NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image	mrblock_id	pdb_id	bmrb_id	cing	stage	position	program	type	subtype	subsubtype
	5899	1i5t	5026	cing	1-original	4	DYANA/DIANA	distance	NOE	simple

-30 LTNS PCN   135 HEMC FE      0.20  5.00E+00                 
  1 GLY  HN      1 GLY  HA1     3.39                
  1 GLY  HN      1 GLY  HA2     3.11                
  1 GLY  HN      2 ASP- HN      4.07                
  1 GLY  HN     96 ALA  QB      4.64                
  1 GLY  HA1     1 GLY  HA2     2.43                
  1 GLY  HA1     2 ASP- HN      3.64                
  1 GLY  HA1    93 ASP- HA      4.23                
  1 GLY  HA2     2 ASP- HN      3.61                
  1 GLY  HA2    92 GLU- HB2     4.45                
  1 GLY  HA2    93 ASP- HA      3.67                
  1 GLY  HA2    96 ALA  QB      3.43                
  2 ASP- HN      2 ASP- HA      3.42                
  2 ASP- HN      2 ASP- HB2     3.05                
  2 ASP- HN      2 ASP- HB3     3.24                
  2 ASP- HN      3 VAL  HN      5.34                
  2 ASP- HN      5 LYS+ HB2     4.17                
  2 ASP- HN      5 LYS+ HB3     5.50                
  2 ASP- HN      6 GLY  HN      5.50                
  2 ASP- HN     93 ASP- HN      5.50                
  2 ASP- HN     93 ASP- HA      2.86                
  2 ASP- HN     93 ASP- HB2     5.50                
  2 ASP- HN     93 ASP- HB3     5.19                
  2 ASP- HN     96 ALA  QB      5.01                
  2 ASP- HA      2 ASP- HB2     3.39                
  2 ASP- HA      2 ASP- HB3     2.99                
  2 ASP- HA      3 VAL  HN      2.68                
  2 ASP- HA     96 ALA  QB      4.79                
  2 ASP- HB2     2 ASP- HB3     2.40                
  2 ASP- HB2     3 VAL  HN      4.82                
  2 ASP- HB2     5 LYS+ HN      4.23                
  2 ASP- HB2     5 LYS+ HB2     2.80                
  2 ASP- HB2     5 LYS+ HB3     5.28                
  2 ASP- HB2     5 LYS+ HG3     4.07                
  2 ASP- HB2    93 ASP- HA      5.50                
  2 ASP- HB3     3 VAL  HN      4.32                
  2 ASP- HB3     5 LYS+ HN      4.32                
  2 ASP- HB3     5 LYS+ HB2     3.21                
  2 ASP- HB3     5 LYS+ HB3     5.22                
  2 ASP- HB3     5 LYS+ HG3     4.20                
  2 ASP- HB3    93 ASP- HA      5.50                
  3 VAL  HN      3 VAL  HA      3.36                
  3 VAL  HN      3 VAL  HB      2.90                
  3 VAL  HN      3 VAL  QG1     3.43                
  3 VAL  HN      3 VAL  QG2     4.51                
  3 VAL  HN      4 GLU- HN      3.24                
  3 VAL  HN      5 LYS+ HN      5.16                
  3 VAL  HN     96 ALA  QB      5.41                
  3 VAL  HN     97 TYR  HA      4.72                
  3 VAL  HA      3 VAL  HB      3.05                
  3 VAL  HA      3 VAL  QG1     3.89                
  3 VAL  HA      3 VAL  QG2     3.61                
  3 VAL  HA      4 GLU- HN      3.70                
  3 VAL  HA      5 LYS+ HN      5.50                
  3 VAL  HA      6 GLY  HN      3.67                
  3 VAL  HA      6 GLY  HA2     4.01                
  3 VAL  HA      7 LYS+ HN      4.17                
  3 VAL  HA     96 ALA  QB      4.23                
  3 VAL  HA     97 TYR  HN      3.55                
  3 VAL  HA     97 TYR  HA      3.11                
  3 VAL  HA     97 TYR  HB3     3.95                
  3 VAL  HA     97 TYR  HD1     5.38                
  3 VAL  HB      3 VAL  QG1     3.43                
  3 VAL  HB      3 VAL  QG2     3.43                
  3 VAL  HB      6 GLY  HN      5.31                
  3 VAL  HB     96 ALA  QB      4.23                
  3 VAL  HB     97 TYR  HA      5.50                
  3 VAL  QG1     4 GLU- HN      4.48                
  3 VAL  QG1    96 ALA  HA      6.53                
  3 VAL  QG1    96 ALA  QB      5.32                
  3 VAL  QG1    97 TYR  HN      6.53                
  3 VAL  QG1    97 TYR  HA      4.30                
  3 VAL  QG1    97 TYR  HB3     6.53                
  3 VAL  QG1   100 LYS+ HN      6.50                
  3 VAL  QG1   100 LYS+ QE      7.40                
  3 VAL  QG2     4 GLU- HN      4.48                
  3 VAL  QG2     4 GLU- HA      6.06                
