084
  141   3HG1  VAL  17          3HG1      VAL  17  -3.736   3.016  -1.016
  142   1HG2  VAL  17          1HG2      VAL  17  -3.583   2.334   2.089
  143   2HG2  VAL  17          2HG2      VAL  17  -4.029   3.920   2.710
  144   3HG2  VAL  17          3HG2      VAL  17  -2.812   3.783   1.444
  145    H    LYS  18           H        LYS  18  -5.397   5.475  -2.092
  146    HA   LYS  18           HA       LYS  18  -8.335   5.514  -2.079
  147   1HB   LYS  18          2HB       LYS  18  -6.902   7.135  -3.493
  148   2HB   LYS  18          1HB       LYS  18  -6.519   5.753  -4.490
  149   1HG   LYS  18          2HG       LYS  18  -8.975   5.342  -4.803
  150   2HG   LYS  18          1HG       LYS  18  -9.274   6.881  -4.033
  151   1HD   LYS  18          2HD       LYS  18  -7.785   6.435  -6.632
  152   2HD   LYS  18          1HD       LYS  18  -9.437   6.986  -6.494
  153   1HE   LYS  18          2HE       LYS  18  -8.259   8.941  -6.944
  154   2HE   LYS  18          1HE       LYS  18  -8.417   8.990  -5.194
  155   1HZ   LYS  18          1HZ       LYS  18  -6.021   8.085  -6.692
  156   2HZ   LYS  18          2HZ       LYS  18  -6.051   8.305  -5.008
  157   3HZ   LYS  18          3HZ       LYS  18  -6.231   9.593  -6.061
  158    H    LYS  19           H        LYS  19  -5.614   3.722  -3.182
  159    HA   LYS  19           HA       LYS  19  -7.144   1.341  -3.809
  160   1HB   LYS  19          2HB       LYS  19  -5.484   2.734  -5.926
  161   2HB   LYS  19          1HB       LYS  19  -6.069   1.087  -6.032
  162   1HG   LYS  19          2HG       LYS  19  -8.353   1.884  -6.069
  163   2HG   LYS  19          1HG       LYS  19  -7.795   3.551  -5.888
  164   1HD   LYS  19          2HD       LYS  19  -8.313   3.061  -8.243
  165   2HD   LYS  19          1HD       LYS  19  -6.593   3.378  -8.013
  166   1HE   LYS  19          2HE       LYS  19  -6.117   0.991  -8.063
  167   2HE   LYS  19          1HE       LYS  19  -7.841   0.630  -8.194
  168   1HZ   LYS  19          1HZ       LYS  19  -6.667   0.509 -10.304
  169   2HZ   LYS  19          2HZ       LYS  19  -6.242   2.132 -10.192
  170   3HZ   LYS  19          3HZ       LYS  19  -7.865   1.682 -10.349
  171    H    LEU  20           H        LEU  20  -5.854  -0.477  -3.757
  172    HA   LEU  20           HA       LEU  20  -2.980  -0.090  -3.325
  173   1HB   LEU  20          2HB       LEU  20  -4.298  -0.361  -1.163
  174   2HB   LEU  20          1HB       LEU  20  -4.798  -1.925  -1.739
  175    HG   LEU  20           HG       LEU  20  -1.926  -1.169  -1.117
  176   1HD1  LEU  20          1HD1      LEU  20  -2.227  -2.463   0.924
  177   2HD1  LEU  20          2HD1      LEU  20  -3.923  -2.724   0.524
  178   3HD1  LEU  20          3HD1      LEU  20  -3.337  -1.101   0.876
  179   1HD2  LEU  20          1HD2      LEU  20  -1.512  -3.588  -1.150
  180   2HD2  LEU  20          2HD2      LEU  20  -2.143  -3.053  -2.709
  181   3HD2  LEU  20          3HD2      LEU  20  -3.202  -3.878  -1.566
  182    H    GLU  21           H        GLU  21  -1.934  -1.313  -4.813
  183    HA   GLU  21           HA       GLU  21  -3.174  -3.815  -5.591
  184   1HB   GLU  21          2HB       GLU  21  -2.402  -3.393  -7.943
  185   2HB   GLU  21          1HB       GLU  21  -3.718  -2.351  -7.419
  186   1HG   GLU  21          2HG       GLU  21  -2.052  -0.561  -7.013
  187   2HG   GLU  21          1HG       GLU  21  -0.806  -1.639  -7.650
  188    H    MET  22           H        MET  22  -1.786  -5.467  -5.567
  189    HA   MET  22           HA       MET  22   0.956  -4.685  -4.962
  190   1HB   MET  22          2HB       MET  22  -0.231  -5.968  -3.232
  191   2HB   MET  22          1HB       MET  22  -0.510  -7.260  -4.386
  192   1HG   MET  22          2HG       MET  22   1.833  -7.675  -4.535
  193   2HG   MET  22          1HG       MET  22   2.196  -6.344  -3.441
  194   1HE   MET  22          1HE       MET  22  -0.064 -10.181  -2.164
  195   2HE   MET  22          2HE       MET  22   0.538  -9.898  -3.798
  196   3HE   MET  22          3HE       MET  22  -0.789  -8.925  -3.163
  197    H    LYS  23           H        LYS  23   2.206  -4.724  -6.597
  198    HA   LYS  23           HA       LYS  23   2.719  -7.024  -8.095
  199   1HB   LYS  23          2HB       LYS  23   2.380  -5.971 -10.387
  200   2HB   LYS  23          1HB       LYS  23   0.915  -6.386  -9.545
  201   1HG   LYS  23          2HG       LYS  23   0.531  -4.324 -10.641
  202   2HG   LYS  23          1HG       LYS  23   0.701  -3.950  -8.933
  203   1HD   LYS  23          2HD       LYS  23   2.961  -3.138  -9.322
  204   2HD   LYS  23          1HD       LYS  23   2.872  -3.631 -11.015
  205   1HE   LYS  23          2HE       LYS  23   0.990  -2.095 -11.352
  206   2HE   LYS  23          1HE       LYS  23   1.105  -1.571  -9.684
  207   1HZ   LYS  23          1HZ       LYS  23   3.333  -0.674 -10.184
  208   2HZ   LYS  23          2HZ       LYS  23   2.160  -0.050 -11.231
  209   3HZ   LYS  23          3HZ       LYS  23   3.183  -1.246 -11.771
  210    HA   PRO  24           HA       PRO  24   6.589  -5.206  -7.644
  211   1HB   PRO  24          2HB       PRO  24   8.126  -6.396  -9.494
  212   2HB   PRO  24          1HB       PRO  24   7.470  -7.271  -8.127
  213   1HG   PRO  24          2HG       PRO  24   6.445  -7.179 -10.937
  214   2HG   PRO  24          1HG       PRO  24   6.605  -8.576  -9.856
  215   1HD   PRO  24          2HD       PRO  24   4.234  -7.273 -10.265
  216   2HD   PRO  24          1HD       PRO  24   4.658  -8.107  -8.753
  217    H    LYS  25           H        LYS  25   7.837  -3.557  -8.230
  218    HA   LYS  25           HA       LYS  25   6.946  -1.736 -10.192
  219   1HB   LYS  25          2HB       LYS  25   8.126  -1.151  -8.114
  220   2HB   LYS  25          1HB       LYS  25   9.592  -1.865  -8.766
  221   1HG   LYS  25          2HG       LYS  25   9.746  -0.206 -10.449
  222   2HG   LYS  25          1HG       LYS  25   8.133   0.411 -10.067
  223   1HD   LYS  25          2HD       LYS  25   8.836   0.965  -7.901
  224   2HD   LYS  25          1HD       LYS  25  10.482   0.394  -8.212
  225   1HE   LYS  25          2HE       LYS  25   9.072   2.688  -9.617
  226   2HE   LYS  25          1HE       LYS  25  10.355   2.855  -8.421
  227   1HZ   LYS  25          1HZ       LYS  25  10.621   1.545 -11.062
  228   2HZ   LYS  25          2HZ       LYS  25  11.868   1.744  -9.934
  229   3HZ   LYS  25          3HZ       LYS  25  11.162   3.084 -10.675
  230    H    TYR  26           H        TYR  26   9.456  -4.133  -9.959
  231    HA   TYR  26           HA       TYR  26   9.621  -4.295 -12.832
  232   1HB   TYR  26          2HB       TYR  26  12.004  -4.214 -10.924
  233   2HB   TYR  26          1HB       TYR  26  12.085  -4.985 -12.478
  234    HD1  TYR  26           1HD      TYR  26  12.138  -3.794 -14.459
  235    HD2  TYR  26           2HD      TYR  26  11.762  -1.759 -10.764
  236    HE1  TYR  26           1HE      TYR  26  12.712  -1.663 -15.585
  237    HE2  TYR  26           2HE      TYR  26  12.345   0.374 -11.857
  238    HH   TYR  26           HH       TYR  26  13.540   1.143 -13.862
  239    HA   PRO  27           HA       PRO  27   8.413  -8.449 -11.760
  240   1HB   PRO  27          2HB       PRO  27   9.814  -9.128 -14.291
  241   2HB   PRO  27          1HB       PRO  27   8.165  -9.527 -13.780
  242   1HG   PRO  27          2HG       PRO  27   8.560  -7.639 -15.595
  243   2HG   PRO  27          1HG       PRO  27   7.355  -7.411 -14.316
  244   1HD   PRO  27          2HD       PRO  27  10.105  -6.247 -14.543
  245   2HD   PRO  27          1HD       PRO  27   8.583  -5.505 -13.996
  246    H    HIS  28           H        HIS  28  11.610  -7.572 -12.594
  247    HA   HIS  28           HA       HIS  28  12.820 -10.043 -11.645
  248   1HB   HIS  28          2HB       HIS  28  15.009  -8.966 -12.191
  249   2HB   HIS  28          1HB       HIS  28  13.908  -8.989 -13.555
  250    HD1  HIS  28           1HD      HIS  28  15.745  -6.714 -11.242
  251    HD2  HIS  28           2HD      HIS  28  13.081  -6.312 -14.432
  252    HE1  HIS  28           1HE      HIS  28  15.714  -4.290 -11.901
  253    HE2  HIS  28           2HE      HIS  28  14.596  -4.318 -14.081
  254    H    CYS  29           H        CYS  29  11.272  -8.442  -9.781
  255    HA   CYS  29           HA       CYS  29  13.295  -7.677  -7.808
  256   1HB   CYS  29          2HB       CYS  29  10.500  -6.798  -8.323
  257   2HB   CYS  29          1HB       CYS  29  11.242  -6.367  -6.813
  258    H    GLU  30           H        GLU  30  12.334  -7.936  -5.421
  259    HA   GLU  30           HA       GLU  30  11.879 -10.762  -5.015
  260   1HB   GLU  30          2HB       GLU  30  11.814  -8.489  -3.037
  261   2HB   GLU  30          1HB       GLU  30  12.127 -10.182  -2.745
  262   1HG   GLU  30          2HG       GLU  30  14.213 -10.023  -3.672
  263   2HG   GLU  30          1HG       GLU  30  13.877  -8.379  -4.270
  264    H    GLU  31           H        GLU  31   9.770 -11.553  -4.718
  265    HA   GLU  31           HA       GLU  31   7.525 -11.629  -4.392
  266   1HB   GLU  31          2HB       GLU  31   8.270 -11.135  -2.085
  267   2HB   GLU  31          1HB       GLU  31   8.240  -9.419  -2.423
  268   1HG   GLU  31          2HG       GLU  31   6.373 -10.175  -1.026
  269   2HG   GLU  31          1HG       GLU  31   5.826  -9.451  -2.534
  270    H    LYS  32           H        LYS  32   5.449  -9.975  -4.220
  271    HA   LYS  32           HA       LYS  32   5.589  -8.234  -6.548
  272   1HB   LYS  32          2HB       LYS  32   3.341  -8.809  -4.645
  273   2HB   LYS  32          1HB       LYS  32   3.185  -8.039  -6.229
  274   1HG   LYS  32          2HG       LYS  32   3.997 -10.850  -5.647
  275   2HG   LYS  32          1HG       LYS  32   2.388 -10.327  -6.198
  276   1HD   LYS  32          2HD       LYS  32   3.445  -9.509  -8.261
  277   2HD   LYS  32          1HD       LYS  32   5.005 -10.139  -7.686
  278   1HE   LYS  32          2HE       LYS  32   2.506 -11.747  -8.267
  279   2HE   LYS  32          1HE       LYS  32   3.928 -11.657  -9.296
  280   1HZ   LYS  32          1HZ       LYS  32   5.217 -12.771  -7.572
  281   2HZ   LYS  32          2HZ       LYS  32   3.868 -13.674  -7.946
  282   3HZ   LYS  32          3HZ       LYS  32   3.886 -12.777  -6.531
  283    H    MET  33           H        MET  33   5.576  -6.051  -6.356
  284    HA   MET  33           HA       MET  33   6.190  -4.864  -3.781
  285   1HB   MET  33          2HB       MET  33   5.818  -3.544  -6.457
  286   2HB   MET  33          1HB       MET  33   5.833  -2.603  -5.014
  287   1HG   MET  33          2HG       MET  33   7.981  -2.439  -6.068
  288   2HG   MET  33          1HG       MET  33   8.150  -3.312  -4.562
  289   1HE   MET  33          1HE       MET  33   7.604  -6.256  -5.070
  290   2HE   MET  33          2HE       MET  33   9.120  -5.675  -4.378
  291   3HE   MET  33          3HE       MET  33   9.141  -6.848  -5.696
  292    H    VAL  34           H        VAL  34   5.104  -3.236  -2.790
  293    HA   VAL  34           HA       VAL  34   2.216  -3.514  -2.972
  294    HB   VAL  34           HB       VAL  34   4.000  -2.271  -0.885
  295   1HG1  VAL  34          1HG1      VAL  34   1.834  -1.146  -1.048
  296   2HG1  VAL  34          2HG1      VAL  34   1.988  -2.024   0.473
  297   3HG1  VAL  34          3HG1      VAL  34   1.009  -2.693  -0.839
  298   1HG2  VAL  34          1HG2      VAL  34   3.274  -4.158   0.528
  299   2HG2  VAL  34          2HG2      VAL  34   4.144  -4.691  -0.908
  300   3HG2  VAL  34          3HG2      VAL  34   2.385  -4.819  -0.844
  301    H    ILE  35           H        ILE  35   1.316  -2.070  -4.328
  302    HA   ILE  35           HA       ILE  35   2.572   0.552  -4.588
  303    HB   ILE  35           HB       ILE  35   0.355  -0.639  -6.257
  304   1HG1  ILE  35          2HG1      ILE  35   2.277  -2.083  -6.473
  305   2HG1  ILE  35          1HG1      ILE  35   2.035  -1.188  -7.957
  306   1HG2  ILE  35          1HG2      ILE  35   1.035   1.064  -7.903
  307   2HG2  ILE  35          2HG2      ILE  35   2.234   1.667  -6.764
  308   3HG2  ILE  35          3HG2      ILE  35   0.517   1.779  -6.374
  309   1HD1  ILE  35          1HD1      ILE  35   3.865   0.341  -7.307
  310   2HD1  ILE  35          2HD1      ILE  35   4.411  -1.324  -7.455
  311   3HD1  ILE  35          3HD1      ILE  35   4.138  -0.623  -5.856
  312    H    ILE  36           H        ILE  36   1.737   1.906  -3.198
  313    HA   ILE  36           HA       ILE  36  -1.117   1.698  -2.647
  314    HB   ILE  36           HB       ILE  36   1.065   2.844  -0.928
  315   1HG1  ILE  36          2HG1      ILE  36  -0.967   0.657  -0.572
  316   2HG1  ILE  36          1HG1      ILE  36   0.765   0.467  -0.813
  317   1HG2  ILE  36          1HG2      ILE  36  -0.823   4.410  -0.855
  318   2HG2  ILE  36          2HG2      ILE  36  -0.632   3.539   0.665
  319   3HG2  ILE  36          3HG2      ILE  36  -1.904   3.069  -0.456
  320   1HD1  ILE  36          1HD1      ILE  36   0.084   0.130   1.495
  321   2HD1  ILE  36          2HD1      ILE  36  -0.574   1.782   1.469
  322   3HD1  ILE  36          3HD1      ILE  36   1.167   1.537   1.325
  323    H    THR  37           H        THR  37  -2.334   2.971  -3.502
  324    HA   THR  37           HA       THR  37  -1.301   5.405  -4.777
  325    HB   THR  37           HB       THR  37  -3.986   4.018  -5.084
  326    HG1  THR  37           1HG      THR  37  -1.602   3.247  -5.841
  327   1HG2  THR  37          1HG2      THR  37  -2.566   6.068  -6.807
  328   2HG2  THR  37          2HG2      THR  37  -3.972   6.380  -5.785
  329   3HG2  THR  37          3HG2      THR  37  -4.110   5.298  -7.174
  330    H    THR  38           H        THR  38  -1.652   7.291  -3.695
  331    HA   THR  38           HA       THR  38  -3.456   7.186  -1.483
  332    HB   THR  38           HB       THR  38  -2.648   9.569  -1.011
  333    HG1  THR  38           1HG      THR  38  -0.727   8.845  -3.019
  334   1HG2  THR  38          1HG2      THR  38  -0.533   8.742  -0.055
  335   2HG2  THR  38          2HG2      THR  38  -0.704   7.284  -1.030
  336   3HG2  THR  38          3HG2      THR  38  -1.882   7.636   0.232
  337    H    LYS  39           H        LYS  39  -4.797   9.211  -0.975
  338    HA   LYS  39           HA       LYS  39  -6.934   9.103  -2.893
  339   1HB   LYS  39          2HB       LYS  39  -6.561  10.713  -0.394
  340   2HB   LYS  39          1HB       LYS  39  -8.053  10.652  -1.305
  341   1HG   LYS  39          2HG       LYS  39  -6.716   8.267  -0.044
  342   2HG   LYS  39          1HG       LYS  39  -8.005   9.196   0.709
  343   1HD   LYS  39          2HD       LYS  39  -8.189   7.677  -1.890
  344   2HD   LYS  39          1HD       LYS  39  -8.866   7.181  -0.342
  345   1HE   LYS  39          2HE       LYS  39  -9.653   9.616  -1.949
  346   2HE   LYS  39          1HE       LYS  39 -10.586   8.147  -1.774
  347   1HZ   LYS  39          1HZ       LYS  39 -10.831   8.586   0.574
  348   2HZ   LYS  39          2HZ       LYS  39 -11.382   9.897  -0.320
  349   3HZ   LYS  39          3HZ       LYS  39  -9.917  10.000   0.472
  350    H    SER  40           H        SER  40  -4.915  11.746  -1.670
  351    HA   SER  40           HA       SER  40  -4.431  13.431  -3.687
  352   1HB   SER  40          2HB       SER  40  -6.860  13.353  -4.384
  353   2HB   SER  40          1HB       SER  40  -7.315  13.983  -2.810
  354    HG   SER  40           HG       SER  40  -7.072  15.419  -4.731
  355    H    VAL  41           H        VAL  41  -6.658  13.881  -0.936
  356    HA   VAL  41           HA       VAL  41  -5.320  16.123   0.195
  357    HB   VAL  41           HB       VAL  41  -7.316  14.240   1.513
  358   1HG1  VAL  41          1HG1      VAL  41  -6.659  17.111   2.162
  359   2HG1  VAL  41          2HG1      VAL  41  -6.226  15.697   3.123
  360   3HG1  VAL  41          3HG1      VAL  41  -7.921  16.143   2.924
  361   1HG2  VAL  41          1HG2      VAL  41  -7.847  16.728  -0.111
  362   2HG2  VAL  41          2HG2      VAL  41  -9.059  15.811   0.783
  363   3HG2  VAL  41          3HG2      VAL  41  -8.224  15.071  -0.584
  364    H    SER  42           H        SER  42  -4.806  12.860   0.265
  365    HA   SER  42           HA       SER  42  -3.677  12.255   2.739
  366   1HB   SER  42          2HB       SER  42  -2.603  10.466   1.301
  367   2HB   SER  42          1HB       SER  42  -4.372  10.569   1.247
  368    HG   SER  42           HG       SER  42  -2.908  12.122  -0.529
  369    H    ARG  43           H        ARG  43  -1.342  11.831   3.098
  370    HA   ARG  43           HA       ARG  43   0.155  14.181   2.855
  371   1HB   ARG  43          2HB       ARG  43   1.190  11.419   3.497
  372   2HB   ARG  43          1HB       ARG  43   2.076  12.912   3.740
  373   1HG   ARG  43          2HG       ARG  43   0.347  13.652   5.322
  374   2HG   ARG  43          1HG       ARG  43  -0.476  12.103   5.103
  375   1HD   ARG  43          2HD       ARG  43   1.534  10.946   5.919
  376   2HD   ARG  43          1HD       ARG  43   2.315  12.510   6.160
  377    HE   ARG  43           HE       ARG  43  -0.183  12.279   7.512
  378   1HH1  ARG  43          1HH1      ARG  43   3.284  11.613   7.765
  379   2HH1  ARG  43          2HH1      ARG  43   3.286  11.492   9.471
  380   1HH2  ARG  43          1HH2      ARG  43  -0.163  12.098   9.877
  381   2HH2  ARG  43          2HH2      ARG  43   1.295  11.785  10.691
  382    H    TYR  44           H        TYR  44   0.241  11.316   0.771
  383    HA   TYR  44           HA       TYR  44   2.577  12.317  -0.555
  384   1HB   TYR  44          2HB       TYR  44   2.022   9.884   0.109
  385   2HB   TYR  44          1HB       TYR  44   1.008   9.892  -1.322
  386    HD1  TYR  44           1HD      TYR  44   2.039   8.618  -2.899
  387    HD2  TYR  44           2HD      TYR  44   4.304  11.314  -0.638
  388    HE1  TYR  44           1HE      TYR  44   4.018   8.038  -4.268
  389    HE2  TYR  44           2HE      TYR  44   6.348  10.777  -1.995
  390    HH   TYR  44           HH       TYR  44   6.117   9.019  -4.892
  391    H    ARG  45           H        ARG  45  -0.473  13.257  -0.686
  392    HA   ARG  45           HA       ARG  45  -1.666  14.527  -1.995
  393   1HB   ARG  45          2HB       ARG  45   0.625  15.545  -2.100
  394   2HB   ARG  45          1HB       ARG  45   0.805  14.785  -3.668
  395   1HG   ARG  45          2HG       ARG  45  -1.018  16.051  -4.545
  396   2HG   ARG  45          1HG       ARG  45  -1.335  16.708  -2.927
  397   1HD   ARG  45          2HD       ARG  45   1.208  17.106  -4.499
  398   2HD   ARG  45          1HD       ARG  45  -0.068  18.312  -4.338
  399    HE   ARG  45           HE       ARG  45   0.634  17.574  -1.779
  400   1HH1  ARG  45          1HH1      ARG  45   2.268  19.078  -4.526
  401   2HH1  ARG  45          2HH1      ARG  45   3.357  19.975  -3.554
  402   1HH2  ARG  45          1HH2      ARG  45   2.131  18.815  -0.473
  403   2HH2  ARG  45          2HH2      ARG  45   3.277  19.828  -1.231
  404    H    GLY  46           H        GLY  46  -1.466  11.552  -2.833
  405   1HA   GLY  46          2HA       GLY  46  -3.119  10.629  -4.280
  406   2HA   GLY  46          1HA       GLY  46  -2.927  12.019  -5.338
  407    H    GLN  47           H        GLN  47   0.051  11.119  -4.419
  408    HA   GLN  47           HA       GLN  47   0.629   9.813  -6.929
  409   1HB   GLN  47          2HB       GLN  47   2.454  10.496  -4.617
  410   2HB   GLN  47          1HB       GLN  47   2.959   9.946  -6.207
  411   1HG   GLN  47          2HG       GLN  47   2.103  11.966  -7.218
  412   2HG   GLN  47          1HG       GLN  47   1.481  12.505  -5.660
  413   1HE2  GLN  47          1HE2      GLN  47   4.578  10.903  -6.040
  414   2HE2  GLN  47          2HE2      GLN  47   5.528  12.288  -5.659
  415    H    GLU  48           H        GLU  48   1.874   7.764  -7.002
  416    HA   GLU  48           HA       GLU  48   0.741   5.883  -5.107
  417   1HB   GLU  48          2HB       GLU  48   2.328   5.396  -7.634
  418   2HB   GLU  48          1HB       GLU  48   1.705   4.130  -6.601
  419   1HG   GLU  48          2HG       GLU  48   0.297   4.304  -8.514
  420   2HG   GLU  48          1HG       GLU  48  -0.594   4.915  -7.134
  421    H    HIS  49           H        HIS  49   1.779   5.082  -3.537
  422    HA   HIS  49           HA       HIS  49   4.606   5.542  -2.984
  423   1HB   HIS  49          2HB       HIS  49   2.467   4.057  -1.483
  424   2HB   HIS  49          1HB       HIS  49   4.128   4.102  -0.961
  425    HD1  HIS  49           1HD      HIS  49   4.898   6.207   0.174
  426    HD2  HIS  49           2HD      HIS  49   0.941   6.273  -0.989
  427    HE1  HIS  49           1HE      HIS  49   3.845   8.073   1.521
  428    HE2  HIS  49           2HE      HIS  49   1.410   7.822   1.061
  429    H    CYS  50           H        CYS  50   6.057   3.799  -2.575
  430    HA   CYS  50           HA       CYS  50   5.049   1.216  -3.382
  431   1HB   CYS  50          2HB       CYS  50   7.262   0.660  -4.382
  432   2HB   CYS  50          1HB       CYS  50   6.455   1.958  -5.238
  433    H    LEU  51           H        LEU  51   5.327  -0.255  -1.893
  434    HA   LEU  51           HA       LEU  51   7.036   0.463   0.405
  435   1HB   LEU  51          2HB       LEU  51   4.323   0.443   0.500
  436   2HB   LEU  51          1HB       LEU  51   4.594  -1.263   0.616
  437    HG   LEU  51           HG       LEU  51   5.567   0.785   2.585
  438   1HD1  LEU  51          1HD1      LEU  51   3.890  -0.172   4.071
  439   2HD1  LEU  51          2HD1      LEU  51   3.288  -1.150   2.730
  440   3HD1  LEU  51          3HD1      LEU  51   3.203   0.610   2.652
  441   1HD2  LEU  51          1HD2      LEU  51   7.041  -1.165   2.518
  442   2HD2  LEU  51          2HD2      LEU  51   5.647  -2.226   2.712
  443   3HD2  LEU  51          3HD2      LEU  51   6.106  -1.130   4.011
  444    H    HIS  52           H        HIS  52   8.386  -1.196   1.091
  445    HA   HIS  52           HA       HIS  52   8.681  -3.389  -0.743
  446   1HB   HIS  52          2HB       HIS  52  10.644  -2.126   0.199
  447   2HB   HIS  52          1HB       HIS  52  10.282  -2.822   1.773
  448    HD1  HIS  52           1HD      HIS  52  11.625  -4.854   2.285
  449    HD2  HIS  52           2HD      HIS  52  11.194  -4.283  -1.806
  450    HE1  HIS  52           1HE      HIS  52  12.887  -6.718   1.211
  451    HE2  HIS  52           2HE      HIS  52  12.921  -6.138  -1.211
  452    HA   PRO  53           HA       PRO  53   5.751  -5.873   1.489
  453   1HB   PRO  53          2HB       PRO  53   6.111  -8.187   0.138
  454   2HB   PRO  53          1HB       PRO  53   5.252  -6.795  -0.529
  455   1HG   PRO  53          2HG       PRO  53   8.117  -7.602  -0.925
  456   2HG   PRO  53          1HG       PRO  53   6.917  -7.129  -2.145
  457   1HD   PRO  53          2HD       PRO  53   8.738  -5.401  -1.278
  458   2HD   PRO  53          1HD       PRO  53   7.068  -4.875  -1.592
  459    H    LYS  54           H        LYS  54   9.088  -6.475   1.707
  460    HA   LYS  54           HA       LYS  54   8.939  -8.950   3.039
  461   1HB   LYS  54          2HB       LYS  54  11.153  -7.056   2.624
  462   2HB   LYS  54          1HB       LYS  54  11.327  -8.180   3.963
  463   1HG   LYS  54          2HG       LYS  54  12.353  -9.091   2.000
  464   2HG   LYS  54          1HG       LYS  54  10.945 -10.046   2.425
  465   1HD   LYS  54          2HD       LYS  54   9.674  -8.720   0.720
  466   2HD   LYS  54          1HD       LYS  54  11.216  -8.038   0.210
  467   1HE   LYS  54          2HE       LYS  54  10.351 -10.884   0.225
  468   2HE   LYS  54          1HE       LYS  54  10.698  -9.898  -1.206
  469   1HZ   LYS  54          1HZ       LYS  54  13.115  -9.896  -0.548
  470   2HZ   LYS  54          2HZ       LYS  54  12.535 -11.463  -0.676
  471   3HZ   LYS  54          3HZ       LYS  54  12.711 -10.788   0.818
  472    H    LEU  55           H        LEU  55   8.143  -5.912   4.133
  473    HA   LEU  55           HA       LEU  55   9.079  -6.199   6.851
  474   1HB   LEU  55          2HB       LEU  55   7.289  -4.131   5.595
  475   2HB   LEU  55          1HB       LEU  55   8.066  -4.008   7.164
  476    HG   LEU  55           HG       LEU  55   9.532  -4.145   4.523
  477   1HD1  LEU  55          1HD1      LEU  55  10.047  -1.801   4.901
  478   2HD1  LEU  55          2HD1      LEU  55   9.040  -1.819   6.345
  479   3HD1  LEU  55          3HD1      LEU  55   8.311  -2.061   4.757
  480   1HD2  LEU  55          1HD2      LEU  55  10.519  -3.610   7.314
  481   2HD2  LEU  55          2HD2      LEU  55  11.489  -3.516   5.847
  482   3HD2  LEU  55          3HD2      LEU  55  10.829  -5.067   6.369
  483    H    GLN  56           H        GLN  56   7.892  -6.832   8.565
  484    HA   GLN  56           HA       GLN  56   5.560  -8.423   8.146
  485   1HB   GLN  56          2HB       GLN  56   6.785  -7.460  10.738
  486   2HB   GLN  56          1HB       GLN  56   5.556  -8.702  10.592
  487   1HG   GLN  56          2HG       GLN  56   7.115 -10.103   9.340
  488   2HG   GLN  56          1HG       GLN  56   8.355  -8.857   9.478
  489   1HE2  GLN  56          1HE2      GLN  56   9.318  -8.500  11.515
  490   2HE2  GLN  56          2HE2      GLN  56   9.190  -9.666  12.772
  491    H    SER  57           H        SER  57   5.988  -5.119   9.255
  492    HA   SER  57           HA       SER  57   3.368  -4.794  10.233
  493   1HB   SER  57          2HB       SER  57   3.939  -2.348  10.007
  494   2HB   SER  57          1HB       SER  57   5.118  -3.286  10.924
  495    HG   SER  57           HG       SER  57   5.457  -1.850   8.712
  496    H    THR  58           H        THR  58   4.788  -4.677   7.069
  497    HA   THR  58           HA       THR  58   2.821  -3.261   5.699
  498    HB   THR  58           HB       THR  58   4.642  -5.451   4.678
  499    HG1  THR  58           1HG      THR  58   5.948  -3.533   4.168
  500   1HG2  THR  58          1HG2      THR  58   2.870  -4.770   3.069
  501   2HG2  THR  58          2HG2      THR  58   4.464  -4.251   2.529
  502   3HG2  THR  58          3HG2      THR  58   3.366  -3.089   3.252
  503    H    LYS  59           H        LYS  59   3.199  -6.736   6.393
  504    HA   LYS  59           HA       LYS  59   1.022  -7.677   4.891
  505   1HB   LYS  59          2HB       LYS  59   2.338  -8.752   7.354
  506   2HB   LYS  59          1HB       LYS  59   0.929  -9.545   6.645
  507   1HG   LYS  59          2HG       LYS  59   2.851 -10.664   5.877
  508   2HG   LYS  59          1HG       LYS  59   2.230  -9.721   4.543
  509   1HD   LYS  59          2HD       LYS  59   3.912  -8.017   4.896
  510   2HD   LYS  59          1HD       LYS  59   4.527  -8.885   6.305
  511   1HE   LYS  59          2HE       LYS  59   5.921  -9.294   4.355
  512   2HE   LYS  59          1HE       LYS  59   5.124 -10.775   4.877
  513   1HZ   LYS  59          1HZ       LYS  59   4.242  -9.047   2.636
  514   2HZ   LYS  59          2HZ       LYS  59   3.533 -10.517   3.076
  515   3HZ   LYS  59          3HZ       LYS  59   5.102 -10.482   2.481
  516    H    ARG  60           H        ARG  60   0.956  -6.469   8.259
  517    HA   ARG  60           HA       ARG  60  -1.782  -6.993   8.502
  518   1HB   ARG  60          2HB       ARG  60  -0.001  -5.004   9.868
  519   2HB   ARG  60          1HB       ARG  60  -1.725  -5.043  10.134
  520   1HG   ARG  60          2HG       ARG  60  -0.725  -6.161  11.903
  521   2HG   ARG  60          1HG       ARG  60  -1.485  -7.366  10.893
  522   1HD   ARG  60          2HD       ARG  60   0.634  -7.943   9.844
  523   2HD   ARG  60          1HD       ARG  60   1.463  -6.694  10.762
  524    HE   ARG  60           HE       ARG  60   0.155  -8.471  12.494
  525   1HH1  ARG  60          1HH1      ARG  60   3.008  -8.253  10.409
  526   2HH1  ARG  60          2HH1      ARG  60   3.868  -9.459  11.281
  527   1HH2  ARG  60          1HH2      ARG  60   1.390 -10.066  13.681
  528   2HH2  ARG  60          2HH2      ARG  60   2.946 -10.493  13.138
  529    H    PHE  61           H        PHE  61  -0.004  -4.113   7.530
  530    HA   PHE  61           HA       PHE  61  -2.143  -2.400   7.280
  531   1HB   PHE  61          2HB       PHE  61   0.357  -1.910   7.048
  532   2HB   PHE  61          1HB       PHE  61   0.139  -2.475   5.386
  533    HD1  PHE  61           1HD      PHE  61  -1.263  -1.155   3.781
  534    HD2  PHE  61           2HD      PHE  61  -0.422   0.277   7.700
  535    HE1  PHE  61           1HE      PHE  61  -1.998   1.095   3.122
  536    HE2  PHE  61           2HE      PHE  61  -1.176   2.537   7.030
  537    HZ   PHE  61           HZ       PHE  61  -1.949   2.936   4.755
  538    H    ILE  62           H        ILE  62  -0.809  -4.670   4.894
  539    HA   ILE  62           HA       ILE  62  -2.512  -3.869   2.782
  540    HB   ILE  62           HB       ILE  62  -1.188  -6.573   3.124
  541   1HG1  ILE  62          2HG1      ILE  62   0.506  -4.872   3.234
  542   2HG1  ILE  62          1HG1      ILE  62   0.571  -5.613   1.639
  543   1HG2  ILE  62          1HG2      ILE  62  -2.950  -6.559   1.467
  544   2HG2  ILE  62          2HG2      ILE  62  -1.373  -6.683   0.667
  545   3HG2  ILE  62          3HG2      ILE  62  -2.247  -5.146   0.688
  546   1HD1  ILE  62          1HD1      ILE  62  -0.720  -2.995   2.322
  547   2HD1  ILE  62          2HD1      ILE  62  -0.609  -3.709   0.707
  548   3HD1  ILE  62          3HD1      ILE  62   0.853  -3.207   1.562
  549    H    LYS  63           H        LYS  63  -2.650  -6.623   4.952
  550    HA   LYS  63           HA       LYS  63  -5.196  -7.421   3.939
  551   1HB   LYS  63          2HB       LYS  63  -3.635  -8.317   6.314
  552   2HB   LYS  63          1HB       LYS  63  -5.353  -8.660   6.320
  553   1HG   LYS  63          2HG       LYS  63  -4.261 -10.592   5.418
  554   2HG   LYS  63          1HG       LYS  63  -5.094  -9.785   4.104
  555   1HD   LYS  63          2HD       LYS  63  -3.001 -10.442   3.228
  556   2HD   LYS  63          1HD       LYS  63  -2.845  -8.715   3.549
  557   1HE   LYS  63          2HE       LYS  63  -0.860  -9.934   4.286
  558   2HE   LYS  63          1HE       LYS  63  -1.703  -9.210   5.654
  559   1HZ   LYS  63          1HZ       LYS  63  -2.677 -11.372   6.143
  560   2HZ   LYS  63          2HZ       LYS  63  -1.004 -11.489   6.113
  561   3HZ   LYS  63          3HZ       LYS  63  -1.903 -12.043   4.805
  562    H    TRP  64           H        TRP  64  -4.302  -5.216   6.323
  563    HA   TRP  64           HA       TRP  64  -6.786  -4.905   7.653
  564   1HB   TRP  64          2HB       TRP  64  -4.279  -4.157   8.158
  565   2HB   TRP  64          1HB       TRP  64  -4.825  -2.692   7.368
  566    HD1  TRP  64           HD       TRP  64  -4.611  -4.328  10.615
  567    HE1  TRP  64           1HE      TRP  64  -6.000  -3.044  12.384
  568    HE3  TRP  64           3HE      TRP  64  -7.345  -1.313   7.515
  569    HZ2  TRP  64           2HZ      TRP  64  -7.950  -1.054  12.440
  570    HZ3  TRP  64           3HZ      TRP  64  -8.948   0.250   8.509
  571    HH2  TRP  64           HH       TRP  64  -9.248   0.381  10.920
  572    H    TYR  65           H        TYR  65  -5.067  -3.093   5.013
  573    HA   TYR  65           HA       TYR  65  -7.114  -1.220   4.663
  574   1HB   TYR  65          2HB       TYR  65  -4.887  -0.738   3.753
  575   2HB   TYR  65          1HB       TYR  65  -5.051  -2.079   2.624
  576    HD1  TYR  65           1HD      TYR  65  -5.879  -1.668   0.483
  577    HD2  TYR  65           2HD      TYR  65  -6.812   1.065   3.599
  578    HE1  TYR  65           1HE      TYR  65  -7.062  -0.217  -1.136
  579    HE2  TYR  65           2HE      TYR  65  -7.984   2.505   1.988
  580    HH   TYR  65           HH       TYR  65  -8.047   2.936  -0.351
  581    H    ASN  66           H        ASN  66  -6.559  -4.323   3.144
  582    HA   ASN  66           HA       ASN  66  -8.639  -4.108   1.278
  583   1HB   ASN  66          2HB       ASN  66  -7.395  -6.525   2.563
  584   2HB   ASN  66          1HB       ASN  66  -8.764  -6.675   1.474
  585   1HD2  ASN  66          1HD2      ASN  66  -5.365  -5.870   1.720
  586   2HD2  ASN  66          2HD2      ASN  66  -5.063  -5.942   0.025
  587    H    ALA  67           H        ALA  67  -8.694  -5.309   4.593
  588    HA   ALA  67           HA       ALA  67 -11.430  -5.929   4.672
  589   1HB   ALA  67          1HB       ALA  67  -9.649  -5.038   6.938
  590   2HB   ALA  67          2HB       ALA  67  -9.804  -6.691   6.347
  591   3HB   ALA  67          3HB       ALA  67 -11.184  -5.893   7.096
  592    H    TRP  68           H        TRP  68  -9.686  -2.976   5.449
  593    HA   TRP  68           HA       TRP  68 -11.774  -1.291   6.257
  594   1HB   TRP  68          2HB       TRP  68  -9.575  -0.511   6.595
  595   2HB   TRP  68          1HB       TRP  68  -9.103  -0.876   4.952
  596    HD1  TRP  68           HD       TRP  68  -9.752   0.930   3.068
  597    HE1  TRP  68           1HE      TRP  68 -10.148   3.436   3.183
  598    HE3  TRP  68           3HE      TRP  68 -10.582   1.384   8.108
  599    HZ2  TRP  68           2HZ      TRP  68 -10.729   5.378   5.118
  600    HZ3  TRP  68           3HZ      TRP  68 -11.040   3.637   8.994
  601    HH2  TRP  68           HH       TRP  68 -11.106   5.600   7.495
  602    H    ASN  69           H        ASN  69 -10.473  -1.863   3.027
  603    HA   ASN  69           HA       ASN  69 -12.215  -0.093   1.706
  604   1HB   ASN  69          2HB       ASN  69 -10.122  -0.898   0.679
  605   2HB   ASN  69          1HB       ASN  69 -10.782  -2.528   0.606
  606   1HD2  ASN  69          1HD2      ASN  69 -10.937   0.691  -0.712
  607   2HD2  ASN  69          2HD2      ASN  69 -11.801   0.267  -2.144
  608    H    GLU  70           H        GLU  70 -12.456  -3.510   2.518
  609    HA   GLU  70           HA       GLU  70 -14.886  -4.035   1.213
  610   1HB   GLU  70          2HB       GLU  70 -13.711  -5.269   3.706
  611   2HB   GLU  70          1HB       GLU  70 -15.142  -5.882   2.892
  612   1HG   GLU  70          2HG       GLU  70 -13.828  -6.351   0.907
  613   2HG   GLU  70          1HG       GLU  70 -12.399  -5.669   1.680
  614    H    LYS  71           H        LYS  71 -14.167  -2.739   4.422
  615    HA   LYS  71           HA       LYS  71 -16.743  -2.693   5.534
  616   1HB   LYS  71          2HB       LYS  71 -14.418  -0.810   5.933
  617   2HB   LYS  71          1HB       LYS  71 -15.870  -0.784   6.912
  618   1HG   LYS  71          2HG       LYS  71 -14.103  -3.199   6.652
  619   2HG   LYS  71          1HG       LYS  71 -13.863  -1.973   7.882
  620   1HD   LYS  71          2HD       LYS  71 -16.433  -3.524   7.525
  621   2HD   LYS  71          1HD       LYS  71 -15.159  -3.975   8.656
  622   1HE   LYS  71          2HE       LYS  71 -15.401  -1.765   9.756
  623   2HE   LYS  71          1HE       LYS  71 -16.723  -1.385   8.664
  624   1HZ   LYS  71          1HZ       LYS  71 -17.458  -2.187  10.840
  625   2HZ   LYS  71          2HZ       LYS  71 -16.731  -3.686  10.557
  626   3HZ   LYS  71          3HZ       LYS  71 -18.005  -3.145   9.583
  627    H    ARG  72           H        ARG  72 -15.209  -0.551   3.255
  628    HA   ARG  72           HA       ARG  72 -17.406   1.362   3.467
  629   1HB   ARG  72          2HB       ARG  72 -14.958   1.459   1.716
  630   2HB   ARG  72          1HB       ARG  72 -16.093   2.772   1.996
  631   1HG   ARG  72          2HG       ARG  72 -15.443   2.768   4.383
  632   2HG   ARG  72          1HG       ARG  72 -14.237   1.532   4.015
  633   1HD   ARG  72          2HD       ARG  72 -13.157   3.671   4.030
  634   2HD   ARG  72          1HD       ARG  72 -13.233   3.088   2.373
  635    HE   ARG  72           HE       ARG  72 -15.429   4.759   3.164
  636   1HH1  ARG  72          1HH1      ARG  72 -12.266   4.637   1.556
  637   2HH1  ARG  72          2HH1      ARG  72 -12.412   6.169   0.850
  638   1HH2  ARG  72          1HH2      ARG  72 -15.614   6.884   2.183
  639   2HH2  ARG  72          2HH2      ARG  72 -14.335   7.483   1.221
  640    H    ARG  73           H        ARG  73 -16.763  -1.400   1.836
  641    HA   ARG  73           HA       ARG  73 -18.070  -0.646  -0.676
  642   1HB   ARG  73          2HB       ARG  73 -16.025  -2.064  -0.651
  643   2HB   ARG  73          1HB       ARG  73 -16.922  -3.279   0.241
  644   1HG   ARG  73          2HG       ARG  73 -18.506  -3.409  -1.685
  645   2HG   ARG  73          1HG       ARG  73 -17.409  -2.351  -2.577
  646   1HD   ARG  73          2HD       ARG  73 -16.802  -5.072  -1.444
  647   2HD   ARG  73          1HD       ARG  73 -16.930  -4.633  -3.147
  648    HE   ARG  73           HE       ARG  73 -14.981  -3.015  -2.119
  649   1HH1  ARG  73          1HH1      ARG  73 -15.466  -6.507  -2.481
  650   2HH1  ARG  73          2HH1      ARG  73 -13.823  -6.897  -2.500
  651   1HH2  ARG  73          1HH2      ARG  73 -12.709  -3.535  -2.124
  652   2HH2  ARG  73          2HH2      ARG  73 -12.204  -5.160  -2.295
  653    H    VAL  74           H        VAL  74 -18.311  -3.038   1.930
  654    HA   VAL  74           HA       VAL  74 -21.182  -3.145   1.616
  655    HB   VAL  74           HB       VAL  74 -20.258  -4.853   0.093
  656   1HG1  VAL  74          1HG1      VAL  74 -19.022  -6.787   0.940
  657   2HG1  VAL  74          2HG1      VAL  74 -18.927  -6.005   2.519
  658   3HG1  VAL  74          3HG1      VAL  74 -18.138  -5.271   1.123
  659   1HG2  VAL  74          1HG2      VAL  74 -21.453  -6.827   0.939
  660   2HG2  VAL  74          2HG2      VAL  74 -22.385  -5.348   1.184
  661   3HG2  VAL  74          3HG2      VAL  74 -21.532  -6.082   2.535
  662    H    TYR  75           H        TYR  75 -22.167  -4.152   3.485
  663    HA   TYR  75           HA       TYR  75 -21.183  -3.403   5.912
  664   1HB   TYR  75          2HB       TYR  75 -22.896  -4.898   6.914
  665   2HB   TYR  75          1HB       TYR  75 -23.500  -3.835   5.653
  666    HD1  TYR  75           1HD      TYR  75 -24.099  -4.673   3.594
  667    HD2  TYR  75           2HD      TYR  75 -22.800  -7.217   6.596
  668    HE1  TYR  75           1HE      TYR  75 -25.073  -6.614   2.290
  669    HE2  TYR  75           2HE      TYR  75 -23.716  -9.215   5.395
  670    HH   TYR  75           HH       TYR  75 -25.467  -9.635   3.722
  671    H    GLU  76           H        GLU  76 -20.270  -4.527   7.670
  672    HA   GLU  76           HA       GLU  76 -18.302  -6.449   6.986
  673   1HB   GLU  76          2HB       GLU  76 -18.053  -4.818   8.824
  674   2HB   GLU  76          1HB       GLU  76 -19.311  -5.680   9.711
  675   1HG   GLU  76          2HG       GLU  76 -17.898  -7.675   9.729
  676   2HG   GLU  76          1HG       GLU  76 -16.633  -6.777   8.897
  677    H    GLU  77           H        GLU  77 -18.412  -8.558   6.990
  678    HA   GLU  77           HA       GLU  77 -20.529  -9.957   8.396
  679   1HB   GLU  77          2HB       GLU  77 -21.146  -9.273   5.919
  680   2HB   GLU  77          1HB       GLU  77 -20.002 -10.525   5.475
  681   1HG   GLU  77          2HG       GLU  77 -22.548 -10.887   7.061
  682   2HG   GLU  77          1HG       GLU  77 -22.292 -11.332   5.384
  Start of MODEL   16
    1    H    SER   1           H        SER   1  22.526  -3.799  -4.659
    2    HA   SER   1           HA       SER   1  20.966  -1.456  -3.963
    3   1HB   SER   1          2HB       SER   1  23.271  -0.644  -4.328
    4   2HB   SER   1          1HB       SER   1  23.303  -1.432  -5.900
    5    HG   SER   1           HG       SER   1  22.690   0.962  -5.538
    6    H    LYS   2           H        LYS   2  19.165  -2.668  -4.604
    7    HA   LYS   2           HA       LYS   2  18.773  -2.702  -7.487
    8   1HB   LYS   2          2HB       LYS   2  18.193  -5.080  -5.712
    9   2HB   LYS   2          1HB       LYS   2  17.581  -4.887  -7.341
   10   1HG   LYS   2          2HG       LYS   2  19.864  -4.885  -8.201
   11   2HG   LYS   2          1HG       LYS   2  20.482  -5.081  -6.564
   12   1HD   LYS   2          2HD       LYS   2  19.299  -7.217  -6.373
   13   2HD   LYS   2          1HD       LYS   2  18.664  -7.003  -8.006
   14   1HE   LYS   2          2HE       LYS   2  21.579  -7.227  -7.266
   15   2HE   LYS   2          1HE       LYS   2  20.598  -8.509  -7.966
   16   1HZ   LYS   2          1HZ       LYS   2  21.159  -5.902  -9.260
   17   2HZ   LYS   2          2HZ       LYS   2  20.339  -7.203  -9.975
   18   3HZ   LYS   2          3HZ       LYS   2  21.970  -7.329  -9.581
   19    H    CYS   3           H        CYS   3  16.662  -2.486  -8.112
   20    HA   CYS   3           HA       CYS   3  14.563  -1.793  -8.101
   21   1HB   CYS   3          2HB       CYS   3  14.440  -3.029  -5.343
   22   2HB   CYS   3          1HB       CYS   3  13.038  -2.519  -6.284
   23    H    LYS   4           H        LYS   4  14.768   0.287  -8.325
   24    HA   LYS   4           HA       LYS   4  15.551   2.141  -6.375
   25   1HB   LYS   4          2HB       LYS   4  13.939   2.527  -8.870
   26   2HB   LYS   4          1HB       LYS   4  14.597   3.849  -7.916
   27   1HG   LYS   4          2HG       LYS   4  16.848   3.100  -8.350
   28   2HG   LYS   4          1HG       LYS   4  16.248   1.684  -9.207
   29   1HD   LYS   4          2HD       LYS   4  15.832   4.560 -10.031
   30   2HD   LYS   4          1HD       LYS   4  16.985   3.429 -10.753
   31   1HE   LYS   4          2HE       LYS   4  15.065   1.957 -11.354
   32   2HE   LYS   4          1HE       LYS   4  13.981   3.195 -10.738
   33   1HZ   LYS   4          1HZ       LYS   4  14.221   3.251 -13.101
   34   2HZ   LYS   4          2HZ       LYS   4  15.864   3.542 -12.996
   35   3HZ   LYS   4          3HZ       LYS   4  14.755   4.707 -12.446
   36    H    CYS   5           H        CYS   5  12.444   0.738  -7.000
   37    HA   CYS   5           HA       CYS   5  11.365   2.517  -4.941
   38   1HB   CYS   5          2HB       CYS   5  10.390   2.621  -7.375
   39   2HB   CYS   5          1HB       CYS   5   9.664   1.080  -6.984
   40    H    SER   6           H        SER   6  12.122   1.144  -3.382
   41    HA   SER   6           HA       SER   6  11.002  -1.562  -3.250
   42   1HB   SER   6          2HB       SER   6  13.152  -0.220  -1.571
   43   2HB   SER   6          1HB       SER   6  12.626  -1.896  -1.421
   44    HG   SER   6           HG       SER   6  13.873  -0.718  -3.710
   45    H    ARG   7           H        ARG   7  11.625   1.237  -1.177
   46    HA   ARG   7           HA       ARG   7   8.904   1.251  -0.421
   47   1HB   ARG   7          2HB       ARG   7   9.328   1.366   2.033
   48   2HB   ARG   7          1HB       ARG   7   9.818  -0.171   1.372
   49   1HG   ARG   7          2HG       ARG   7  11.462   0.338   2.949
   50   2HG   ARG   7          1HG       ARG   7  12.211   0.801   1.428
   51   1HD   ARG   7          2HD       ARG   7  11.680   3.143   1.861
   52   2HD   ARG   7          1HD       ARG   7  10.835   2.702   3.342
   53    HE   ARG   7           HE       ARG   7  13.535   1.792   3.268
   54   1HH1  ARG   7          1HH1      ARG   7  11.566   4.706   3.955
   55   2HH1  ARG   7          2HH1      ARG   7  12.645   5.296   5.124
   56   1HH2  ARG   7          1HH2      ARG   7  14.997   2.668   4.877
   57   2HH2  ARG   7          2HH2      ARG   7  14.631   4.146   5.652
   58    H    LYS   8           H        LYS   8   8.229   3.141  -0.734
   59    HA   LYS   8           HA       LYS   8   9.986   5.419  -0.291
   60   1HB   LYS   8          2HB       LYS   8  10.436   4.779  -2.567
   61   2HB   LYS   8          1HB       LYS   8   8.723   4.737  -2.942
   62   1HG   LYS   8          2HG       LYS   8   8.580   7.153  -2.582
   63   2HG   LYS   8          1HG       LYS   8  10.299   7.200  -2.192
   64   1HD   LYS   8          2HD       LYS   8   9.141   6.280  -4.821
   65   2HD   LYS   8          1HD       LYS   8   9.804   7.884  -4.521
   66   1HE   LYS   8          2HE       LYS   8  11.320   5.266  -4.332
   67   2HE   LYS   8          1HE       LYS   8  11.428   6.437  -5.637
   68   1HZ   LYS   8          1HZ       LYS   8  12.223   6.968  -2.803
   69   2HZ   LYS   8          2HZ       LYS   8  12.293   8.066  -4.060
   70   3HZ   LYS   8          3HZ       LYS   8  13.255   6.687  -4.105
   71    H    GLY   9           H        GLY   9   8.923   7.216   0.250
   72   1HA   GLY   9          2HA       GLY   9   6.996   8.599   0.028
   73   2HA   GLY   9          1HA       GLY   9   6.044   7.116   0.002
   74    HA   PRO  10           HA       PRO  10   6.740   8.934   4.510
   75   1HB   PRO  10          2HB       PRO  10   4.104  10.167   3.870
   76   2HB   PRO  10          1HB       PRO  10   5.412  10.786   4.882
   77   1HG   PRO  10          2HG       PRO  10   5.032  11.804   2.476
   78   2HG   PRO  10          1HG       PRO  10   6.676  11.480   3.058
   79   1HD   PRO  10          2HD       PRO  10   5.014   9.933   1.117
   80   2HD   PRO  10          1HD       PRO  10   6.752  10.296   1.098
   81    H    LYS  11           H        LYS  11   5.376   8.226   6.279
   82    HA   LYS  11           HA       LYS  11   4.213   5.716   5.837
   83   1HB   LYS  11          2HB       LYS  11   5.296   6.355   7.949
   84   2HB   LYS  11          1HB       LYS  11   4.016   7.524   8.242
   85   1HG   LYS  11          2HG       LYS  11   2.404   5.744   8.479
   86   2HG   LYS  11          1HG       LYS  11   3.625   4.544   8.047
   87   1HD   LYS  11          2HD       LYS  11   3.306   4.614  10.470
   88   2HD   LYS  11          1HD       LYS  11   4.924   5.141  10.031
   89   1HE   LYS  11          2HE       LYS  11   4.205   7.488  10.257
   90   2HE   LYS  11          1HE       LYS  11   2.599   6.934  10.729
   91   1HZ   LYS  11          1HZ       LYS  11   5.117   6.377  12.181
   92   2HZ   LYS  11          2HZ       LYS  11   3.580   5.875  12.656
   93   3HZ   LYS  11          3HZ       LYS  11   3.961   7.517  12.625
   94    H    ILE  12           H        ILE  12   2.175   5.060   5.688
   95    HA   ILE  12           HA       ILE  12   0.202   7.095   4.863
   96    HB   ILE  12           HB       ILE  12   0.290   4.175   4.105
   97   1HG1  ILE  12          2HG1      ILE  12   1.457   6.477   2.547
   98   2HG1  ILE  12          1HG1      ILE  12   2.410   5.313   3.461
   99   1HG2  ILE  12          1HG2      ILE  12  -0.957   6.607   2.802
  100   2HG2  ILE  12          2HG2      ILE  12  -1.829   5.377   3.723
  101   3HG2  ILE  12          3HG2      ILE  12  -1.044   4.960   2.194
  102   1HD1  ILE  12          1HD1      ILE  12   2.383   4.765   1.113
  103   2HD1  ILE  12          2HD1      ILE  12   0.621   4.716   1.131
  104   3HD1  ILE  12          3HD1      ILE  12   1.545   3.523   2.046
  105    H    ARG  13           H        ARG  13  -1.884   6.955   5.644
  106    HA   ARG  13           HA       ARG  13  -2.419   4.859   7.597
  107   1HB   ARG  13          2HB       ARG  13  -3.760   7.498   7.032
  108   2HB   ARG  13          1HB       ARG  13  -4.442   6.282   8.097
  109   1HG   ARG  13          2HG       ARG  13  -2.528   6.443   9.547
  110   2HG   ARG  13          1HG       ARG  13  -1.792   7.638   8.475
  111   1HD   ARG  13          2HD       ARG  13  -3.618   9.153   8.876
  112   2HD   ARG  13          1HD       ARG  13  -4.439   7.956   9.882
  113    HE   ARG  13           HE       ARG  13  -1.976   8.276  10.991
  114   1HH1  ARG  13          1HH1      ARG  13  -4.668  10.465  10.255
  115   2HH1  ARG  13          2HH1      ARG  13  -4.370  11.482  11.583
  116   1HH2  ARG  13          1HH2      ARG  13  -1.572   9.678  12.782
  117   2HH2  ARG  13          2HH2      ARG  13  -2.586  11.028  13.067
  118    H    TYR  14           H        TYR  14  -4.678   3.984   7.437
  119    HA   TYR  14           HA       TYR  14  -5.020   2.845   4.854
  120   1HB   TYR  14          2HB       TYR  14  -7.057   2.921   7.083
  121   2HB   TYR  14          1HB       TYR  14  -6.907   1.711   5.818
  122    HD1  TYR  14           1HD      TYR  14  -6.077   2.559   9.157
  123    HD2  TYR  14           2HD      TYR  14  -4.674   0.289   5.836
  124    HE1  TYR  14           1HE      TYR  14  -4.669   1.249  10.655
  125    HE2  TYR  14           2HE      TYR  14  -3.276  -1.023   7.332
  126    HH   TYR  14           HH       TYR  14  -3.654  -0.900  10.714
  127    H    SER  15           H        SER  15  -6.365   5.456   6.624
  128    HA   SER  15           HA       SER  15  -8.614   6.106   5.153
  129   1HB   SER  15          2HB       SER  15  -6.742   7.821   6.725
  130   2HB   SER  15          1HB       SER  15  -8.394   8.261   6.274
  131    HG   SER  15           HG       SER  15  -9.149   7.020   7.778
  132    H    ASP  16           H        ASP  16  -5.214   6.593   4.415
  133    HA   ASP  16           HA       ASP  16  -5.680   8.859   2.631
  134   1HB   ASP  16          2HB       ASP  16  -3.125   7.316   3.170
  135   2HB   ASP  16          1HB       ASP  16  -3.246   8.726   2.141
  136    H    VAL  17           H        VAL  17  -5.704   5.498   2.454
  137    HA   VAL  17           HA       VAL  17  -4.601   5.393  -0.256
  138    HB   VAL  17           HB       VAL  17  -5.754   3.081   1.276
  139   1HG1  VAL  17          1HG1      VAL  17  -5.533   2.547  -0.971
  140   2HG1  VAL  17          2HG1      VAL  17  -4.228   1.739  -0.112
  141   3HG1  VAL  17          3HG1      VAL  17  -3.914   3.208  -1.070
  142   1HG2  VAL  17          1HG2      VAL  17  -3.468   2.542   2.009
  143   2HG2  VAL  17          2HG2      VAL  17  -4.025   4.079   2.666
  144   3HG2  VAL  17          3HG2      VAL  17  -2.903   4.059   1.307
  145    H    LYS  18           H        LYS  18  -5.732   5.227  -2.077
  146    HA   LYS  18           HA       LYS  18  -8.674   4.969  -1.974
  147   1HB   LYS  18          2HB       LYS  18  -6.843   5.511  -4.297
  148   2HB   LYS  18          1HB       LYS  18  -8.580   5.393  -4.422
  149   1HG   LYS  18          2HG       LYS  18  -8.690   7.369  -2.875
  150   2HG   LYS  18          1HG       LYS  18  -6.931   7.502  -3.054
  151   1HD   LYS  18          2HD       LYS  18  -9.011   7.722  -5.256
  152   2HD   LYS  18          1HD       LYS  18  -8.023   9.026  -4.612
  153   1HE   LYS  18          2HE       LYS  18  -6.003   7.868  -5.439
  154   2HE   LYS  18          1HE       LYS  18  -7.020   6.608  -6.133
  155   1HZ   LYS  18          1HZ       LYS  18  -6.952   9.478  -6.901
  156   2HZ   LYS  18          2HZ       LYS  18  -8.065   8.393  -7.510
  157   3HZ   LYS  18          3HZ       LYS  18  -6.419   8.176  -7.831
  158    H    LYS  19           H        LYS  19  -5.800   3.404  -3.141
  159    HA   LYS  19           HA       LYS  19  -7.184   0.965  -3.757
  160   1HB   LYS  19          2HB       LYS  19  -7.452   2.216  -5.832
  161   2HB   LYS  19          1HB       LYS  19  -5.737   2.575  -5.870
  162   1HG   LYS  19          2HG       LYS  19  -5.242   0.200  -6.134
  163   2HG   LYS  19          1HG       LYS  19  -6.977  -0.133  -6.064
  164   1HD   LYS  19          2HD       LYS  19  -7.321   1.167  -8.105
  165   2HD   LYS  19          1HD       LYS  19  -5.605   1.576  -8.137
  166   1HE   LYS  19          2HE       LYS  19  -5.020  -0.760  -8.468
  167   2HE   LYS  19          1HE       LYS  19  -6.712  -1.231  -8.336
  168   1HZ   LYS  19          1HZ       LYS  19  -5.985  -1.123 -10.651
  169   2HZ   LYS  19          2HZ       LYS  19  -5.590   0.507 -10.479
  170   3HZ   LYS  19          3HZ       LYS  19  -7.188   0.005 -10.325
  171    H    LEU  20           H        LEU  20  -5.845  -0.737  -3.576
  172    HA   LEU  20           HA       LEU  20  -2.986  -0.271  -3.151
  173   1HB   LEU  20          2HB       LEU  20  -4.368  -0.723  -1.086
  174   2HB   LEU  20          1HB       LEU  20  -4.891  -2.214  -1.802
  175    HG   LEU  20           HG       LEU  20  -2.031  -1.622  -0.981
  176   1HD1  LEU  20          1HD1      LEU  20  -2.530  -3.021   0.966
  177   2HD1  LEU  20          2HD1      LEU  20  -4.192  -3.194   0.433
  178   3HD1  LEU  20          3HD1      LEU  20  -3.595  -1.622   0.928
  179   1HD2  LEU  20          1HD2      LEU  20  -1.739  -4.057  -1.157
  180   2HD2  LEU  20          2HD2      LEU  20  -2.241  -3.386  -2.707
  181   3HD2  LEU  20          3HD2      LEU  20  -3.411  -4.229  -1.692
  182    H    GLU  21           H        GLU  21  -1.859  -1.370  -4.750
  183    HA   GLU  21           HA       GLU  21  -3.170  -3.695  -5.984
  184   1HB   GLU  21          2HB       GLU  21  -3.295  -1.718  -7.442
  185   2HB   GLU  21          1HB       GLU  21  -1.562  -1.488  -7.302
  186   1HG   GLU  21          2HG       GLU  21  -2.129  -2.491  -9.428
  187   2HG   GLU  21          1HG       GLU  21  -1.193  -3.614  -8.440
  188    H    MET  22           H        MET  22  -1.728  -5.496  -6.252
  189    HA   MET  22           HA       MET  22   0.928  -4.893  -5.267
  190   1HB   MET  22          2HB       MET  22   1.123  -7.201  -4.619
  191   2HB   MET  22          1HB       MET  22  -0.312  -6.519  -3.894
  192   1HG   MET  22          2HG       MET  22  -0.207  -8.375  -6.278
  193   2HG   MET  22          1HG       MET  22  -0.661  -8.825  -4.640
  194   1HE   MET  22          1HE       MET  22  -2.876  -9.968  -5.586
  195   2HE   MET  22          2HE       MET  22  -2.353  -9.529  -7.212
  196   3HE   MET  22          3HE       MET  22  -3.992  -9.165  -6.678
  197    H    LYS  23           H        LYS  23   2.312  -4.612  -6.796
  198    HA   LYS  23           HA       LYS  23   2.913  -6.679  -8.555
  199   1HB   LYS  23          2HB       LYS  23   2.726  -5.476 -10.724
  200   2HB   LYS  23          1HB       LYS  23   1.167  -5.733  -9.991
  201   1HG   LYS  23          2HG       LYS  23   1.048  -3.594 -10.933
  202   2HG   LYS  23          1HG       LYS  23   1.356  -3.272  -9.229
  203   1HD   LYS  23          2HD       LYS  23   3.726  -2.925  -9.720
  204   2HD   LYS  23          1HD       LYS  23   3.439  -3.332 -11.410
  205   1HE   LYS  23          2HE       LYS  23   2.282  -0.941  -9.946
  206   2HE   LYS  23          1HE       LYS  23   3.601  -0.917 -11.102
  207   1HZ   LYS  23          1HZ       LYS  23   1.520  -0.241 -12.053
  208   2HZ   LYS  23          2HZ       LYS  23   0.804  -1.721 -11.715
  209   3HZ   LYS  23          3HZ       LYS  23   2.069  -1.629 -12.822
  210    HA   PRO  24           HA       PRO  24   6.755  -4.920  -7.554
  211   1HB   PRO  24          2HB       PRO  24   8.338  -6.045  -9.461
  212   2HB   PRO  24          1HB       PRO  24   7.792  -6.938  -8.048
  213   1HG   PRO  24          2HG       PRO  24   6.778  -6.980 -10.849
  214   2HG   PRO  24          1HG       PRO  24   6.907  -8.313  -9.689
  215   1HD   PRO  24          2HD       PRO  24   4.553  -7.047 -10.270
  216   2HD   PRO  24          1HD       PRO  24   4.914  -7.822  -8.715
  217    H    LYS  25           H        LYS  25   7.860  -3.095  -8.112
  218    HA   LYS  25           HA       LYS  25   6.976  -1.596 -10.335
  219   1HB   LYS  25          2HB       LYS  25   7.860  -0.548  -8.325
  220   2HB   LYS  25          1HB       LYS  25   9.511  -1.136  -8.663
  221   1HG   LYS  25          2HG       LYS  25   9.406   1.152  -9.275
  222   2HG   LYS  25          1HG       LYS  25   9.275   0.261 -10.796
  223   1HD   LYS  25          2HD       LYS  25   6.797   0.404 -10.555
  224   2HD   LYS  25          1HD       LYS  25   7.037   1.452  -9.188
  225   1HE   LYS  25          2HE       LYS  25   8.257   3.084 -10.563
  226   2HE   LYS  25          1HE       LYS  25   8.037   2.054 -11.974
  227   1HZ   LYS  25          1HZ       LYS  25   5.660   2.381 -11.833
  228   2HZ   LYS  25          2HZ       LYS  25   6.438   3.871 -11.905
  229   3HZ   LYS  25          3HZ       LYS  25   5.827   3.340 -10.441
  230    H    TYR  26           H        TYR  26   9.567  -3.779  -9.686
  231    HA   TYR  26           HA       TYR  26  10.231  -3.964 -12.520
  232   1HB   TYR  26          2HB       TYR  26  12.119  -3.910 -10.153
  233   2HB   TYR  26          1HB       TYR  26  12.581  -4.634 -11.685
  234    HD1  TYR  26           1HD      TYR  26  13.363  -3.342 -13.407
  235    HD2  TYR  26           2HD      TYR  26  11.515  -1.442 -10.110
  236    HE1  TYR  26           1HE      TYR  26  14.071  -1.146 -14.294
  237    HE2  TYR  26           2HE      TYR  26  12.218   0.762 -10.963
  238    HH   TYR  26           HH       TYR  26  13.391   1.145 -14.122
  239    HA   PRO  27           HA       PRO  27   8.780  -8.137 -11.611
  240   1HB   PRO  27          2HB       PRO  27  10.321  -8.749 -14.083
  241   2HB   PRO  27          1HB       PRO  27   8.645  -9.133 -13.685
  242   1HG   PRO  27          2HG       PRO  27   9.180  -7.180 -15.396
  243   2HG   PRO  27          1HG       PRO  27   7.893  -6.994 -14.193
  244   1HD   PRO  27          2HD       PRO  27  10.650  -5.817 -14.200
  245   2HD   PRO  27          1HD       PRO  27   9.099  -5.110 -13.703
  246    H    HIS  28           H        HIS  28  12.083  -7.319 -12.248
  247    HA   HIS  28           HA       HIS  28  13.174  -9.854 -11.428
  248   1HB   HIS  28          2HB       HIS  28  15.395  -8.785 -11.484
  249   2HB   HIS  28          1HB       HIS  28  14.499  -8.453 -12.960
  250    HD1  HIS  28           1HD      HIS  28  15.498  -6.781  -9.682
  251    HD2  HIS  28           2HD      HIS  28  14.447  -5.715 -13.572
  252    HE1  HIS  28           1HE      HIS  28  15.818  -4.311  -9.871
  253    HE2  HIS  28           2HE      HIS  28  15.592  -3.860 -12.288
  254    H    CYS  29           H        CYS  29  11.468  -8.078  -9.522
  255    HA   CYS  29           HA       CYS  29  13.394  -8.000  -7.304
  256   1HB   CYS  29          2HB       CYS  29  11.773  -5.989  -8.259
  257   2HB   CYS  29          1HB       CYS  29  10.777  -6.693  -7.008
  258    H    GLU  30           H        GLU  30  12.195  -8.473  -5.104
  259    HA   GLU  30           HA       GLU  30  11.086 -11.118  -5.413
  260   1HB   GLU  30          2HB       GLU  30  11.588  -9.457  -2.942
  261   2HB   GLU  30          1HB       GLU  30  11.126 -11.148  -2.967
  262   1HG   GLU  30          2HG       GLU  30  13.131 -11.711  -3.999
  263   2HG   GLU  30          1HG       GLU  30  13.570 -10.003  -4.136
  264    H    GLU  31           H        GLU  31   9.058 -11.679  -5.387
  265    HA   GLU  31           HA       GLU  31   6.835 -11.636  -5.355
  266   1HB   GLU  31          2HB       GLU  31   7.501 -10.293  -2.765
  267   2HB   GLU  31          1HB       GLU  31   5.825 -10.521  -3.220
  268   1HG   GLU  31          2HG       GLU  31   6.601 -12.303  -1.743
  269   2HG   GLU  31          1HG       GLU  31   6.153 -12.928  -3.315
  270    H    LYS  32           H        LYS  32   4.856  -9.918  -4.614
  271    HA   LYS  32           HA       LYS  32   5.131  -7.856  -6.620
  272   1HB   LYS  32          2HB       LYS  32   2.783  -9.186  -5.322
  273   2HB   LYS  32          1HB       LYS  32   2.591  -7.644  -6.136
  274   1HG   LYS  32          2HG       LYS  32   1.983  -9.580  -7.520
  275   2HG   LYS  32          1HG       LYS  32   3.279  -8.626  -8.230
  276   1HD   LYS  32          2HD       LYS  32   4.861 -10.195  -7.314
  277   2HD   LYS  32          1HD       LYS  32   3.528 -11.198  -6.722
  278   1HE   LYS  32          2HE       LYS  32   4.126 -10.518  -9.619
  279   2HE   LYS  32          1HE       LYS  32   4.364 -12.089  -8.859
  280   1HZ   LYS  32          1HZ       LYS  32   1.966 -12.240  -8.523
  281   2HZ   LYS  32          2HZ       LYS  32   2.360 -12.050 -10.149
  282   3HZ   LYS  32          3HZ       LYS  32   1.744 -10.743  -9.286
  283    H    MET  33           H        MET  33   5.684  -6.023  -6.041
  284    HA   MET  33           HA       MET  33   5.703  -5.084  -3.412
  285   1HB   MET  33          2HB       MET  33   6.077  -3.564  -5.964
  286   2HB   MET  33          1HB       MET  33   6.032  -2.745  -4.422
  287   1HG   MET  33          2HG       MET  33   8.304  -3.176  -5.039
  288   2HG   MET  33          1HG       MET  33   7.860  -4.105  -3.608
  289   1HE   MET  33          1HE       MET  33   9.390  -5.889  -3.541
  290   2HE   MET  33          2HE       MET  33  10.365  -4.904  -4.644
  291   3HE   MET  33          3HE       MET  33  10.210  -6.661  -4.903
  292    H    VAL  34           H        VAL  34   4.574  -3.296  -2.552
  293    HA   VAL  34           HA       VAL  34   1.798  -3.438  -3.358
  294    HB   VAL  34           HB       VAL  34   2.999  -2.199  -0.892
  295   1HG1  VAL  34          1HG1      VAL  34   0.844  -1.293  -1.660
  296   2HG1  VAL  34          2HG1      VAL  34   0.701  -2.093  -0.098
  297   3HG1  VAL  34          3HG1      VAL  34   0.140  -2.891  -1.576
  298   1HG2  VAL  34          1HG2      VAL  34   2.171  -4.192   0.280
  299   2HG2  VAL  34          2HG2      VAL  34   3.355  -4.631  -0.951
  300   3HG2  VAL  34          3HG2      VAL  34   1.631  -4.874  -1.251
  301    H    ILE  35           H        ILE  35   1.132  -2.002  -4.679
  302    HA   ILE  35           HA       ILE  35   2.411   0.597  -4.883
  303    HB   ILE  35           HB       ILE  35   0.244  -0.681  -6.559
  304   1HG1  ILE  35          2HG1      ILE  35   2.274  -2.011  -6.585
  305   2HG1  ILE  35          1HG1      ILE  35   1.952  -1.305  -8.153
  306   1HG2  ILE  35          1HG2      ILE  35   0.898   0.990  -8.234
  307   2HG2  ILE  35          2HG2      ILE  35   2.046   1.668  -7.071
  308   3HG2  ILE  35          3HG2      ILE  35   0.310   1.713  -6.733
  309   1HD1  ILE  35          1HD1      ILE  35   3.685   0.428  -7.668
  310   2HD1  ILE  35          2HD1      ILE  35   4.338  -1.203  -7.684
  311   3HD1  ILE  35          3HD1      ILE  35   4.036  -0.393  -6.144
  312    H    ILE  36           H        ILE  36   1.548   2.008  -3.532
  313    HA   ILE  36           HA       ILE  36  -1.294   1.751  -2.903
  314    HB   ILE  36           HB       ILE  36   0.896   3.052  -1.304
  315   1HG1  ILE  36          2HG1      ILE  36  -0.851   0.634  -0.873
  316   2HG1  ILE  36          1HG1      ILE  36   0.884   0.665  -1.184
  317   1HG2  ILE  36          1HG2      ILE  36  -1.158   4.390  -1.107
  318   2HG2  ILE  36          2HG2      ILE  36  -0.825   3.513   0.391
  319   3HG2  ILE  36          3HG2      ILE  36  -2.052   2.915  -0.718
  320   1HD1  ILE  36          1HD1      ILE  36   0.308   0.242   1.156
  321   2HD1  ILE  36          2HD1      ILE  36  -0.480   1.840   1.153
  322   3HD1  ILE  36          3HD1      ILE  36   1.264   1.733   0.922
  323    H    THR  37           H        THR  37  -2.577   3.014  -3.693
  324    HA   THR  37           HA       THR  37  -1.689   5.514  -4.949
  325    HB   THR  37           HB       THR  37  -4.354   4.075  -5.226
  326    HG1  THR  37           1HG      THR  37  -2.040   3.307  -6.055
  327   1HG2  THR  37          1HG2      THR  37  -3.036   6.232  -6.881
  328   2HG2  THR  37          2HG2      THR  37  -4.414   6.461  -5.805
  329   3HG2  THR  37          3HG2      THR  37  -4.578   5.454  -7.244
  330    H    THR  38           H        THR  38  -2.178   7.422  -3.979
  331    HA   THR  38           HA       THR  38  -3.742   7.303  -1.545
  332    HB   THR  38           HB       THR  38  -2.822   9.611  -1.157
  333    HG1  THR  38           1HG      THR  38  -0.933   9.050  -3.210
  334   1HG2  THR  38          1HG2      THR  38  -0.566   8.784  -0.599
  335   2HG2  THR  38          2HG2      THR  38  -0.862   7.358  -1.592
  336   3HG2  THR  38          3HG2      THR  38  -1.823   7.631  -0.139
  337    H    LYS  39           H        LYS  39  -4.992   9.300  -0.976
  338    HA   LYS  39           HA       LYS  39  -7.301   9.454  -2.477
  339   1HB   LYS  39          2HB       LYS  39  -6.283  11.307  -0.344
  340   2HB   LYS  39          1HB       LYS  39  -7.888  11.440  -1.044
  341   1HG   LYS  39          2HG       LYS  39  -6.831   8.993   0.366
  342   2HG   LYS  39          1HG       LYS  39  -7.851  10.230   1.106
  343   1HD   LYS  39          2HD       LYS  39  -9.622   9.754  -0.490
  344   2HD   LYS  39          1HD       LYS  39  -8.605   8.561  -1.297
  345   1HE   LYS  39          2HE       LYS  39  -8.585   7.214   0.733
  346   2HE   LYS  39          1HE       LYS  39  -9.564   8.431   1.550
  347   1HZ   LYS  39          1HZ       LYS  39 -10.909   6.544   0.713
  348   2HZ   LYS  39          2HZ       LYS  39 -10.430   6.909  -0.851
  349   3HZ   LYS  39          3HZ       LYS  39 -11.368   7.988   0.018
  350    H    SER  40           H        SER  40  -4.469  11.201  -3.104
  351    HA   SER  40           HA       SER  40  -3.900  12.401  -4.909
  352   1HB   SER  40          2HB       SER  40  -6.822  12.344  -5.724
  353   2HB   SER  40          1HB       SER  40  -5.464  12.837  -6.755
  354    HG   SER  40           HG       SER  40  -5.149  10.402  -5.555
  355    H    VAL  41           H        VAL  41  -6.639  13.506  -3.087
  356    HA   VAL  41           HA       VAL  41  -6.009  16.291  -3.395
  357    HB   VAL  41           HB       VAL  41  -8.286  15.459  -2.727
  358   1HG1  VAL  41          1HG1      VAL  41  -6.992  14.753  -0.106
  359   2HG1  VAL  41          2HG1      VAL  41  -7.681  13.637  -1.283
  360   3HG1  VAL  41          3HG1      VAL  41  -8.727  14.765  -0.420
  361   1HG2  VAL  41          1HG2      VAL  41  -7.024  17.324  -0.713
  362   2HG2  VAL  41          2HG2      VAL  41  -8.759  17.135  -0.978
  363   3HG2  VAL  41          3HG2      VAL  41  -7.735  17.780  -2.260
  364    H    SER  42           H        SER  42  -4.675  13.694  -1.837
  365    HA   SER  42           HA       SER  42  -3.504  14.820   0.459
  366   1HB   SER  42          2HB       SER  42  -2.103  12.705   0.242
  367   2HB   SER  42          1HB       SER  42  -3.845  12.460   0.334
  368    HG   SER  42           HG       SER  42  -2.292  11.526  -1.502
  369    H    ARG  43           H        ARG  43  -1.179  15.290   0.683
  370    HA   ARG  43           HA       ARG  43  -0.352  16.937  -1.469
  371   1HB   ARG  43          2HB       ARG  43   1.610  17.530  -0.128
  372   2HB   ARG  43          1HB       ARG  43   0.099  17.711   0.743
  373   1HG   ARG  43          2HG       ARG  43   0.547  15.640   1.954
  374   2HG   ARG  43          1HG       ARG  43   2.048  15.431   1.046
  375   1HD   ARG  43          2HD       ARG  43   2.893  17.529   1.929
  376   2HD   ARG  43          1HD       ARG  43   1.386  17.780   2.810
  377    HE   ARG  43           HE       ARG  43   2.397  15.341   3.612
  378   1HH1  ARG  43          1HH1      ARG  43   3.421  18.739   3.725
  379   2HH1  ARG  43          2HH1      ARG  43   4.265  18.561   5.200
  380   1HH2  ARG  43          1HH2      ARG  43   3.574  15.134   5.630
  381   2HH2  ARG  43          2HH2      ARG  43   4.342  16.490   6.301
  382    H    TYR  44           H        TYR  44   0.176  13.653  -0.979
  383    HA   TYR  44           HA       TYR  44   2.669  13.507  -2.327
  384   1HB   TYR  44          2HB       TYR  44   1.481  11.791  -0.758
  385   2HB   TYR  44          1HB       TYR  44   0.621  11.306  -2.213
  386    HD1  TYR  44           1HD      TYR  44   1.699   9.906  -3.833
  387    HD2  TYR  44           2HD      TYR  44   3.860  11.620  -0.649
  388    HE1  TYR  44           1HE      TYR  44   3.590   8.437  -4.370
  389    HE2  TYR  44           2HE      TYR  44   5.814  10.143  -1.165
  390    HH   TYR  44           HH       TYR  44   6.015   8.384  -4.045
  391    H    ARG  45           H        ARG  45  -0.354  14.469  -3.282
  392    HA   ARG  45           HA       ARG  45  -1.257  15.107  -5.216
  393   1HB   ARG  45          2HB       ARG  45   1.448  14.404  -6.351
  394   2HB   ARG  45          1HB       ARG  45   0.197  15.267  -7.239
  395   1HG   ARG  45          2HG       ARG  45   0.248  17.057  -5.590
  396   2HG   ARG  45          1HG       ARG  45   1.482  16.188  -4.678
  397   1HD   ARG  45          2HD       ARG  45   2.989  16.363  -6.611
  398   2HD   ARG  45          1HD       ARG  45   1.746  17.269  -7.479
  399    HE   ARG  45           HE       ARG  45   2.083  18.568  -5.103
  400   1HH1  ARG  45          1HH1      ARG  45   4.170  17.834  -7.879
  401   2HH1  ARG  45          2HH1      ARG  45   5.182  19.177  -7.629
  402   1HH2  ARG  45          1HH2      ARG  45   3.476  20.398  -4.769
  403   2HH2  ARG  45          2HH2      ARG  45   4.773  20.664  -5.837
  404    H    GLY  46           H        GLY  46  -1.323  12.299  -4.336
  405   1HA   GLY  46          2HA       GLY  46  -2.748  10.599  -5.060
  406   2HA   GLY  46          1HA       GLY  46  -2.834  11.383  -6.632
  407    H    GLN  47           H        GLN  47   0.310  11.205  -5.890
  408    HA   GLN  47           HA       GLN  47   0.866   9.186  -7.753
  409   1HB   GLN  47          2HB       GLN  47   2.639  10.558  -5.730
  410   2HB   GLN  47          1HB       GLN  47   3.219   9.512  -7.023
  411   1HG   GLN  47          2HG       GLN  47   2.371  11.035  -8.686
  412   2HG   GLN  47          1HG       GLN  47   1.648  12.045  -7.437
  413   1HE2  GLN  47          1HE2      GLN  47   2.795  13.803  -8.103
  414   2HE2  GLN  47          2HE2      GLN  47   4.479  14.023  -7.798
  415    H    GLU  48           H        GLU  48   2.118   7.270  -7.293
  416    HA   GLU  48           HA       GLU  48   0.815   5.931  -5.094
  417   1HB   GLU  48          2HB       GLU  48   2.450   4.655  -7.280
  418   2HB   GLU  48          1HB       GLU  48   1.429   3.841  -6.113
  419   1HG   GLU  48          2HG       GLU  48   0.136   3.778  -8.011
  420   2HG   GLU  48          1HG       GLU  48  -0.481   5.223  -7.221
  421    H    HIS  49           H        HIS  49   1.786   4.979  -3.526
  422    HA   HIS  49           HA       HIS  49   4.653   5.454  -3.042
  423   1HB   HIS  49          2HB       HIS  49   2.486   4.284  -1.282
  424   2HB   HIS  49          1HB       HIS  49   4.164   4.453  -0.819
  425    HD1  HIS  49           1HD      HIS  49   4.467   6.306   0.696
  426    HD2  HIS  49           2HD      HIS  49   1.336   7.032  -1.912
  427    HE1  HIS  49           1HE      HIS  49   3.491   8.505   1.420
  428    HE2  HIS  49           2HE      HIS  49   1.424   8.705   0.085
  429    H    CYS  50           H        CYS  50   5.983   3.599  -2.535
  430    HA   CYS  50           HA       CYS  50   4.682   1.088  -3.220
  431   1HB   CYS  50          2HB       CYS  50   6.800   0.250  -4.200
  432   2HB   CYS  50          1HB       CYS  50   6.159   1.631  -5.071
  433    H    LEU  51           H        LEU  51   4.753  -0.394  -1.757
  434    HA   LEU  51           HA       LEU  51   6.618   0.015   0.465
  435   1HB   LEU  51          2HB       LEU  51   4.234   0.470   1.040
  436   2HB   LEU  51          1HB       LEU  51   3.830  -1.160   0.579
  437    HG   LEU  51           HG       LEU  51   5.140  -2.037   2.456
  438   1HD1  LEU  51          1HD1      LEU  51   6.067  -0.512   4.130
  439   2HD1  LEU  51          2HD1      LEU  51   5.644   0.866   3.116
  440   3HD1  LEU  51          3HD1      LEU  51   6.857  -0.293   2.568
  441   1HD2  LEU  51          1HD2      LEU  51   3.704  -1.224   4.248
  442   2HD2  LEU  51          2HD2      LEU  51   2.766  -1.468   2.770
  443   3HD2  LEU  51          3HD2      LEU  51   3.236   0.157   3.259
  444    H    HIS  52           H        HIS  52   7.659  -1.764   1.258
  445    HA   HIS  52           HA       HIS  52   7.950  -3.853  -0.730
  446   1HB   HIS  52          2HB       HIS  52   9.868  -2.487   0.264
  447   2HB   HIS  52          1HB       HIS  52   9.641  -3.428   1.735
  448    HD1  HIS  52           1HD      HIS  52  11.456  -5.170   1.824
  449    HD2  HIS  52           2HD      HIS  52  10.080  -4.506  -2.036
  450    HE1  HIS  52           1HE      HIS  52  12.650  -6.792   0.412
  451    HE2  HIS  52           2HE      HIS  52  12.164  -5.985  -1.928
  452    HA   PRO  53           HA       PRO  53   5.309  -6.527   1.733
  453   1HB   PRO  53          2HB       PRO  53   5.616  -8.750   0.217
  454   2HB   PRO  53          1HB       PRO  53   4.540  -7.409  -0.211
  455   1HG   PRO  53          2HG       PRO  53   7.278  -8.070  -1.225
  456   2HG   PRO  53          1HG       PRO  53   5.867  -7.435  -2.097
  457   1HD   PRO  53          2HD       PRO  53   7.951  -5.880  -1.333
  458   2HD   PRO  53          1HD       PRO  53   6.290  -5.273  -1.474
  459    H    LYS  54           H        LYS  54   8.634  -6.817   1.672
  460    HA   LYS  54           HA       LYS  54   8.813  -9.368   2.907
  461   1HB   LYS  54          2HB       LYS  54  10.785  -7.154   2.576
  462   2HB   LYS  54          1HB       LYS  54  11.173  -8.678   3.371
  463   1HG   LYS  54          2HG       LYS  54  10.063  -8.489   0.590
  464   2HG   LYS  54          1HG       LYS  54  11.780  -8.534   0.982
  465   1HD   LYS  54          2HD       LYS  54  11.620 -10.688   1.895
  466   2HD   LYS  54          1HD       LYS  54   9.853 -10.675   1.865
  467   1HE   LYS  54          2HE       LYS  54   9.823 -10.607  -0.457
  468   2HE   LYS  54          1HE       LYS  54  11.585 -10.454  -0.578
  469   1HZ   LYS  54          1HZ       LYS  54  11.818 -12.685   0.219
  470   2HZ   LYS  54          2HZ       LYS  54  10.585 -12.737  -0.990
  471   3HZ   LYS  54          3HZ       LYS  54  10.188 -12.770   0.623
  472    H    LEU  55           H        LEU  55   7.978  -6.276   3.993
  473    HA   LEU  55           HA       LEU  55   9.031  -6.563   6.683
  474   1HB   LEU  55          2HB       LEU  55   7.408  -4.371   5.407
  475   2HB   LEU  55          1HB       LEU  55   8.052  -4.324   7.032
  476    HG   LEU  55           HG       LEU  55   9.704  -4.434   4.502
  477   1HD1  LEU  55          1HD1      LEU  55  10.282  -2.128   5.045
  478   2HD1  LEU  55          2HD1      LEU  55   9.163  -2.169   6.410
  479   3HD1  LEU  55          3HD1      LEU  55   8.551  -2.304   4.761
  480   1HD2  LEU  55          1HD2      LEU  55  10.503  -4.105   7.394
  481   2HD2  LEU  55          2HD2      LEU  55  11.579  -3.939   6.015
  482   3HD2  LEU  55          3HD2      LEU  55  10.846  -5.504   6.370
  483    H    GLN  56           H        GLN  56   7.839  -6.886   8.479
  484    HA   GLN  56           HA       GLN  56   5.363  -8.257   8.256
  485   1HB   GLN  56          2HB       GLN  56   7.017  -8.707  10.047
  486   2HB   GLN  56          1HB       GLN  56   6.719  -7.112  10.713
  487   1HG   GLN  56          2HG       GLN  56   5.575  -8.822  11.995
  488   2HG   GLN  56          1HG       GLN  56   4.414  -7.747  11.216
  489   1HE2  GLN  56          1HE2      GLN  56   5.763 -10.920  11.281
  490   2HE2  GLN  56          2HE2      GLN  56   4.584 -11.670  10.264
  491    H    SER  57           H        SER  57   6.290  -4.977   8.990
  492    HA   SER  57           HA       SER  57   3.869  -3.971   9.977
  493   1HB   SER  57          2HB       SER  57   5.934  -2.560   8.273
  494   2HB   SER  57          1HB       SER  57   4.740  -1.778   9.313
  495    HG   SER  57           HG       SER  57   5.793  -3.305  10.941
  496    H    THR  58           H        THR  58   5.102  -4.401   6.690
  497    HA   THR  58           HA       THR  58   3.054  -3.211   5.252
  498    HB   THR  58           HB       THR  58   4.744  -5.622   4.503
  499    HG1  THR  58           1HG      THR  58   6.140  -3.967   3.614
  500   1HG2  THR  58          1HG2      THR  58   2.911  -5.177   2.927
  501   2HG2  THR  58          2HG2      THR  58   4.467  -4.755   2.195
  502   3HG2  THR  58          3HG2      THR  58   3.416  -3.492   2.811
  503    H    LYS  59           H        LYS  59   3.546  -6.525   6.400
  504    HA   LYS  59           HA       LYS  59   1.254  -7.567   5.209
  505   1HB   LYS  59          2HB       LYS  59   2.866  -8.631   7.464
  506   2HB   LYS  59          1HB       LYS  59   1.563  -9.506   6.653
  507   1HG   LYS  59          2HG       LYS  59   2.734  -9.252   4.527
  508   2HG   LYS  59          1HG       LYS  59   4.063  -8.456   5.378
  509   1HD   LYS  59          2HD       LYS  59   4.238 -10.319   6.776
  510   2HD   LYS  59          1HD       LYS  59   3.048 -11.232   5.838
  511   1HE   LYS  59          2HE       LYS  59   4.463 -10.884   3.800
  512   2HE   LYS  59          1HE       LYS  59   5.699 -10.166   4.837
  513   1HZ   LYS  59          1HZ       LYS  59   6.209 -12.451   4.366
  514   2HZ   LYS  59          2HZ       LYS  59   4.724 -12.973   4.972
  515   3HZ   LYS  59          3HZ       LYS  59   5.873 -12.291   6.000
  516    H    ARG  60           H        ARG  60   1.570  -5.955   8.314
  517    HA   ARG  60           HA       ARG  60  -1.095  -6.805   9.020
  518   1HB   ARG  60          2HB       ARG  60   0.675  -5.816  10.681
  519   2HB   ARG  60          1HB       ARG  60   0.169  -4.264   9.999
  520   1HG   ARG  60          2HG       ARG  60  -2.177  -4.938  10.551
  521   2HG   ARG  60          1HG       ARG  60  -1.457  -6.211  11.544
  522   1HD   ARG  60          2HD       ARG  60  -1.868  -4.376  13.002
  523   2HD   ARG  60          1HD       ARG  60  -0.130  -4.384  12.684
  524    HE   ARG  60           HE       ARG  60  -1.664  -2.751  10.896
  525   1HH1  ARG  60          1HH1      ARG  60   0.217  -2.753  13.914
  526   2HH1  ARG  60          2HH1      ARG  60   0.347  -1.059  13.975
  527   1HH2  ARG  60          1HH2      ARG  60  -1.488  -0.432  11.011
  528   2HH2  ARG  60          2HH2      ARG  60  -0.623   0.285  12.296
  529    H    PHE  61           H        PHE  61   0.422  -3.870   7.758
  530    HA   PHE  61           HA       PHE  61  -1.792  -2.236   7.632
  531   1HB   PHE  61          2HB       PHE  61   0.591  -1.544   7.372
  532   2HB   PHE  61          1HB       PHE  61   0.549  -2.226   5.753
  533    HD1  PHE  61           1HD      PHE  61  -0.456  -1.001   3.920
  534    HD2  PHE  61           2HD      PHE  61  -0.702   0.495   7.893
  535    HE1  PHE  61           1HE      PHE  61  -1.211   1.185   3.054
  536    HE2  PHE  61           2HE      PHE  61  -1.452   2.670   7.032
  537    HZ   PHE  61           HZ       PHE  61  -1.699   3.029   4.631
  538    H    ILE  62           H        ILE  62  -0.537  -4.461   5.136
  539    HA   ILE  62           HA       ILE  62  -2.324  -3.590   3.108
  540    HB   ILE  62           HB       ILE  62  -0.781  -6.174   3.380
  541   1HG1  ILE  62          2HG1      ILE  62   0.766  -4.382   3.402
  542   2HG1  ILE  62          1HG1      ILE  62   0.794  -5.051   1.776
  543   1HG2  ILE  62          1HG2      ILE  62  -2.575  -6.412   1.801
  544   2HG2  ILE  62          2HG2      ILE  62  -1.024  -6.395   0.953
  545   3HG2  ILE  62          3HG2      ILE  62  -2.065  -4.967   0.931
  546   1HD1  ILE  62          1HD1      ILE  62  -0.671  -2.575   2.625
  547   2HD1  ILE  62          2HD1      ILE  62  -0.553  -3.224   0.982
  548   3HD1  ILE  62          3HD1      ILE  62   0.892  -2.631   1.817
  549    H    LYS  63           H        LYS  63  -2.282  -6.240   5.332
  550    HA   LYS  63           HA       LYS  63  -4.602  -7.443   4.286
  551   1HB   LYS  63          2HB       LYS  63  -3.049  -7.909   6.827
  552   2HB   LYS  63          1HB       LYS  63  -4.536  -8.791   6.506
  553   1HG   LYS  63          2HG       LYS  63  -2.489 -10.069   5.878
  554   2HG   LYS  63          1HG       LYS  63  -3.568  -9.804   4.515
  555   1HD   LYS  63          2HD       LYS  63  -2.172  -7.992   3.722
  556   2HD   LYS  63          1HD       LYS  63  -1.150  -8.116   5.145
  557   1HE   LYS  63          2HE       LYS  63  -0.146  -9.026   3.239
  558   2HE   LYS  63          1HE       LYS  63  -0.428 -10.299   4.436
  559   1HZ   LYS  63          1HZ       LYS  63  -2.366 -11.000   3.120
  560   2HZ   LYS  63          2HZ       LYS  63  -0.972 -11.074   2.200
  561   3HZ   LYS  63          3HZ       LYS  63  -2.076  -9.820   1.975
  562    H    TRP  64           H        TRP  64  -3.932  -5.098   6.663
  563    HA   TRP  64           HA       TRP  64  -6.429  -5.032   8.041
  564   1HB   TRP  64          2HB       TRP  64  -4.001  -4.044   8.566
  565   2HB   TRP  64          1HB       TRP  64  -4.668  -2.643   7.748
  566    HD1  TRP  64           HD       TRP  64  -4.352  -4.186  11.008
  567    HE1  TRP  64           1HE      TRP  64  -5.887  -3.064  12.753
  568    HE3  TRP  64           3HE      TRP  64  -7.347  -1.487   7.859
  569    HZ2  TRP  64           2HZ      TRP  64  -8.067  -1.281  12.782
  570    HZ3  TRP  64           3HZ      TRP  64  -9.126  -0.102   8.829
  571    HH2  TRP  64           HH       TRP  64  -9.480   0.000  11.240
  572    H    TYR  65           H        TYR  65  -4.868  -3.172   5.402
  573    HA   TYR  65           HA       TYR  65  -6.994  -1.416   4.972
  574   1HB   TYR  65          2HB       TYR  65  -4.741  -0.933   4.070
  575   2HB   TYR  65          1HB       TYR  65  -4.927  -2.262   2.928
  576    HD1  TYR  65           1HD      TYR  65  -5.906  -1.862   0.812
  577    HD2  TYR  65           2HD      TYR  65  -6.550   0.926   3.956
  578    HE1  TYR  65           1HE      TYR  65  -7.073  -0.350  -0.756
  579    HE2  TYR  65           2HE      TYR  65  -7.722   2.416   2.393
  580    HH   TYR  65           HH       TYR  65  -7.837   2.844   0.012
  581    H    ASN  66           H        ASN  66  -6.337  -4.591   3.684
  582    HA   ASN  66           HA       ASN  66  -8.295  -4.685   1.714
  583   1HB   ASN  66          2HB       ASN  66  -7.425  -6.913   3.569
  584   2HB   ASN  66          1HB       ASN  66  -8.486  -7.153   2.191
  585   1HD2  ASN  66          1HD2      ASN  66  -5.900  -8.307   2.719
  586   2HD2  ASN  66          2HD2      ASN  66  -4.877  -7.839   1.412
  587    H    ALA  67           H        ALA  67  -8.652  -5.281   5.175
  588    HA   ALA  67           HA       ALA  67 -11.416  -5.896   5.074
  589   1HB   ALA  67          1HB       ALA  67  -9.822  -4.731   7.365
  590   2HB   ALA  67          2HB       ALA  67 -10.011  -6.448   7.015
  591   3HB   ALA  67          3HB       ALA  67 -11.409  -5.487   7.496
  592    H    TRP  68           H        TRP  68  -9.703  -2.918   5.813
  593    HA   TRP  68           HA       TRP  68 -11.871  -1.144   6.180
  594   1HB   TRP  68          2HB       TRP  68  -9.620  -0.491   6.802
  595   2HB   TRP  68          1HB       TRP  68  -9.041  -0.751   5.174
  596    HD1  TRP  68           HD       TRP  68  -9.685   1.165   3.342
  597    HE1  TRP  68           1HE      TRP  68 -10.116   3.668   3.631
  598    HE3  TRP  68           3HE      TRP  68 -10.619   1.258   8.381
  599    HZ2  TRP  68           2HZ      TRP  68 -10.757   5.457   5.695
  600    HZ3  TRP  68           3HZ      TRP  68 -11.123   3.434   9.420
  601    HH2  TRP  68           HH       TRP  68 -11.183   5.492   8.071
  602    H    ASN  69           H        ASN  69 -10.124  -1.924   3.236
  603    HA   ASN  69           HA       ASN  69 -11.517  -0.138   1.593
  604   1HB   ASN  69          2HB       ASN  69  -9.370  -1.242   0.992
  605   2HB   ASN  69          1HB       ASN  69 -10.241  -2.758   0.796
  606   1HD2  ASN  69          1HD2      ASN  69  -9.762  -2.963  -1.332
  607   2HD2  ASN  69          2HD2      ASN  69 -10.408  -1.933  -2.558
  608    H    GLU  70           H        GLU  70 -12.112  -3.539   2.444
  609    HA   GLU  70           HA       GLU  70 -14.279  -3.862   0.700
  610   1HB   GLU  70          2HB       GLU  70 -13.719  -5.326   3.280
  611   2HB   GLU  70          1HB       GLU  70 -14.914  -5.812   2.088
  612   1HG   GLU  70          2HG       GLU  70 -11.936  -5.664   1.682
  613   2HG   GLU  70          1HG       GLU  70 -12.900  -7.122   1.885
  614    H    LYS  71           H        LYS  71 -14.111  -2.463   3.948
  615    HA   LYS  71           HA       LYS  71 -16.947  -2.339   4.146
  616   1HB   LYS  71          2HB       LYS  71 -14.747  -1.008   5.649
  617   2HB   LYS  71          1HB       LYS  71 -16.353  -0.342   5.815
  618   1HG   LYS  71          2HG       LYS  71 -15.979  -1.826   7.626
  619   2HG   LYS  71          1HG       LYS  71 -17.122  -2.603   6.533
  620   1HD   LYS  71          2HD       LYS  71 -15.224  -3.908   5.597
  621   2HD   LYS  71          1HD       LYS  71 -14.179  -3.181   6.819
  622   1HE   LYS  71          2HE       LYS  71 -16.571  -4.953   7.280
  623   2HE   LYS  71          1HE       LYS  71 -14.881  -5.343   7.582
  624   1HZ   LYS  71          1HZ       LYS  71 -14.842  -3.603   9.305
  625   2HZ   LYS  71          2HZ       LYS  71 -16.023  -4.768   9.624
  626   3HZ   LYS  71          3HZ       LYS  71 -16.476  -3.286   9.007
  627    H    ARG  72           H        ARG  72 -14.562  -0.148   2.919
  628    HA   ARG  72           HA       ARG  72 -16.343   1.986   2.303
  629   1HB   ARG  72          2HB       ARG  72 -13.615   1.259   1.290
  630   2HB   ARG  72          1HB       ARG  72 -14.521   2.529   0.506
  631   1HG   ARG  72          2HG       ARG  72 -12.845   3.391   2.102
  632   2HG   ARG  72          1HG       ARG  72 -14.474   3.870   2.525
  633   1HD   ARG  72          2HD       ARG  72 -13.102   1.516   3.797
  634   2HD   ARG  72          1HD       ARG  72 -12.887   3.143   4.416
  635    HE   ARG  72           HE       ARG  72 -15.642   2.487   4.152
  636   1HH1  ARG  72          1HH1      ARG  72 -12.875   1.866   6.268
  637   2HH1  ARG  72          2HH1      ARG  72 -13.825   1.643   7.669
  638   1HH2  ARG  72          1HH2      ARG  72 -16.912   2.169   6.033
  639   2HH2  ARG  72          2HH2      ARG  72 -16.189   1.792   7.529
  640    H    ARG  73           H        ARG  73 -15.269  -0.785   0.423
  641    HA   ARG  73           HA       ARG  73 -16.729  -0.033  -1.955
  642   1HB   ARG  73          2HB       ARG  73 -15.401  -2.618  -1.173
  643   2HB   ARG  73          1HB       ARG  73 -16.050  -2.259  -2.765
  644   1HG   ARG  73          2HG       ARG  73 -14.399  -0.516  -3.061
  645   2HG   ARG  73          1HG       ARG  73 -13.800  -0.790  -1.421
  646   1HD   ARG  73          2HD       ARG  73 -12.379  -1.923  -3.024
  647   2HD   ARG  73          1HD       ARG  73 -13.226  -3.087  -2.009
  648    HE   ARG  73           HE       ARG  73 -14.222  -2.397  -4.677
  649   1HH1  ARG  73          1HH1      ARG  73 -13.108  -4.940  -2.358
  650   2HH1  ARG  73          2HH1      ARG  73 -13.461  -6.173  -3.447
  651   1HH2  ARG  73          1HH2      ARG  73 -14.672  -4.185  -6.081
  652   2HH2  ARG  73          2HH2      ARG  73 -14.369  -5.775  -5.556
  653    H    VAL  74           H        VAL  74 -17.439  -1.607   0.939
  654    HA   VAL  74           HA       VAL  74 -19.127  -2.703   1.828
  655    HB   VAL  74           HB       VAL  74 -20.649  -2.068  -0.617
  656   1HG1  VAL  74          1HG1      VAL  74 -22.700  -2.267   0.867
  657   2HG1  VAL  74          2HG1      VAL  74 -21.626  -2.761   2.179
  658   3HG1  VAL  74          3HG1      VAL  74 -21.777  -3.765   0.739
  659   1HG2  VAL  74          1HG2      VAL  74 -21.599  -0.090   0.610
  660   2HG2  VAL  74          2HG2      VAL  74 -19.862   0.014   0.307
  661   3HG2  VAL  74          3HG2      VAL  74 -20.453  -0.428   1.907
  662    H    TYR  75           H        TYR  75 -17.714  -4.286   1.355
  663    HA   TYR  75           HA       TYR  75 -19.039  -6.631   0.218
  664   1HB   TYR  75          2HB       TYR  75 -16.162  -5.890  -0.369
  665   2HB   TYR  75          1HB       TYR  75 -16.811  -7.501  -0.586
  666    HD1  TYR  75           1HD      TYR  75 -16.586  -4.148  -1.927
  667    HD2  TYR  75           2HD      TYR  75 -18.415  -7.939  -2.414
  668    HE1  TYR  75           1HE      TYR  75 -17.189  -3.549  -4.231
  669    HE2  TYR  75           2HE      TYR  75 -19.031  -7.354  -4.724
  670    HH   TYR  75           HH       TYR  75 -17.695  -4.682  -6.313
  671    H    GLU  76           H        GLU  76 -17.859  -8.624   0.949
  672    HA   GLU  76           HA       GLU  76 -16.085  -8.504   3.139
  673   1HB   GLU  76          2HB       GLU  76 -18.272  -8.080   4.288
  674   2HB   GLU  76          1HB       GLU  76 -18.919  -9.534   3.551
  675   1HG   GLU  76          2HG       GLU  76 -17.266 -10.872   4.775
  676   2HG   GLU  76          1HG       GLU  76 -16.655  -9.402   5.526
  677    H    GLU  77           H        GLU  77 -15.418 -10.781   3.574
  678    HA   GLU  77           HA       GLU  77 -15.721 -12.302   1.138
  679   1HB   GLU  77          2HB       GLU  77 -13.466 -11.920   2.272
  680   2HB   GLU  77          1HB       GLU  77 -14.023 -13.000   3.539
  681   1HG   GLU  77          2HG       GLU  77 -12.632 -14.227   2.014
  682   2HG   GLU  77          1HG       GLU  77 -14.293 -14.787   1.855
  Start of MODEL   17
    1    H    SER   1           H        SER   1  21.388  -6.437 -10.381
    2    HA   SER   1           HA       SER   1  20.831  -4.916  -8.823
    3   1HB   SER   1          2HB       SER   1  18.431  -4.370 -10.590
    4   2HB   SER   1          1HB       SER   1  18.977  -3.338  -9.271
    5    HG   SER   1           HG       SER   1  21.060  -3.806 -10.745
    6    H    LYS   2           H        LYS   2  18.759  -4.196  -7.397
    7    HA   LYS   2           HA       LYS   2  17.406  -6.662  -6.625
    8   1HB   LYS   2          2HB       LYS   2  18.640  -4.538  -4.851
    9   2HB   LYS   2          1HB       LYS   2  17.565  -5.799  -4.255
   10   1HG   LYS   2          2HG       LYS   2  19.158  -7.497  -5.017
   11   2HG   LYS   2          1HG       LYS   2  20.242  -6.223  -5.576
   12   1HD   LYS   2          2HD       LYS   2  20.473  -5.415  -3.297
   13   2HD   LYS   2          1HD       LYS   2  19.329  -6.636  -2.725
   14   1HE   LYS   2          2HE       LYS   2  20.844  -8.402  -3.483
   15   2HE   LYS   2          1HE       LYS   2  21.977  -7.186  -4.059
   16   1HZ   LYS   2          1HZ       LYS   2  22.270  -6.435  -1.783
   17   2HZ   LYS   2          2HZ       LYS   2  22.612  -8.080  -1.914
   18   3HZ   LYS   2          3HZ       LYS   2  21.164  -7.579  -1.227
   19    H    CYS   3           H        CYS   3  15.921  -5.146  -4.538
   20    HA   CYS   3           HA       CYS   3  14.084  -3.933  -6.440
   21   1HB   CYS   3          2HB       CYS   3  13.496  -5.120  -3.737
   22   2HB   CYS   3          1HB       CYS   3  12.314  -4.559  -4.920
   23    H    LYS   4           H        LYS   4  14.771  -1.851  -6.446
   24    HA   LYS   4           HA       LYS   4  14.650  -0.399  -3.906
   25   1HB   LYS   4          2HB       LYS   4  16.861  -0.283  -4.957
   26   2HB   LYS   4          1HB       LYS   4  16.141   0.233  -6.467
   27   1HG   LYS   4          2HG       LYS   4  17.183   2.110  -5.330
   28   2HG   LYS   4          1HG       LYS   4  15.438   2.332  -5.416
   29   1HD   LYS   4          2HD       LYS   4  15.231   1.573  -3.094
   30   2HD   LYS   4          1HD       LYS   4  16.981   1.350  -3.012
   31   1HE   LYS   4          2HE       LYS   4  17.292   3.748  -3.445
   32   2HE   LYS   4          1HE       LYS   4  15.542   3.952  -3.520
   33   1HZ   LYS   4          1HZ       LYS   4  16.426   4.576  -1.350
   34   2HZ   LYS   4          2HZ       LYS   4  17.090   3.066  -1.154
   35   3HZ   LYS   4          3HZ       LYS   4  15.424   3.239  -1.186
   36    H    CYS   5           H        CYS   5  13.228   1.233  -3.726
   37    HA   CYS   5           HA       CYS   5  11.776   2.003  -6.133
   38   1HB   CYS   5          2HB       CYS   5  10.414   0.523  -4.616
   39   2HB   CYS   5          1HB       CYS   5  10.593   1.732  -3.350
   40    H    SER   6           H        SER   6  10.338   4.130  -5.111
   41    HA   SER   6           HA       SER   6  12.148   6.198  -5.315
   42   1HB   SER   6          2HB       SER   6   9.342   6.254  -4.221
   43   2HB   SER   6          1HB       SER   6  10.241   7.626  -4.881
   44    HG   SER   6           HG       SER   6   9.846   6.964  -6.814
   45    H    ARG   7           H        ARG   7  11.153   4.521  -2.416
   46    HA   ARG   7           HA       ARG   7  12.765   6.440  -0.883
   47   1HB   ARG   7          2HB       ARG   7  10.356   7.103  -0.692
   48   2HB   ARG   7          1HB       ARG   7  10.009   5.548   0.026
   49   1HG   ARG   7          2HG       ARG   7  10.136   7.050   1.829
   50   2HG   ARG   7          1HG       ARG   7  11.680   6.197   1.844
   51   1HD   ARG   7          2HD       ARG   7  11.178   8.949   0.681
   52   2HD   ARG   7          1HD       ARG   7  11.950   8.612   2.221
   53    HE   ARG   7           HE       ARG   7  13.647   7.376   0.743
   54   1HH1  ARG   7          1HH1      ARG   7  11.940  10.359  -0.228
   55   2HH1  ARG   7          2HH1      ARG   7  13.201  10.894  -1.230
   56   1HH2  ARG   7          1HH2      ARG   7  15.370   8.168  -0.643
   57   2HH2  ARG   7          2HH2      ARG   7  15.167   9.658  -1.443
   58    H    LYS   8           H        LYS   8  10.623   3.864   0.162
   59    HA   LYS   8           HA       LYS   8  12.413   1.775   0.595
   60   1HB   LYS   8          2HB       LYS   8  13.396   3.336   2.297
   61   2HB   LYS   8          1HB       LYS   8  11.817   3.498   3.043
   62   1HG   LYS   8          2HG       LYS   8  13.049   1.971   4.391
   63   2HG   LYS   8          1HG       LYS   8  11.867   1.027   3.500
   64   1HD   LYS   8          2HD       LYS   8  13.839  -0.244   3.364
   65   2HD   LYS   8          1HD       LYS   8  13.756   0.583   1.814
   66   1HE   LYS   8          2HE       LYS   8  15.471   1.381   4.186
   67   2HE   LYS   8          1HE       LYS   8  16.035   0.603   2.720
   68   1HZ   LYS   8          1HZ       LYS   8  16.525   2.921   2.655
   69   2HZ   LYS   8          2HZ       LYS   8  14.965   3.362   2.987
   70   3HZ   LYS   8          3HZ       LYS   8  15.351   2.632   1.492
   71    H    GLY   9           H        GLY   9   9.986   3.591   2.351
   72   1HA   GLY   9          2HA       GLY   9   7.713   2.419   1.505
   73   2HA   GLY   9          1HA       GLY   9   8.189   1.437   2.866
   74    HA   PRO  10           HA       PRO  10   7.388   6.032   4.286
   75   1HB   PRO  10          2HB       PRO  10   5.164   6.798   2.598
   76   2HB   PRO  10          1HB       PRO  10   6.707   7.619   2.826
   77   1HG   PRO  10          2HG       PRO  10   5.910   6.300   0.515
   78   2HG   PRO  10          1HG       PRO  10   7.573   6.726   0.934
   79   1HD   PRO  10          2HD       PRO  10   6.257   4.039   1.043
   80   2HD   PRO  10          1HD       PRO  10   7.953   4.506   0.890
   81    H    LYS  11           H        LYS  11   5.922   6.439   5.891
   82    HA   LYS  11           HA       LYS  11   4.075   4.379   6.525
   83   1HB   LYS  11          2HB       LYS  11   5.338   5.555   8.265
   84   2HB   LYS  11          1HB       LYS  11   4.559   7.063   7.808
   85   1HG   LYS  11          2HG       LYS  11   2.417   6.237   8.599
   86   2HG   LYS  11          1HG       LYS  11   3.127   4.664   8.939
   87   1HD   LYS  11          2HD       LYS  11   2.896   6.015  10.983
   88   2HD   LYS  11          1HD       LYS  11   4.578   5.636  10.623
   89   1HE   LYS  11          2HE       LYS  11   4.805   7.909   9.607
   90   2HE   LYS  11          1HE       LYS  11   3.151   8.250  10.106
   91   1HZ   LYS  11          1HZ       LYS  11   5.413   7.622  11.897
   92   2HZ   LYS  11          2HZ       LYS  11   3.840   7.918  12.412
   93   3HZ   LYS  11          3HZ       LYS  11   4.737   9.139  11.666
   94    H    ILE  12           H        ILE  12   2.139   4.180   5.802
   95    HA   ILE  12           HA       ILE  12   0.649   6.502   4.760
   96    HB   ILE  12           HB       ILE  12   0.344   3.595   3.966
   97   1HG1  ILE  12          2HG1      ILE  12   1.830   5.782   2.515
   98   2HG1  ILE  12          1HG1      ILE  12   2.576   4.413   3.336
   99   1HG2  ILE  12          1HG2      ILE  12  -0.607   6.165   2.683
  100   2HG2  ILE  12          2HG2      ILE  12  -1.615   5.031   3.584
  101   3HG2  ILE  12          3HG2      ILE  12  -0.880   4.539   2.057
  102   1HD1  ILE  12          1HD1      ILE  12   2.494   4.028   0.983
  103   2HD1  ILE  12          2HD1      ILE  12   0.770   4.355   0.959
  104   3HD1  ILE  12          3HD1      ILE  12   1.389   2.910   1.798
  105    H    ARG  13           H        ARG  13  -1.512   6.679   5.353
  106    HA   ARG  13           HA       ARG  13  -2.355   4.873   7.474
  107   1HB   ARG  13          2HB       ARG  13  -3.626   7.425   6.470
  108   2HB   ARG  13          1HB       ARG  13  -4.065   6.498   7.897
  109   1HG   ARG  13          2HG       ARG  13  -1.905   7.072   8.922
  110   2HG   ARG  13          1HG       ARG  13  -1.509   8.045   7.503
  111   1HD   ARG  13          2HD       ARG  13  -2.372   9.469   9.269
  112   2HD   ARG  13          1HD       ARG  13  -3.508   9.421   7.918
  113    HE   ARG  13           HE       ARG  13  -4.030   7.454   9.908
  114   1HH1  ARG  13          1HH1      ARG  13  -4.693  10.785   8.974
  115   2HH1  ARG  13          2HH1      ARG  13  -6.069  10.955   9.963
  116   1HH2  ARG  13          1HH2      ARG  13  -5.927   7.665  11.275
  117   2HH2  ARG  13          2HH2      ARG  13  -6.777   9.136  11.310
  118    H    TYR  14           H        TYR  14  -4.612   4.106   7.205
  119    HA   TYR  14           HA       TYR  14  -5.048   2.996   4.606
  120   1HB   TYR  14          2HB       TYR  14  -7.085   3.256   6.830
  121   2HB   TYR  14          1HB       TYR  14  -7.045   2.061   5.544
  122    HD1  TYR  14           1HD      TYR  14  -6.167   2.746   8.902
  123    HD2  TYR  14           2HD      TYR  14  -4.943   0.427   5.534
  124    HE1  TYR  14           1HE      TYR  14  -4.901   1.262  10.376
  125    HE2  TYR  14           2HE      TYR  14  -3.698  -1.048   7.010
  126    HH   TYR  14           HH       TYR  14  -2.635  -0.901   9.223
  127    H    SER  15           H        SER  15  -5.959   5.858   6.211
  128    HA   SER  15           HA       SER  15  -8.192   6.658   4.715
  129   1HB   SER  15          2HB       SER  15  -6.181   8.312   6.199
  130   2HB   SER  15          1HB       SER  15  -7.814   8.816   5.741
  131    HG   SER  15           HG       SER  15  -8.508   7.889   7.477
  132    H    ASP  16           H        ASP  16  -4.743   6.758   3.986
  133    HA   ASP  16           HA       ASP  16  -4.951   8.933   2.051
  134   1HB   ASP  16          2HB       ASP  16  -2.678   6.954   2.483
  135   2HB   ASP  16          1HB       ASP  16  -2.627   8.323   1.405
  136    H    VAL  17           H        VAL  17  -5.285   5.559   2.184
  137    HA   VAL  17           HA       VAL  17  -4.398   5.036  -0.520
  138    HB   VAL  17           HB       VAL  17  -5.843   3.097   1.242
  139   1HG1  VAL  17          1HG1      VAL  17  -5.623   2.353  -0.981
  140   2HG1  VAL  17          2HG1      VAL  17  -4.556   1.415   0.057
  141   3HG1  VAL  17          3HG1      VAL  17  -3.895   2.668  -0.987
  142   1HG2  VAL  17          1HG2      VAL  17  -3.642   2.338   2.088
  143   2HG2  VAL  17          2HG2      VAL  17  -4.036   3.982   2.594
  144   3HG2  VAL  17          3HG2      VAL  17  -2.892   3.717   1.281
  145    H    LYS  18           H        LYS  18  -5.613   5.121  -2.256
  146    HA   LYS  18           HA       LYS  18  -8.550   5.134  -2.051
  147   1HB   LYS  18          2HB       LYS  18  -7.033   6.710  -3.546
  148   2HB   LYS  18          1HB       LYS  18  -6.922   5.333  -4.578
  149   1HG   LYS  18          2HG       LYS  18  -9.593   6.551  -3.835
  150   2HG   LYS  18          1HG       LYS  18  -8.700   7.015  -5.267
  151   1HD   LYS  18          2HD       LYS  18  -9.643   4.207  -4.665
  152   2HD   LYS  18          1HD       LYS  18 -10.542   5.362  -5.652
  153   1HE   LYS  18          2HE       LYS  18  -7.751   4.339  -6.249
  154   2HE   LYS  18          1HE       LYS  18  -9.226   3.745  -6.999
  155   1HZ   LYS  18          1HZ       LYS  18  -8.201   6.549  -7.255
  156   2HZ   LYS  18          2HZ       LYS  18  -9.597   5.925  -7.943
  157   3HZ   LYS  18          3HZ       LYS  18  -8.130   5.345  -8.427
  158    H    LYS  19           H        LYS  19  -5.793   3.369  -3.181
  159    HA   LYS  19           HA       LYS  19  -7.208   0.913  -3.516
  160   1HB   LYS  19          2HB       LYS  19  -6.486   0.524  -5.869
  161   2HB   LYS  19          1HB       LYS  19  -7.584   1.906  -5.763
  162   1HG   LYS  19          2HG       LYS  19  -5.842   3.422  -6.069
  163   2HG   LYS  19          1HG       LYS  19  -4.634   2.148  -5.822
  164   1HD   LYS  19          2HD       LYS  19  -6.588   2.126  -8.113
  165   2HD   LYS  19          1HD       LYS  19  -5.010   2.908  -8.218
  166   1HE   LYS  19          2HE       LYS  19  -3.931   0.754  -7.663
  167   2HE   LYS  19          1HE       LYS  19  -5.511  -0.019  -7.612
  168   1HZ   LYS  19          1HZ       LYS  19  -4.278  -0.322  -9.724
  169   2HZ   LYS  19          2HZ       LYS  19  -4.375   1.320 -10.005
  170   3HZ   LYS  19          3HZ       LYS  19  -5.787   0.395  -9.963
  171    H    LEU  20           H        LEU  20  -5.741  -0.807  -3.649
  172    HA   LEU  20           HA       LEU  20  -2.919  -0.120  -3.189
  173   1HB   LEU  20          2HB       LEU  20  -4.252  -0.745  -1.115
  174   2HB   LEU  20          1HB       LEU  20  -4.553  -2.291  -1.853
  175    HG   LEU  20           HG       LEU  20  -1.805  -1.285  -1.068
  176   1HD1  LEU  20          1HD1      LEU  20  -2.024  -2.779   0.834
  177   2HD1  LEU  20          2HD1      LEU  20  -3.664  -3.195   0.331
  178   3HD1  LEU  20          3HD1      LEU  20  -3.287  -1.554   0.841
  179   1HD2  LEU  20          1HD2      LEU  20  -1.124  -3.628  -1.321
  180   2HD2  LEU  20          2HD2      LEU  20  -1.779  -3.018  -2.842
  181   3HD2  LEU  20          3HD2      LEU  20  -2.760  -4.064  -1.817
  182    H    GLU  21           H        GLU  21  -1.684  -1.119  -4.768
  183    HA   GLU  21           HA       GLU  21  -2.956  -3.394  -6.066
  184   1HB   GLU  21          2HB       GLU  21  -2.998  -1.311  -7.410
  185   2HB   GLU  21          1HB       GLU  21  -1.256  -1.214  -7.278
  186   1HG   GLU  21          2HG       GLU  21  -1.035  -3.279  -8.541
  187   2HG   GLU  21          1HG       GLU  21  -2.792  -3.418  -8.628
  188    H    MET  22           H        MET  22  -1.656  -5.176  -6.055
  189    HA   MET  22           HA       MET  22   1.057  -4.710  -5.137
  190   1HB   MET  22          2HB       MET  22   1.096  -7.141  -4.661
  191   2HB   MET  22          1HB       MET  22  -0.118  -6.264  -3.739
  192   1HG   MET  22          2HG       MET  22  -1.848  -7.094  -5.273
  193   2HG   MET  22          1HG       MET  22  -0.619  -7.958  -6.189
  194   1HE   MET  22          1HE       MET  22  -0.745  -7.586  -2.246
  195   2HE   MET  22          2HE       MET  22  -1.745  -8.978  -1.816
  196   3HE   MET  22          3HE       MET  22  -2.441  -7.639  -2.724
  197    H    LYS  23           H        LYS  23   2.412  -4.451  -6.637
  198    HA   LYS  23           HA       LYS  23   2.963  -6.492  -8.426
  199   1HB   LYS  23          2HB       LYS  23   2.825  -5.184 -10.561
  200   2HB   LYS  23          1HB       LYS  23   1.267  -5.527  -9.857
  201   1HG   LYS  23          2HG       LYS  23   1.058  -3.359 -10.661
  202   2HG   LYS  23          1HG       LYS  23   1.398  -3.112  -8.952
  203   1HD   LYS  23          2HD       LYS  23   3.717  -2.606  -9.467
  204   2HD   LYS  23          1HD       LYS  23   3.444  -2.979 -11.171
  205   1HE   LYS  23          2HE       LYS  23   2.202  -0.683  -9.613
  206   2HE   LYS  23          1HE       LYS  23   3.413  -0.586 -10.885
  207   1HZ   LYS  23          1HZ       LYS  23   1.262  -0.052 -11.723
  208   2HZ   LYS  23          2HZ       LYS  23   0.598  -1.447 -11.129
  209   3HZ   LYS  23          3HZ       LYS  23   1.718  -1.527 -12.411
  210    HA   PRO  24           HA       PRO  24   6.863  -5.070  -7.315
  211   1HB   PRO  24          2HB       PRO  24   8.379  -6.183  -9.280
  212   2HB   PRO  24          1HB       PRO  24   7.680  -7.120  -7.955
  213   1HG   PRO  24          2HG       PRO  24   6.665  -6.749 -10.749
  214   2HG   PRO  24          1HG       PRO  24   6.776  -8.243  -9.796
  215   1HD   PRO  24          2HD       PRO  24   4.459  -6.920 -10.057
  216   2HD   PRO  24          1HD       PRO  24   4.907  -7.723  -8.537
  217    H    LYS  25           H        LYS  25   8.203  -3.362  -7.649
  218    HA   LYS  25           HA       LYS  25   7.567  -1.361  -9.544
  219   1HB   LYS  25          2HB       LYS  25   8.849  -1.190  -7.181
  220   2HB   LYS  25          1HB       LYS  25  10.228  -1.605  -8.193
  221   1HG   LYS  25          2HG       LYS  25   8.610   0.804  -8.844
  222   2HG   LYS  25          1HG       LYS  25   9.838   0.853  -7.586
  223   1HD   LYS  25          2HD       LYS  25  11.510   0.161  -9.137
  224   2HD   LYS  25          1HD       LYS  25  10.286  -0.075 -10.387
  225   1HE   LYS  25          2HE       LYS  25   9.811   2.361 -10.345
  226   2HE   LYS  25          1HE       LYS  25  10.981   2.565  -9.045
  227   1HZ   LYS  25          1HZ       LYS  25  11.617   1.701 -11.826
  228   2HZ   LYS  25          2HZ       LYS  25  12.737   1.931 -10.559
  229   3HZ   LYS  25          3HZ       LYS  25  11.881   3.234 -11.155
  230    H    TYR  26           H        TYR  26   9.869  -3.944  -9.412
  231    HA   TYR  26           HA       TYR  26  10.320  -3.726 -12.296
  232   1HB   TYR  26          2HB       TYR  26  12.273  -4.542 -10.124
  233   2HB   TYR  26          1HB       TYR  26  12.488  -5.035 -11.785
  234    HD1  TYR  26           1HD      TYR  26  13.059  -3.453 -13.468
  235    HD2  TYR  26           2HD      TYR  26  12.662  -2.286  -9.423
  236    HE1  TYR  26           1HE      TYR  26  14.244  -1.348 -13.977
  237    HE2  TYR  26           2HE      TYR  26  13.845  -0.193  -9.893
  238    HH   TYR  26           HH       TYR  26  15.436   0.698 -11.559
  239    HA   PRO  27           HA       PRO  27   8.096  -7.642 -12.050
  240   1HB   PRO  27          2HB       PRO  27   9.500  -8.058 -14.646
  241   2HB   PRO  27          1HB       PRO  27   7.787  -8.244 -14.252
  242   1HG   PRO  27          2HG       PRO  27   8.614  -6.125 -15.622
  243   2HG   PRO  27          1HG       PRO  27   7.374  -5.960 -14.368
  244   1HD   PRO  27          2HD       PRO  27  10.269  -5.223 -14.272
  245   2HD   PRO  27          1HD       PRO  27   8.857  -4.403 -13.570
  246    H    HIS  28           H        HIS  28  11.470  -7.288 -12.661
  247    HA   HIS  28           HA       HIS  28  12.129 -10.071 -12.207
  248   1HB   HIS  28          2HB       HIS  28  14.492  -9.411 -12.421
  249   2HB   HIS  28          1HB       HIS  28  13.554  -8.722 -13.740
  250    HD1  HIS  28           1HD      HIS  28  15.198  -7.736 -10.468
  251    HD2  HIS  28           2HD      HIS  28  13.898  -5.912 -13.985
  252    HE1  HIS  28           1HE      HIS  28  15.968  -5.369 -10.380
  253    HE2  HIS  28           2HE      HIS  28  15.656  -4.616 -12.707
  254    H    CYS  29           H        CYS  29  10.755  -8.594 -10.011
  255    HA   CYS  29           HA       CYS  29  12.848  -8.695  -7.929
  256   1HB   CYS  29          2HB       CYS  29  11.690  -6.522  -8.160
  257   2HB   CYS  29          1HB       CYS  29  10.144  -7.316  -7.951
  258    H    GLU  30           H        GLU  30  12.377  -9.862  -6.004
  259    HA   GLU  30           HA       GLU  30  10.486 -12.009  -6.381
  260   1HB   GLU  30          2HB       GLU  30  12.857 -12.458  -5.661
  261   2HB   GLU  30          1HB       GLU  30  12.565 -11.506  -4.233
  262   1HG   GLU  30          2HG       GLU  30  10.981 -13.915  -4.800
  263   2HG   GLU  30          1HG       GLU  30  12.581 -14.069  -4.075
  264    H    GLU  31           H        GLU  31   8.622 -12.163  -5.339
  265    HA   GLU  31           HA       GLU  31   6.807 -11.692  -4.137
  266   1HB   GLU  31          2HB       GLU  31   8.294 -11.573  -2.140
  267   2HB   GLU  31          1HB       GLU  31   8.541  -9.865  -2.451
  268   1HG   GLU  31          2HG       GLU  31   6.946 -10.181  -0.673
  269   2HG   GLU  31          1HG       GLU  31   6.157  -9.473  -2.082
  270    H    LYS  32           H        LYS  32   5.158 -10.089  -3.994
  271    HA   LYS  32           HA       LYS  32   5.503  -8.133  -6.108
  272   1HB   LYS  32          2HB       LYS  32   3.011  -8.821  -4.549
  273   2HB   LYS  32          1HB       LYS  32   3.102  -7.910  -6.052
  274   1HG   LYS  32          2HG       LYS  32   3.886 -10.772  -5.699
  275   2HG   LYS  32          1HG       LYS  32   2.372 -10.188  -6.432
  276   1HD   LYS  32          2HD       LYS  32   3.608  -9.183  -8.221
  277   2HD   LYS  32          1HD       LYS  32   5.142  -9.581  -7.430
  278   1HE   LYS  32          2HE       LYS  32   3.134 -11.593  -8.427
  279   2HE   LYS  32          1HE       LYS  32   4.583 -11.103  -9.303
  280   1HZ   LYS  32          1HZ       LYS  32   5.916 -11.973  -7.478
  281   2HZ   LYS  32          2HZ       LYS  32   4.936 -13.155  -8.131
  282   3HZ   LYS  32          3HZ       LYS  32   4.532 -12.480  -6.651
  283    H    MET  33           H        MET  33   5.555  -6.031  -5.892
  284    HA   MET  33           HA       MET  33   6.139  -4.934  -3.320
  285   1HB   MET  33          2HB       MET  33   7.352  -4.354  -5.347
  286   2HB   MET  33          1HB       MET  33   5.860  -3.672  -6.026
  287   1HG   MET  33          2HG       MET  33   7.238  -1.924  -5.326
  288   2HG   MET  33          1HG       MET  33   5.893  -2.078  -4.181
  289   1HE   MET  33          1HE       MET  33   9.151  -4.348  -4.387
  290   2HE   MET  33          2HE       MET  33  10.221  -3.498  -3.279
  291   3HE   MET  33          3HE       MET  33   9.733  -2.734  -4.792
  292    H    VAL  34           H        VAL  34   5.102  -3.075  -2.634
  293    HA   VAL  34           HA       VAL  34   2.187  -3.266  -2.963
  294    HB   VAL  34           HB       VAL  34   3.794  -2.026  -0.746
  295   1HG1  VAL  34          1HG1      VAL  34   1.664  -0.881  -1.056
  296   2HG1  VAL  34          2HG1      VAL  34   1.641  -1.805   0.442
  297   3HG1  VAL  34          3HG1      VAL  34   0.801  -2.417  -0.988
  298   1HG2  VAL  34          1HG2      VAL  34   2.970  -3.906   0.610
  299   2HG2  VAL  34          2HG2      VAL  34   3.946  -4.448  -0.752
  300   3HG2  VAL  34          3HG2      VAL  34   2.187  -4.578  -0.819
  301    H    ILE  35           H        ILE  35   1.406  -1.844  -4.372
  302    HA   ILE  35           HA       ILE  35   2.648   0.803  -4.558
  303    HB   ILE  35           HB       ILE  35   0.639  -0.493  -6.390
  304   1HG1  ILE  35          2HG1      ILE  35   2.649  -1.775  -6.276
  305   2HG1  ILE  35          1HG1      ILE  35   2.486  -1.062  -7.861
  306   1HG2  ILE  35          1HG2      ILE  35   1.350   1.261  -7.983
  307   2HG2  ILE  35          2HG2      ILE  35   2.418   1.931  -6.742
  308   3HG2  ILE  35          3HG2      ILE  35   0.685   1.941  -6.497
  309   1HD1  ILE  35          1HD1      ILE  35   4.154   0.689  -7.179
  310   2HD1  ILE  35          2HD1      ILE  35   4.815  -0.946  -7.145
  311   3HD1  ILE  35          3HD1      ILE  35   4.342  -0.157  -5.642
  312    H    ILE  36           H        ILE  36   1.599   2.357  -3.590
  313    HA   ILE  36           HA       ILE  36  -1.238   1.976  -3.255
  314    HB   ILE  36           HB       ILE  36   0.703   2.960  -1.224
  315   1HG1  ILE  36          2HG1      ILE  36  -1.561   0.968  -1.255
  316   2HG1  ILE  36          1HG1      ILE  36   0.155   0.607  -1.317
  317   1HG2  ILE  36          1HG2      ILE  36  -0.946   4.719  -1.265
  318   2HG2  ILE  36          2HG2      ILE  36  -1.210   3.720   0.167
  319   3HG2  ILE  36          3HG2      ILE  36  -2.253   3.544  -1.249
  320   1HD1  ILE  36          1HD1      ILE  36  -0.839   0.192   0.844
  321   2HD1  ILE  36          2HD1      ILE  36  -1.309   1.888   0.934
  322   3HD1  ILE  36          3HD1      ILE  36   0.414   1.441   0.923
  323    H    THR  37           H        THR  37  -2.439   3.155  -4.135
  324    HA   THR  37           HA       THR  37  -1.620   5.690  -5.310
  325    HB   THR  37           HB       THR  37  -4.027   3.938  -5.539
  326    HG1  THR  37           1HG      THR  37  -1.640   4.106  -7.011
  327   1HG2  THR  37          1HG2      THR  37  -3.291   6.263  -7.347
  328   2HG2  THR  37          2HG2      THR  37  -4.575   6.233  -6.111
  329   3HG2  THR  37          3HG2      THR  37  -4.676   5.146  -7.477
  330    H    THR  38           H        THR  38  -2.315   7.508  -4.343
  331    HA   THR  38           HA       THR  38  -3.980   7.253  -2.021
  332    HB   THR  38           HB       THR  38  -3.457   9.643  -1.607
  333    HG1  THR  38           1HG      THR  38  -2.453   9.411  -4.197
  334   1HG2  THR  38          1HG2      THR  38  -1.063   9.265  -1.111
  335   2HG2  THR  38          2HG2      THR  38  -1.071   7.858  -2.164
  336   3HG2  THR  38          3HG2      THR  38  -2.009   7.839  -0.693
  337    H    LYS  39           H        LYS  39  -5.705   8.868  -1.584
  338    HA   LYS  39           HA       LYS  39  -7.801   8.339  -3.410
  339   1HB   LYS  39          2HB       LYS  39  -7.986   8.623  -0.941
  340   2HB   LYS  39          1HB       LYS  39  -7.802  10.350  -1.175
  341   1HG   LYS  39          2HG       LYS  39  -9.856  10.434  -2.437
  342   2HG   LYS  39          1HG       LYS  39 -10.013   8.676  -2.341
  343   1HD   LYS  39          2HD       LYS  39 -10.074   8.871   0.135
  344   2HD   LYS  39          1HD       LYS  39 -10.070  10.626  -0.043
  345   1HE   LYS  39          2HE       LYS  39 -12.144  10.516  -1.285
  346   2HE   LYS  39          1HE       LYS  39 -12.153   8.759  -1.166
  347   1HZ   LYS  39          1HZ       LYS  39 -12.269   9.003   1.255
  348   2HZ   LYS  39          2HZ       LYS  39 -13.599   9.710   0.476
  349   3HZ   LYS  39          3HZ       LYS  39 -12.349  10.676   1.081
  350    H    SER  40           H        SER  40  -6.266  11.469  -2.772
  351    HA   SER  40           HA       SER  40  -6.247  12.344  -5.437
  352   1HB   SER  40          2HB       SER  40  -8.481  13.629  -3.771
  353   2HB   SER  40          1HB       SER  40  -7.887  14.256  -5.296
  354    HG   SER  40           HG       SER  40  -8.607  11.645  -5.379
  355    H    VAL  41           H        VAL  41  -7.117  14.112  -2.506
  356    HA   VAL  41           HA       VAL  41  -4.623  15.603  -2.682
  357    HB   VAL  41           HB       VAL  41  -7.085  16.115  -0.969
  358   1HG1  VAL  41          1HG1      VAL  41  -6.116  18.332  -0.585
  359   2HG1  VAL  41          2HG1      VAL  41  -4.695  17.868  -1.518
  360   3HG1  VAL  41          3HG1      VAL  41  -5.060  17.049   0.002
  361   1HG2  VAL  41          1HG2      VAL  41  -6.235  17.459  -3.537
  362   2HG2  VAL  41          2HG2      VAL  41  -7.589  17.958  -2.522
  363   3HG2  VAL  41          3HG2      VAL  41  -7.621  16.389  -3.329
  364    H    SER  42           H        SER  42  -3.141  14.380  -1.712
  365    HA   SER  42           HA       SER  42  -3.782  13.343   0.925
  366   1HB   SER  42          2HB       SER  42  -2.294  11.429   0.345
  367   2HB   SER  42          1HB       SER  42  -3.775  11.516  -0.616
  368    HG   SER  42           HG       SER  42  -2.261  11.259  -2.164
  369    H    ARG  43           H        ARG  43  -1.666  12.730   2.021
  370    HA   ARG  43           HA       ARG  43  -0.076  15.011   2.419
  371   1HB   ARG  43          2HB       ARG  43   0.434  12.145   3.173
  372   2HB   ARG  43          1HB       ARG  43   1.293  13.534   3.815
  373   1HG   ARG  43          2HG       ARG  43  -0.734  14.377   4.816
  374   2HG   ARG  43          1HG       ARG  43  -1.653  13.053   4.094
  375   1HD   ARG  43          2HD       ARG  43   0.605  12.728   6.053
  376   2HD   ARG  43          1HD       ARG  43  -1.105  12.664   6.461
  377    HE   ARG  43           HE       ARG  43  -1.209  10.737   4.846
  378   1HH1  ARG  43          1HH1      ARG  43   1.874  11.523   6.432
  379   2HH1  ARG  43          2HH1      ARG  43   2.349   9.906   6.623
  380   1HH2  ARG  43          1HH2      ARG  43  -0.560   8.561   5.103
  381   2HH2  ARG  43          2HH2      ARG  43   0.956   8.171   5.856
  382    H    TYR  44           H        TYR  44   0.225  12.442   0.073
  383    HA   TYR  44           HA       TYR  44   2.951  13.255  -0.515
  384   1HB   TYR  44          2HB       TYR  44   2.428  10.934   0.262
  385   2HB   TYR  44          1HB       TYR  44   1.425  10.748  -1.159
  386    HD1  TYR  44           1HD      TYR  44   4.833  11.866  -0.370
  387    HD2  TYR  44           2HD      TYR  44   2.315   9.551  -2.732
  388    HE1  TYR  44           1HE      TYR  44   6.858  10.948  -1.543
  389    HE2  TYR  44           2HE      TYR  44   4.269   8.590  -3.964
  390    HH   TYR  44           HH       TYR  44   6.599   9.199  -4.444
  391    H    ARG  45           H        ARG  45  -0.063  13.963  -1.225
  392    HA   ARG  45           HA       ARG  45  -1.397  14.461  -2.907
  393   1HB   ARG  45          2HB       ARG  45  -0.037  16.409  -2.162
  394   2HB   ARG  45          1HB       ARG  45   1.007  16.155  -3.542
  395   1HG   ARG  45          2HG       ARG  45  -1.919  16.727  -3.758
  396   2HG   ARG  45          1HG       ARG  45  -0.709  18.007  -3.695
  397   1HD   ARG  45          2HD       ARG  45  -0.956  15.843  -5.795
  398   2HD   ARG  45          1HD       ARG  45  -1.373  17.549  -6.000
  399    HE   ARG  45           HE       ARG  45   1.169  17.689  -5.258
  400   1HH1  ARG  45          1HH1      ARG  45  -0.405  15.699  -7.698
  401   2HH1  ARG  45          2HH1      ARG  45   0.950  15.625  -8.735
  402   1HH2  ARG  45          1HH2      ARG  45   3.044  17.588  -6.668
  403   2HH2  ARG  45          2HH2      ARG  45   2.939  16.694  -8.125
  404    H    GLY  46           H        GLY  46  -1.834  12.731  -4.169
  405   1HA   GLY  46          2HA       GLY  46  -2.288  11.887  -6.261
  406   2HA   GLY  46          1HA       GLY  46  -1.403  13.238  -6.925
  407    H    GLN  47           H        GLN  47   0.712  11.696  -4.940
  408    HA   GLN  47           HA       GLN  47   1.734  10.147  -7.179
  409   1HB   GLN  47          2HB       GLN  47   3.144  11.270  -4.762
  410   2HB   GLN  47          1HB       GLN  47   3.906  10.172  -5.899
  411   1HG   GLN  47          2HG       GLN  47   2.781  12.884  -6.567
  412   2HG   GLN  47          1HG       GLN  47   4.490  12.488  -6.372
  413   1HE2  GLN  47          1HE2      GLN  47   3.096  13.527  -8.711
  414   2HE2  GLN  47          2HE2      GLN  47   3.361  12.372  -9.966
  415    H    GLU  48           H        GLU  48   2.743   8.106  -6.763
  416    HA   GLU  48           HA       GLU  48   1.058   6.540  -4.980
  417   1HB   GLU  48          2HB       GLU  48   2.971   5.669  -7.161
  418   2HB   GLU  48          1HB       GLU  48   2.022   4.579  -6.173
  419   1HG   GLU  48          2HG       GLU  48   1.019   4.832  -8.358
  420   2HG   GLU  48          1HG       GLU  48  -0.038   5.531  -7.140
  421    H    HIS  49           H        HIS  49   1.776   5.454  -3.345
  422    HA   HIS  49           HA       HIS  49   4.572   5.899  -2.519
  423   1HB   HIS  49          2HB       HIS  49   2.319   4.620  -0.981
  424   2HB   HIS  49          1HB       HIS  49   3.927   4.927  -0.366
  425    HD1  HIS  49           1HD      HIS  49   4.282   7.210   0.762
  426    HD2  HIS  49           2HD      HIS  49   0.628   6.865  -1.199
  427    HE1  HIS  49           1HE      HIS  49   2.874   9.053   1.652
  428    HE2  HIS  49           2HE      HIS  49   0.605   8.592   0.724
  429    H    CYS  50           H        CYS  50   5.815   4.024  -1.891
  430    HA   CYS  50           HA       CYS  50   4.599   1.518  -2.672
  431   1HB   CYS  50          2HB       CYS  50   6.859   0.809  -3.495
  432   2HB   CYS  50          1HB       CYS  50   6.076   2.051  -4.462
  433    H    LEU  51           H        LEU  51   4.643   0.066  -1.181
  434    HA   LEU  51           HA       LEU  51   6.381   0.511   1.122
  435   1HB   LEU  51          2HB       LEU  51   3.787  -0.986   0.895
  436   2HB   LEU  51          1HB       LEU  51   4.863  -1.178   2.261
  437    HG   LEU  51           HG       LEU  51   3.783   1.435   1.390
  438   1HD1  LEU  51          1HD1      LEU  51   2.140   1.146   3.284
  439   2HD1  LEU  51          2HD1      LEU  51   2.761  -0.482   3.544
  440   3HD1  LEU  51          3HD1      LEU  51   1.910  -0.091   2.050
  441   1HD2  LEU  51          1HD2      LEU  51   5.750   1.582   2.759
  442   2HD2  LEU  51          2HD2      LEU  51   5.042   0.492   3.949
  443   3HD2  LEU  51          3HD2      LEU  51   4.354   2.096   3.703
  444    H    HIS  52           H        HIS  52   7.631  -0.894   1.798
  445    HA   HIS  52           HA       HIS  52   8.471  -2.869  -0.144
  446   1HB   HIS  52          2HB       HIS  52  10.093  -1.388   1.176
  447   2HB   HIS  52          1HB       HIS  52   9.760  -2.417   2.565
  448    HD1  HIS  52           1HD      HIS  52  11.618  -4.065   2.851
  449    HD2  HIS  52           2HD      HIS  52  10.864  -3.230  -1.149
  450    HE1  HIS  52           1HE      HIS  52  13.105  -5.576   1.551
  451    HE2  HIS  52           2HE      HIS  52  12.728  -4.995  -0.850
  452    HA   PRO  53           HA       PRO  53   5.736  -5.837   1.762
  453   1HB   PRO  53          2HB       PRO  53   6.158  -7.847   0.088
  454   2HB   PRO  53          1HB       PRO  53   5.263  -6.393  -0.409
  455   1HG   PRO  53          2HG       PRO  53   8.137  -7.118  -0.890
  456   2HG   PRO  53          1HG       PRO  53   6.949  -6.482  -2.043
  457   1HD   PRO  53          2HD       PRO  53   8.774  -4.908  -0.851
  458   2HD   PRO  53          1HD       PRO  53   7.139  -4.322  -1.234
  459    H    LYS  54           H        LYS  54   8.981  -5.956   2.051
  460    HA   LYS  54           HA       LYS  54   9.163  -8.698   2.799
  461   1HB   LYS  54          2HB       LYS  54  11.191  -6.508   3.039
  462   2HB   LYS  54          1HB       LYS  54  11.518  -8.218   3.340
  463   1HG   LYS  54          2HG       LYS  54  10.528  -7.062   0.749
  464   2HG   LYS  54          1HG       LYS  54  12.190  -7.496   1.140
  465   1HD   LYS  54          2HD       LYS  54  11.729  -9.727   1.215
  466   2HD   LYS  54          1HD       LYS  54   9.967  -9.516   1.279
  467   1HE   LYS  54          2HE       LYS  54  10.000  -8.561  -0.879
  468   2HE   LYS  54          1HE       LYS  54  11.751  -8.766  -1.043
  469   1HZ   LYS  54          1HZ       LYS  54  11.382 -11.188  -0.974
  470   2HZ   LYS  54          2HZ       LYS  54  10.508 -10.472  -2.197
  471   3HZ   LYS  54          3HZ       LYS  54   9.740 -10.961  -0.782
  472    H    LEU  55           H        LEU  55   8.285  -5.791   4.267
  473    HA   LEU  55           HA       LEU  55   9.145  -6.368   6.969
  474   1HB   LEU  55          2HB       LEU  55   7.469  -4.140   5.823
  475   2HB   LEU  55          1HB       LEU  55   8.012  -4.226   7.482
  476    HG   LEU  55           HG       LEU  55   9.825  -3.982   5.081
  477   1HD1  LEU  55          1HD1      LEU  55  10.216  -1.709   5.888
  478   2HD1  LEU  55          2HD1      LEU  55   9.008  -1.950   7.150
  479   3HD1  LEU  55          3HD1      LEU  55   8.524  -1.954   5.454
  480   1HD2  LEU  55          1HD2      LEU  55  10.395  -3.883   8.036
  481   2HD2  LEU  55          2HD2      LEU  55  11.547  -3.529   6.757
  482   3HD2  LEU  55          3HD2      LEU  55  10.892  -5.156   6.918
  483    H    GLN  56           H        GLN  56   7.762  -6.936   8.658
  484    HA   GLN  56           HA       GLN  56   5.423  -8.367   7.873
  485   1HB   GLN  56          2HB       GLN  56   5.120  -8.913  10.244
  486   2HB   GLN  56          1HB       GLN  56   6.760  -9.221   9.699
  487   1HG   GLN  56          2HG       GLN  56   7.548  -7.241  10.795
  488   2HG   GLN  56          1HG       GLN  56   5.902  -6.783  11.228
  489   1HE2  GLN  56          1HE2      GLN  56   8.534  -8.944  11.876
  490   2HE2  GLN  56          2HE2      GLN  56   7.919  -9.545  13.363
  491    H    SER  57           H        SER  57   5.984  -5.222   9.282
  492    HA   SER  57           HA       SER  57   3.406  -4.612  10.152
  493   1HB   SER  57          2HB       SER  57   5.420  -3.227  10.636
  494   2HB   SER  57          1HB       SER  57   5.504  -2.780   8.937
  495    HG   SER  57           HG       SER  57   3.753  -1.952  10.934
  496    H    THR  58           H        THR  58   4.925  -4.535   6.985
  497    HA   THR  58           HA       THR  58   2.960  -3.204   5.570
  498    HB   THR  58           HB       THR  58   4.815  -5.390   4.572
  499    HG1  THR  58           1HG      THR  58   6.162  -3.543   4.060
  500   1HG2  THR  58          1HG2      THR  58   3.048  -4.763   2.973
  501   2HG2  THR  58          2HG2      THR  58   4.622  -4.185   2.417
  502   3HG2  THR  58          3HG2      THR  58   3.484  -3.066   3.156
  503    H    LYS  59           H        LYS  59   3.395  -6.737   6.214
  504    HA   LYS  59           HA       LYS  59   1.193  -7.633   4.764
  505   1HB   LYS  59          2HB       LYS  59   2.501  -8.798   7.193
  506   2HB   LYS  59          1HB       LYS  59   1.093  -9.535   6.454
  507   1HG   LYS  59          2HG       LYS  59   3.007 -10.665   5.669
  508   2HG   LYS  59          1HG       LYS  59   2.360  -9.712   4.350
  509   1HD   LYS  59          2HD       LYS  59   4.077  -8.047   4.640
  510   2HD   LYS  59          1HD       LYS  59   4.693  -8.891   6.063
  511   1HE   LYS  59          2HE       LYS  59   6.077  -9.370   4.112
  512   2HE   LYS  59          1HE       LYS  59   5.262 -10.823   4.679
  513   1HZ   LYS  59          1HZ       LYS  59   4.369  -9.156   2.385
  514   2HZ   LYS  59          2HZ       LYS  59   3.668 -10.602   2.878
  515   3HZ   LYS  59          3HZ       LYS  59   5.242 -10.603   2.278
  516    H    ARG  60           H        ARG  60   1.211  -6.531   8.195
  517    HA   ARG  60           HA       ARG  60  -1.519  -7.061   8.541
  518   1HB   ARG  60          2HB       ARG  60   0.389  -5.216   9.870
  519   2HB   ARG  60          1HB       ARG  60  -1.309  -4.884  10.057
  520   1HG   ARG  60          2HG       ARG  60  -0.842  -6.082  11.948
  521   2HG   ARG  60          1HG       ARG  60  -1.446  -7.310  10.882
  522   1HD   ARG  60          2HD       ARG  60   1.506  -6.776  11.280
  523   2HD   ARG  60          1HD       ARG  60   0.608  -7.963  12.199
  524    HE   ARG  60           HE       ARG  60   0.286  -8.497   9.466
  525   1HH1  ARG  60          1HH1      ARG  60   2.776  -8.584  11.989
  526   2HH1  ARG  60          2HH1      ARG  60   3.646  -9.865  11.308
  527   1HH2  ARG  60          1HH2      ARG  60   1.500 -10.297   8.524
  528   2HH2  ARG  60          2HH2      ARG  60   2.917 -10.853   9.285
  529    H    PHE  61           H        PHE  61   0.136  -4.145   7.440
  530    HA   PHE  61           HA       PHE  61  -2.102  -2.501   7.223
  531   1HB   PHE  61          2HB       PHE  61   0.347  -1.877   7.041
  532   2HB   PHE  61          1HB       PHE  61   0.239  -2.535   5.402
  533    HD1  PHE  61           1HD      PHE  61  -0.603  -1.199   3.608
  534    HD2  PHE  61           2HD      PHE  61  -1.049   0.161   7.613
  535    HE1  PHE  61           1HE      PHE  61  -1.319   1.004   2.793
  536    HE2  PHE  61           2HE      PHE  61  -1.763   2.370   6.785
  537    HZ   PHE  61           HZ       PHE  61  -1.888   2.796   4.392
  538    H    ILE  62           H        ILE  62  -0.660  -4.735   4.880
  539    HA   ILE  62           HA       ILE  62  -2.374  -4.121   2.722
  540    HB   ILE  62           HB       ILE  62  -1.009  -6.766   3.289
  541   1HG1  ILE  62          2HG1      ILE  62   0.660  -5.054   3.214
  542   2HG1  ILE  62          1HG1      ILE  62   0.712  -5.915   1.680
  543   1HG2  ILE  62          1HG2      ILE  62  -2.775  -6.979   1.662
  544   2HG2  ILE  62          2HG2      ILE  62  -1.201  -7.154   0.872
  545   3HG2  ILE  62          3HG2      ILE  62  -2.109  -5.641   0.727
  546   1HD1  ILE  62          1HD1      ILE  62  -0.623  -3.286   2.190
  547   2HD1  ILE  62          2HD1      ILE  62  -0.553  -4.123   0.638
  548   3HD1  ILE  62          3HD1      ILE  62   0.933  -3.517   1.378
  549    H    LYS  63           H        LYS  63  -2.470  -6.731   5.045
  550    HA   LYS  63           HA       LYS  63  -4.983  -7.624   4.038
  551   1HB   LYS  63          2HB       LYS  63  -3.415  -8.463   6.427
  552   2HB   LYS  63          1HB       LYS  63  -5.117  -8.893   6.370
  553   1HG   LYS  63          2HG       LYS  63  -3.947 -10.742   5.473
  554   2HG   LYS  63          1HG       LYS  63  -4.707  -9.935   4.110
  555   1HD   LYS  63          2HD       LYS  63  -2.559 -10.499   3.362
  556   2HD   LYS  63          1HD       LYS  63  -2.422  -8.795   3.798
  557   1HE   LYS  63          2HE       LYS  63  -0.516 -10.044   4.635
  558   2HE   LYS  63          1HE       LYS  63  -1.489  -9.436   5.972
  559   1HZ   LYS  63          1HZ       LYS  63  -0.845 -11.725   6.365
  560   2HZ   LYS  63          2HZ       LYS  63  -1.507 -12.202   4.900
  561   3HZ   LYS  63          3HZ       LYS  63  -2.507 -11.674   6.146
  562    H    TRP  64           H        TRP  64  -4.157  -5.372   6.423
  563    HA   TRP  64           HA       TRP  64  -6.704  -5.176   7.664
  564   1HB   TRP  64          2HB       TRP  64  -4.259  -4.276   8.299
  565   2HB   TRP  64          1HB       TRP  64  -4.861  -2.845   7.485
  566    HD1  TRP  64           HD       TRP  64  -4.882  -4.632  10.729
  567    HE1  TRP  64           1HE      TRP  64  -6.406  -3.422  12.410
  568    HE3  TRP  64           3HE      TRP  64  -7.280  -1.419   7.535
  569    HZ2  TRP  64           2HZ      TRP  64  -8.352  -1.387  12.401
  570    HZ3  TRP  64           3HZ      TRP  64  -8.959   0.128   8.464
  571    HH2  TRP  64           HH       TRP  64  -9.479   0.140  10.838
  572    H    TYR  65           H        TYR  65  -5.000  -3.495   4.950
  573    HA   TYR  65           HA       TYR  65  -7.007  -1.672   4.446
  574   1HB   TYR  65          2HB       TYR  65  -4.879  -1.325   3.384
  575   2HB   TYR  65          1HB       TYR  65  -5.002  -2.849   2.493
  576    HD1  TYR  65           1HD      TYR  65  -6.290  -2.972   0.445
  577    HD2  TYR  65           2HD      TYR  65  -6.349   0.579   2.790
  578    HE1  TYR  65           1HE      TYR  65  -7.447  -1.783  -1.379
  579    HE2  TYR  65           2HE      TYR  65  -7.510   1.758   0.949
  580    HH   TYR  65           HH       TYR  65  -7.782   1.556  -1.466
  581    H    ASN  66           H        ASN  66  -6.666  -4.982   3.431
  582    HA   ASN  66           HA       ASN  66  -8.771  -4.979   1.561
  583   1HB   ASN  66          2HB       ASN  66  -7.609  -7.234   3.190
  584   2HB   ASN  66          1HB       ASN  66  -8.969  -7.501   2.106
  585   1HD2  ASN  66          1HD2      ASN  66  -5.561  -6.630   2.282
  586   2HD2  ASN  66          2HD2      ASN  66  -5.250  -6.937   0.622
  587    H    ALA  67           H        ALA  67  -8.849  -5.396   5.044
  588    HA   ALA  67           HA       ALA  67 -11.643  -5.937   5.205
  589   1HB   ALA  67          1HB       ALA  67  -9.745  -4.774   7.250
  590   2HB   ALA  67          2HB       ALA  67 -10.113  -6.485   7.041
  591   3HB   ALA  67          3HB       ALA  67 -11.367  -5.370   7.588
  592    H    TRP  68           H        TRP  68  -9.650  -3.098   5.583
  593    HA   TRP  68           HA       TRP  68 -11.534  -1.107   6.044
  594   1HB   TRP  68          2HB       TRP  68  -9.207  -0.702   6.363
  595   2HB   TRP  68          1HB       TRP  68  -8.854  -1.152   4.707
  596    HD1  TRP  68           HD       TRP  68  -8.663   0.747   3.011
  597    HE1  TRP  68           1HE      TRP  68  -9.035   3.293   3.076
  598    HE3  TRP  68           3HE      TRP  68 -10.901   1.149   7.587
  599    HZ2  TRP  68           2HZ      TRP  68 -10.113   5.185   4.777
  600    HZ3  TRP  68           3HZ      TRP  68 -11.573   3.391   8.346
  601    HH2  TRP  68           HH       TRP  68 -11.167   5.373   6.931
  602    H    ASN  69           H        ASN  69 -10.329  -2.390   3.005
  603    HA   ASN  69           HA       ASN  69 -11.549  -0.643   1.193
  604   1HB   ASN  69          2HB       ASN  69  -9.749  -2.244   0.613
  605   2HB   ASN  69          1HB       ASN  69 -10.870  -3.577   0.844
  606   1HD2  ASN  69          1HD2      ASN  69 -10.541  -4.270  -1.253
  607   2HD2  ASN  69          2HD2      ASN  69 -11.220  -3.467  -2.608
  608    H    GLU  70           H        GLU  70 -12.647  -3.735   2.519
  609    HA   GLU  70           HA       GLU  70 -15.170  -3.704   1.244
  610   1HB   GLU  70          2HB       GLU  70 -14.092  -5.195   3.622
  611   2HB   GLU  70          1HB       GLU  70 -15.738  -5.401   3.043
  612   1HG   GLU  70          2HG       GLU  70 -13.267  -5.866   1.402
  613   2HG   GLU  70          1HG       GLU  70 -14.209  -7.126   2.212
  614    H    LYS  71           H        LYS  71 -14.012  -2.574   4.386
  615    HA   LYS  71           HA       LYS  71 -16.493  -2.044   5.518
  616   1HB   LYS  71          2HB       LYS  71 -14.298  -2.293   6.697
  617   2HB   LYS  71          1HB       LYS  71 -13.831  -0.733   6.056
  618   1HG   LYS  71          2HG       LYS  71 -14.544  -0.613   8.370
  619   2HG   LYS  71          1HG       LYS  71 -15.571   0.350   7.294
  620   1HD   LYS  71          2HD       LYS  71 -16.888  -0.891   8.969
  621   2HD   LYS  71          1HD       LYS  71 -17.284  -1.391   7.327
  622   1HE   LYS  71          2HE       LYS  71 -17.145  -3.349   8.740
  623   2HE   LYS  71          1HE       LYS  71 -15.772  -3.366   7.645
  624   1HZ   LYS  71          1HZ       LYS  71 -14.385  -2.516   9.452
  625   2HZ   LYS  71          2HZ       LYS  71 -15.138  -3.951   9.912
  626   3HZ   LYS  71          3HZ       LYS  71 -15.727  -2.476  10.470
  627    H    ARG  72           H        ARG  72 -14.520  -0.243   3.325
  628    HA   ARG  72           HA       ARG  72 -15.892   2.267   3.541
  629   1HB   ARG  72          2HB       ARG  72 -14.006   1.118   1.495
  630   2HB   ARG  72          1HB       ARG  72 -14.712   2.713   1.321
  631   1HG   ARG  72          2HG       ARG  72 -13.615   3.478   3.307
  632   2HG   ARG  72          1HG       ARG  72 -13.072   1.846   3.684
  633   1HD   ARG  72          2HD       ARG  72 -11.329   3.276   2.714
  634   2HD   ARG  72          1HD       ARG  72 -11.617   1.808   1.781
  635    HE   ARG  72           HE       ARG  72 -12.909   4.317   0.958
  636   1HH1  ARG  72          1HH1      ARG  72 -10.497   1.809   0.284
  637   2HH1  ARG  72          2HH1      ARG  72 -10.223   2.281  -1.328
  638   1HH2  ARG  72          1HH2      ARG  72 -12.543   4.973  -1.225
  639   2HH2  ARG  72          2HH2      ARG  72 -11.444   4.135  -2.236
  640    H    ARG  73           H        ARG  73 -16.726  -0.656   2.207
  641    HA   ARG  73           HA       ARG  73 -18.545   0.531   0.234
  642   1HB   ARG  73          2HB       ARG  73 -17.602  -2.312   0.620
  643   2HB   ARG  73          1HB       ARG  73 -18.789  -1.805  -0.575
  644   1HG   ARG  73          2HG       ARG  73 -17.151  -0.458  -1.699
  645   2HG   ARG  73          1HG       ARG  73 -15.966  -0.796  -0.436
  646   1HD   ARG  73          2HD       ARG  73 -15.935  -3.135  -1.032
  647   2HD   ARG  73          1HD       ARG  73 -17.229  -2.885  -2.207
  648    HE   ARG  73           HE       ARG  73 -15.454  -1.214  -3.134
  649   1HH1  ARG  73          1HH1      ARG  73 -14.786  -4.518  -1.886
  650   2HH1  ARG  73          2HH1      ARG  73 -13.578  -4.794  -3.040
  651   1HH2  ARG  73          1HH2      ARG  73 -13.760  -1.686  -4.677
  652   2HH2  ARG  73          2HH2      ARG  73 -12.980  -3.199  -4.624
  653    H    VAL  74           H        VAL  74 -18.418  -1.932   2.794
  654    HA   VAL  74           HA       VAL  74 -21.099  -1.256   3.615
  655    HB   VAL  74           HB       VAL  74 -21.358  -2.924   1.806
  656   1HG1  VAL  74          1HG1      VAL  74 -20.632  -5.249   2.106
  657   2HG1  VAL  74          2HG1      VAL  74 -19.734  -4.762   3.543
  658   3HG1  VAL  74          3HG1      VAL  74 -19.288  -4.117   1.963
  659   1HG2  VAL  74          1HG2      VAL  74 -22.758  -4.549   3.011
  660   2HG2  VAL  74          2HG2      VAL  74 -23.030  -2.893   3.540
  661   3HG2  VAL  74          3HG2      VAL  74 -22.064  -3.989   4.533
  662    H    TYR  75           H        TYR  75 -21.543  -2.267   5.734
  663    HA   TYR  75           HA       TYR  75 -19.111  -2.532   7.247
  664   1HB   TYR  75          2HB       TYR  75 -21.991  -2.735   8.148
  665   2HB   TYR  75          1HB       TYR  75 -20.600  -2.771   9.227
  666    HD1  TYR  75           1HD      TYR  75 -23.064  -0.748   7.814
  667    HD2  TYR  75           2HD      TYR  75 -18.974  -0.704   8.937
  668    HE1  TYR  75           1HE      TYR  75 -23.128   1.682   7.913
  669    HE2  TYR  75           2HE      TYR  75 -19.026   1.754   9.046
  670    HH   TYR  75           HH       TYR  75 -20.318   3.600   8.160
  671    H    GLU  76           H        GLU  76 -18.801  -4.353   8.741
  672    HA   GLU  76           HA       GLU  76 -19.138  -6.747   7.166
  673   1HB   GLU  76          2HB       GLU  76 -17.456  -7.714   8.622
  674   2HB   GLU  76          1HB       GLU  76 -16.901  -6.201   7.922
  675   1HG   GLU  76          2HG       GLU  76 -17.400  -5.072  10.049
  676   2HG   GLU  76          1HG       GLU  76 -17.884  -6.627  10.731
  677    H    GLU  77           H        GLU  77 -19.624  -8.769   8.293
  678    HA   GLU  77           HA       GLU  77 -21.115  -8.589  10.699
  679   1HB   GLU  77          2HB       GLU  77 -23.184  -9.578   9.639
  680   2HB   GLU  77          1HB       GLU  77 -22.870  -7.895   9.261
  681   1HG   GLU  77          2HG       GLU  77 -21.982  -8.536   7.088
  682   2HG   GLU  77          1HG       GLU  77 -22.267 -10.233   7.457
  Start of MODEL   18
    1    H    SER   1           H        SER   1  19.975  -5.288  -7.702
    2    HA   SER   1           HA       SER   1  18.267  -7.561  -7.107
    3   1HB   SER   1          2HB       SER   1  19.480  -7.503  -4.912
    4   2HB   SER   1          1HB       SER   1  20.522  -7.752  -6.318
    5    HG   SER   1           HG       SER   1  21.573  -6.178  -5.398
    6    H    LYS   2           H        LYS   2  17.885  -4.272  -7.204
    7    HA   LYS   2           HA       LYS   2  15.882  -4.355  -5.063
    8   1HB   LYS   2          2HB       LYS   2  16.551  -2.117  -4.337
    9   2HB   LYS   2          1HB       LYS   2  17.856  -3.284  -4.145
   10   1HG   LYS   2          2HG       LYS   2  18.905  -2.460  -6.192
   11   2HG   LYS   2          1HG       LYS   2  17.598  -1.301  -6.401
   12   1HD   LYS   2          2HD       LYS   2  19.544  -0.213  -5.441
   13   2HD   LYS   2          1HD       LYS   2  18.223  -0.257  -4.271
   14   1HE   LYS   2          2HE       LYS   2  19.239  -2.154  -3.157
   15   2HE   LYS   2          1HE       LYS   2  20.522  -2.206  -4.358
   16   1HZ   LYS   2          1HZ       LYS   2  21.257  -0.039  -3.616
   17   2HZ   LYS   2          2HZ       LYS   2  21.233  -1.127  -2.343
   18   3HZ   LYS   2          3HZ       LYS   2  20.011   0.034  -2.476
   19    H    CYS   3           H        CYS   3  14.303  -2.576  -5.256
   20    HA   CYS   3           HA       CYS   3  14.253  -0.861  -7.451
   21   1HB   CYS   3          2HB       CYS   3  12.328  -1.753  -8.634
   22   2HB   CYS   3          1HB       CYS   3  13.660  -2.902  -8.695
   23    H    LYS   4           H        LYS   4  12.868   0.759  -6.995
   24    HA   LYS   4           HA       LYS   4  10.482   0.401  -5.568
   25   1HB   LYS   4          2HB       LYS   4  12.267   0.230  -3.726
   26   2HB   LYS   4          1HB       LYS   4  12.625   1.917  -4.052
   27   1HG   LYS   4          2HG       LYS   4  10.381   2.550  -3.429
   28   2HG   LYS   4          1HG       LYS   4   9.946   0.856  -3.199
   29   1HD   LYS   4          2HD       LYS   4  11.646   0.702  -1.419
   30   2HD   LYS   4          1HD       LYS   4  11.989   2.422  -1.629
   31   1HE   LYS   4          2HE       LYS   4   9.353   1.215  -0.819
   32   2HE   LYS   4          1HE       LYS   4  10.473   2.075   0.236
   33   1HZ   LYS   4          1HZ       LYS   4  10.136   4.066  -1.137
   34   2HZ   LYS   4          2HZ       LYS   4   8.712   3.524  -0.439
   35   3HZ   LYS   4          3HZ       LYS   4   8.969   3.260  -2.059
   36    H    CYS   5           H        CYS   5   9.434   2.561  -5.272
   37    HA   CYS   5           HA       CYS   5   9.714   4.117  -7.601
   38   1HB   CYS   5          2HB       CYS   5   8.315   4.915  -5.076
   39   2HB   CYS   5          1HB       CYS   5   7.876   5.315  -6.737
   40    H    SER   6           H        SER   6  10.555   4.592  -4.195
   41    HA   SER   6           HA       SER   6  12.641   6.409  -4.788
   42   1HB   SER   6          2HB       SER   6  10.617   7.911  -4.801
   43   2HB   SER   6          1HB       SER   6  10.220   7.348  -3.188
   44    HG   SER   6           HG       SER   6  12.415   8.886  -4.048
   45    H    ARG   7           H        ARG   7  13.939   6.635  -2.866
   46    HA   ARG   7           HA       ARG   7  14.261   4.311  -1.375
   47   1HB   ARG   7          2HB       ARG   7  15.192   7.085  -0.689
   48   2HB   ARG   7          1HB       ARG   7  15.764   5.615   0.068
   49   1HG   ARG   7          2HG       ARG   7  16.744   4.873  -2.000
   50   2HG   ARG   7          1HG       ARG   7  16.069   6.263  -2.859
   51   1HD   ARG   7          2HD       ARG   7  18.067   6.354  -0.602
   52   2HD   ARG   7          1HD       ARG   7  18.405   6.674  -2.304
   53    HE   ARG   7           HE       ARG   7  16.451   8.415  -1.797
   54   1HH1  ARG   7          1HH1      ARG   7  19.492   7.795  -0.114
   55   2HH1  ARG   7          2HH1      ARG   7  19.620   9.361   0.532
   56   1HH2  ARG   7          1HH2      ARG   7  16.599  10.529  -0.916
   57   2HH2  ARG   7          2HH2      ARG   7  17.917  10.982   0.075
   58    H    LYS   8           H        LYS   8  13.249   3.477   0.241
   59    HA   LYS   8           HA       LYS   8  12.050   3.071   2.016
   60   1HB   LYS   8          2HB       LYS   8  12.842   5.853   2.865
   61   2HB   LYS   8          1HB       LYS   8  11.980   4.726   3.911
   62   1HG   LYS   8          2HG       LYS   8  13.832   3.119   3.666
   63   2HG   LYS   8          1HG       LYS   8  14.685   4.292   2.669
   64   1HD   LYS   8          2HD       LYS   8  14.797   5.830   4.545
   65   2HD   LYS   8          1HD       LYS   8  13.882   4.700   5.550
   66   1HE   LYS   8          2HE       LYS   8  15.663   3.027   5.272
   67   2HE   LYS   8          1HE       LYS   8  16.577   4.159   4.297
   68   1HZ   LYS   8          1HZ       LYS   8  17.350   4.087   6.577
   69   2HZ   LYS   8          2HZ       LYS   8  15.857   4.569   7.153
   70   3HZ   LYS   8          3HZ       LYS   8  16.781   5.616   6.194
   71    H    GLY   9           H        GLY   9  10.101   3.350   3.194
   72   1HA   GLY   9          2HA       GLY   9   8.093   4.423   1.355
   73   2HA   GLY   9          1HA       GLY   9   7.843   3.179   2.555
   74    HA   PRO  10           HA       PRO  10   7.303   7.661   4.434
   75   1HB   PRO  10          2HB       PRO  10   5.053   8.184   2.585
   76   2HB   PRO  10          1HB       PRO  10   6.307   9.295   3.139
   77   1HG   PRO  10          2HG       PRO  10   6.312   8.384   0.645
   78   2HG   PRO  10          1HG       PRO  10   7.828   8.573   1.546
   79   1HD   PRO  10          2HD       PRO  10   6.250   6.085   0.999
   80   2HD   PRO  10          1HD       PRO  10   8.007   6.356   0.925
   81    H    LYS  11           H        LYS  11   5.500   8.094   5.842
   82    HA   LYS  11           HA       LYS  11   4.106   5.762   6.558
   83   1HB   LYS  11          2HB       LYS  11   3.723   8.605   7.502
   84   2HB   LYS  11          1HB       LYS  11   2.948   7.200   8.213
   85   1HG   LYS  11          2HG       LYS  11   5.157   6.300   8.793
   86   2HG   LYS  11          1HG       LYS  11   5.896   7.761   8.134
   87   1HD   LYS  11          2HD       LYS  11   4.677   9.124   9.747
   88   2HD   LYS  11          1HD       LYS  11   3.888   7.680  10.382
   89   1HE   LYS  11          2HE       LYS  11   6.091   6.806  11.054
   90   2HE   LYS  11          1HE       LYS  11   6.841   8.280  10.445
   91   1HZ   LYS  11          1HZ       LYS  11   6.509   8.376  12.840
   92   2HZ   LYS  11          2HZ       LYS  11   4.858   8.143  12.658
   93   3HZ   LYS  11          3HZ       LYS  11   5.575   9.549  12.099
   94    H    ILE  12           H        ILE  12   2.080   5.127   6.217
   95    HA   ILE  12           HA       ILE  12   0.208   6.810   4.660
   96    HB   ILE  12           HB       ILE  12   0.721   3.892   4.050
   97   1HG1  ILE  12          2HG1      ILE  12   1.739   6.264   2.471
   98   2HG1  ILE  12          1HG1      ILE  12   2.742   5.220   3.470
   99   1HG2  ILE  12          1HG2      ILE  12  -0.706   6.061   2.504
  100   2HG2  ILE  12          2HG2      ILE  12  -1.489   4.802   3.472
  101   3HG2  ILE  12          3HG2      ILE  12  -0.556   4.372   2.040
  102   1HD1  ILE  12          1HD1      ILE  12   2.917   4.631   1.135
  103   2HD1  ILE  12          2HD1      ILE  12   1.172   4.395   1.053
  104   3HD1  ILE  12          3HD1      ILE  12   2.165   3.320   2.050
  105    H    ARG  13           H        ARG  13  -1.833   6.615   5.464
  106    HA   ARG  13           HA       ARG  13  -2.292   4.261   7.070
  107   1HB   ARG  13          2HB       ARG  13  -3.716   6.933   7.262
  108   2HB   ARG  13          1HB       ARG  13  -4.086   5.480   8.199
  109   1HG   ARG  13          2HG       ARG  13  -1.830   5.554   9.175
  110   2HG   ARG  13          1HG       ARG  13  -1.530   7.051   8.295
  111   1HD   ARG  13          2HD       ARG  13  -3.381   8.107   9.509
  112   2HD   ARG  13          1HD       ARG  13  -3.641   6.614  10.407
  113    HE   ARG  13           HE       ARG  13  -1.121   8.119  10.508
  114   1HH1  ARG  13          1HH1      ARG  13  -3.680   6.313  12.182
  115   2HH1  ARG  13          2HH1      ARG  13  -3.062   6.582  13.738
  116   1HH2  ARG  13          1HH2      ARG  13  -0.265   8.496  12.673
  117   2HH2  ARG  13          2HH2      ARG  13  -1.081   7.850  14.029
  118    H    TYR  14           H        TYR  14  -4.727   3.685   6.975
  119    HA   TYR  14           HA       TYR  14  -5.046   2.798   4.290
  120   1HB   TYR  14          2HB       TYR  14  -7.104   2.665   6.493
  121   2HB   TYR  14          1HB       TYR  14  -6.891   1.578   5.122
  122    HD1  TYR  14           1HD      TYR  14  -6.030   2.219   8.528
  123    HD2  TYR  14           2HD      TYR  14  -4.723   0.179   5.021
  124    HE1  TYR  14           1HE      TYR  14  -4.553   0.835   9.891
  125    HE2  TYR  14           2HE      TYR  14  -3.247  -1.205   6.383
  126    HH   TYR  14           HH       TYR  14  -2.114  -1.126   8.558
  127    H    SER  15           H        SER  15  -6.289   5.419   6.128
  128    HA   SER  15           HA       SER  15  -8.519   6.086   4.506
  129   1HB   SER  15          2HB       SER  15  -6.908   7.745   6.408
  130   2HB   SER  15          1HB       SER  15  -8.545   8.108   5.835
  131    HG   SER  15           HG       SER  15  -9.330   6.732   7.208
  132    H    ASP  16           H        ASP  16  -5.143   6.467   4.130
  133    HA   ASP  16           HA       ASP  16  -5.179   8.915   2.580
  134   1HB   ASP  16          2HB       ASP  16  -3.012   6.832   3.038
  135   2HB   ASP  16          1HB       ASP  16  -2.787   8.274   2.081
  136    H    VAL  17           H        VAL  17  -5.468   5.581   2.160
  137    HA   VAL  17           HA       VAL  17  -4.499   5.484  -0.578
  138    HB   VAL  17           HB       VAL  17  -5.788   3.290   0.989
  139   1HG1  VAL  17          1HG1      VAL  17  -5.654   2.716  -1.238
  140   2HG1  VAL  17          2HG1      VAL  17  -4.371   1.822  -0.421
  141   3HG1  VAL  17          3HG1      VAL  17  -3.997   3.254  -1.380
  142   1HG2  VAL  17          1HG2      VAL  17  -3.526   2.557   1.684
  143   2HG2  VAL  17          2HG2      VAL  17  -3.986   4.114   2.376
  144   3HG2  VAL  17          3HG2      VAL  17  -2.873   4.055   1.016
  145    H    LYS  18           H        LYS  18  -5.782   5.362  -2.338
  146    HA   LYS  18           HA       LYS  18  -8.666   4.888  -1.917
  147   1HB   LYS  18          2HB       LYS  18  -7.229   5.760  -4.421
  148   2HB   LYS  18          1HB       LYS  18  -8.940   5.402  -4.339
  149   1HG   LYS  18          2HG       LYS  18  -8.972   7.275  -2.541
  150   2HG   LYS  18          1HG       LYS  18  -7.411   7.725  -3.233
  151   1HD   LYS  18          2HD       LYS  18 -10.020   7.488  -4.741
  152   2HD   LYS  18          1HD       LYS  18  -9.249   8.987  -4.259
  153   1HE   LYS  18          2HE       LYS  18  -7.998   6.960  -6.126
  154   2HE   LYS  18          1HE       LYS  18  -8.958   8.322  -6.675
  155   1HZ   LYS  18          1HZ       LYS  18  -6.359   8.582  -5.166
  156   2HZ   LYS  18          2HZ       LYS  18  -7.351   9.822  -5.750
  157   3HZ   LYS  18          3HZ       LYS  18  -6.633   8.792  -6.817
  158    H    LYS  19           H        LYS  19  -5.821   3.743  -3.426
  159    HA   LYS  19           HA       LYS  19  -7.010   1.145  -3.948
  160   1HB   LYS  19          2HB       LYS  19  -5.669   2.782  -6.100
  161   2HB   LYS  19          1HB       LYS  19  -5.930   1.055  -6.218
  162   1HG   LYS  19          2HG       LYS  19  -8.359   1.451  -6.066
  163   2HG   LYS  19          1HG       LYS  19  -8.046   3.189  -6.038
  164   1HD   LYS  19          2HD       LYS  19  -6.988   3.060  -8.217
  165   2HD   LYS  19          1HD       LYS  19  -7.193   1.310  -8.243
  166   1HE   LYS  19          2HE       LYS  19  -9.628   1.604  -8.188
  167   2HE   LYS  19          1HE       LYS  19  -9.410   3.350  -8.181
  168   1HZ   LYS  19          1HZ       LYS  19  -8.540   1.524 -10.358
  169   2HZ   LYS  19          2HZ       LYS  19  -8.370   3.199 -10.352
  170   3HZ   LYS  19          3HZ       LYS  19  -9.899   2.510 -10.387
  171    H    LEU  20           H        LEU  20  -5.647  -0.478  -3.803
  172    HA   LEU  20           HA       LEU  20  -2.783   0.003  -3.522
  173   1HB   LEU  20          2HB       LEU  20  -3.876  -0.053  -1.272
  174   2HB   LEU  20          1HB       LEU  20  -4.538  -1.616  -1.659
  175    HG   LEU  20           HG       LEU  20  -1.566  -1.089  -1.437
  176   1HD1  LEU  20          1HD1      LEU  20  -1.735  -2.053   0.800
  177   2HD1  LEU  20          2HD1      LEU  20  -3.490  -2.152   0.639
  178   3HD1  LEU  20          3HD1      LEU  20  -2.692  -0.583   0.675
  179   1HD2  LEU  20          1HD2      LEU  20  -1.435  -3.522  -1.181
  180   2HD2  LEU  20          2HD2      LEU  20  -2.219  -3.107  -2.707
  181   3HD2  LEU  20          3HD2      LEU  20  -3.187  -3.643  -1.336
  182    H    GLU  21           H        GLU  21  -1.744  -1.330  -4.800
  183    HA   GLU  21           HA       GLU  21  -3.127  -3.739  -5.716
  184   1HB   GLU  21          2HB       GLU  21  -3.421  -1.924  -7.333
  185   2HB   GLU  21          1HB       GLU  21  -1.690  -1.663  -7.366
  186   1HG   GLU  21          2HG       GLU  21  -1.342  -3.785  -8.369
  187   2HG   GLU  21          1HG       GLU  21  -3.066  -4.182  -8.266
  188    H    MET  22           H        MET  22  -1.743  -5.512  -5.623
  189    HA   MET  22           HA       MET  22   0.998  -4.800  -5.096
  190   1HB   MET  22          2HB       MET  22   1.304  -7.072  -4.255
  191   2HB   MET  22          1HB       MET  22   0.074  -6.193  -3.364
  192   1HG   MET  22          2HG       MET  22  -1.656  -7.443  -4.504
  193   2HG   MET  22          1HG       MET  22  -0.448  -8.265  -5.493
  194   1HE   MET  22          1HE       MET  22  -0.198  -7.385  -1.628
  195   2HE   MET  22          2HE       MET  22  -0.862  -8.856  -0.920
  196   3HE   MET  22          3HE       MET  22  -1.901  -7.780  -1.853
  197    H    LYS  23           H        LYS  23   2.245  -4.749  -6.633
  198    HA   LYS  23           HA       LYS  23   2.812  -6.961  -8.205
  199   1HB   LYS  23          2HB       LYS  23   2.609  -5.747 -10.472
  200   2HB   LYS  23          1HB       LYS  23   1.114  -6.295  -9.757
  201   1HG   LYS  23          2HG       LYS  23   0.700  -4.164 -10.708
  202   2HG   LYS  23          1HG       LYS  23   0.747  -3.935  -8.967
  203   1HD   LYS  23          2HD       LYS  23   3.044  -3.091  -9.172
  204   2HD   LYS  23          1HD       LYS  23   2.955  -3.315 -10.921
  205   1HE   LYS  23          2HE       LYS  23   1.136  -1.538  -9.303
  206   2HE   LYS  23          1HE       LYS  23   2.513  -0.963 -10.256
  207   1HZ   LYS  23          1HZ       LYS  23   0.511  -0.632 -11.398
  208   2HZ   LYS  23          2HZ       LYS  23  -0.018  -2.202 -11.184
  209   3HZ   LYS  23          3HZ       LYS  23   1.308  -1.872 -12.222
  210    HA   PRO  24           HA       PRO  24   6.674  -5.263  -7.337
  211   1HB   PRO  24          2HB       PRO  24   8.304  -6.289  -9.221
  212   2HB   PRO  24          1HB       PRO  24   7.592  -7.270  -7.964
  213   1HG   PRO  24          2HG       PRO  24   6.583  -6.893 -10.767
  214   2HG   PRO  24          1HG       PRO  24   6.824  -8.412  -9.881
  215   1HD   PRO  24          2HD       PRO  24   4.389  -7.296 -10.057
  216   2HD   PRO  24          1HD       PRO  24   4.931  -8.087  -8.559
  217    H    LYS  25           H        LYS  25   8.148  -3.680  -7.896
  218    HA   LYS  25           HA       LYS  25   7.159  -1.746  -9.767
  219   1HB   LYS  25          2HB       LYS  25   8.732  -1.562  -7.463
  220   2HB   LYS  25          1HB       LYS  25   9.899  -1.491  -8.790
  221   1HG   LYS  25          2HG       LYS  25   7.579   0.374  -8.599
  222   2HG   LYS  25          1HG       LYS  25   9.175   0.719  -7.939
  223   1HD   LYS  25          2HD       LYS  25  10.166   0.579 -10.047
  224   2HD   LYS  25          1HD       LYS  25   8.687  -0.070 -10.760
  225   1HE   LYS  25          2HE       LYS  25   7.570   2.099 -10.234
  226   2HE   LYS  25          1HE       LYS  25   9.090   2.704  -9.588
  227   1HZ   LYS  25          1HZ       LYS  25   8.574   1.914 -12.405
  228   2HZ   LYS  25          2HZ       LYS  25  10.055   2.485 -11.832
  229   3HZ   LYS  25          3HZ       LYS  25   8.705   3.483 -11.828
  230    H    TYR  26           H        TYR  26   9.728  -4.103  -9.502
  231    HA   TYR  26           HA       TYR  26  10.142  -4.093 -12.377
  232   1HB   TYR  26          2HB       TYR  26  12.230  -4.072 -10.202
  233   2HB   TYR  26          1HB       TYR  26  12.589  -4.778 -11.760
  234    HD1  TYR  26           1HD      TYR  26  13.597  -3.444 -13.317
  235    HD2  TYR  26           2HD      TYR  26  11.281  -1.590 -10.302
  236    HE1  TYR  26           1HE      TYR  26  14.289  -1.226 -14.156
  237    HE2  TYR  26           2HE      TYR  26  11.974   0.627 -11.113
  238    HH   TYR  26           HH       TYR  26  13.813   1.584 -12.357
  239    HA   PRO  27           HA       PRO  27   8.940  -8.373 -11.782
  240   1HB   PRO  27          2HB       PRO  27  10.655  -8.823 -14.169
  241   2HB   PRO  27          1HB       PRO  27   8.973  -9.277 -13.896
  242   1HG   PRO  27          2HG       PRO  27   9.571  -7.233 -15.485
  243   2HG   PRO  27          1HG       PRO  27   8.170  -7.162 -14.402
  244   1HD   PRO  27          2HD       PRO  27  10.833  -5.837 -14.143
  245   2HD   PRO  27          1HD       PRO  27   9.216  -5.254 -13.704
  246    H    HIS  28           H        HIS  28  12.258  -7.430 -12.124
  247    HA   HIS  28           HA       HIS  28  13.368  -9.978 -11.281
  248   1HB   HIS  28          2HB       HIS  28  15.577  -8.841 -11.260
  249   2HB   HIS  28          1HB       HIS  28  14.737  -8.553 -12.779
  250    HD1  HIS  28           1HD      HIS  28  15.526  -6.839  -9.507
  251    HD2  HIS  28           2HD      HIS  28  14.618  -5.838 -13.431
  252    HE1  HIS  28           1HE      HIS  28  15.753  -4.340  -9.674
  253    HE2  HIS  28           2HE      HIS  28  15.704  -3.936 -12.082
  254    H    CYS  29           H        CYS  29  11.532  -8.278  -9.519
  255    HA   CYS  29           HA       CYS  29  13.235  -8.154  -7.151
  256   1HB   CYS  29          2HB       CYS  29  10.759  -6.749  -8.006
  257   2HB   CYS  29          1HB       CYS  29  11.292  -6.543  -6.371
  258    H    GLU  30           H        GLU  30  12.319  -8.975  -5.112
  259    HA   GLU  30           HA       GLU  30  10.835 -11.380  -5.649
  260   1HB   GLU  30          2HB       GLU  30  12.850 -11.469  -4.253
  261   2HB   GLU  30          1HB       GLU  30  12.107 -10.382  -3.082
  262   1HG   GLU  30          2HG       GLU  30  12.024 -12.637  -2.313
  263   2HG   GLU  30          1HG       GLU  30  10.412 -12.046  -2.729
  264    H    GLU  31           H        GLU  31   8.874 -11.888  -4.851
  265    HA   GLU  31           HA       GLU  31   6.744 -11.622  -4.332
  266   1HB   GLU  31          2HB       GLU  31   7.909  -9.758  -2.288
  267   2HB   GLU  31          1HB       GLU  31   6.180 -10.115  -2.330
  268   1HG   GLU  31          2HG       GLU  31   6.705 -12.496  -1.977
  269   2HG   GLU  31          1HG       GLU  31   8.419 -12.103  -1.922
  270    H    LYS  32           H        LYS  32   4.973  -9.755  -3.899
  271    HA   LYS  32           HA       LYS  32   5.263  -8.046  -6.253
  272   1HB   LYS  32          2HB       LYS  32   2.817  -8.528  -4.572
  273   2HB   LYS  32          1HB       LYS  32   2.885  -7.787  -6.165
  274   1HG   LYS  32          2HG       LYS  32   3.531 -10.598  -5.479
  275   2HG   LYS  32          1HG       LYS  32   2.024 -10.033  -6.249
  276   1HD   LYS  32          2HD       LYS  32   3.377  -9.281  -8.156
  277   2HD   LYS  32          1HD       LYS  32   4.829  -9.915  -7.358
  278   1HE   LYS  32          2HE       LYS  32   2.431 -11.519  -8.266
  279   2HE   LYS  32          1HE       LYS  32   4.008 -11.477  -9.046
  280   1HZ   LYS  32          1HZ       LYS  32   4.971 -12.467  -7.028
  281   2HZ   LYS  32          2HZ       LYS  32   3.756 -13.435  -7.676
  282   3HZ   LYS  32          3HZ       LYS  32   3.459 -12.515  -6.303
  283    H    MET  33           H        MET  33   5.515  -5.963  -6.028
  284    HA   MET  33           HA       MET  33   5.864  -4.786  -3.420
  285   1HB   MET  33          2HB       MET  33   5.822  -3.467  -6.126
  286   2HB   MET  33          1HB       MET  33   5.813  -2.536  -4.673
  287   1HG   MET  33          2HG       MET  33   8.046  -2.560  -5.570
  288   2HG   MET  33          1HG       MET  33   8.021  -3.433  -4.058
  289   1HE   MET  33          1HE       MET  33   7.355  -6.383  -4.576
  290   2HE   MET  33          2HE       MET  33   8.859  -5.888  -3.807
  291   3HE   MET  33          3HE       MET  33   8.889  -7.059  -5.125
  292    H    VAL  34           H        VAL  34   4.733  -3.070  -2.561
  293    HA   VAL  34           HA       VAL  34   1.869  -3.334  -3.051
  294    HB   VAL  34           HB       VAL  34   3.382  -2.161  -0.715
  295   1HG1  VAL  34          1HG1      VAL  34   1.227  -1.054  -0.989
  296   2HG1  VAL  34          2HG1      VAL  34   1.189  -2.102   0.430
  297   3HG1  VAL  34          3HG1      VAL  34   0.417  -2.615  -1.072
  298   1HG2  VAL  34          1HG2      VAL  34   2.563  -4.133   0.510
  299   2HG2  VAL  34          2HG2      VAL  34   3.607  -4.564  -0.845
  300   3HG2  VAL  34          3HG2      VAL  34   1.864  -4.750  -0.986
  301    H    ILE  35           H        ILE  35   1.127  -1.917  -4.420
  302    HA   ILE  35           HA       ILE  35   2.381   0.707  -4.666
  303    HB   ILE  35           HB       ILE  35   0.431  -0.772  -6.443
  304   1HG1  ILE  35          2HG1      ILE  35   2.554  -1.886  -6.322
  305   2HG1  ILE  35          1HG1      ILE  35   2.337  -1.194  -7.917
  306   1HG2  ILE  35          1HG2      ILE  35   0.963   0.880  -8.141
  307   2HG2  ILE  35          2HG2      ILE  35   1.976   1.759  -6.992
  308   3HG2  ILE  35          3HG2      ILE  35   0.236   1.635  -6.721
  309   1HD1  ILE  35          1HD1      ILE  35   3.840   0.673  -7.275
  310   2HD1  ILE  35          2HD1      ILE  35   4.628  -0.899  -7.201
  311   3HD1  ILE  35          3HD1      ILE  35   4.099  -0.109  -5.715
  312    H    ILE  36           H        ILE  36   1.362   2.384  -3.832
  313    HA   ILE  36           HA       ILE  36  -1.483   2.117  -3.179
  314    HB   ILE  36           HB       ILE  36   0.744   3.226  -1.526
  315   1HG1  ILE  36          2HG1      ILE  36  -1.338   1.102  -1.079
  316   2HG1  ILE  36          1HG1      ILE  36   0.385   0.863  -1.352
  317   1HG2  ILE  36          1HG2      ILE  36  -1.061   4.863  -1.429
  318   2HG2  ILE  36          2HG2      ILE  36  -0.897   4.000   0.100
  319   3HG2  ILE  36          3HG2      ILE  36  -2.201   3.582  -1.009
  320   1HD1  ILE  36          1HD1      ILE  36  -0.239   0.599   0.974
  321   2HD1  ILE  36          2HD1      ILE  36  -0.893   2.238   0.931
  322   3HD1  ILE  36          3HD1      ILE  36   0.853   1.992   0.730
  323    H    THR  37           H        THR  37  -2.642   3.447  -4.064
  324    HA   THR  37           HA       THR  37  -1.637   6.039  -5.059
  325    HB   THR  37           HB       THR  37  -4.182   4.524  -5.743
  326    HG1  THR  37           1HG      THR  37  -1.994   5.143  -7.414
  327   1HG2  THR  37          1HG2      THR  37  -3.082   7.090  -6.917
  328   2HG2  THR  37          2HG2      THR  37  -4.534   6.934  -5.914
  329   3HG2  THR  37          3HG2      THR  37  -4.487   6.199  -7.518
  330    H    THR  38           H        THR  38  -2.138   7.821  -3.874
  331    HA   THR  38           HA       THR  38  -3.986   7.520  -1.678
  332    HB   THR  38           HB       THR  38  -3.184   9.750  -0.966
  333    HG1  THR  38           1HG      THR  38  -1.982  10.955  -2.188
  334   1HG2  THR  38          1HG2      THR  38  -0.807   9.100  -0.558
  335   2HG2  THR  38          2HG2      THR  38  -1.018   7.793  -1.705
  336   3HG2  THR  38          3HG2      THR  38  -1.946   7.783  -0.213
  337    H    LYS  39           H        LYS  39  -5.596   9.136  -1.207
  338    HA   LYS  39           HA       LYS  39  -7.098   9.933  -3.524
  339   1HB   LYS  39          2HB       LYS  39  -8.693  10.949  -1.910
  340   2HB   LYS  39          1HB       LYS  39  -8.369   9.260  -1.581
  341   1HG   LYS  39          2HG       LYS  39  -6.791   9.982   0.220
  342   2HG   LYS  39          1HG       LYS  39  -7.289  11.647  -0.081
  343   1HD   LYS  39          2HD       LYS  39  -9.119   9.390   0.748
  344   2HD   LYS  39          1HD       LYS  39  -8.507  10.653   1.811
  345   1HE   LYS  39          2HE       LYS  39  -9.679  12.342   0.515
  346   2HE   LYS  39          1HE       LYS  39 -10.235  11.126  -0.628
  347   1HZ   LYS  39          1HZ       LYS  39 -11.429  10.060   1.200
  348   2HZ   LYS  39          2HZ       LYS  39 -11.971  11.642   0.948
  349   3HZ   LYS  39          3HZ       LYS  39 -10.946  11.269   2.245
  350    H    SER  40           H        SER  40  -5.290  11.590  -1.059
  351    HA   SER  40           HA       SER  40  -4.182  13.362  -2.847
  352   1HB   SER  40          2HB       SER  40  -6.337  14.572  -2.679
  353   2HB   SER  40          1HB       SER  40  -6.234  14.584  -0.930
  354    HG   SER  40           HG       SER  40  -5.255  16.306  -2.682
  355    H    VAL  41           H        VAL  41  -5.038  14.256   0.431
  356    HA   VAL  41           HA       VAL  41  -3.893  14.588   2.252
  357    HB   VAL  41           HB       VAL  41  -3.189  12.478   3.434
  358   1HG1  VAL  41          1HG1      VAL  41  -5.475  13.351   3.519
  359   2HG1  VAL  41          2HG1      VAL  41  -5.460  11.590   3.518
  360   3HG1  VAL  41          3HG1      VAL  41  -5.866  12.461   2.044
  361   1HG2  VAL  41          1HG2      VAL  41  -3.769  10.343   2.355
  362   2HG2  VAL  41          2HG2      VAL  41  -2.442  11.134   1.530
  363   3HG2  VAL  41          3HG2      VAL  41  -4.071  11.186   0.840
  364    H    SER  42           H        SER  42  -1.515  12.351   0.891
  365    HA   SER  42           HA       SER  42   0.550  13.833   2.231
  366   1HB   SER  42          2HB       SER  42   1.982  11.913   1.304
  367   2HB   SER  42          1HB       SER  42   0.764  11.502   2.515
  368    HG   SER  42           HG       SER  42  -0.421  10.564   1.071
  369    H    ARG  43           H        ARG  43   2.705  13.945   0.878
  370    HA   ARG  43           HA       ARG  43   2.341  16.063  -0.885
  371   1HB   ARG  43          2HB       ARG  43   4.758  16.002  -1.245
  372   2HB   ARG  43          1HB       ARG  43   4.368  15.759   0.443
  373   1HG   ARG  43          2HG       ARG  43   6.081  14.214   0.087
  374   2HG   ARG  43          1HG       ARG  43   4.632  13.239  -0.109
  375   1HD   ARG  43          2HD       ARG  43   6.242  12.738  -1.864
  376   2HD   ARG  43          1HD       ARG  43   4.800  13.490  -2.549
  377    HE   ARG  43           HE       ARG  43   6.869  15.345  -1.881
  378   1HH1  ARG  43          1HH1      ARG  43   5.670  13.229  -4.495
  379   2HH1  ARG  43          2HH1      ARG  43   6.486  14.086  -5.711
  380   1HH2  ARG  43          1HH2      ARG  43   7.944  16.477  -3.568
  381   2HH2  ARG  43          2HH2      ARG  43   7.812  15.966  -5.188
  382    H    TYR  44           H        TYR  44   2.002  12.843  -1.602
  383    HA   TYR  44           HA       TYR  44   2.794  12.970  -4.342
  384   1HB   TYR  44          2HB       TYR  44   1.315  10.894  -2.760
  385   2HB   TYR  44          1HB       TYR  44   1.587  10.693  -4.479
  386    HD1  TYR  44           1HD      TYR  44   3.873  10.435  -5.331
  387    HD2  TYR  44           2HD      TYR  44   3.051  10.663  -1.197
  388    HE1  TYR  44           1HE      TYR  44   6.130   9.581  -4.871
  389    HE2  TYR  44           2HE      TYR  44   5.326   9.804  -0.695
  390    HH   TYR  44           HH       TYR  44   7.741   9.586  -3.111
  391    H    ARG  45           H        ARG  45  -0.287  12.921  -2.654
  392    HA   ARG  45           HA       ARG  45  -2.366  13.273  -3.250
  393   1HB   ARG  45          2HB       ARG  45  -1.104  15.503  -4.825
  394   2HB   ARG  45          1HB       ARG  45  -2.834  15.370  -4.549
  395   1HG   ARG  45          2HG       ARG  45  -2.467  15.490  -2.152
  396   2HG   ARG  45          1HG       ARG  45  -0.728  15.605  -2.424
  397   1HD   ARG  45          2HD       ARG  45  -1.034  17.691  -3.611
  398   2HD   ARG  45          1HD       ARG  45  -2.784  17.574  -3.410
  399    HE   ARG  45           HE       ARG  45  -1.711  17.374  -0.904
  400   1HH1  ARG  45          1HH1      ARG  45  -1.686  19.840  -3.443
  401   2HH1  ARG  45          2HH1      ARG  45  -1.587  21.141  -2.328
  402   1HH2  ARG  45          1HH2      ARG  45  -1.581  19.135   0.563
  403   2HH2  ARG  45          2HH2      ARG  45  -1.525  20.734  -0.002
  404    H    GLY  46           H        GLY  46  -2.377  11.175  -4.352
  405   1HA   GLY  46          2HA       GLY  46  -3.691  10.169  -6.022
  406   2HA   GLY  46          1HA       GLY  46  -3.390  11.551  -7.070
  407    H    GLN  47           H        GLN  47  -0.576  10.918  -5.746
  408    HA   GLN  47           HA       GLN  47   0.257   9.154  -7.887
  409   1HB   GLN  47          2HB       GLN  47   1.855  11.157  -6.290
  410   2HB   GLN  47          1HB       GLN  47   2.662   9.819  -7.088
  411   1HG   GLN  47          2HG       GLN  47   2.883  11.745  -8.462
  412   2HG   GLN  47          1HG       GLN  47   1.740  10.675  -9.241
  413   1HE2  GLN  47          1HE2      GLN  47   2.263  13.503  -9.530
  414   2HE2  GLN  47          2HE2      GLN  47   0.778  14.327  -9.285
  415    H    GLU  48           H        GLU  48   1.968   7.548  -7.387
  416    HA   GLU  48           HA       GLU  48   0.795   6.044  -5.228
  417   1HB   GLU  48          2HB       GLU  48   2.594   5.202  -7.481
  418   2HB   GLU  48          1HB       GLU  48   2.105   4.135  -6.185
  419   1HG   GLU  48          2HG       GLU  48   0.762   3.728  -8.136
  420   2HG   GLU  48          1HG       GLU  48  -0.235   4.410  -6.866
  421    H    HIS  49           H        HIS  49   1.743   5.208  -3.659
  422    HA   HIS  49           HA       HIS  49   4.569   5.783  -2.976
  423   1HB   HIS  49          2HB       HIS  49   2.294   4.739  -1.251
  424   2HB   HIS  49          1HB       HIS  49   3.939   4.976  -0.717
  425    HD1  HIS  49           1HD      HIS  49   4.124   6.943   0.739
  426    HD2  HIS  49           2HD      HIS  49   1.101   7.426  -2.070
  427    HE1  HIS  49           1HE      HIS  49   2.997   9.083   1.349
  428    HE2  HIS  49           2HE      HIS  49   1.197   9.402  -0.332
  429    H    CYS  50           H        CYS  50   5.785   3.805  -2.306
  430    HA   CYS  50           HA       CYS  50   4.246   1.410  -2.678
  431   1HB   CYS  50          2HB       CYS  50   6.148   0.329  -3.931
  432   2HB   CYS  50          1HB       CYS  50   5.267   1.569  -4.810
  433    H    LEU  51           H        LEU  51   4.457  -0.014  -1.254
  434    HA   LEU  51           HA       LEU  51   6.457   0.402   0.817
  435   1HB   LEU  51          2HB       LEU  51   3.862  -1.112   0.851
  436   2HB   LEU  51          1HB       LEU  51   5.056  -1.246   2.123
  437    HG   LEU  51           HG       LEU  51   3.859   1.327   1.262
  438   1HD1  LEU  51          1HD1      LEU  51   2.395   1.095   3.306
  439   2HD1  LEU  51          2HD1      LEU  51   3.066  -0.516   3.564
  440   3HD1  LEU  51          3HD1      LEU  51   2.077  -0.188   2.142
  441   1HD2  LEU  51          1HD2      LEU  51   5.948   1.554   2.450
  442   2HD2  LEU  51          2HD2      LEU  51   5.347   0.509   3.745
  443   3HD2  LEU  51          3HD2      LEU  51   4.628   2.095   3.485
  444    H    HIS  52           H        HIS  52   7.687  -1.047   1.521
  445    HA   HIS  52           HA       HIS  52   8.572  -3.061  -0.374
  446   1HB   HIS  52          2HB       HIS  52  10.135  -1.666   1.128
  447   2HB   HIS  52          1HB       HIS  52   9.604  -2.679   2.462
  448    HD1  HIS  52           1HD      HIS  52  11.147  -4.680   2.900
  449    HD2  HIS  52           2HD      HIS  52  11.404  -3.272  -1.011
  450    HE1  HIS  52           1HE      HIS  52  12.773  -6.160   1.767
  451    HE2  HIS  52           2HE      HIS  52  13.264  -4.938  -0.370
  452    HA   PRO  53           HA       PRO  53   5.453  -5.796   1.400
  453   1HB   PRO  53          2HB       PRO  53   5.683  -7.796  -0.343
  454   2HB   PRO  53          1HB       PRO  53   4.973  -6.241  -0.808
  455   1HG   PRO  53          2HG       PRO  53   7.768  -7.246  -1.246
  456   2HG   PRO  53          1HG       PRO  53   6.662  -6.472  -2.400
  457   1HD   PRO  53          2HD       PRO  53   8.621  -5.097  -1.150
  458   2HD   PRO  53          1HD       PRO  53   7.060  -4.357  -1.557
  459    H    LYS  54           H        LYS  54   8.655  -6.191   1.573
  460    HA   LYS  54           HA       LYS  54   8.794  -8.947   2.411
  461   1HB   LYS  54          2HB       LYS  54  10.476  -7.781   1.117
  462   2HB   LYS  54          1HB       LYS  54  10.787  -6.711   2.484
  463   1HG   LYS  54          2HG       LYS  54  12.440  -8.329   2.295
  464   2HG   LYS  54          1HG       LYS  54  11.472  -8.738   3.727
  465   1HD   LYS  54          2HD       LYS  54  11.952 -10.701   2.497
  466   2HD   LYS  54          1HD       LYS  54  10.219 -10.257   2.345
  467   1HE   LYS  54          2HE       LYS  54  10.727  -9.349   0.045
  468   2HE   LYS  54          1HE       LYS  54  12.385  -9.888   0.230
  469   1HZ   LYS  54          1HZ       LYS  54  11.558 -12.171   0.404
  470   2HZ   LYS  54          2HZ       LYS  54  11.119 -11.435  -1.030
  471   3HZ   LYS  54          3HZ       LYS  54   9.972 -11.582   0.205
  472    H    LEU  55           H        LEU  55   8.017  -5.921   3.763
  473    HA   LEU  55           HA       LEU  55   8.996  -6.465   6.435
  474   1HB   LEU  55          2HB       LEU  55   7.250  -4.248   5.372
  475   2HB   LEU  55          1HB       LEU  55   7.869  -4.343   7.003
  476    HG   LEU  55           HG       LEU  55   9.557  -4.039   4.516
  477   1HD1  LEU  55          1HD1      LEU  55   9.922  -1.757   5.333
  478   2HD1  LEU  55          2HD1      LEU  55   8.786  -2.050   6.649
  479   3HD1  LEU  55          3HD1      LEU  55   8.221  -2.056   4.976
  480   1HD2  LEU  55          1HD2      LEU  55  10.283  -3.935   7.444
  481   2HD2  LEU  55          2HD2      LEU  55  11.373  -3.588   6.102
  482   3HD2  LEU  55          3HD2      LEU  55  10.729  -5.215   6.316
  483    H    GLN  56           H        GLN  56   7.767  -6.916   8.191
  484    HA   GLN  56           HA       GLN  56   5.383  -8.435   7.775
  485   1HB   GLN  56          2HB       GLN  56   6.605  -7.469  10.370
  486   2HB   GLN  56          1HB       GLN  56   5.403  -8.736  10.200
  487   1HG   GLN  56          2HG       GLN  56   7.017 -10.104   8.971
  488   2HG   GLN  56          1HG       GLN  56   8.222  -8.829   9.150
  489   1HE2  GLN  56          1HE2      GLN  56   9.633 -10.071  10.319
  490   2HE2  GLN  56          2HE2      GLN  56   9.324 -10.594  11.933
  491    H    SER  57           H        SER  57   6.171  -5.203   8.771
  492    HA   SER  57           HA       SER  57   3.707  -4.350   9.816
  493   1HB   SER  57          2HB       SER  57   5.801  -3.026  10.010
  494   2HB   SER  57          1HB       SER  57   5.801  -2.770   8.271
  495    HG   SER  57           HG       SER  57   4.181  -1.652  10.259
  496    H    THR  58           H        THR  58   5.005  -4.381   6.505
  497    HA   THR  58           HA       THR  58   2.881  -3.172   5.187
  498    HB   THR  58           HB       THR  58   4.760  -5.297   4.118
  499    HG1  THR  58           1HG      THR  58   6.133  -3.511   3.666
  500   1HG2  THR  58          1HG2      THR  58   2.926  -4.657   2.617
  501   2HG2  THR  58          2HG2      THR  58   4.471  -4.070   2.004
  502   3HG2  THR  58          3HG2      THR  58   3.359  -2.961   2.805
  503    H    LYS  59           H        LYS  59   3.412  -6.470   6.269
  504    HA   LYS  59           HA       LYS  59   1.314  -7.732   4.782
  505   1HB   LYS  59          2HB       LYS  59   2.454  -8.531   7.447
  506   2HB   LYS  59          1HB       LYS  59   1.472  -9.527   6.382
  507   1HG   LYS  59          2HG       LYS  59   4.272  -8.527   5.837
  508   2HG   LYS  59          1HG       LYS  59   3.715 -10.164   6.219
  509   1HD   LYS  59          2HD       LYS  59   2.480 -10.278   4.148
  510   2HD   LYS  59          1HD       LYS  59   2.945  -8.623   3.741
  511   1HE   LYS  59          2HE       LYS  59   5.309  -9.324   3.741
  512   2HE   LYS  59          1HE       LYS  59   4.801 -10.978   4.072
  513   1HZ   LYS  59          1HZ       LYS  59   4.116  -9.406   1.642
  514   2HZ   LYS  59          2HZ       LYS  59   3.585 -10.970   1.947
  515   3HZ   LYS  59          3HZ       LYS  59   5.219 -10.656   1.677
  516    H    ARG  60           H        ARG  60   1.320  -6.379   8.112
  517    HA   ARG  60           HA       ARG  60  -1.401  -6.904   8.419
  518   1HB   ARG  60          2HB       ARG  60   0.458  -5.038   9.804
  519   2HB   ARG  60          1HB       ARG  60  -1.266  -4.899  10.054
  520   1HG   ARG  60          2HG       ARG  60  -0.483  -6.174  11.813
  521   2HG   ARG  60          1HG       ARG  60  -1.263  -7.273  10.724
  522   1HD   ARG  60          2HD       ARG  60   0.856  -7.958   9.715
  523   2HD   ARG  60          1HD       ARG  60   1.732  -6.843  10.753
  524    HE   ARG  60           HE       ARG  60   0.303  -8.518  12.400
  525   1HH1  ARG  60          1HH1      ARG  60   2.837  -8.807   9.992
  526   2HH1  ARG  60          2HH1      ARG  60   3.600 -10.176  10.671
  527   1HH2  ARG  60          1HH2      ARG  60   1.367 -10.416  13.426
  528   2HH2  ARG  60          2HH2      ARG  60   2.756 -11.074  12.705
  529    H    PHE  61           H        PHE  61   0.352  -4.257   7.004
  530    HA   PHE  61           HA       PHE  61  -1.787  -2.471   6.897
  531   1HB   PHE  61          2HB       PHE  61   0.703  -2.075   6.336
  532   2HB   PHE  61          1HB       PHE  61   0.268  -2.694   4.744
  533    HD1  PHE  61           1HD      PHE  61  -1.167  -1.355   3.226
  534    HD2  PHE  61           2HD      PHE  61  -0.092   0.079   7.086
  535    HE1  PHE  61           1HE      PHE  61  -1.917   0.907   2.602
  536    HE2  PHE  61           2HE      PHE  61  -0.854   2.341   6.456
  537    HZ   PHE  61           HZ       PHE  61  -1.744   2.766   4.246
  538    H    ILE  62           H        ILE  62  -0.715  -5.008   4.649
  539    HA   ILE  62           HA       ILE  62  -2.790  -4.614   2.749
  540    HB   ILE  62           HB       ILE  62  -1.275  -7.162   3.357
  541   1HG1  ILE  62          2HG1      ILE  62   0.254  -5.418   2.660
  542   2HG1  ILE  62          1HG1      ILE  62   0.053  -6.552   1.332
  543   1HG2  ILE  62          1HG2      ILE  62  -3.375  -7.629   2.198
  544   2HG2  ILE  62          2HG2      ILE  62  -2.014  -7.931   1.121
  545   3HG2  ILE  62          3HG2      ILE  62  -2.975  -6.464   0.948
  546   1HD1  ILE  62          1HD1      ILE  62  -1.286  -3.884   1.612
  547   2HD1  ILE  62          2HD1      ILE  62  -1.533  -4.999   0.283
  548   3HD1  ILE  62          3HD1      ILE  62   0.048  -4.249   0.525
  549    H    LYS  63           H        LYS  63  -2.407  -6.863   5.415
  550    HA   LYS  63           HA       LYS  63  -4.881  -8.267   5.176
  551   1HB   LYS  63          2HB       LYS  63  -3.625  -7.489   7.808
  552   2HB   LYS  63          1HB       LYS  63  -4.744  -8.793   7.531
  553   1HG   LYS  63          2HG       LYS  63  -1.882  -8.679   6.551
  554   2HG   LYS  63          1HG       LYS  63  -2.465  -9.541   7.959
  555   1HD   LYS  63          2HD       LYS  63  -2.162 -11.172   6.273
  556   2HD   LYS  63          1HD       LYS  63  -3.894 -10.896   6.363
  557   1HE   LYS  63          2HE       LYS  63  -3.808  -9.528   4.338
  558   2HE   LYS  63          1HE       LYS  63  -2.049  -9.656   4.319
  559   1HZ   LYS  63          1HZ       LYS  63  -2.262 -12.008   3.994
  560   2HZ   LYS  63          2HZ       LYS  63  -3.085 -11.194   2.777
  561   3HZ   LYS  63          3HZ       LYS  63  -3.937 -11.921   4.044
  562    H    TRP  64           H        TRP  64  -4.119  -5.298   6.792
  563    HA   TRP  64           HA       TRP  64  -6.666  -4.930   8.005
  564   1HB   TRP  64          2HB       TRP  64  -4.141  -3.967   8.368
  565   2HB   TRP  64          1HB       TRP  64  -4.940  -2.600   7.609
  566    HD1  TRP  64           HD       TRP  64  -4.488  -4.328  10.855
  567    HE1  TRP  64           1HE      TRP  64  -5.989  -3.227  12.649
  568    HE3  TRP  64           3HE      TRP  64  -7.419  -1.431   7.812
  569    HZ2  TRP  64           2HZ      TRP  64  -8.134  -1.355  12.736
  570    HZ3  TRP  64           3HZ      TRP  64  -9.154  -0.020   8.824
  571    HH2  TRP  64           HH       TRP  64  -9.505   0.016  11.220
  572    H    TYR  65           H        TYR  65  -4.943  -3.432   5.193
  573    HA   TYR  65           HA       TYR  65  -6.947  -1.652   4.435
  574   1HB   TYR  65          2HB       TYR  65  -4.734  -1.457   3.471
  575   2HB   TYR  65          1HB       TYR  65  -4.855  -3.062   2.766
  576    HD1  TYR  65           1HD      TYR  65  -6.018  -3.426   0.694
  577    HD2  TYR  65           2HD      TYR  65  -6.037   0.445   2.478
  578    HE1  TYR  65           1HE      TYR  65  -6.916  -2.489  -1.378
  579    HE2  TYR  65           2HE      TYR  65  -6.934   1.395   0.367
  580    HH   TYR  65           HH       TYR  65  -7.099   0.894  -1.932
  581    H    ASN  66           H        ASN  66  -6.471  -5.005   3.802
  582    HA   ASN  66           HA       ASN  66  -8.227  -5.396   1.667
  583   1HB   ASN  66          2HB       ASN  66  -6.474  -6.934   2.914
  584   2HB   ASN  66          1HB       ASN  66  -7.894  -7.445   3.815
  585   1HD2  ASN  66          1HD2      ASN  66  -6.256  -7.422   0.846
  586   2HD2  ASN  66          2HD2      ASN  66  -7.154  -8.625   0.022
  587    H    ALA  67           H        ALA  67  -8.732  -5.511   5.177
  588    HA   ALA  67           HA       ALA  67 -11.536  -6.093   5.011
  589   1HB   ALA  67          1HB       ALA  67  -9.899  -5.034   7.322
  590   2HB   ALA  67          2HB       ALA  67 -10.207  -6.738   6.979
  591   3HB   ALA  67          3HB       ALA  67 -11.538  -5.673   7.429
  592    H    TRP  68           H        TRP  68  -9.582  -3.243   5.670
  593    HA   TRP  68           HA       TRP  68 -11.554  -1.345   6.139
  594   1HB   TRP  68          2HB       TRP  68  -9.362  -0.727   6.660
  595   2HB   TRP  68          1HB       TRP  68  -8.759  -1.225   5.089
  596    HD1  TRP  68           HD       TRP  68  -8.501   0.598   3.303
  597    HE1  TRP  68           1HE      TRP  68  -9.007   3.107   3.178
  598    HE3  TRP  68           3HE      TRP  68 -11.257   1.103   7.588
  599    HZ2  TRP  68           2HZ      TRP  68 -10.394   5.033   4.643
  600    HZ3  TRP  68           3HZ      TRP  68 -12.142   3.340   8.139
  601    HH2  TRP  68           HH       TRP  68 -11.698   5.268   6.665
  602    H    ASN  69           H        ASN  69 -10.102  -2.272   3.062
  603    HA   ASN  69           HA       ASN  69 -11.377  -0.377   1.460
  604   1HB   ASN  69          2HB       ASN  69  -9.447  -1.759   0.697
  605   2HB   ASN  69          1HB       ASN  69 -10.485  -3.162   0.737
  606   1HD2  ASN  69          1HD2      ASN  69 -11.858  -3.581  -0.929
  607   2HD2  ASN  69          2HD2      ASN  69 -11.915  -2.624  -2.363
  608    H    GLU  70           H        GLU  70 -12.395  -3.521   2.564
  609    HA   GLU  70           HA       GLU  70 -14.758  -3.602   1.000
  610   1HB   GLU  70          2HB       GLU  70 -13.728  -5.620   1.908
  611   2HB   GLU  70          1HB       GLU  70 -14.012  -5.044   3.543
  612   1HG   GLU  70          2HG       GLU  70 -16.407  -5.162   3.172
  613   2HG   GLU  70          1HG       GLU  70 -16.128  -5.721   1.528
  614    H    LYS  71           H        LYS  71 -14.053  -2.711   4.369
  615    HA   LYS  71           HA       LYS  71 -16.715  -2.160   5.106
  616   1HB   LYS  71          2HB       LYS  71 -14.066  -1.639   6.332
  617   2HB   LYS  71          1HB       LYS  71 -15.441  -0.736   6.948
  618   1HG   LYS  71          2HG       LYS  71 -14.982  -2.755   8.228
  619   2HG   LYS  71          1HG       LYS  71 -16.585  -2.744   7.487
  620   1HD   LYS  71          2HD       LYS  71 -15.687  -4.203   5.680
  621   2HD   LYS  71          1HD       LYS  71 -14.159  -4.281   6.558
  622   1HE   LYS  71          2HE       LYS  71 -15.236  -5.315   8.447
  623   2HE   LYS  71          1HE       LYS  71 -16.816  -5.143   7.688
  624   1HZ   LYS  71          1HZ       LYS  71 -14.573  -6.848   6.758
  625   2HZ   LYS  71          2HZ       LYS  71 -16.013  -6.641   5.903
  626   3HZ   LYS  71          3HZ       LYS  71 -16.035  -7.365   7.416
  627    H    ARG  72           H        ARG  72 -14.373  -0.182   3.639
  628    HA   ARG  72           HA       ARG  72 -16.020   2.199   3.984
  629   1HB   ARG  72          2HB       ARG  72 -14.346   3.411   2.726
  630   2HB   ARG  72          1HB       ARG  72 -13.586   2.446   3.983
  631   1HG   ARG  72          2HG       ARG  72 -12.950   0.795   2.331
  632   2HG   ARG  72          1HG       ARG  72 -13.752   1.732   1.071
  633   1HD   ARG  72          2HD       ARG  72 -11.535   2.682   2.812
  634   2HD   ARG  72          1HD       ARG  72 -11.321   2.106   1.144
  635    HE   ARG  72           HE       ARG  72 -13.216   4.245   1.416
  636   1HH1  ARG  72          1HH1      ARG  72  -9.854   3.464   0.884
  637   2HH1  ARG  72          2HH1      ARG  72  -9.365   5.002   0.405
  638   1HH2  ARG  72          1HH2      ARG  72 -12.680   6.353   0.701
  639   2HH2  ARG  72          2HH2      ARG  72 -11.100   6.778   0.263
  640    H    ARG  73           H        ARG  73 -15.823  -0.353   1.780
  641    HA   ARG  73           HA       ARG  73 -16.812   1.197  -0.471
  642   1HB   ARG  73          2HB       ARG  73 -15.108  -0.599  -0.761
  643   2HB   ARG  73          1HB       ARG  73 -16.303  -1.769  -0.245
  644   1HG   ARG  73          2HG       ARG  73 -17.660  -1.286  -2.184
  645   2HG   ARG  73          1HG       ARG  73 -16.524  -0.026  -2.680
  646   1HD   ARG  73          2HD       ARG  73 -14.745  -1.729  -2.806
  647   2HD   ARG  73          1HD       ARG  73 -15.933  -2.966  -2.409
  648    HE   ARG  73           HE       ARG  73 -16.765  -1.472  -4.644
  649   1HH1  ARG  73          1HH1      ARG  73 -14.476  -4.010  -3.703
  650   2HH1  ARG  73          2HH1      ARG  73 -14.326  -4.658  -5.267
  651   1HH2  ARG  73          1HH2      ARG  73 -16.566  -2.323  -6.774
  652   2HH2  ARG  73          2HH2      ARG  73 -15.561  -3.679  -7.069
  653    H    VAL  74           H        VAL  74 -17.841  -1.638   1.422
  654    HA   VAL  74           HA       VAL  74 -20.552  -1.134   0.532
  655    HB   VAL  74           HB       VAL  74 -19.754  -3.488   0.601
  656   1HG1  VAL  74          1HG1      VAL  74 -19.482  -4.669   2.731
  657   2HG1  VAL  74          2HG1      VAL  74 -19.623  -3.130   3.586
  658   3HG1  VAL  74          3HG1      VAL  74 -18.268  -3.411   2.494
  659   1HG2  VAL  74          1HG2      VAL  74 -22.136  -3.091   0.761
  660   2HG2  VAL  74          2HG2      VAL  74 -22.014  -2.917   2.512
  661   3HG2  VAL  74          3HG2      VAL  74 -21.696  -4.480   1.758
  662    H    TYR  75           H        TYR  75 -22.177  -0.608   1.941
  663    HA   TYR  75           HA       TYR  75 -21.217   1.000   4.116
  664   1HB   TYR  75          2HB       TYR  75 -24.003   0.732   2.986
  665   2HB   TYR  75          1HB       TYR  75 -23.509   1.906   4.204
  666    HD1  TYR  75           1HD      TYR  75 -23.483   1.049   0.694
  667    HD2  TYR  75           2HD      TYR  75 -21.937   3.729   3.600
  668    HE1  TYR  75           1HE      TYR  75 -22.788   2.571  -1.101
  669    HE2  TYR  75           2HE      TYR  75 -21.231   5.267   1.812
  670    HH   TYR  75           HH       TYR  75 -20.695   5.196  -0.546
  671    H    GLU  76           H        GLU  76 -20.701  -0.129   5.758
  672    HA   GLU  76           HA       GLU  76 -21.974  -2.432   6.704
  673   1HB   GLU  76          2HB       GLU  76 -20.044  -0.527   7.957
  674   2HB   GLU  76          1HB       GLU  76 -20.677  -1.927   8.815
  675   1HG   GLU  76          2HG       GLU  76 -19.241  -2.047   6.191
  676   2HG   GLU  76          1HG       GLU  76 -18.490  -2.293   7.781
  677    H    GLU  77           H        GLU  77 -23.471  -2.787   8.088
  678    HA   GLU  77           HA       GLU  77 -24.488  -0.701   9.776
  679   1HB   GLU  77          2HB       GLU  77 -25.821  -0.489   7.713
  680   2HB   GLU  77          1HB       GLU  77 -26.242  -2.191   7.812
  681   1HG   GLU  77          2HG       GLU  77 -27.362  -1.753   9.969
  682   2HG   GLU  77          1HG       GLU  77 -26.999  -0.040   9.771
  Start of MODEL   19
    1    H    SER   1           H        SER   1  21.229  -2.539  -3.483
    2    HA   SER   1           HA       SER   1  18.502  -3.098  -2.983
    3   1HB   SER   1          2HB       SER   1  19.795  -0.898  -4.577
    4   2HB   SER   1          1HB       SER   1  18.103  -0.935  -4.077
    5    HG   SER   1           HG       SER   1  19.716  -1.368  -1.976
    6    H    LYS   2           H        LYS   2  17.515  -4.602  -4.135
    7    HA   LYS   2           HA       LYS   2  17.817  -4.797  -7.017
    8   1HB   LYS   2          2HB       LYS   2  15.838  -6.096  -5.099
    9   2HB   LYS   2          1HB       LYS   2  16.014  -6.501  -6.795
   10   1HG   LYS   2          2HG       LYS   2  18.226  -7.369  -6.408
   11   2HG   LYS   2          1HG       LYS   2  18.164  -6.853  -4.720
   12   1HD   LYS   2          2HD       LYS   2  16.325  -8.393  -4.299
   13   2HD   LYS   2          1HD       LYS   2  16.303  -8.861  -5.997
   14   1HE   LYS   2          2HE       LYS   2  17.452 -10.522  -4.614
   15   2HE   LYS   2          1HE       LYS   2  18.540  -9.800  -5.787
   16   1HZ   LYS   2          1HZ       LYS   2  19.449  -8.401  -4.016
   17   2HZ   LYS   2          2HZ       LYS   2  19.561 -10.022  -3.602
   18   3HZ   LYS   2          3HZ       LYS   2  18.364  -9.069  -2.913
   19    H    CYS   3           H        CYS   3  15.207  -4.325  -4.747
   20    HA   CYS   3           HA       CYS   3  14.298  -2.000  -6.208
   21   1HB   CYS   3          2HB       CYS   3  12.547  -4.186  -5.014
   22   2HB   CYS   3          1HB       CYS   3  11.941  -2.677  -5.701
   23    H    LYS   4           H        LYS   4  14.844  -0.471  -4.955
   24    HA   LYS   4           HA       LYS   4  15.756  -0.749  -2.330
   25   1HB   LYS   4          2HB       LYS   4  16.572   0.871  -3.966
   26   2HB   LYS   4          1HB       LYS   4  15.058   1.749  -3.866
   27   1HG   LYS   4          2HG       LYS   4  15.529   2.267  -1.513
   28   2HG   LYS   4          1HG       LYS   4  17.053   1.387  -1.638
   29   1HD   LYS   4          2HD       LYS   4  16.292   3.817  -3.264
   30   2HD   LYS   4          1HD       LYS   4  17.360   3.821  -1.866
   31   1HE   LYS   4          2HE       LYS   4  17.856   2.369  -4.483
   32   2HE   LYS   4          1HE       LYS   4  18.617   3.865  -3.968
   33   1HZ   LYS   4          1HZ       LYS   4  19.602   2.650  -2.090
   34   2HZ   LYS   4          2HZ       LYS   4  20.088   2.037  -3.576
   35   3HZ   LYS   4          3HZ       LYS   4  18.982   1.189  -2.665
   36    H    CYS   5           H        CYS   5  12.591  -0.152  -3.466
   37    HA   CYS   5           HA       CYS   5  11.581   1.199  -1.172
   38   1HB   CYS   5          2HB       CYS   5  10.076  -0.472  -3.195
   39   2HB   CYS   5          1HB       CYS   5   9.355   0.619  -2.024
   40    H    SER   6           H        SER   6  12.431  -0.080   0.604
   41    HA   SER   6           HA       SER   6  11.092  -2.622   0.944
   42   1HB   SER   6          2HB       SER   6  13.515  -2.520   1.531
   43   2HB   SER   6          1HB       SER   6  13.144  -1.334   2.775
   44    HG   SER   6           HG       SER   6  13.310  -3.452   3.607
   45    H    ARG   7           H        ARG   7  11.721   0.001   3.269
   46    HA   ARG   7           HA       ARG   7   8.865   0.419   3.421
   47   1HB   ARG   7          2HB       ARG   7   9.839  -1.079   5.406
   48   2HB   ARG   7          1HB       ARG   7  10.455   0.462   5.987
   49   1HG   ARG   7          2HG       ARG   7   7.542  -0.223   5.507
   50   2HG   ARG   7          1HG       ARG   7   8.335  -0.081   7.066
   51   1HD   ARG   7          2HD       ARG   7   8.641   2.284   6.758
   52   2HD   ARG   7          1HD       ARG   7   8.084   2.186   5.086
   53    HE   ARG   7           HE       ARG   7   6.198   1.292   7.078
   54   1HH1  ARG   7          1HH1      ARG   7   7.345   4.102   5.247
   55   2HH1  ARG   7          2HH1      ARG   7   5.892   4.935   5.246
   56   1HH2  ARG   7          1HH2      ARG   7   4.161   2.382   7.120
   57   2HH2  ARG   7          2HH2      ARG   7   3.947   3.905   6.398
   58    H    LYS   8           H        LYS   8   9.144   2.237   2.303
   59    HA   LYS   8           HA       LYS   8  10.562   4.402   3.596
   60   1HB   LYS   8          2HB       LYS   8  12.171   3.408   1.983
   61   2HB   LYS   8          1HB       LYS   8  10.978   3.545   0.708
   62   1HG   LYS   8          2HG       LYS   8  11.073   5.967   0.854
   63   2HG   LYS   8          1HG       LYS   8  12.221   5.859   2.188
   64   1HD   LYS   8          2HD       LYS   8  13.842   4.775   0.712
   65   2HD   LYS   8          1HD       LYS   8  12.678   4.827  -0.615
   66   1HE   LYS   8          2HE       LYS   8  12.684   7.256  -0.556
   67   2HE   LYS   8          1HE       LYS   8  13.780   7.246   0.820
   68   1HZ   LYS   8          1HZ       LYS   8  14.414   6.207  -1.890
   69   2HZ   LYS   8          2HZ       LYS   8  15.485   6.261  -0.586
   70   3HZ   LYS   8          3HZ       LYS   8  14.929   7.679  -1.274
   71    H    GLY   9           H        GLY   9   9.758   6.451   2.764
   72   1HA   GLY   9          2HA       GLY   9   8.216   7.610   1.336
   73   2HA   GLY   9          1HA       GLY   9   7.193   6.180   1.374
   74    HA   PRO  10           HA       PRO  10   6.549   9.321   5.118
   75   1HB   PRO  10          2HB       PRO  10   4.294  10.223   3.386
   76   2HB   PRO  10          1HB       PRO  10   5.291  11.168   4.501
   77   1HG   PRO  10          2HG       PRO  10   5.671  11.354   1.882
   78   2HG   PRO  10          1HG       PRO  10   7.053  11.321   2.996
   79   1HD   PRO  10          2HD       PRO  10   5.985   9.157   1.236
   80   2HD   PRO  10          1HD       PRO  10   7.668   9.565   1.641
   81    H    LYS  11           H        LYS  11   4.854   8.987   6.591
   82    HA   LYS  11           HA       LYS  11   3.669   6.441   6.476
   83   1HB   LYS  11          2HB       LYS  11   3.097   8.755   8.325
   84   2HB   LYS  11          1HB       LYS  11   2.533   7.108   8.568
   85   1HG   LYS  11          2HG       LYS  11   4.831   6.324   8.743
   86   2HG   LYS  11          1HG       LYS  11   5.418   7.958   8.455
   87   1HD   LYS  11          2HD       LYS  11   4.316   8.728  10.495
   88   2HD   LYS  11          1HD       LYS  11   3.695   7.103  10.779
   89   1HE   LYS  11          2HE       LYS  11   6.607   7.847  10.631
   90   2HE   LYS  11          1HE       LYS  11   5.699   7.645  12.127
   91   1HZ   LYS  11          1HZ       LYS  11   6.240   5.507  10.107
   92   2HZ   LYS  11          2HZ       LYS  11   5.333   5.316  11.517
   93   3HZ   LYS  11          3HZ       LYS  11   6.965   5.683  11.604
   94    H    ILE  12           H        ILE  12   1.619   5.801   6.156
   95    HA   ILE  12           HA       ILE  12  -0.230   7.717   4.850
   96    HB   ILE  12           HB       ILE  12   0.118   4.793   4.116
   97   1HG1  ILE  12          2HG1      ILE  12   1.240   7.185   2.642
   98   2HG1  ILE  12          1HG1      ILE  12   2.202   6.083   3.624
   99   1HG2  ILE  12          1HG2      ILE  12  -1.228   7.103   2.704
  100   2HG2  ILE  12          2HG2      ILE  12  -2.048   5.801   3.567
  101   3HG2  ILE  12          3HG2      ILE  12  -1.122   5.445   2.106
  102   1HD1  ILE  12          1HD1      ILE  12   2.400   5.566   1.269
  103   2HD1  ILE  12          2HD1      ILE  12   0.653   5.380   1.152
  104   3HD1  ILE  12          3HD1      ILE  12   1.595   4.247   2.125
  105    H    ARG  13           H        ARG  13  -2.381   7.444   5.362
  106    HA   ARG  13           HA       ARG  13  -2.962   5.520   7.499
  107   1HB   ARG  13          2HB       ARG  13  -4.634   7.757   6.399
  108   2HB   ARG  13          1HB       ARG  13  -4.937   6.752   7.813
  109   1HG   ARG  13          2HG       ARG  13  -3.178   7.787   9.037
  110   2HG   ARG  13          1HG       ARG  13  -2.596   8.633   7.594
  111   1HD   ARG  13          2HD       ARG  13  -5.262   9.041   8.942
  112   2HD   ARG  13          1HD       ARG  13  -3.886  10.151   9.006
  113    HE   ARG  13           HE       ARG  13  -4.315   9.811   6.352
  114   1HH1  ARG  13          1HH1      ARG  13  -6.431  10.843   8.988
  115   2HH1  ARG  13          2HH1      ARG  13  -7.404  11.826   8.001
  116   1HH2  ARG  13          1HH2      ARG  13  -5.615  11.158   5.007
  117   2HH2  ARG  13          2HH2      ARG  13  -6.932  12.022   5.676
  118    H    TYR  14           H        TYR  14  -5.158   4.482   7.211
  119    HA   TYR  14           HA       TYR  14  -5.240   3.168   4.678
  120   1HB   TYR  14          2HB       TYR  14  -7.388   3.143   6.796
  121   2HB   TYR  14          1HB       TYR  14  -7.084   1.920   5.563
  122    HD1  TYR  14           1HD      TYR  14  -6.416   2.941   8.887
  123    HD2  TYR  14           2HD      TYR  14  -4.785   0.683   5.677
  124    HE1  TYR  14           1HE      TYR  14  -4.914   1.811  10.455
  125    HE2  TYR  14           2HE      TYR  14  -3.296  -0.451   7.231
  126    HH   TYR  14           HH       TYR  14  -2.290  -0.120   9.421
  127    H    SER  15           H        SER  15  -6.880   5.855   6.090
  128    HA   SER  15           HA       SER  15  -9.082   6.066   4.366
  129   1HB   SER  15          2HB       SER  15  -7.608   8.179   5.916
  130   2HB   SER  15          1HB       SER  15  -9.256   8.309   5.288
  131    HG   SER  15           HG       SER  15  -9.946   7.233   6.925
  132    H    ASP  16           H        ASP  16  -5.686   6.924   4.025
  133    HA   ASP  16           HA       ASP  16  -6.151   8.938   1.989
  134   1HB   ASP  16          2HB       ASP  16  -3.547   7.738   2.966
  135   2HB   ASP  16          1HB       ASP  16  -3.683   9.066   1.830
  136    H    VAL  17           H        VAL  17  -5.750   5.602   2.142
  137    HA   VAL  17           HA       VAL  17  -4.472   5.381  -0.463
  138    HB   VAL  17           HB       VAL  17  -5.661   3.153   1.178
  139   1HG1  VAL  17          1HG1      VAL  17  -5.251   2.482  -1.035
  140   2HG1  VAL  17          2HG1      VAL  17  -4.040   1.741   0.002
  141   3HG1  VAL  17          3HG1      VAL  17  -3.623   3.137  -1.010
  142   1HG2  VAL  17          1HG2      VAL  17  -3.424   2.748   2.103
  143   2HG2  VAL  17          2HG2      VAL  17  -4.052   4.324   2.581
  144   3HG2  VAL  17          3HG2      VAL  17  -2.840   4.210   1.310
  145    H    LYS  18           H        LYS  18  -5.560   5.233  -2.317
  146    HA   LYS  18           HA       LYS  18  -8.485   4.819  -2.196
  147   1HB   LYS  18          2HB       LYS  18  -7.030   6.768  -3.453
  148   2HB   LYS  18          1HB       LYS  18  -7.235   5.623  -4.759
  149   1HG   LYS  18          2HG       LYS  18  -9.475   6.899  -3.170
  150   2HG   LYS  18          1HG       LYS  18  -8.971   7.365  -4.785
  151   1HD   LYS  18          2HD       LYS  18 -10.108   4.662  -4.025
  152   2HD   LYS  18          1HD       LYS  18 -11.036   5.978  -4.737
  153   1HE   LYS  18          2HE       LYS  18  -9.569   5.892  -6.722
  154   2HE   LYS  18          1HE       LYS  18  -8.707   4.536  -5.995
  155   1HZ   LYS  18          1HZ       LYS  18 -11.581   4.568  -6.715
  156   2HZ   LYS  18          2HZ       LYS  18 -10.751   3.254  -6.041
  157   3HZ   LYS  18          3HZ       LYS  18 -10.379   3.805  -7.590
  158    H    LYS  19           H        LYS  19  -5.495   3.520  -3.222
  159    HA   LYS  19           HA       LYS  19  -6.708   1.068  -4.124
  160   1HB   LYS  19          2HB       LYS  19  -4.845   2.598  -5.986
  161   2HB   LYS  19          1HB       LYS  19  -5.277   0.922  -6.159
  162   1HG   LYS  19          2HG       LYS  19  -7.585   1.569  -6.549
  163   2HG   LYS  19          1HG       LYS  19  -7.128   3.273  -6.387
  164   1HD   LYS  19          2HD       LYS  19  -5.541   3.021  -8.255
  165   2HD   LYS  19          1HD       LYS  19  -6.018   1.335  -8.431
  166   1HE   LYS  19          2HE       LYS  19  -8.299   2.046  -8.954
  167   2HE   LYS  19          1HE       LYS  19  -7.813   3.728  -8.778
  168   1HZ   LYS  19          1HZ       LYS  19  -6.806   1.821 -10.824
  169   2HZ   LYS  19          2HZ       LYS  19  -6.239   3.400 -10.643
  170   3HZ   LYS  19          3HZ       LYS  19  -7.835   3.108 -11.101
  171    H    LEU  20           H        LEU  20  -5.420  -0.580  -3.708
  172    HA   LEU  20           HA       LEU  20  -2.591  -0.089  -3.161
  173   1HB   LEU  20          2HB       LEU  20  -3.948  -0.272  -1.020
  174   2HB   LEU  20          1HB       LEU  20  -4.457  -1.856  -1.537
  175    HG   LEU  20           HG       LEU  20  -1.591  -1.107  -0.876
  176   1HD1  LEU  20          1HD1      LEU  20  -1.964  -2.320   1.203
  177   2HD1  LEU  20          2HD1      LEU  20  -3.653  -2.560   0.769
  178   3HD1  LEU  20          3HD1      LEU  20  -3.039  -0.936   1.079
  179   1HD2  LEU  20          1HD2      LEU  20  -1.219  -3.536  -0.785
  180   2HD2  LEU  20          2HD2      LEU  20  -1.779  -3.046  -2.384
  181   3HD2  LEU  20          3HD2      LEU  20  -2.896  -3.816  -1.259
  182    H    GLU  21           H        GLU  21  -1.494  -1.415  -4.558
  183    HA   GLU  21           HA       GLU  21  -2.943  -3.794  -5.452
  184   1HB   GLU  21          2HB       GLU  21  -1.451  -1.846  -7.211
  185   2HB   GLU  21          1HB       GLU  21  -2.204  -3.342  -7.743
  186   1HG   GLU  21          2HG       GLU  21  -4.400  -2.435  -7.087
  187   2HG   GLU  21          1HG       GLU  21  -3.612  -0.932  -6.616
  188    H    MET  22           H        MET  22  -1.689  -5.581  -5.393
  189    HA   MET  22           HA       MET  22   1.107  -5.102  -4.949
  190   1HB   MET  22          2HB       MET  22   1.238  -7.516  -4.402
  191   2HB   MET  22          1HB       MET  22   0.132  -6.648  -3.360
  192   1HG   MET  22          2HG       MET  22  -0.667  -8.388  -5.697
  193   2HG   MET  22          1HG       MET  22  -0.658  -8.898  -4.011
  194   1HE   MET  22          1HE       MET  22  -3.166  -9.688  -4.241
  195   2HE   MET  22          2HE       MET  22  -3.186  -9.182  -5.933
  196   3HE   MET  22          3HE       MET  22  -4.476  -8.673  -4.841
  197    H    LYS  23           H        LYS  23   2.275  -4.904  -6.567
  198    HA   LYS  23           HA       LYS  23   2.421  -6.834  -8.654
  199   1HB   LYS  23          2HB       LYS  23   2.182  -5.089 -10.405
  200   2HB   LYS  23          1HB       LYS  23   0.690  -5.424  -9.535
  201   1HG   LYS  23          2HG       LYS  23   1.223  -3.408  -8.098
  202   2HG   LYS  23          1HG       LYS  23   2.502  -3.033  -9.250
  203   1HD   LYS  23          2HD       LYS  23   0.800  -3.024 -11.044
  204   2HD   LYS  23          1HD       LYS  23  -0.391  -3.343  -9.769
  205   1HE   LYS  23          2HE       LYS  23  -0.410  -0.957 -10.320
  206   2HE   LYS  23          1HE       LYS  23   0.174  -1.224  -8.682
  207   1HZ   LYS  23          1HZ       LYS  23   2.486  -0.978  -9.593
  208   2HZ   LYS  23          2HZ       LYS  23   1.543   0.406  -9.803
  209   3HZ   LYS  23          3HZ       LYS  23   1.815  -0.633 -11.075
  210    HA   PRO  24           HA       PRO  24   6.546  -5.515  -7.883
  211   1HB   PRO  24          2HB       PRO  24   7.840  -6.387 -10.090
  212   2HB   PRO  24          1HB       PRO  24   7.248  -7.482  -8.845
  213   1HG   PRO  24          2HG       PRO  24   5.981  -6.778 -11.456
  214   2HG   PRO  24          1HG       PRO  24   6.157  -8.375 -10.707
  215   1HD   PRO  24          2HD       PRO  24   3.835  -6.955 -10.570
  216   2HD   PRO  24          1HD       PRO  24   4.348  -8.025  -9.257
  217    H    LYS  25           H        LYS  25   7.749  -3.725  -8.219
  218    HA   LYS  25           HA       LYS  25   6.664  -1.698  -9.912
  219   1HB   LYS  25          2HB       LYS  25   7.576  -1.194  -7.743
  220   2HB   LYS  25          1HB       LYS  25   9.221  -1.685  -8.224
  221   1HG   LYS  25          2HG       LYS  25   9.117   0.676  -8.204
  222   2HG   LYS  25          1HG       LYS  25   8.979   0.231  -9.912
  223   1HD   LYS  25          2HD       LYS  25   6.525   0.334  -9.674
  224   2HD   LYS  25          1HD       LYS  25   6.729   0.896  -8.038
  225   1HE   LYS  25          2HE       LYS  25   7.935   2.873  -8.757
  226   2HE   LYS  25          1HE       LYS  25   7.835   2.361 -10.442
  227   1HZ   LYS  25          1HZ       LYS  25   5.430   2.600 -10.311
  228   2HZ   LYS  25          2HZ       LYS  25   6.193   4.032  -9.938
  229   3HZ   LYS  25          3HZ       LYS  25   5.498   3.134  -8.716
  230    H    TYR  26           H        TYR  26   9.416  -3.858  -9.940
  231    HA   TYR  26           HA       TYR  26   9.833  -3.341 -12.779
  232   1HB   TYR  26          2HB       TYR  26  12.225  -3.869 -10.942
  233   2HB   TYR  26          1HB       TYR  26  12.176  -3.285 -12.569
  234    HD1  TYR  26           1HD      TYR  26  11.173  -0.888 -12.928
  235    HD2  TYR  26           2HD      TYR  26  12.565  -2.423  -9.211
  236    HE1  TYR  26           1HE      TYR  26  11.477   1.411 -12.099
  237    HE2  TYR  26           2HE      TYR  26  12.849  -0.132  -8.363
  238    HH   TYR  26           HH       TYR  26  13.217   2.084  -9.277
  239    HA   PRO  27           HA       PRO  27   9.779  -7.853 -12.689
  240   1HB   PRO  27          2HB       PRO  27  12.231  -7.953 -14.360
  241   2HB   PRO  27          1HB       PRO  27  10.620  -8.590 -14.701
  242   1HG   PRO  27          2HG       PRO  27  11.528  -6.427 -15.977
  243   2HG   PRO  27          1HG       PRO  27   9.830  -6.560 -15.487
  244   1HD   PRO  27          2HD       PRO  27  12.055  -5.023 -14.201
  245   2HD   PRO  27          1HD       PRO  27  10.367  -4.544 -14.476
  246    H    HIS  28           H        HIS  28  12.614  -6.140 -11.909
  247    HA   HIS  28           HA       HIS  28  13.927  -8.418 -10.677
  248   1HB   HIS  28          2HB       HIS  28  15.786  -6.814 -10.088
  249   2HB   HIS  28          1HB       HIS  28  15.482  -7.029 -11.797
  250    HD1  HIS  28           1HD      HIS  28  15.314  -4.947 -13.111
  251    HD2  HIS  28           2HD      HIS  28  14.611  -4.171  -9.079
  252    HE1  HIS  28           1HE      HIS  28  15.257  -2.455 -12.865
  253    HE2  HIS  28           2HE      HIS  28  15.217  -2.081 -10.403
  254    H    CYS  29           H        CYS  29  11.416  -7.494  -9.531
  255    HA   CYS  29           HA       CYS  29  12.319  -6.695  -6.857
  256   1HB   CYS  29          2HB       CYS  29   9.646  -6.509  -8.225
  257   2HB   CYS  29          1HB       CYS  29   9.847  -6.198  -6.522
  258    H    GLU  30           H        GLU  30  11.409  -7.848  -5.030
  259    HA   GLU  30           HA       GLU  30  11.121 -10.666  -5.548
  260   1HB   GLU  30          2HB       GLU  30  11.066  -9.121  -2.951
  261   2HB   GLU  30          1HB       GLU  30  11.327 -10.845  -3.149
  262   1HG   GLU  30          2HG       GLU  30  13.361 -10.347  -4.296
  263   2HG   GLU  30          1HG       GLU  30  13.056  -8.632  -4.007
  264    H    GLU  31           H        GLU  31   9.167 -11.688  -5.563
  265    HA   GLU  31           HA       GLU  31   6.916 -12.132  -5.356
  266   1HB   GLU  31          2HB       GLU  31   7.773 -11.772  -2.908
  267   2HB   GLU  31          1HB       GLU  31   6.989 -10.212  -3.012
  268   1HG   GLU  31          2HG       GLU  31   4.819 -11.355  -3.314
  269   2HG   GLU  31          1HG       GLU  31   5.652 -12.905  -3.223
  270    H    LYS  32           H        LYS  32   4.759 -10.439  -4.652
  271    HA   LYS  32           HA       LYS  32   4.967  -8.421  -6.744
  272   1HB   LYS  32          2HB       LYS  32   2.542  -9.149  -5.107
  273   2HB   LYS  32          1HB       LYS  32   2.586  -8.176  -6.567
  274   1HG   LYS  32          2HG       LYS  32   3.274 -11.042  -6.341
  275   2HG   LYS  32          1HG       LYS  32   1.741 -10.387  -7.003
  276   1HD   LYS  32          2HD       LYS  32   3.092  -9.322  -8.751
  277   2HD   LYS  32          1HD       LYS  32   4.539 -10.116  -8.098
  278   1HE   LYS  32          2HE       LYS  32   2.083 -11.454  -9.254
  279   2HE   LYS  32          1HE       LYS  32   3.677 -11.367  -9.997
  280   1HZ   LYS  32          1HZ       LYS  32   4.542 -12.733  -8.152
  281   2HZ   LYS  32          2HZ       LYS  32   3.289 -13.512  -8.963
  282   3HZ   LYS  32          3HZ       LYS  32   2.995 -12.806  -7.484
  283    H    MET  33           H        MET  33   5.577  -6.568  -6.219
  284    HA   MET  33           HA       MET  33   5.985  -5.611  -3.606
  285   1HB   MET  33          2HB       MET  33   5.903  -4.114  -6.200
  286   2HB   MET  33          1HB       MET  33   6.517  -3.464  -4.702
  287   1HG   MET  33          2HG       MET  33   7.642  -5.863  -6.130
  288   2HG   MET  33          1HG       MET  33   8.313  -4.234  -6.196
  289   1HE   MET  33          1HE       MET  33   9.229  -2.997  -4.097
  290   2HE   MET  33          2HE       MET  33   9.348  -3.707  -2.473
  291   3HE   MET  33          3HE       MET  33   7.759  -3.403  -3.204
  292    H    VAL  34           H        VAL  34   5.032  -3.745  -2.622
  293    HA   VAL  34           HA       VAL  34   2.174  -3.684  -3.096
  294    HB   VAL  34           HB       VAL  34   3.820  -2.634  -0.796
  295   1HG1  VAL  34          1HG1      VAL  34   1.807  -1.309  -1.223
  296   2HG1  VAL  34          2HG1      VAL  34   1.698  -2.191   0.289
  297   3HG1  VAL  34          3HG1      VAL  34   0.822  -2.769  -1.137
  298   1HG2  VAL  34          1HG2      VAL  34   2.770  -4.451   0.480
  299   2HG2  VAL  34          2HG2      VAL  34   3.724  -5.072  -0.869
  300   3HG2  VAL  34          3HG2      VAL  34   1.964  -5.010  -0.986
  301    H    ILE  35           H        ILE  35   1.391  -2.126  -4.263
  302    HA   ILE  35           HA       ILE  35   2.824   0.420  -4.391
  303    HB   ILE  35           HB       ILE  35   0.702  -0.678  -6.242
  304   1HG1  ILE  35          2HG1      ILE  35   2.679  -2.039  -6.352
  305   2HG1  ILE  35          1HG1      ILE  35   2.491  -1.115  -7.835
  306   1HG2  ILE  35          1HG2      ILE  35   1.418   1.128  -7.732
  307   2HG2  ILE  35          2HG2      ILE  35   2.560   1.672  -6.494
  308   3HG2  ILE  35          3HG2      ILE  35   0.818   1.736  -6.187
  309   1HD1  ILE  35          1HD1      ILE  35   4.231   0.462  -7.037
  310   2HD1  ILE  35          2HD1      ILE  35   4.838  -1.186  -7.174
  311   3HD1  ILE  35          3HD1      ILE  35   4.438  -0.525  -5.589
  312    H    ILE  36           H        ILE  36   1.939   1.854  -3.082
  313    HA   ILE  36           HA       ILE  36  -0.929   1.638  -2.523
  314    HB   ILE  36           HB       ILE  36   1.224   3.029  -0.937
  315   1HG1  ILE  36          2HG1      ILE  36  -0.507   0.619  -0.413
  316   2HG1  ILE  36          1HG1      ILE  36   1.237   0.645  -0.665
  317   1HG2  ILE  36          1HG2      ILE  36  -0.846   4.350  -0.861
  318   2HG2  ILE  36          2HG2      ILE  36  -0.525   3.574   0.693
  319   3HG2  ILE  36          3HG2      ILE  36  -1.743   2.903  -0.386
  320   1HD1  ILE  36          1HD1      ILE  36   0.596   0.375   1.682
  321   2HD1  ILE  36          2HD1      ILE  36  -0.236   1.939   1.539
  322   3HD1  ILE  36          3HD1      ILE  36   1.517   1.878   1.386
  323    H    THR  37           H        THR  37  -2.180   2.923  -3.397
  324    HA   THR  37           HA       THR  37  -1.151   5.348  -4.724
  325    HB   THR  37           HB       THR  37  -3.745   3.903  -5.180
  326    HG1  THR  37           1HG      THR  37  -1.347   3.050  -5.678
  327   1HG2  THR  37          1HG2      THR  37  -2.204   5.882  -6.880
  328   2HG2  THR  37          2HG2      THR  37  -3.691   6.217  -5.990
  329   3HG2  THR  37          3HG2      THR  37  -3.713   5.092  -7.347
  330    H    THR  38           H        THR  38  -1.869   7.295  -3.950
  331    HA   THR  38           HA       THR  38  -3.796   7.158  -1.800
  332    HB   THR  38           HB       THR  38  -3.074   9.560  -1.354
  333    HG1  THR  38           1HG      THR  38  -0.931   8.930  -3.149
  334   1HG2  THR  38          1HG2      THR  38  -0.938   8.912  -0.346
  335   2HG2  THR  38          2HG2      THR  38  -0.909   7.461  -1.332
  336   3HG2  THR  38          3HG2      THR  38  -2.153   7.654  -0.086
  337    H    LYS  39           H        LYS  39  -5.431   8.872  -1.634
  338    HA   LYS  39           HA       LYS  39  -7.118   8.834  -3.942
  339   1HB   LYS  39          2HB       LYS  39  -8.041   8.659  -1.681
  340   2HB   LYS  39          1HB       LYS  39  -7.462  10.269  -1.294
  341   1HG   LYS  39          2HG       LYS  39  -8.974  11.176  -3.063
  342   2HG   LYS  39          1HG       LYS  39  -9.608   9.554  -3.295
  343   1HD   LYS  39          2HD       LYS  39  -9.713  11.100  -0.699
  344   2HD   LYS  39          1HD       LYS  39 -11.032  11.003  -1.857
  345   1HE   LYS  39          2HE       LYS  39 -11.114   8.566  -1.527
  346   2HE   LYS  39          1HE       LYS  39  -9.808   8.689  -0.350
  347   1HZ   LYS  39          1HZ       LYS  39 -12.024   8.617   0.712
  348   2HZ   LYS  39          2HZ       LYS  39 -12.447  10.031  -0.085
  349   3HZ   LYS  39          3HZ       LYS  39 -11.211  10.056   1.038
  350    H    SER  40           H        SER  40  -4.694  10.939  -3.132
  351    HA   SER  40           HA       SER  40  -3.979  12.962  -3.770
  352   1HB   SER  40          2HB       SER  40  -6.639  13.326  -5.243
  353   2HB   SER  40          1HB       SER  40  -5.332  14.511  -5.261
  354    HG   SER  40           HG       SER  40  -4.056  13.082  -6.380
  355    H    VAL  41           H        VAL  41  -5.142  15.508  -3.505
  356    HA   VAL  41           HA       VAL  41  -5.439  16.958  -1.870
  357    HB   VAL  41           HB       VAL  41  -7.374  16.935  -0.470
  358   1HG1  VAL  41          1HG1      VAL  41  -7.924  17.330  -2.707
  359   2HG1  VAL  41          2HG1      VAL  41  -9.232  16.413  -1.959
  360   3HG1  VAL  41          3HG1      VAL  41  -8.093  15.608  -3.038
  361   1HG2  VAL  41          1HG2      VAL  41  -8.849  14.989  -0.062
  362   2HG2  VAL  41          2HG2      VAL  41  -7.226  14.735   0.585
  363   3HG2  VAL  41          3HG2      VAL  41  -7.703  13.960  -0.924
  364    H    SER  42           H        SER  42  -3.752  14.653  -1.575
  365    HA   SER  42           HA       SER  42  -3.147  14.718   1.274
  366   1HB   SER  42          2HB       SER  42  -2.003  12.513   0.717
  367   2HB   SER  42          1HB       SER  42  -3.765  12.499   0.610
  368    HG   SER  42           HG       SER  42  -3.615  12.039  -1.332
  369    H    ARG  43           H        ARG  43  -0.632  14.207   1.453
  370    HA   ARG  43           HA       ARG  43   0.612  16.435   0.277
  371   1HB   ARG  43          2HB       ARG  43   1.824  14.142   1.798
  372   2HB   ARG  43          1HB       ARG  43   2.717  15.560   1.290
  373   1HG   ARG  43          2HG       ARG  43   0.381  15.518   3.192
  374   2HG   ARG  43          1HG       ARG  43   2.078  15.697   3.643
  375   1HD   ARG  43          2HD       ARG  43   1.161  17.900   3.680
  376   2HD   ARG  43          1HD       ARG  43   2.085  17.795   2.189
  377    HE   ARG  43           HE       ARG  43  -0.812  17.339   2.196
  378   1HH1  ARG  43          1HH1      ARG  43   1.943  19.198   0.983
  379   2HH1  ARG  43          2HH1      ARG  43   1.003  20.109  -0.109
  380   1HH2  ARG  43          1HH2      ARG  43  -2.051  18.557   0.716
  381   2HH2  ARG  43          2HH2      ARG  43  -1.318  19.723  -0.300
  382    H    TYR  44           H        TYR  44   0.831  12.965  -0.529
  383    HA   TYR  44           HA       TYR  44   2.781  13.614  -2.497
  384   1HB   TYR  44          2HB       TYR  44   2.724  11.527  -1.027
  385   2HB   TYR  44          1HB       TYR  44   1.455  10.947  -2.098
  386    HD1  TYR  44           1HD      TYR  44   4.537  12.788  -2.726
  387    HD2  TYR  44           2HD      TYR  44   2.365   9.256  -3.353
  388    HE1  TYR  44           1HE      TYR  44   6.350  11.984  -4.255
  389    HE2  TYR  44           2HE      TYR  44   4.127   8.399  -4.881
  390    HH   TYR  44           HH       TYR  44   7.178   9.815  -5.085
  391    H    ARG  45           H        ARG  45  -0.375  14.101  -2.437
  392    HA   ARG  45           HA       ARG  45  -1.892  14.793  -3.953
  393   1HB   ARG  45          2HB       ARG  45   0.456  14.751  -5.825
  394   2HB   ARG  45          1HB       ARG  45  -1.102  15.473  -6.197
  395   1HG   ARG  45          2HG       ARG  45  -0.823  17.012  -4.302
  396   2HG   ARG  45          1HG       ARG  45   0.752  16.292  -3.972
  397   1HD   ARG  45          2HD       ARG  45   1.519  16.966  -6.188
  398   2HD   ARG  45          1HD       ARG  45  -0.057  17.684  -6.517
  399    HE   ARG  45           HE       ARG  45   1.055  18.722  -4.146
  400   1HH1  ARG  45          1HH1      ARG  45   1.365  18.938  -7.661
  401   2HH1  ARG  45          2HH1      ARG  45   1.985  20.539  -7.649
  402   1HH2  ARG  45          1HH2      ARG  45   1.937  20.922  -4.139
  403   2HH2  ARG  45          2HH2      ARG  45   2.300  21.668  -5.636
  404    H    GLY  46           H        GLY  46  -1.382  11.764  -3.789
  405   1HA   GLY  46          2HA       GLY  46  -3.016  10.238  -4.627
  406   2HA   GLY  46          1HA       GLY  46  -3.167  11.233  -6.066
  407    H    GLN  47           H        GLN  47  -0.018  11.040  -5.478
  408    HA   GLN  47           HA       GLN  47   0.435   9.107  -7.525
  409   1HB   GLN  47          2HB       GLN  47   2.405  10.562  -5.759
  410   2HB   GLN  47          1HB       GLN  47   2.821   9.603  -7.169
  411   1HG   GLN  47          2HG       GLN  47   1.589  11.143  -8.588
  412   2HG   GLN  47          1HG       GLN  47   1.145  12.094  -7.172
  413   1HE2  GLN  47          1HE2      GLN  47   2.711  13.277  -6.134
  414   2HE2  GLN  47          2HE2      GLN  47   4.207  13.713  -6.888
  415    H    GLU  48           H        GLU  48   1.955   7.265  -7.204
  416    HA   GLU  48           HA       GLU  48   1.007   5.956  -4.867
  417   1HB   GLU  48          2HB       GLU  48   1.813   3.859  -5.995
  418   2HB   GLU  48          1HB       GLU  48   0.408   4.686  -6.624
  419   1HG   GLU  48          2HG       GLU  48   1.668   3.857  -8.292
  420   2HG   GLU  48          1HG       GLU  48   1.780   5.608  -8.426
  421    H    HIS  49           H        HIS  49   2.105   4.802  -3.481
  422    HA   HIS  49           HA       HIS  49   4.940   5.516  -3.087
  423   1HB   HIS  49          2HB       HIS  49   2.896   4.525  -1.070
  424   2HB   HIS  49          1HB       HIS  49   4.553   4.951  -0.706
  425    HD1  HIS  49           1HD      HIS  49   5.057   7.454  -0.342
  426    HD2  HIS  49           2HD      HIS  49   1.143   6.717  -1.517
  427    HE1  HIS  49           1HE      HIS  49   3.797   9.542   0.197
  428    HE2  HIS  49           2HE      HIS  49   1.416   9.024  -0.326
  429    H    CYS  50           H        CYS  50   6.288   3.735  -2.174
  430    HA   CYS  50           HA       CYS  50   5.302   1.159  -3.180
  431   1HB   CYS  50          2HB       CYS  50   7.655   0.696  -3.920
  432   2HB   CYS  50          1HB       CYS  50   6.798   1.953  -4.807
  433    H    LEU  51           H        LEU  51   5.355  -0.500  -1.868
  434    HA   LEU  51           HA       LEU  51   7.216  -0.504   0.370
  435   1HB   LEU  51          2HB       LEU  51   4.280  -1.094   0.488
  436   2HB   LEU  51          1HB       LEU  51   5.400  -1.697   1.699
  437    HG   LEU  51           HG       LEU  51   5.075   1.174   1.006
  438   1HD1  LEU  51          1HD1      LEU  51   3.744   1.328   3.124
  439   2HD1  LEU  51          2HD1      LEU  51   3.897  -0.414   3.326
  440   3HD1  LEU  51          3HD1      LEU  51   2.963   0.237   1.978
  441   1HD2  LEU  51          1HD2      LEU  51   7.192   0.667   2.037
  442   2HD2  LEU  51          2HD2      LEU  51   6.368  -0.202   3.341
  443   3HD2  LEU  51          3HD2      LEU  51   6.177   1.542   3.181
  444    H    HIS  52           H        HIS  52   7.935  -2.303   1.048
  445    HA   HIS  52           HA       HIS  52   7.963  -4.499  -0.902
  446   1HB   HIS  52          2HB       HIS  52  10.007  -3.496  -0.193
  447   2HB   HIS  52          1HB       HIS  52   9.715  -3.928   1.506
  448    HD1  HIS  52           1HD      HIS  52  11.040  -5.965   2.172
  449    HD2  HIS  52           2HD      HIS  52  10.388  -5.805  -1.940
  450    HE1  HIS  52           1HE      HIS  52  12.250  -7.892   1.217
  451    HE2  HIS  52           2HE      HIS  52  12.198  -7.585  -1.198
  452    HA   PRO  53           HA       PRO  53   4.892  -6.481   1.660
  453   1HB   PRO  53          2HB       PRO  53   4.653  -8.747   0.244
  454   2HB   PRO  53          1HB       PRO  53   4.039  -7.194  -0.340
  455   1HG   PRO  53          2HG       PRO  53   6.638  -8.549  -0.994
  456   2HG   PRO  53          1HG       PRO  53   5.446  -7.845  -2.104
  457   1HD   PRO  53          2HD       PRO  53   7.637  -6.507  -1.401
  458   2HD   PRO  53          1HD       PRO  53   6.083  -5.670  -1.599
  459    H    LYS  54           H        LYS  54   8.094  -7.542   1.408
  460    HA   LYS  54           HA       LYS  54   7.828 -10.071   2.524
  461   1HB   LYS  54          2HB       LYS  54  10.183  -8.244   2.392
  462   2HB   LYS  54          1HB       LYS  54  10.255  -9.928   2.918
  463   1HG   LYS  54          2HG       LYS  54   9.233  -9.017   0.252
  464   2HG   LYS  54          1HG       LYS  54  10.864  -9.594   0.587
  465   1HD   LYS  54          2HD       LYS  54  10.102 -11.681   1.193
  466   2HD   LYS  54          1HD       LYS  54   8.390 -11.223   1.121
  467   1HE   LYS  54          2HE       LYS  54   8.616 -10.727  -1.144
  468   2HE   LYS  54          1HE       LYS  54  10.316 -11.215  -1.205
  469   1HZ   LYS  54          1HZ       LYS  54   9.459 -13.491  -0.464
  470   2HZ   LYS  54          2HZ       LYS  54   9.008 -13.034  -2.012
  471   3HZ   LYS  54          3HZ       LYS  54   7.896 -12.901  -0.753
  472    H    LEU  55           H        LEU  55   7.557  -6.993   3.862
  473    HA   LEU  55           HA       LEU  55   8.515  -7.668   6.548
  474   1HB   LEU  55          2HB       LEU  55   7.464  -5.085   5.394
  475   2HB   LEU  55          1HB       LEU  55   8.045  -5.278   7.034
  476    HG   LEU  55           HG       LEU  55   9.718  -5.579   4.534
  477   1HD1  LEU  55          1HD1      LEU  55  10.778  -3.507   5.271
  478   2HD1  LEU  55          2HD1      LEU  55   9.632  -3.397   6.607
  479   3HD1  LEU  55          3HD1      LEU  55   9.061  -3.275   4.941
  480   1HD2  LEU  55          1HD2      LEU  55  10.485  -5.652   7.454
  481   2HD2  LEU  55          2HD2      LEU  55  11.608  -5.641   6.099
  482   3HD2  LEU  55          3HD2      LEU  55  10.526  -7.013   6.330
  483    H    GLN  56           H        GLN  56   7.171  -8.088   8.197
  484    HA   GLN  56           HA       GLN  56   4.449  -8.665   7.598
  485   1HB   GLN  56          2HB       GLN  56   4.259  -9.352   9.961
  486   2HB   GLN  56          1HB       GLN  56   5.617 -10.089   9.131
  487   1HG   GLN  56          2HG       GLN  56   7.114  -8.439  10.181
  488   2HG   GLN  56          1HG       GLN  56   5.729  -7.787  11.055
  489   1HE2  GLN  56          1HE2      GLN  56   7.830 -10.470  10.667
  490   2HE2  GLN  56          2HE2      GLN  56   7.471 -11.252  12.157
  491    H    SER  57           H        SER  57   6.018  -5.948   9.132
  492    HA   SER  57           HA       SER  57   3.651  -4.892  10.258
  493   1HB   SER  57          2HB       SER  57   5.024  -2.758  10.308
  494   2HB   SER  57          1HB       SER  57   5.766  -4.141  11.118
  495    HG   SER  57           HG       SER  57   6.927  -2.706   9.439
  496    H    THR  58           H        THR  58   5.246  -4.589   7.151
  497    HA   THR  58           HA       THR  58   3.454  -2.782   5.914
  498    HB   THR  58           HB       THR  58   5.014  -5.095   4.712
  499    HG1  THR  58           1HG      THR  58   6.489  -3.264   4.206
  500   1HG2  THR  58          1HG2      THR  58   3.308  -4.186   3.194
  501   2HG2  THR  58          2HG2      THR  58   4.927  -3.772   2.631
  502   3HG2  THR  58          3HG2      THR  58   3.941  -2.559   3.447
  503    H    LYS  59           H        LYS  59   3.531  -6.337   6.104
  504    HA   LYS  59           HA       LYS  59   1.272  -6.881   4.601
  505   1HB   LYS  59          2HB       LYS  59   2.228  -8.376   6.993
  506   2HB   LYS  59          1HB       LYS  59   1.060  -8.961   5.821
  507   1HG   LYS  59          2HG       LYS  59   2.801  -8.716   4.069
  508   2HG   LYS  59          1HG       LYS  59   3.959  -8.346   5.356
  509   1HD   LYS  59          2HD       LYS  59   3.197 -10.323   6.461
  510   2HD   LYS  59          1HD       LYS  59   2.327 -10.832   5.025
  511   1HE   LYS  59          2HE       LYS  59   4.488 -11.948   4.824
  512   2HE   LYS  59          1HE       LYS  59   4.502 -10.545   3.746
  513   1HZ   LYS  59          1HZ       LYS  59   5.744  -9.313   5.313
  514   2HZ   LYS  59          2HZ       LYS  59   6.535 -10.777   5.025
  515   3HZ   LYS  59          3HZ       LYS  59   5.681 -10.587   6.447
  516    H    ARG  60           H        ARG  60   1.500  -6.007   8.050
  517    HA   ARG  60           HA       ARG  60  -1.104  -6.563   8.734
  518   1HB   ARG  60          2HB       ARG  60   0.794  -5.951  10.320
  519   2HB   ARG  60          1HB       ARG  60   0.527  -4.281   9.798
  520   1HG   ARG  60          2HG       ARG  60  -0.512  -4.696  11.879
  521   2HG   ARG  60          1HG       ARG  60  -1.711  -4.352  10.611
  522   1HD   ARG  60          2HD       ARG  60  -2.084  -6.785  10.358
  523   2HD   ARG  60          1HD       ARG  60  -0.928  -7.059  11.664
  524    HE   ARG  60           HE       ARG  60  -2.813  -5.426  12.741
  525   1HH1  ARG  60          1HH1      ARG  60  -2.885  -8.582  11.136
  526   2HH1  ARG  60          2HH1      ARG  60  -4.270  -9.134  11.964
  527   1HH2  ARG  60          1HH2      ARG  60  -4.756  -6.198  13.879
  528   2HH2  ARG  60          2HH2      ARG  60  -5.333  -7.767  13.551
  529    H    PHE  61           H        PHE  61   0.392  -3.538   7.630
  530    HA   PHE  61           HA       PHE  61  -1.910  -1.916   7.633
  531   1HB   PHE  61          2HB       PHE  61   0.516  -1.160   7.388
  532   2HB   PHE  61          1HB       PHE  61   0.388  -1.780   5.742
  533    HD1  PHE  61           1HD      PHE  61  -0.719  -0.491   3.990
  534    HD2  PHE  61           2HD      PHE  61  -0.754   0.930   8.012
  535    HE1  PHE  61           1HE      PHE  61  -1.519   1.712   3.213
  536    HE2  PHE  61           2HE      PHE  61  -1.571   3.165   7.193
  537    HZ   PHE  61           HZ       PHE  61  -1.924   3.531   4.835
  538    H    ILE  62           H        ILE  62  -0.442  -3.983   5.211
  539    HA   ILE  62           HA       ILE  62  -2.155  -3.340   3.059
  540    HB   ILE  62           HB       ILE  62  -0.813  -6.011   3.516
  541   1HG1  ILE  62          2HG1      ILE  62   0.908  -4.385   3.650
  542   2HG1  ILE  62          1HG1      ILE  62   0.977  -5.044   2.023
  543   1HG2  ILE  62          1HG2      ILE  62  -2.501  -6.056   1.815
  544   2HG2  ILE  62          2HG2      ILE  62  -0.899  -6.219   1.079
  545   3HG2  ILE  62          3HG2      ILE  62  -1.772  -4.674   0.999
  546   1HD1  ILE  62          1HD1      ILE  62  -0.326  -2.447   2.780
  547   2HD1  ILE  62          2HD1      ILE  62  -0.098  -3.089   1.148
  548   3HD1  ILE  62          3HD1      ILE  62   1.304  -2.631   2.117
  549    H    LYS  63           H        LYS  63  -2.296  -6.008   5.327
  550    HA   LYS  63           HA       LYS  63  -4.788  -7.064   4.347
  551   1HB   LYS  63          2HB       LYS  63  -3.233  -7.482   6.872
  552   2HB   LYS  63          1HB       LYS  63  -4.910  -7.958   6.856
  553   1HG   LYS  63          2HG       LYS  63  -3.393  -9.851   6.464
  554   2HG   LYS  63          1HG       LYS  63  -4.470  -9.594   5.112
  555   1HD   LYS  63          2HD       LYS  63  -1.633  -8.564   5.148
  556   2HD   LYS  63          1HD       LYS  63  -2.025 -10.196   4.622
  557   1HE   LYS  63          2HE       LYS  63  -3.032  -7.622   3.402
  558   2HE   LYS  63          1HE       LYS  63  -1.811  -8.691   2.724
  559   1HZ   LYS  63          1HZ       LYS  63  -4.685  -9.400   3.140
  560   2HZ   LYS  63          2HZ       LYS  63  -3.498 -10.434   2.557
  561   3HZ   LYS  63          3HZ       LYS  63  -3.935  -9.079   1.671
  562    H    TRP  64           H        TRP  64  -3.941  -4.711   6.675
  563    HA   TRP  64           HA       TRP  64  -6.443  -4.371   7.920
  564   1HB   TRP  64          2HB       TRP  64  -3.896  -3.403   8.262
  565   2HB   TRP  64          1HB       TRP  64  -4.758  -1.997   7.661
  566    HD1  TRP  64           HD       TRP  64  -4.064  -3.901  10.723
  567    HE1  TRP  64           1HE      TRP  64  -5.520  -3.017  12.688
  568    HE3  TRP  64           3HE      TRP  64  -7.334  -0.986   8.085
  569    HZ2  TRP  64           2HZ      TRP  64  -7.737  -1.306  13.040
  570    HZ3  TRP  64           3HZ      TRP  64  -9.078   0.242   9.300
  571    HH2  TRP  64           HH       TRP  64  -9.276   0.091  11.714
  572    H    TYR  65           H        TYR  65  -4.792  -2.647   5.221
  573    HA   TYR  65           HA       TYR  65  -6.916  -0.899   4.724
  574   1HB   TYR  65          2HB       TYR  65  -4.735  -0.379   3.768
  575   2HB   TYR  65          1HB       TYR  65  -4.791  -1.834   2.775
  576    HD1  TYR  65           1HD      TYR  65  -5.753  -1.756   0.603
  577    HD2  TYR  65           2HD      TYR  65  -6.617   1.351   3.373
  578    HE1  TYR  65           1HE      TYR  65  -6.990  -0.523  -1.158
  579    HE2  TYR  65           2HE      TYR  65  -7.841   2.568   1.618
  580    HH   TYR  65           HH       TYR  65  -7.930   2.701  -0.792
  581    H    ASN  66           H        ASN  66  -6.207  -4.073   3.435
  582    HA   ASN  66           HA       ASN  66  -8.349  -3.961   1.598
  583   1HB   ASN  66          2HB       ASN  66  -6.788  -6.319   2.632
  584   2HB   ASN  66          1HB       ASN  66  -8.156  -6.521   1.541
  585   1HD2  ASN  66          1HD2      ASN  66  -4.866  -5.351   1.840
  586   2HD2  ASN  66          2HD2      ASN  66  -4.592  -5.208   0.142
  587    H    ALA  67           H        ALA  67  -8.197  -5.106   4.912
  588    HA   ALA  67           HA       ALA  67 -10.842  -6.098   5.033
  589   1HB   ALA  67          1HB       ALA  67  -9.131  -4.878   7.212
  590   2HB   ALA  67          2HB       ALA  67  -9.168  -6.580   6.766
  591   3HB   ALA  67          3HB       ALA  67 -10.594  -5.825   7.483
  592    H    TRP  68           H        TRP  68  -9.431  -2.992   5.887
  593    HA   TRP  68           HA       TRP  68 -11.710  -1.530   6.475
  594   1HB   TRP  68          2HB       TRP  68  -9.780  -0.451   7.077
  595   2HB   TRP  68          1HB       TRP  68  -8.920  -0.972   5.650
  596    HD1  TRP  68           HD       TRP  68  -8.665   0.701   3.753
  597    HE1  TRP  68           1HE      TRP  68  -9.308   3.148   3.389
  598    HE3  TRP  68           3HE      TRP  68 -11.896   1.298   7.674
  599    HZ2  TRP  68           2HZ      TRP  68 -10.944   5.064   4.545
  600    HZ3  TRP  68           3HZ      TRP  68 -12.962   3.506   7.955
  601    HH2  TRP  68           HH       TRP  68 -12.454   5.365   6.370
  602    H    ASN  69           H        ASN  69 -10.176  -2.137   3.389
  603    HA   ASN  69           HA       ASN  69 -11.708  -0.472   1.752
  604   1HB   ASN  69          2HB       ASN  69  -9.665  -1.578   0.966
  605   2HB   ASN  69          1HB       ASN  69 -10.452  -3.145   1.095
  606   1HD2  ASN  69          1HD2      ASN  69 -10.120  -3.602  -1.056
  607   2HD2  ASN  69          2HD2      ASN  69 -10.988  -2.837  -2.329
  608    H    GLU  70           H        GLU  70 -12.303  -3.761   2.863
  609    HA   GLU  70           HA       GLU  70 -14.643  -4.127   1.320
  610   1HB   GLU  70          2HB       GLU  70 -13.744  -5.503   3.842
  611   2HB   GLU  70          1HB       GLU  70 -15.093  -6.018   2.842
  612   1HG   GLU  70          2HG       GLU  70 -13.549  -6.343   0.960
  613   2HG   GLU  70          1HG       GLU  70 -12.210  -5.880   2.011
  614    H    LYS  71           H        LYS  71 -14.059  -2.923   4.583
  615    HA   LYS  71           HA       LYS  71 -16.772  -2.746   5.382
  616   1HB   LYS  71          2HB       LYS  71 -14.764  -2.790   6.890
  617   2HB   LYS  71          1HB       LYS  71 -14.347  -1.197   6.303
  618   1HG   LYS  71          2HG       LYS  71 -15.388  -0.995   8.433
  619   2HG   LYS  71          1HG       LYS  71 -16.451  -0.324   7.185
  620   1HD   LYS  71          2HD       LYS  71 -17.757  -1.635   8.772
  621   2HD   LYS  71          1HD       LYS  71 -17.757  -2.428   7.201
  622   1HE   LYS  71          2HE       LYS  71 -15.941  -3.937   7.997
  623   2HE   LYS  71          1HE       LYS  71 -16.021  -3.145   9.569
  624   1HZ   LYS  71          1HZ       LYS  71 -17.225  -5.226   9.531
  625   2HZ   LYS  71          2HZ       LYS  71 -18.206  -4.678   8.285
  626   3HZ   LYS  71          3HZ       LYS  71 -18.277  -3.961   9.816
  627    H    ARG  72           H        ARG  72 -14.515  -0.707   3.708
  628    HA   ARG  72           HA       ARG  72 -15.926   1.741   3.737
  629   1HB   ARG  72          2HB       ARG  72 -13.445   1.143   3.485
  630   2HB   ARG  72          1HB       ARG  72 -13.839   0.756   1.828
  631   1HG   ARG  72          2HG       ARG  72 -14.541   3.061   1.483
  632   2HG   ARG  72          1HG       ARG  72 -14.114   3.388   3.179
  633   1HD   ARG  72          2HD       ARG  72 -11.835   2.538   2.718
  634   2HD   ARG  72          1HD       ARG  72 -12.243   2.464   1.008
  635    HE   ARG  72           HE       ARG  72 -12.734   5.033   2.032
  636   1HH1  ARG  72          1HH1      ARG  72 -10.120   2.886   1.036
  637   2HH1  ARG  72          2HH1      ARG  72  -8.971   4.126   0.804
  638   1HH2  ARG  72          1HH2      ARG  72 -11.164   6.724   1.773
  639   2HH2  ARG  72          2HH2      ARG  72  -9.569   6.401   1.276
  640    H    ARG  73           H        ARG  73 -15.895  -1.154   1.839
  641    HA   ARG  73           HA       ARG  73 -17.261   0.016  -0.413
  642   1HB   ARG  73          2HB       ARG  73 -15.552  -1.704  -0.786
  643   2HB   ARG  73          1HB       ARG  73 -16.489  -2.852   0.153
  644   1HG   ARG  73          2HG       ARG  73 -18.235  -2.852  -1.513
  645   2HG   ARG  73          1HG       ARG  73 -17.403  -1.592  -2.429
  646   1HD   ARG  73          2HD       ARG  73 -16.994  -3.769  -3.428
  647   2HD   ARG  73          1HD       ARG  73 -15.504  -3.106  -2.765
  648    HE   ARG  73           HE       ARG  73 -17.042  -4.995  -1.136
  649   1HH1  ARG  73          1HH1      ARG  73 -14.141  -4.361  -3.064
  650   2HH1  ARG  73          2HH1      ARG  73 -13.316  -5.759  -2.550
  651   1HH2  ARG  73          1HH2      ARG  73 -15.940  -6.907  -0.453
  652   2HH2  ARG  73          2HH2      ARG  73 -14.382  -7.269  -1.027
  653    H    VAL  74           H        VAL  74 -17.975  -2.250   2.241
  654    HA   VAL  74           HA       VAL  74 -20.775  -1.612   1.889
  655    HB   VAL  74           HB       VAL  74 -20.474  -3.647   0.631
  656   1HG1  VAL  74          1HG1      VAL  74 -19.818  -5.781   1.742
  657   2HG1  VAL  74          2HG1      VAL  74 -19.429  -4.859   3.194
  658   3HG1  VAL  74          3HG1      VAL  74 -18.518  -4.590   1.711
  659   1HG2  VAL  74          1HG2      VAL  74 -21.936  -4.118   3.219
  660   2HG2  VAL  74          2HG2      VAL  74 -22.142  -5.079   1.752
  661   3HG2  VAL  74          3HG2      VAL  74 -22.583  -3.369   1.760
  662    H    TYR  75           H        TYR  75 -21.787  -1.384   3.707
  663    HA   TYR  75           HA       TYR  75 -20.288  -1.670   6.177
  664   1HB   TYR  75          2HB       TYR  75 -21.552   0.428   5.734
  665   2HB   TYR  75          1HB       TYR  75 -23.047  -0.500   5.719
  666    HD1  TYR  75           1HD      TYR  75 -24.186  -0.941   7.732
  667    HD2  TYR  75           2HD      TYR  75 -20.185   0.468   7.853
  668    HE1  TYR  75           1HE      TYR  75 -24.371  -0.645  10.164
  669    HE2  TYR  75           2HE      TYR  75 -20.356   0.772  10.288
  670    HH   TYR  75           HH       TYR  75 -22.922  -0.526  12.098
  671    H    GLU  76           H        GLU  76 -20.564  -3.265   7.556
  672    HA   GLU  76           HA       GLU  76 -21.160  -5.185   8.496
  673   1HB   GLU  76          2HB       GLU  76 -23.897  -4.663   7.330
  674   2HB   GLU  76          1HB       GLU  76 -23.529  -5.971   8.439
  675   1HG   GLU  76          2HG       GLU  76 -22.931  -4.368  10.158
  676   2HG   GLU  76          1HG       GLU  76 -23.240  -3.039   9.039
  677    H    GLU  77           H        GLU  77 -21.612  -7.431   8.072
  678    HA   GLU  77           HA       GLU  77 -21.712  -8.217   5.312
  679   1HB   GLU  77          2HB       GLU  77 -19.336  -7.701   5.703
  680   2HB   GLU  77          1HB       GLU  77 -19.323  -8.795   7.070
  681   1HG   GLU  77          2HG       GLU  77 -19.809 -10.662   5.562
  682   2HG   GLU  77          1HG       GLU  77 -19.778  -9.545   4.195
  Start of MODEL   20
    1    H    SER   1           H        SER   1  17.832  -9.663  -7.231
    2    HA   SER   1           HA       SER   1  15.361  -8.473  -8.027
    3   1HB   SER   1          2HB       SER   1  14.421  -9.719  -6.058
    4   2HB   SER   1          1HB       SER   1  15.205 -10.740  -7.263
    5    HG   SER   1           HG       SER   1  16.312  -9.781  -4.862
    6    H    LYS   2           H        LYS   2  16.189  -6.354  -7.819
    7    HA   LYS   2           HA       LYS   2  15.208  -5.136  -5.402
    8   1HB   LYS   2          2HB       LYS   2  17.977  -4.472  -6.475
    9   2HB   LYS   2          1HB       LYS   2  17.100  -3.494  -5.319
   10   1HG   LYS   2          2HG       LYS   2  17.202  -5.384  -3.727
   11   2HG   LYS   2          1HG       LYS   2  18.186  -6.268  -4.893
   12   1HD   LYS   2          2HD       LYS   2  19.833  -4.432  -4.854
   13   2HD   LYS   2          1HD       LYS   2  18.862  -3.614  -3.636
   14   1HE   LYS   2          2HE       LYS   2  20.687  -4.797  -2.568
   15   2HE   LYS   2          1HE       LYS   2  19.147  -5.541  -2.134
   16   1HZ   LYS   2          1HZ       LYS   2  19.563  -7.235  -3.828
   17   2HZ   LYS   2          2HZ       LYS   2  20.739  -7.234  -2.659
   18   3HZ   LYS   2          3HZ       LYS   2  21.063  -6.549  -4.174
   19    H    CYS   3           H        CYS   3  14.384  -3.068  -5.911
   20    HA   CYS   3           HA       CYS   3  14.576  -2.374  -8.740
   21   1HB   CYS   3          2HB       CYS   3  12.031  -2.573  -7.140
   22   2HB   CYS   3          1HB       CYS   3  12.169  -2.008  -8.806
   23    H    LYS   4           H        LYS   4  14.079  -0.201  -9.202
   24    HA   LYS   4           HA       LYS   4  14.910   1.590  -7.176
   25   1HB   LYS   4          2HB       LYS   4  15.567   1.886  -9.510
   26   2HB   LYS   4          1HB       LYS   4  13.886   2.079  -9.970
   27   1HG   LYS   4          2HG       LYS   4  13.771   4.144  -8.672
   28   2HG   LYS   4          1HG       LYS   4  15.468   3.943  -8.216
   29   1HD   LYS   4          2HD       LYS   4  16.117   4.029 -10.558
   30   2HD   LYS   4          1HD       LYS   4  14.426   4.189 -11.030
   31   1HE   LYS   4          2HE       LYS   4  14.287   6.305  -9.837
   32   2HE   LYS   4          1HE       LYS   4  15.972   6.136  -9.337
   33   1HZ   LYS   4          1HZ       LYS   4  15.748   7.586 -11.240
   34   2HZ   LYS   4          2HZ       LYS   4  15.011   6.350 -12.131
   35   3HZ   LYS   4          3HZ       LYS   4  16.625   6.195 -11.641
   36    H    CYS   5           H        CYS   5  13.392   1.359  -5.627
   37    HA   CYS   5           HA       CYS   5  11.478   3.310  -5.356
   38   1HB   CYS   5          2HB       CYS   5  10.203   1.752  -7.034
   39   2HB   CYS   5          1HB       CYS   5  10.114   0.604  -5.708
   40    H    SER   6           H        SER   6  11.523  -0.168  -4.633
   41    HA   SER   6           HA       SER   6  11.792  -1.405  -2.822
   42   1HB   SER   6          2HB       SER   6  13.490   0.895  -1.835
   43   2HB   SER   6          1HB       SER   6  13.518  -0.754  -1.205
   44    HG   SER   6           HG       SER   6  13.814  -1.144  -3.678
   45    H    ARG   7           H        ARG   7  11.608   1.793  -1.307
   46    HA   ARG   7           HA       ARG   7   9.020   1.242  -0.272
   47   1HB   ARG   7          2HB       ARG   7  10.572   0.070   1.336
   48   2HB   ARG   7          1HB       ARG   7  11.303   1.628   1.676
   49   1HG   ARG   7          2HG       ARG   7   9.142   2.453   2.498
   50   2HG   ARG   7          1HG       ARG   7   8.440   0.865   2.183
   51   1HD   ARG   7          2HD       ARG   7   8.993   0.986   4.505
   52   2HD   ARG   7          1HD       ARG   7  10.119  -0.122   3.723
   53    HE   ARG   7           HE       ARG   7  10.971   2.635   4.000
   54   1HH1  ARG   7          1HH1      ARG   7  11.300  -0.702   5.127
   55   2HH1  ARG   7          2HH1      ARG   7  12.555  -0.369   6.208
   56   1HH2  ARG   7          1HH2      ARG   7  12.746   3.091   5.442
   57   2HH2  ARG   7          2HH2      ARG   7  13.417   1.853   6.388
   58    H    LYS   8           H        LYS   8   8.637   3.074  -1.524
   59    HA   LYS   8           HA       LYS   8   9.990   5.540  -0.807
   60   1HB   LYS   8          2HB       LYS   8   7.862   4.993  -2.860
   61   2HB   LYS   8          1HB       LYS   8   8.436   6.602  -2.493
   62   1HG   LYS   8          2HG       LYS   8  10.713   5.865  -3.193
   63   2HG   LYS   8          1HG       LYS   8   9.996   4.327  -3.699
   64   1HD   LYS   8          2HD       LYS   8   8.512   5.481  -5.227
   65   2HD   LYS   8          1HD       LYS   8   9.120   7.043  -4.690
   66   1HE   LYS   8          2HE       LYS   8  11.356   6.412  -5.549
   67   2HE   LYS   8          1HE       LYS   8  10.660   4.903  -6.142
   68   1HZ   LYS   8          1HZ       LYS   8  10.802   6.599  -7.874
   69   2HZ   LYS   8          2HZ       LYS   8   9.805   7.613  -6.993
   70   3HZ   LYS   8          3HZ       LYS   8   9.199   6.161  -7.584
   71    H    GLY   9           H        GLY   9   9.368   6.274   1.111
   72   1HA   GLY   9          2HA       GLY   9   7.805   7.943   1.919
   73   2HA   GLY   9          1HA       GLY   9   6.565   6.944   1.167
   74    HA   PRO  10           HA       PRO  10   7.152   5.685   5.800
   75   1HB   PRO  10          2HB       PRO  10   5.321   7.965   6.357
   76   2HB   PRO  10          1HB       PRO  10   6.706   7.405   7.298
   77   1HG   PRO  10          2HG       PRO  10   6.849   9.663   5.921
   78   2HG   PRO  10          1HG       PRO  10   8.230   8.553   5.984
   79   1HD   PRO  10          2HD       PRO  10   6.224   8.946   3.794
   80   2HD   PRO  10          1HD       PRO  10   7.991   8.756   3.702
   81    H    LYS  11           H        LYS  11   5.229   4.724   6.870
   82    HA   LYS  11           HA       LYS  11   3.481   3.793   4.872
   83   1HB   LYS  11          2HB       LYS  11   2.324   2.479   6.565
   84   2HB   LYS  11          1HB       LYS  11   4.058   2.340   6.766
   85   1HG   LYS  11          2HG       LYS  11   3.977   3.845   8.669
   86   2HG   LYS  11          1HG       LYS  11   2.245   4.084   8.429
   87   1HD   LYS  11          2HD       LYS  11   1.911   1.655   8.781
   88   2HD   LYS  11          1HD       LYS  11   3.633   1.493   9.118
   89   1HE   LYS  11          2HE       LYS  11   2.354   1.614  11.190
   90   2HE   LYS  11          1HE       LYS  11   3.403   3.019  11.011
   91   1HZ   LYS  11          1HZ       LYS  11   1.158   3.551  11.794
   92   2HZ   LYS  11          2HZ       LYS  11   0.496   3.010  10.353
   93   3HZ   LYS  11          3HZ       LYS  11   1.527   4.364  10.391
   94    H    ILE  12           H        ILE  12   1.717   4.408   4.164
   95    HA   ILE  12           HA       ILE  12   0.474   6.845   5.014
   96    HB   ILE  12           HB       ILE  12  -0.229   4.940   2.752
   97   1HG1  ILE  12          2HG1      ILE  12   1.447   7.443   2.795
   98   2HG1  ILE  12          1HG1      ILE  12   2.018   5.803   2.523
   99   1HG2  ILE  12          1HG2      ILE  12  -1.022   7.825   3.202
  100   2HG2  ILE  12          2HG2      ILE  12  -2.113   6.436   3.342
  101   3HG2  ILE  12          3HG2      ILE  12  -1.386   6.869   1.779
  102   1HD1  ILE  12          1HD1      ILE  12   1.864   7.101   0.476
  103   2HD1  ILE  12          2HD1      ILE  12   0.138   7.317   0.753
  104   3HD1  ILE  12          3HD1      ILE  12   0.783   5.709   0.445
  105    H    ARG  13           H        ARG  13  -1.626   7.059   5.770
  106    HA   ARG  13           HA       ARG  13  -2.514   4.707   7.170
  107   1HB   ARG  13          2HB       ARG  13  -4.370   6.040   7.919
  108   2HB   ARG  13          1HB       ARG  13  -2.834   6.840   8.261
  109   1HG   ARG  13          2HG       ARG  13  -3.181   8.283   6.317
  110   2HG   ARG  13          1HG       ARG  13  -4.705   7.463   5.989
  111   1HD   ARG  13          2HD       ARG  13  -5.571   8.250   8.133
  112   2HD   ARG  13          1HD       ARG  13  -4.049   9.097   8.438
  113    HE   ARG  13           HE       ARG  13  -4.698  10.049   6.065
  114   1HH1  ARG  13          1HH1      ARG  13  -6.638   9.779   9.010
  115   2HH1  ARG  13          2HH1      ARG  13  -7.652  11.098   8.649
  116   1HH2  ARG  13          1HH2      ARG  13  -6.097  11.843   5.555
  117   2HH2  ARG  13          2HH2      ARG  13  -7.338  12.299   6.617
  118    H    TYR  14           H        TYR  14  -4.630   3.815   6.909
  119    HA   TYR  14           HA       TYR  14  -5.060   2.905   4.290
  120   1HB   TYR  14          2HB       TYR  14  -7.015   2.837   6.594
  121   2HB   TYR  14          1HB       TYR  14  -6.958   1.757   5.211
  122    HD1  TYR  14           1HD      TYR  14  -5.556   2.549   8.454
  123    HD2  TYR  14           2HD      TYR  14  -5.160   0.036   5.050
  124    HE1  TYR  14           1HE      TYR  14  -4.119   1.060   9.731
  125    HE2  TYR  14           2HE      TYR  14  -3.727  -1.471   6.335
  126    HH   TYR  14           HH       TYR  14  -2.281  -1.399   8.307
  127    H    SER  15           H        SER  15  -6.369   5.548   6.120
  128    HA   SER  15           HA       SER  15  -8.727   6.035   4.667
  129   1HB   SER  15          2HB       SER  15  -7.064   7.973   6.285
  130   2HB   SER  15          1HB       SER  15  -8.739   8.210   5.790
  131    HG   SER  15           HG       SER  15  -9.396   6.685   7.136
  132    H    ASP  16           H        ASP  16  -5.390   7.069   4.115
  133    HA   ASP  16           HA       ASP  16  -6.266   8.929   2.043
  134   1HB   ASP  16          2HB       ASP  16  -3.475   8.272   2.989
  135   2HB   ASP  16          1HB       ASP  16  -3.822   9.361   1.658
  136    H    VAL  17           H        VAL  17  -5.533   5.703   2.250
  137    HA   VAL  17           HA       VAL  17  -4.352   5.541  -0.392
  138    HB   VAL  17           HB       VAL  17  -5.324   3.273   1.341
  139   1HG1  VAL  17          1HG1      VAL  17  -5.037   2.620  -0.935
  140   2HG1  VAL  17          2HG1      VAL  17  -3.741   1.918   0.037
  141   3HG1  VAL  17          3HG1      VAL  17  -3.426   3.326  -0.977
  142   1HG2  VAL  17          1HG2      VAL  17  -2.996   2.975   2.064
  143   2HG2  VAL  17          2HG2      VAL  17  -3.654   4.528   2.582
  144   3HG2  VAL  17          3HG2      VAL  17  -2.555   4.451   1.205
  145    H    LYS  18           H        LYS  18  -5.517   5.438  -2.126
  146    HA   LYS  18           HA       LYS  18  -8.425   5.056  -1.922
  147   1HB   LYS  18          2HB       LYS  18  -7.178   6.930  -3.102
  148   2HB   LYS  18          1HB       LYS  18  -6.790   5.784  -4.337
  149   1HG   LYS  18          2HG       LYS  18  -9.646   6.483  -3.583
  150   2HG   LYS  18          1HG       LYS  18  -8.771   7.233  -4.905
  151   1HD   LYS  18          2HD       LYS  18  -9.355   4.281  -4.679
  152   2HD   LYS  18          1HD       LYS  18 -10.336   5.421  -5.593
  153   1HE   LYS  18          2HE       LYS  18  -7.409   4.864  -6.099
  154   2HE   LYS  18          1HE       LYS  18  -8.737   4.141  -6.997
  155   1HZ   LYS  18          1HZ       LYS  18  -8.120   7.053  -6.874
  156   2HZ   LYS  18          2HZ       LYS  18  -9.384   6.372  -7.723
  157   3HZ   LYS  18          3HZ       LYS  18  -7.804   6.028  -8.162
  158    H    LYS  19           H        LYS  19  -5.525   3.685  -3.082
  159    HA   LYS  19           HA       LYS  19  -6.798   1.230  -3.844
  160   1HB   LYS  19          2HB       LYS  19  -6.905   2.557  -5.899
  161   2HB   LYS  19          1HB       LYS  19  -5.173   2.854  -5.813
  162   1HG   LYS  19          2HG       LYS  19  -4.805   0.409  -5.972
  163   2HG   LYS  19          1HG       LYS  19  -6.548   0.230  -6.162
  164   1HD   LYS  19          2HD       LYS  19  -4.720   1.772  -8.010
  165   2HD   LYS  19          1HD       LYS  19  -5.367   0.165  -8.330
  166   1HE   LYS  19          2HE       LYS  19  -7.637   1.075  -8.270
  167   2HE   LYS  19          1HE       LYS  19  -6.984   2.681  -7.962
  168   1HZ   LYS  19          1HZ       LYS  19  -6.517   1.039 -10.372
  169   2HZ   LYS  19          2HZ       LYS  19  -5.828   2.547 -10.111
  170   3HZ   LYS  19          3HZ       LYS  19  -7.509   2.402 -10.286
  171    H    LEU  20           H        LEU  20  -5.419  -0.413  -3.519
  172    HA   LEU  20           HA       LEU  20  -2.595   0.175  -3.037
  173   1HB   LEU  20          2HB       LEU  20  -3.967   0.101  -0.925
  174   2HB   LEU  20          1HB       LEU  20  -4.420  -1.532  -1.339
  175    HG   LEU  20           HG       LEU  20  -2.070  -2.240  -1.082
  176   1HD1  LEU  20          1HD1      LEU  20  -0.485  -0.673  -0.086
  177   2HD1  LEU  20          2HD1      LEU  20  -1.678   0.611  -0.225
  178   3HD1  LEU  20          3HD1      LEU  20  -0.998  -0.127  -1.686
  179   1HD2  LEU  20          1HD2      LEU  20  -1.947  -1.885   1.348
  180   2HD2  LEU  20          2HD2      LEU  20  -3.564  -2.386   0.818
  181   3HD2  LEU  20          3HD2      LEU  20  -3.233  -0.700   1.228
  182    H    GLU  21           H        GLU  21  -1.438  -1.248  -4.383
  183    HA   GLU  21           HA       GLU  21  -2.758  -3.812  -4.978
  184   1HB   GLU  21          2HB       GLU  21  -1.329  -2.093  -6.997
  185   2HB   GLU  21          1HB       GLU  21  -2.009  -3.679  -7.284
  186   1HG   GLU  21          2HG       GLU  21  -4.254  -2.704  -6.802
  187   2HG   GLU  21          1HG       GLU  21  -3.476  -1.122  -6.736
  188    H    MET  22           H        MET  22  -1.340  -5.547  -4.871
  189    HA   MET  22           HA       MET  22   1.413  -4.731  -4.777
  190   1HB   MET  22          2HB       MET  22   1.924  -6.887  -3.777
  191   2HB   MET  22          1HB       MET  22   0.814  -5.957  -2.792
  192   1HG   MET  22          2HG       MET  22  -1.010  -7.370  -3.463
  193   2HG   MET  22          1HG       MET  22   0.025  -8.231  -4.607
  194   1HE   MET  22          1HE       MET  22   1.066  -7.023  -0.992
  195   2HE   MET  22          2HE       MET  22   0.587  -8.413  -0.022
  196   3HE   MET  22          3HE       MET  22  -0.640  -7.427  -0.820
  197    H    LYS  23           H        LYS  23   2.442  -4.862  -6.491
  198    HA   LYS  23           HA       LYS  23   2.633  -7.258  -7.967
  199   1HB   LYS  23          2HB       LYS  23   2.097  -6.399 -10.201
  200   2HB   LYS  23          1HB       LYS  23   0.690  -6.269  -9.183
  201   1HG   LYS  23          2HG       LYS  23   2.524  -3.977  -9.909
  202   2HG   LYS  23          1HG       LYS  23   1.026  -4.369 -10.741
  203   1HD   LYS  23          2HD       LYS  23  -0.180  -3.996  -8.587
  204   2HD   LYS  23          1HD       LYS  23   1.351  -3.476  -7.881
  205   1HE   LYS  23          2HE       LYS  23   0.077  -1.526  -8.589
  206   2HE   LYS  23          1HE       LYS  23   1.517  -1.712  -9.588
  207   1HZ   LYS  23          1HZ       LYS  23  -0.406  -1.169 -10.947
  208   2HZ   LYS  23          2HZ       LYS  23  -1.236  -2.513 -10.361
  209   3HZ   LYS  23          3HZ       LYS  23   0.128  -2.712 -11.322
  210    HA   PRO  24           HA       PRO  24   6.626  -5.640  -7.983
  211   1HB   PRO  24          2HB       PRO  24   7.785  -6.862 -10.109
  212   2HB   PRO  24          1HB       PRO  24   7.371  -7.717  -8.628
  213   1HG   PRO  24          2HG       PRO  24   5.838  -7.587 -11.193
  214   2HG   PRO  24          1HG       PRO  24   6.194  -9.000 -10.180
  215   1HD   PRO  24          2HD       PRO  24   3.818  -7.729 -10.087
  216   2HD   PRO  24          1HD       PRO  24   4.538  -8.475  -8.649
  217    H    LYS  25           H        LYS  25   7.253  -3.661  -8.501
  218    HA   LYS  25           HA       LYS  25   6.121  -2.154 -10.606
  219   1HB   LYS  25          2HB       LYS  25   7.211  -1.356  -8.291
  220   2HB   LYS  25          1HB       LYS  25   8.693  -1.471  -9.236
  221   1HG   LYS  25          2HG       LYS  25   6.481   0.271 -10.194
  222   2HG   LYS  25          1HG       LYS  25   7.587   0.824  -8.941
  223   1HD   LYS  25          2HD       LYS  25   9.450   0.483 -10.374
  224   2HD   LYS  25          1HD       LYS  25   8.422  -0.260 -11.596
  225   1HE   LYS  25          2HE       LYS  25   7.255   1.889 -11.896
  226   2HE   LYS  25          1HE       LYS  25   8.224   2.612 -10.615
  227   1HZ   LYS  25          1HZ       LYS  25   9.265   1.626 -13.226
  228   2HZ   LYS  25          2HZ       LYS  25  10.193   2.320 -11.998
  229   3HZ   LYS  25          3HZ       LYS  25   9.041   3.230 -12.779
  230    H    TYR  26           H        TYR  26   8.916  -4.130 -10.232
  231    HA   TYR  26           HA       TYR  26   9.445  -4.033 -13.079
  232   1HB   TYR  26          2HB       TYR  26  11.462  -3.867 -10.824
  233   2HB   TYR  26          1HB       TYR  26  11.937  -4.554 -12.348
  234    HD1  TYR  26           1HD      TYR  26  12.219  -3.234 -14.254
  235    HD2  TYR  26           2HD      TYR  26  10.935  -1.507 -10.607
  236    HE1  TYR  26           1HE      TYR  26  12.713  -0.968 -15.154
  237    HE2  TYR  26           2HE      TYR  26  11.434   0.737 -11.471
  238    HH   TYR  26           HH       TYR  26  11.991   1.343 -14.730
  239    HA   PRO  27           HA       PRO  27   8.729  -8.380 -12.497
  240   1HB   PRO  27          2HB       PRO  27  10.785  -8.834 -14.590
  241   2HB   PRO  27          1HB       PRO  27   9.098  -9.355 -14.548
  242   1HG   PRO  27          2HG       PRO  27   9.867  -7.376 -16.159
  243   2HG   PRO  27          1HG       PRO  27   8.306  -7.324 -15.323
  244   1HD   PRO  27          2HD       PRO  27  10.852  -5.884 -14.673
  245   2HD   PRO  27          1HD       PRO  27   9.169  -5.311 -14.603
  246    H    HIS  28           H        HIS  28  11.809  -6.962 -12.409
  247    HA   HIS  28           HA       HIS  28  13.113  -9.256 -11.153
  248   1HB   HIS  28          2HB       HIS  28  15.194  -7.923 -11.243
  249   2HB   HIS  28          1HB       HIS  28  14.460  -8.076 -12.826
  250    HD1  HIS  28           1HD      HIS  28  15.217  -5.593 -10.114
  251    HD2  HIS  28           2HD      HIS  28  13.701  -5.502 -14.005
  252    HE1  HIS  28           1HE      HIS  28  15.188  -3.223 -10.826
  253    HE2  HIS  28           2HE      HIS  28  14.871  -3.400 -13.276
  254    H    CYS  29           H        CYS  29  10.994  -8.056  -9.675
  255    HA   CYS  29           HA       CYS  29  12.380  -6.755  -7.428
  256   1HB   CYS  29          2HB       CYS  29   9.476  -6.875  -8.242
  257   2HB   CYS  29          1HB       CYS  29   9.964  -6.249  -6.697
  258    H    GLU  30           H        GLU  30  11.917  -7.595  -5.249
  259    HA   GLU  30           HA       GLU  30  11.661 -10.443  -5.125
  260   1HB   GLU  30          2HB       GLU  30  11.553  -8.358  -2.929
  261   2HB   GLU  30          1HB       GLU  30  11.971 -10.051  -2.779
  262   1HG   GLU  30          2HG       GLU  30  13.954  -9.697  -3.928
  263   2HG   GLU  30          1HG       GLU  30  13.496  -8.016  -4.254
  264    H    GLU  31           H        GLU  31   9.666 -11.462  -4.852
  265    HA   GLU  31           HA       GLU  31   7.380 -11.713  -4.689
  266   1HB   GLU  31          2HB       GLU  31   8.071 -11.431  -2.283
  267   2HB   GLU  31          1HB       GLU  31   7.858  -9.701  -2.434
  268   1HG   GLU  31          2HG       GLU  31   6.083 -10.915  -1.185
  269   2HG   GLU  31          1HG       GLU  31   5.452  -9.941  -2.489
  270    H    LYS  32           H        LYS  32   5.384  -9.799  -4.081
  271    HA   LYS  32           HA       LYS  32   5.441  -8.144  -6.484
  272   1HB   LYS  32          2HB       LYS  32   3.279  -8.285  -4.400
  273   2HB   LYS  32          1HB       LYS  32   3.134  -7.821  -6.092
  274   1HG   LYS  32          2HG       LYS  32   3.719 -10.540  -5.036
  275   2HG   LYS  32          1HG       LYS  32   2.154  -9.958  -5.643
  276   1HD   LYS  32          2HD       LYS  32   3.076  -9.725  -7.847
  277   2HD   LYS  32          1HD       LYS  32   4.696 -10.137  -7.260
  278   1HE   LYS  32          2HE       LYS  32   2.291 -11.965  -7.184
  279   2HE   LYS  32          1HE       LYS  32   3.593 -12.051  -8.372
  280   1HZ   LYS  32          1HZ       LYS  32   5.143 -12.657  -6.647
  281   2HZ   LYS  32          2HZ       LYS  32   3.801 -13.642  -6.500
  282   3HZ   LYS  32          3HZ       LYS  32   4.027 -12.380  -5.427
  283    H    MET  33           H        MET  33   5.404  -5.894  -6.313
  284    HA   MET  33           HA       MET  33   6.339  -4.803  -3.734
  285   1HB   MET  33          2HB       MET  33   5.841  -3.316  -6.328
  286   2HB   MET  33          1HB       MET  33   6.563  -2.663  -4.887
  287   1HG   MET  33          2HG       MET  33   7.856  -4.864  -6.491
  288   2HG   MET  33          1HG       MET  33   8.110  -3.166  -6.835
  289   1HE   MET  33          1HE       MET  33   8.073  -5.241  -3.317
  290   2HE   MET  33          2HE       MET  33   9.801  -5.483  -3.208
  291   3HE   MET  33          3HE       MET  33   8.894  -6.216  -4.534
  292    H    VAL  34           H        VAL  34   5.241  -3.120  -2.680
  293    HA   VAL  34           HA       VAL  34   2.372  -3.328  -3.134
  294    HB   VAL  34           HB       VAL  34   3.915  -2.327  -0.737
  295   1HG1  VAL  34          1HG1      VAL  34   1.762  -1.169  -0.949
  296   2HG1  VAL  34          2HG1      VAL  34   1.734  -2.283   0.417
  297   3HG1  VAL  34          3HG1      VAL  34   0.935  -2.721  -1.097
  298   1HG2  VAL  34          1HG2      VAL  34   3.061  -4.355   0.359
  299   2HG2  VAL  34          2HG2      VAL  34   4.084  -4.728  -1.029
  300   3HG2  VAL  34          3HG2      VAL  34   2.330  -4.853  -1.166
  301    H    ILE  35           H        ILE  35   1.574  -1.843  -4.349
  302    HA   ILE  35           HA       ILE  35   2.866   0.766  -4.576
  303    HB   ILE  35           HB       ILE  35   0.648  -0.484  -6.197
  304   1HG1  ILE  35          2HG1      ILE  35   2.673  -1.752  -6.409
  305   2HG1  ILE  35          1HG1      ILE  35   2.316  -0.910  -7.911
  306   1HG2  ILE  35          1HG2      ILE  35   1.138   1.264  -7.841
  307   2HG2  ILE  35          2HG2      ILE  35   2.308   1.970  -6.725
  308   3HG2  ILE  35          3HG2      ILE  35   0.597   1.925  -6.298
  309   1HD1  ILE  35          1HD1      ILE  35   4.035   0.783  -7.332
  310   2HD1  ILE  35          2HD1      ILE  35   4.706  -0.836  -7.465
  311   3HD1  ILE  35          3HD1      ILE  35   4.416  -0.131  -5.872
  312    H    ILE  36           H        ILE  36   2.043   2.357  -3.434
  313    HA   ILE  36           HA       ILE  36  -0.750   2.159  -2.563
  314    HB   ILE  36           HB       ILE  36   1.362   4.020  -1.491
  315   1HG1  ILE  36          2HG1      ILE  36   0.411   1.378  -0.381
  316   2HG1  ILE  36          1HG1      ILE  36   2.003   1.693  -1.056
  317   1HG2  ILE  36          1HG2      ILE  36  -0.891   4.819  -1.073
  318   2HG2  ILE  36          2HG2      ILE  36  -0.261   4.123   0.426
  319   3HG2  ILE  36          3HG2      ILE  36  -1.383   3.200  -0.550
  320   1HD1  ILE  36          1HD1      ILE  36   2.033   1.720   1.380
  321   2HD1  ILE  36          2HD1      ILE  36   0.808   3.013   1.319
  322   3HD1  ILE  36          3HD1      ILE  36   2.427   3.310   0.688
  323    H    THR  37           H        THR  37  -2.114   3.567  -3.204
  324    HA   THR  37           HA       THR  37  -1.254   5.910  -4.781
  325    HB   THR  37           HB       THR  37  -3.660   4.126  -5.239
  326    HG1  THR  37           1HG      THR  37  -1.210   3.709  -5.819
  327   1HG2  THR  37          1HG2      THR  37  -2.570   6.424  -6.886
  328   2HG2  THR  37          2HG2      THR  37  -4.056   6.448  -5.934
  329   3HG2  THR  37          3HG2      THR  37  -3.926   5.389  -7.336
  330    H    THR  38           H        THR  38  -1.996   7.834  -3.866
  331    HA   THR  38           HA       THR  38  -3.803   7.607  -1.658
  332    HB   THR  38           HB       THR  38  -3.331  10.086  -1.383
  333    HG1  THR  38           1HG      THR  38  -1.477  10.791  -2.508
  334   1HG2  THR  38          1HG2      THR  38  -1.006   9.725  -0.617
  335   2HG2  THR  38          2HG2      THR  38  -0.997   8.165  -1.454
  336   3HG2  THR  38          3HG2      THR  38  -2.098   8.434  -0.105
  337    H    LYS  39           H        LYS  39  -5.617   9.250  -1.360
  338    HA   LYS  39           HA       LYS  39  -7.434   8.668  -3.536
  339   1HB   LYS  39          2HB       LYS  39  -8.068   8.296  -1.210
  340   2HB   LYS  39          1HB       LYS  39  -7.956  10.017  -0.900
  341   1HG   LYS  39          2HG       LYS  39  -9.826  10.425  -2.413
  342   2HG   LYS  39          1HG       LYS  39  -9.909   8.703  -2.793
  343   1HD   LYS  39          2HD       LYS  39 -10.348   8.228  -0.402
  344   2HD   LYS  39          1HD       LYS  39 -10.345   9.959  -0.077
  345   1HE   LYS  39          2HE       LYS  39 -12.246   8.529  -1.936
  346   2HE   LYS  39          1HE       LYS  39 -12.626   9.028  -0.291
  347   1HZ   LYS  39          1HZ       LYS  39 -12.314  11.324  -0.969
  348   2HZ   LYS  39          2HZ       LYS  39 -13.469  10.575  -1.930
  349   3HZ   LYS  39          3HZ       LYS  39 -11.915  10.852  -2.527
  350    H    SER  40           H        SER  40  -6.473  11.813  -2.122
  351    HA   SER  40           HA       SER  40  -6.765  13.104  -4.658
  352   1HB   SER  40          2HB       SER  40  -8.989  13.668  -2.661
  353   2HB   SER  40          1HB       SER  40  -8.670  14.619  -4.097
  354    HG   SER  40           HG       SER  40  -8.861  12.008  -4.683
  355    H    VAL  41           H        VAL  41  -7.342  14.067  -1.231
  356    HA   VAL  41           HA       VAL  41  -6.128  16.601  -1.656
  357    HB   VAL  41           HB       VAL  41  -6.410  17.053   0.720
  358   1HG1  VAL  41          1HG1      VAL  41  -8.843  16.788   0.871
  359   2HG1  VAL  41          2HG1      VAL  41  -8.791  15.672  -0.495
  360   3HG1  VAL  41          3HG1      VAL  41  -8.321  17.360  -0.712
  361   1HG2  VAL  41          1HG2      VAL  41  -5.803  14.893   1.645
  362   2HG2  VAL  41          2HG2      VAL  41  -7.251  14.167   0.954
  363   3HG2  VAL  41          3HG2      VAL  41  -7.394  15.378   2.228
  364    H    SER  42           H        SER  42  -4.758  13.678  -1.106
  365    HA   SER  42           HA       SER  42  -2.420  14.345   0.287
  366   1HB   SER  42          2HB       SER  42  -2.985  12.044  -0.152
  367   2HB   SER  42          1HB       SER  42  -2.974  12.327  -1.891
  368    HG   SER  42           HG       SER  42  -0.822  12.287  -0.071
  369    H    ARG  43           H        ARG  43  -0.528  15.201  -0.437
  370    HA   ARG  43           HA       ARG  43  -0.500  17.045  -2.559
  371   1HB   ARG  43          2HB       ARG  43   1.821  15.726  -1.136
  372   2HB   ARG  43          1HB       ARG  43   1.900  17.197  -2.092
  373   1HG   ARG  43          2HG       ARG  43   0.525  18.374  -0.523
  374   2HG   ARG  43          1HG       ARG  43   0.215  16.894   0.382
  375   1HD   ARG  43          2HD       ARG  43   1.891  18.253   1.508
  376   2HD   ARG  43          1HD       ARG  43   2.585  16.740   0.940
  377    HE   ARG  43           HE       ARG  43   2.906  18.863  -0.924
  378   1HH1  ARG  43          1HH1      ARG  43   4.234  17.443   2.005
  379   2HH1  ARG  43          2HH1      ARG  43   5.789  18.116   1.838
  380   1HH2  ARG  43          1HH2      ARG  43   5.063  19.782  -1.213
  381   2HH2  ARG  43          2HH2      ARG  43   6.264  19.503  -0.053
  382    H    TYR  44           H        TYR  44   0.056  13.697  -2.409
  383    HA   TYR  44           HA       TYR  44   1.505  13.532  -4.880
  384   1HB   TYR  44          2HB       TYR  44   0.491  11.446  -2.960
  385   2HB   TYR  44          1HB       TYR  44   1.269  10.994  -4.468
  386    HD1  TYR  44           1HD      TYR  44   1.752  12.662  -1.227
  387    HD2  TYR  44           2HD      TYR  44   3.677  11.207  -4.733
  388    HE1  TYR  44           1HE      TYR  44   3.952  13.044  -0.183
  389    HE2  TYR  44           2HE      TYR  44   5.865  11.577  -3.696
  390    HH   TYR  44           HH       TYR  44   6.853  12.933  -1.964
  391    H    ARG  45           H        ARG  45  -1.834  13.450  -3.911
  392    HA   ARG  45           HA       ARG  45  -3.773  13.171  -4.995
  393   1HB   ARG  45          2HB       ARG  45  -2.615  15.089  -6.195
  394   2HB   ARG  45          1HB       ARG  45  -2.171  13.931  -7.439
  395   1HG   ARG  45          2HG       ARG  45  -4.616  13.426  -7.652
  396   2HG   ARG  45          1HG       ARG  45  -4.878  14.833  -6.611
  397   1HD   ARG  45          2HD       ARG  45  -3.461  14.835  -9.280
  398   2HD   ARG  45          1HD       ARG  45  -5.083  15.445  -8.980
  399    HE   ARG  45           HE       ARG  45  -3.647  16.880  -7.273
  400   1HH1  ARG  45          1HH1      ARG  45  -3.211  16.187 -10.700
  401   2HH1  ARG  45          2HH1      ARG  45  -2.375  17.625 -11.063
  402   1HH2  ARG  45          1HH2      ARG  45  -2.509  18.876  -7.736
  403   2HH2  ARG  45          2HH2      ARG  45  -1.976  19.216  -9.315
  404    H    GLY  46           H        GLY  46  -2.186  10.707  -4.815
  405   1HA   GLY  46          2HA       GLY  46  -2.827   8.587  -5.623
  406   2HA   GLY  46          1HA       GLY  46  -3.311   9.328  -7.141
  407    H    GLN  47           H        GLN  47  -0.359  10.572  -6.224
  408    HA   GLN  47           HA       GLN  47   1.103   9.048  -8.152
  409   1HB   GLN  47          2HB       GLN  47   1.476  11.534  -7.225
  410   2HB   GLN  47          1HB       GLN  47   2.362  10.707  -5.972
  411   1HG   GLN  47          2HG       GLN  47   3.054  10.573  -8.902
  412   2HG   GLN  47          1HG       GLN  47   3.764  11.705  -7.773
  413   1HE2  GLN  47          1HE2      GLN  47   5.232  10.925  -6.254
  414   2HE2  GLN  47          2HE2      GLN  47   5.993   9.383  -6.418
  415    H    GLU  48           H        GLU  48   3.045   7.747  -7.399
  416    HA   GLU  48           HA       GLU  48   1.793   5.852  -5.591
  417   1HB   GLU  48          2HB       GLU  48   4.009   5.427  -7.562
  418   2HB   GLU  48          1HB       GLU  48   3.147   4.183  -6.668
  419   1HG   GLU  48          2HG       GLU  48   1.070   4.805  -7.784
  420   2HG   GLU  48          1HG       GLU  48   1.920   6.070  -8.665
  421    H    HIS  49           H        HIS  49   2.583   5.124  -3.869
  422    HA   HIS  49           HA       HIS  49   5.356   5.681  -3.024
  423   1HB   HIS  49          2HB       HIS  49   2.877   5.250  -1.314
  424   2HB   HIS  49          1HB       HIS  49   4.510   5.332  -0.687
  425    HD1  HIS  49           1HD      HIS  49   5.534   7.646  -0.415
  426    HD2  HIS  49           2HD      HIS  49   1.698   7.719  -2.018
  427    HE1  HIS  49           1HE      HIS  49   4.700  10.042  -0.225
  428    HE2  HIS  49           2HE      HIS  49   2.320   9.811  -0.722
  429    H    CYS  50           H        CYS  50   6.264   3.762  -1.784
  430    HA   CYS  50           HA       CYS  50   4.730   1.383  -2.420
  431   1HB   CYS  50          2HB       CYS  50   6.629   0.191  -3.438
  432   2HB   CYS  50          1HB       CYS  50   6.134   1.589  -4.376
  433    H    LEU  51           H        LEU  51   5.032  -0.365  -1.230
  434    HA   LEU  51           HA       LEU  51   6.868  -0.079   1.020
  435   1HB   LEU  51          2HB       LEU  51   4.161  -1.386   0.976
  436   2HB   LEU  51          1HB       LEU  51   5.339  -1.688   2.236
  437    HG   LEU  51           HG       LEU  51   4.305   0.998   1.527
  438   1HD1  LEU  51          1HD1      LEU  51   2.901   0.752   3.601
  439   2HD1  LEU  51          2HD1      LEU  51   3.486  -0.902   3.766
  440   3HD1  LEU  51          3HD1      LEU  51   2.474  -0.460   2.392
  441   1HD2  LEU  51          1HD2      LEU  51   6.426   1.082   2.655
  442   2HD2  LEU  51          2HD2      LEU  51   5.838  -0.020   3.902
  443   3HD2  LEU  51          3HD2      LEU  51   5.164   1.604   3.773
  444    H    HIS  52           H        HIS  52   7.951  -1.657   1.649
  445    HA   HIS  52           HA       HIS  52   8.566  -3.675  -0.369
  446   1HB   HIS  52          2HB       HIS  52  10.374  -2.283   0.756
  447   2HB   HIS  52          1HB       HIS  52  10.018  -3.148   2.245
  448    HD1  HIS  52           1HD      HIS  52  11.698  -4.966   2.670
  449    HD2  HIS  52           2HD      HIS  52  11.113  -4.309  -1.404
  450    HE1  HIS  52           1HE      HIS  52  13.170  -6.589   1.504
  451    HE2  HIS  52           2HE      HIS  52  12.924  -6.150  -0.918
  452    HA   PRO  53           HA       PRO  53   5.717  -6.401   1.828
  453   1HB   PRO  53          2HB       PRO  53   6.064  -8.584   0.284
  454   2HB   PRO  53          1HB       PRO  53   5.176  -7.159  -0.274
  455   1HG   PRO  53          2HG       PRO  53   8.053  -7.876  -0.752
  456   2HG   PRO  53          1HG       PRO  53   6.814  -7.395  -1.932
  457   1HD   PRO  53          2HD       PRO  53   8.564  -5.627  -1.042
  458   2HD   PRO  53          1HD       PRO  53   6.864  -5.160  -1.261
  459    H    LYS  54           H        LYS  54   9.041  -6.739   1.867
  460    HA   LYS  54           HA       LYS  54   9.089  -9.326   2.971
  461   1HB   LYS  54          2HB       LYS  54  11.200  -7.217   2.811
  462   2HB   LYS  54          1HB       LYS  54  11.497  -8.855   3.403
  463   1HG   LYS  54          2HG       LYS  54  10.399  -8.189   0.682
  464   2HG   LYS  54          1HG       LYS  54  12.088  -8.534   1.051
  465   1HD   LYS  54          2HD       LYS  54  11.662 -10.688   1.630
  466   2HD   LYS  54          1HD       LYS  54   9.911 -10.487   1.745
  467   1HE   LYS  54          2HE       LYS  54   9.843 -10.040  -0.615
  468   2HE   LYS  54          1HE       LYS  54  11.571 -10.324  -0.791
  469   1HZ   LYS  54          1HZ       LYS  54  11.134 -12.621   0.066
  470   2HZ   LYS  54          2HZ       LYS  54  10.386 -12.337  -1.393
  471   3HZ   LYS  54          3HZ       LYS  54   9.484 -12.288   0.042
  472    H    LEU  55           H        LEU  55   8.380  -6.256   4.149
  473    HA   LEU  55           HA       LEU  55   9.191  -6.651   6.902
  474   1HB   LEU  55          2HB       LEU  55   7.550  -4.486   5.592
  475   2HB   LEU  55          1HB       LEU  55   8.106  -4.464   7.250
  476    HG   LEU  55           HG       LEU  55   9.862  -4.345   4.795
  477   1HD1  LEU  55          1HD1      LEU  55  10.280  -2.056   5.502
  478   2HD1  LEU  55          2HD1      LEU  55   9.099  -2.233   6.801
  479   3HD1  LEU  55          3HD1      LEU  55   8.581  -2.310   5.120
  480   1HD2  LEU  55          1HD2      LEU  55  10.550  -4.121   7.726
  481   2HD2  LEU  55          2HD2      LEU  55  11.664  -3.854   6.384
  482   3HD2  LEU  55          3HD2      LEU  55  10.988  -5.458   6.665
  483    H    GLN  56           H        GLN  56   7.788  -7.099   8.563
  484    HA   GLN  56           HA       GLN  56   5.378  -8.486   7.961
  485   1HB   GLN  56          2HB       GLN  56   5.077  -8.702  10.384
  486   2HB   GLN  56          1HB       GLN  56   6.722  -9.098   9.915
  487   1HG   GLN  56          2HG       GLN  56   7.474  -6.907  10.680
  488   2HG   GLN  56          1HG       GLN  56   5.816  -6.488  11.095
  489   1HE2  GLN  56          1HE2      GLN  56   8.200  -6.634  12.753
  490   2HE2  GLN  56          2HE2      GLN  56   7.829  -7.759  14.008
  491    H    SER  57           H        SER  57   6.118  -5.214   8.847
  492    HA   SER  57           HA       SER  57   3.636  -4.304   9.689
  493   1HB   SER  57          2HB       SER  57   5.776  -2.837   8.129
  494   2HB   SER  57          1HB       SER  57   4.478  -2.078   9.051
  495    HG   SER  57           HG       SER  57   5.432  -2.493  10.815
  496    H    THR  58           H        THR  58   4.946  -4.871   6.478
  497    HA   THR  58           HA       THR  58   2.971  -3.545   4.999
  498    HB   THR  58           HB       THR  58   4.654  -5.925   4.171
  499    HG1  THR  58           1HG      THR  58   6.219  -4.315   3.606
  500   1HG2  THR  58          1HG2      THR  58   2.903  -5.252   2.581
  501   2HG2  THR  58          2HG2      THR  58   4.500  -4.841   1.952
  502   3HG2  THR  58          3HG2      THR  58   3.481  -3.588   2.653
  503    H    LYS  59           H        LYS  59   3.182  -6.818   6.373
  504    HA   LYS  59           HA       LYS  59   0.946  -7.732   4.987
  505   1HB   LYS  59          2HB       LYS  59   2.263  -8.789   7.464
  506   2HB   LYS  59          1HB       LYS  59   0.778  -9.495   6.841
  507   1HG   LYS  59          2HG       LYS  59   2.540 -10.803   5.973
  508   2HG   LYS  59          1HG       LYS  59   1.951  -9.786   4.667
  509   1HD   LYS  59          2HD       LYS  59   3.815  -8.239   5.037
  510   2HD   LYS  59          1HD       LYS  59   4.435  -9.309   6.298
  511   1HE   LYS  59          2HE       LYS  59   4.077  -9.987   3.385
  512   2HE   LYS  59          1HE       LYS  59   5.606  -9.672   4.196
  513   1HZ   LYS  59          1HZ       LYS  59   5.333 -11.979   3.965
  514   2HZ   LYS  59          2HZ       LYS  59   3.784 -11.980   4.627
  515   3HZ   LYS  59          3HZ       LYS  59   5.147 -11.662   5.596
  516    H    ARG  60           H        ARG  60   1.156  -6.193   8.229
  517    HA   ARG  60           HA       ARG  60  -1.586  -6.485   8.612
  518   1HB   ARG  60          2HB       ARG  60   0.399  -4.588   9.759
  519   2HB   ARG  60          1HB       ARG  60  -1.311  -4.324  10.008
  520   1HG   ARG  60          2HG       ARG  60  -0.667  -5.470  11.901
  521   2HG   ARG  60          1HG       ARG  60  -1.383  -6.671  10.888
  522   1HD   ARG  60          2HD       ARG  60   0.795  -7.431  10.065
  523   2HD   ARG  60          1HD       ARG  60   1.599  -6.234  11.080
  524    HE   ARG  60           HE       ARG  60  -0.142  -8.151  12.378
  525   1HH1  ARG  60          1HH1      ARG  60   3.203  -7.135  11.708
  526   2HH1  ARG  60          2HH1      ARG  60   3.889  -8.167  12.877
  527   1HH2  ARG  60          1HH2      ARG  60   0.854  -9.532  14.022
  528   2HH2  ARG  60          2HH2      ARG  60   2.539  -9.509  14.215
  529    H    PHE  61           H        PHE  61   0.286  -4.064   6.954
  530    HA   PHE  61           HA       PHE  61  -1.784  -2.217   6.679
  531   1HB   PHE  61          2HB       PHE  61   0.714  -1.936   6.205
  532   2HB   PHE  61          1HB       PHE  61   0.331  -2.671   4.645
  533    HD1  PHE  61           1HD      PHE  61   0.237  -1.087   2.922
  534    HD2  PHE  61           2HD      PHE  61  -1.246  -0.040   6.777
  535    HE1  PHE  61           1HE      PHE  61  -0.370   1.162   2.094
  536    HE2  PHE  61           2HE      PHE  61  -1.849   2.186   5.956
  537    HZ   PHE  61           HZ       PHE  61  -1.401   2.820   3.664
  538    H    ILE  62           H        ILE  62  -0.840  -5.002   4.620
  539    HA   ILE  62           HA       ILE  62  -2.789  -4.383   2.629
  540    HB   ILE  62           HB       ILE  62  -1.375  -6.997   3.191
  541   1HG1  ILE  62          2HG1      ILE  62   0.233  -5.268   2.692
  542   2HG1  ILE  62          1HG1      ILE  62   0.083  -6.326   1.294
  543   1HG2  ILE  62          1HG2      ILE  62  -3.398  -7.318   1.900
  544   2HG2  ILE  62          2HG2      ILE  62  -1.972  -7.602   0.893
  545   3HG2  ILE  62          3HG2      ILE  62  -2.887  -6.094   0.740
  546   1HD1  ILE  62          1HD1      ILE  62  -1.214  -3.669   1.659
  547   2HD1  ILE  62          2HD1      ILE  62  -1.382  -4.690   0.232
  548   3HD1  ILE  62          3HD1      ILE  62   0.196  -3.979   0.640
  549    H    LYS  63           H        LYS  63  -2.607  -6.658   5.250
  550    HA   LYS  63           HA       LYS  63  -5.051  -7.924   4.620
  551   1HB   LYS  63          2HB       LYS  63  -3.308  -8.047   7.067
  552   2HB   LYS  63          1HB       LYS  63  -4.850  -8.879   7.025
  553   1HG   LYS  63          2HG       LYS  63  -2.903 -10.348   6.482
  554   2HG   LYS  63          1HG       LYS  63  -4.099 -10.295   5.193
  555   1HD   LYS  63          2HD       LYS  63  -2.731  -8.697   3.983
  556   2HD   LYS  63          1HD       LYS  63  -1.577  -8.660   5.304
  557   1HE   LYS  63          2HE       LYS  63  -0.850  -9.900   3.475
  558   2HE   LYS  63          1HE       LYS  63  -0.999 -10.943   4.903
  559   1HZ   LYS  63          1HZ       LYS  63  -3.124 -11.782   3.968
  560   2HZ   LYS  63          2HZ       LYS  63  -1.867 -12.054   2.883
  561   3HZ   LYS  63          3HZ       LYS  63  -2.934 -10.781   2.630
  562    H    TRP  64           H        TRP  64  -4.230  -5.236   6.579
  563    HA   TRP  64           HA       TRP  64  -6.757  -5.085   7.942
  564   1HB   TRP  64          2HB       TRP  64  -4.340  -4.113   8.512
  565   2HB   TRP  64          1HB       TRP  64  -4.940  -2.748   7.592
  566    HD1  TRP  64           HD       TRP  64  -4.935  -4.291  10.955
  567    HE1  TRP  64           1HE      TRP  64  -6.449  -2.927  12.560
  568    HE3  TRP  64           3HE      TRP  64  -7.311  -1.290   7.542
  569    HZ2  TRP  64           2HZ      TRP  64  -8.362  -0.870  12.394
  570    HZ3  TRP  64           3HZ      TRP  64  -8.963   0.346   8.354
  571    HH2  TRP  64           HH       TRP  64  -9.472   0.552  10.723
  572    H    TYR  65           H        TYR  65  -5.146  -3.609   5.067
  573    HA   TYR  65           HA       TYR  65  -7.141  -1.748   4.517
  574   1HB   TYR  65          2HB       TYR  65  -4.922  -1.559   3.520
  575   2HB   TYR  65          1HB       TYR  65  -5.171  -3.052   2.600
  576    HD1  TYR  65           1HD      TYR  65  -6.761  -2.999   0.652
  577    HD2  TYR  65           2HD      TYR  65  -5.785   0.516   2.840
  578    HE1  TYR  65           1HE      TYR  65  -7.668  -1.610  -1.173
  579    HE2  TYR  65           2HE      TYR  65  -6.706   1.897   0.996
  580    HH   TYR  65           HH       TYR  65  -8.631   0.693  -1.389
  581    H    ASN  66           H        ASN  66  -6.752  -5.103   3.687
  582    HA   ASN  66           HA       ASN  66  -8.816  -5.361   1.770
  583   1HB   ASN  66          2HB       ASN  66  -7.650  -7.352   3.715
  584   2HB   ASN  66          1HB       ASN  66  -8.954  -7.790   2.628
  585   1HD2  ASN  66          1HD2      ASN  66  -6.477  -5.556   1.592
  586   2HD2  ASN  66          2HD2      ASN  66  -5.679  -6.641   0.521
  587    H    ALA  67           H        ALA  67  -9.011  -5.567   5.286
  588    HA   ALA  67           HA       ALA  67 -11.830  -6.083   5.257
  589   1HB   ALA  67          1HB       ALA  67 -10.075  -5.050   7.491
  590   2HB   ALA  67          2HB       ALA  67 -10.431  -6.747   7.166
  591   3HB   ALA  67          3HB       ALA  67 -11.719  -5.658   7.680
  592    H    TRP  68           H        TRP  68  -9.802  -3.294   5.704
  593    HA   TRP  68           HA       TRP  68 -11.663  -1.277   6.213
  594   1HB   TRP  68          2HB       TRP  68  -9.305  -0.951   6.507
  595   2HB   TRP  68          1HB       TRP  68  -9.002  -1.359   4.832
  596    HD1  TRP  68           HD       TRP  68  -8.485   0.617   3.375
  597    HE1  TRP  68           1HE      TRP  68  -8.931   3.150   3.456
  598    HE3  TRP  68           3HE      TRP  68 -11.384   0.806   7.571
  599    HZ2  TRP  68           2HZ      TRP  68 -10.331   4.958   5.035
  600    HZ3  TRP  68           3HZ      TRP  68 -12.238   2.986   8.286
  601    HH2  TRP  68           HH       TRP  68 -11.701   5.036   7.007
  602    H    ASN  69           H        ASN  69 -10.519  -2.561   3.145
  603    HA   ASN  69           HA       ASN  69 -11.765  -0.862   1.330
  604   1HB   ASN  69          2HB       ASN  69 -10.116  -2.521   0.648
  605   2HB   ASN  69          1HB       ASN  69 -11.199  -3.827   1.110
  606   1HD2  ASN  69          1HD2      ASN  69 -12.910  -4.396  -0.279
  607   2HD2  ASN  69          2HD2      ASN  69 -13.034  -3.773  -1.864
  608    H    GLU  70           H        GLU  70 -13.004  -3.573   3.102
  609    HA   GLU  70           HA       GLU  70 -15.448  -3.810   1.708
  610   1HB   GLU  70          2HB       GLU  70 -14.728  -4.692   4.498
  611   2HB   GLU  70          1HB       GLU  70 -16.145  -5.207   3.597
  612   1HG   GLU  70          2HG       GLU  70 -13.285  -5.721   2.809
  613   2HG   GLU  70          1HG       GLU  70 -14.379  -6.894   3.541
  614    H    LYS  71           H        LYS  71 -14.483  -2.067   4.631
  615    HA   LYS  71           HA       LYS  71 -17.099  -1.176   5.305
  616   1HB   LYS  71          2HB       LYS  71 -14.381  -0.289   6.181
  617   2HB   LYS  71          1HB       LYS  71 -15.774   0.652   6.656
  618   1HG   LYS  71          2HG       LYS  71 -15.268  -0.804   8.438
  619   2HG   LYS  71          1HG       LYS  71 -16.712  -1.422   7.627
  620   1HD   LYS  71          2HD       LYS  71 -15.343  -3.078   6.462
  621   2HD   LYS  71          1HD       LYS  71 -13.907  -2.466   7.282
  622   1HE   LYS  71          2HE       LYS  71 -16.312  -3.737   8.592
  623   2HE   LYS  71          1HE       LYS  71 -14.728  -4.469   8.362
  624   1HZ   LYS  71          1HZ       LYS  71 -13.798  -2.726   9.810
  625   2HZ   LYS  71          2HZ       LYS  71 -14.927  -3.701  10.575
  626   3HZ   LYS  71          3HZ       LYS  71 -15.355  -2.142  10.135
  627    H    ARG  72           H        ARG  72 -14.859  -0.081   3.129
  628    HA   ARG  72           HA       ARG  72 -15.972   2.581   2.798
  629   1HB   ARG  72          2HB       ARG  72 -13.944   1.092   1.132
  630   2HB   ARG  72          1HB       ARG  72 -14.328   2.807   0.975
  631   1HG   ARG  72          2HG       ARG  72 -13.519   3.270   3.164
  632   2HG   ARG  72          1HG       ARG  72 -13.345   1.551   3.511
  633   1HD   ARG  72          2HD       ARG  72 -11.228   2.502   3.100
  634   2HD   ARG  72          1HD       ARG  72 -11.614   1.423   1.760
  635    HE   ARG  72           HE       ARG  72 -12.350   4.044   1.104
  636   1HH1  ARG  72          1HH1      ARG  72  -9.498   2.017   1.543
  637   2HH1  ARG  72          2HH1      ARG  72  -8.447   3.088   0.709
  638   1HH2  ARG  72          1HH2      ARG  72 -10.864   5.496  -0.037
  639   2HH2  ARG  72          2HH2      ARG  72  -9.207   5.038  -0.158
  640    H    ARG  73           H        ARG  73 -17.068  -0.337   1.986
  641    HA   ARG  73           HA       ARG  73 -18.569   0.678  -0.339
  642   1HB   ARG  73          2HB       ARG  73 -16.996  -1.167  -0.864
  643   2HB   ARG  73          1HB       ARG  73 -17.820  -2.176   0.314
  644   1HG   ARG  73          2HG       ARG  73 -19.889  -1.948  -1.051
  645   2HG   ARG  73          1HG       ARG  73 -18.942  -1.083  -2.259
  646   1HD   ARG  73          2HD       ARG  73 -19.067  -3.385  -2.917
  647   2HD   ARG  73          1HD       ARG  73 -17.420  -3.051  -2.376
  648    HE   ARG  73           HE       ARG  73 -19.473  -4.458  -0.823
  649   1HH1  ARG  73          1HH1      ARG  73 -16.004  -3.834  -1.466
  650   2HH1  ARG  73          2HH1      ARG  73 -15.483  -5.101  -0.455
  651   1HH2  ARG  73          1HH2      ARG  73 -18.679  -6.203   0.534
  652   2HH2  ARG  73          2HH2      ARG  73 -16.990  -6.448   0.671
  653    H    VAL  74           H        VAL  74 -18.547  -1.747   2.248
  654    HA   VAL  74           HA       VAL  74 -21.409  -1.456   2.632
  655    HB   VAL  74           HB       VAL  74 -19.459  -3.195   4.089
  656   1HG1  VAL  74          1HG1      VAL  74 -22.450  -3.395   3.817
  657   2HG1  VAL  74          2HG1      VAL  74 -21.557  -2.873   5.240
  658   3HG1  VAL  74          3HG1      VAL  74 -21.432  -4.545   4.686
  659   1HG2  VAL  74          1HG2      VAL  74 -21.104  -3.951   1.685
  660   2HG2  VAL  74          2HG2      VAL  74 -20.165  -5.085   2.654
  661   3HG2  VAL  74          3HG2      VAL  74 -19.348  -3.813   1.740
  662    H    TYR  75           H        TYR  75 -21.812   0.128   3.839
  663    HA   TYR  75           HA       TYR  75 -19.915   1.522   5.388
  664   1HB   TYR  75          2HB       TYR  75 -22.899   1.864   5.258
  665   2HB   TYR  75          1HB       TYR  75 -21.812   2.943   6.130
  666    HD1  TYR  75           1HD      TYR  75 -22.941   1.839   2.819
  667    HD2  TYR  75           2HD      TYR  75 -20.302   4.402   4.944
  668    HE1  TYR  75           1HE      TYR  75 -22.503   3.098   0.749
  669    HE2  TYR  75           2HE      TYR  75 -19.862   5.658   2.899
  670    HH   TYR  75           HH       TYR  75 -21.732   5.270   0.069
  671    H    GLU  76           H        GLU  76 -19.462   1.605   7.419
  672    HA   GLU  76           HA       GLU  76 -20.330  -0.617   9.018
  673   1HB   GLU  76          2HB       GLU  76 -17.988  -0.169   8.765
  674   2HB   GLU  76          1HB       GLU  76 -18.216   1.468   9.375
  675   1HG   GLU  76          2HG       GLU  76 -18.854   0.560  11.540
  676   2HG   GLU  76          1HG       GLU  76 -18.611  -1.074  10.919
  677    H    GLU  77           H        GLU  77 -21.748  -0.422  10.487
  678    HA   GLU  77           HA       GLU  77 -22.322   2.197  11.678
  679   1HB   GLU  77          2HB       GLU  77 -24.154   1.359  10.203
  680   2HB   GLU  77          1HB       GLU  77 -24.257  -0.092  11.178
  681   1HG   GLU  77          2HG       GLU  77 -26.040   1.430  11.745
  682   2HG   GLU  77          1HG       GLU  77 -24.931   1.276  13.109