  3 VAL  QG2     7 LYS+ HN      5.81                
  3 VAL  QG2     7 LYS+ HA      5.81                
  3 VAL  QG2    96 ALA  QB      7.56                
  3 VAL  QG2    97 TYR  HN      6.06                
  3 VAL  QG2    97 TYR  HA      3.46                
  3 VAL  QG2    97 TYR  HB3     5.75                
  3 VAL  QG2    97 TYR  HD1     4.30                
  3 VAL  QG2   100 LYS+ HN      6.28                
  3 VAL  QG2   100 LYS+ QE      7.40                
  4 GLU- HN      4 GLU- HA      3.33                
  4 GLU- HN      4 GLU- HB2     2.59                
  4 GLU- HN      4 GLU- HG2     4.29                
  4 GLU- HN      4 GLU- HG3     4.26                
  4 GLU- HN      6 GLY  HN      3.86                
  4 GLU- HA      4 GLU- HB2     2.90                
  4 GLU- HA      4 GLU- HG2     5.50                
  4 GLU- HA      4 GLU- HG3     4.23                
  4 GLU- HA      5 LYS+ HN      3.58                
  4 GLU- HA      6 GLY  HN      4.01                
  4 GLU- HA      7 LYS+ HN      3.45                
  4 GLU- HA      7 LYS+ QB      4.30                
  4 GLU- HA      7 LYS+ HD2     4.79                
  4 GLU- HA      8 LYS+ HN      4.88                
  4 GLU- HA     97 TYR  HB2     5.50                
  4 GLU- HB2     5 LYS+ HN      3.14                
  4 GLU- HB2     6 GLY  HN      5.34                
  4 GLU- HG2     5 LYS+ HN      5.50                
  4 GLU- HG3     5 LYS+ HN      5.50                
  5 LYS+ HN      5 LYS+ HA      3.42                
  5 LYS+ HN      5 LYS+ HB2     2.71                
  5 LYS+ HN      5 LYS+ HB3     3.64                
  5 LYS+ HN      5 LYS+ HG2     4.07                
  5 LYS+ HN      5 LYS+ HG3     3.67                
  5 LYS+ HN      6 GLY  HN      3.02                
  5 LYS+ HN      7 LYS+ HN      4.85                
  5 LYS+ HA      5 LYS+ HB2     3.05                
  5 LYS+ HA      5 LYS+ HB3     3.11                
  5 LYS+ HA      5 LYS+ HG2     3.17                
  5 LYS+ HA      5 LYS+ HG3     3.76                
  5 LYS+ HA      6 GLY  HN      3.48                
  5 LYS+ HA      7 LYS+ HN      4.42                
  5 LYS+ HA      8 LYS+ HN      3.67                
  5 LYS+ HA      8 LYS+ HB2     2.90                
  5 LYS+ HA      9 ILE  HN      4.66                
  5 LYS+ HB2     6 GLY  HN      3.52                
  5 LYS+ HB2    93 ASP- HB2     4.51                
  5 LYS+ HB2    93 ASP- HB3     3.30                
  5 LYS+ HB3     6 GLY  HN      4.23                
  5 LYS+ HB3     9 ILE  QD1     3.55                
  5 LYS+ HG3     6 GLY  HN      5.50                
  6 GLY  HN      6 GLY  HA1     3.11                
  6 GLY  HN      6 GLY  HA2     3.08                
  6 GLY  HN      7 LYS+ HN      3.30                
  6 GLY  HN      8 LYS+ HN      5.50                
  6 GLY  HN     93 ASP- HB2     5.47                
  6 GLY  HN     93 ASP- HB3     3.76                
  6 GLY  HN     94 LEU  HA      4.54                
  6 GLY  HN     97 TYR  HN      5.38                
  6 GLY  HN     97 TYR  HB3     5.04                
  6 GLY  HA1     6 GLY  HA2     2.43                
  6 GLY  HA1     7 LYS+ HN      3.61                
  6 GLY  HA1     9 ILE  HN      4.29                
  6 GLY  HA1     9 ILE  QG2     6.00                
  6 GLY  HA1     9 ILE  QD1     3.89                
  6 GLY  HA1    10 PHE  HN      5.50                
  6 GLY  HA1    93 ASP- HB2     4.97                
  6 GLY  HA1    93 ASP- HB3     4.79                
  6 GLY  HA1    94 LEU  HN      4.57                
  6 GLY  HA1    94 LEU  HA      3.36                
  6 GLY  HA1    94 LEU  HB3     4.97                
  6 GLY  HA1    94 LEU  QD1     6.25                
  6 GLY  HA1    97 TYR  HN      5.50                
  6 GLY  HA1    97 TYR  HB2     4.97                
  6 GLY  HA1    97 TYR  HB3     4.48                
  6 GLY  HA2     7 LYS+ HN      3.45                
  6 GLY  HA2     9 ILE  QD1     6.53                
  6 GLY  HA2    10 PHE  HN      5.50                
  6 GLY  HA2    93 ASP- HB2     5.28                
  6 GLY  HA2    93 ASP- HB3     4.63                
  6 GLY  HA2    94 LEU  HN      5.31                
  6 GLY  HA2    94 LEU  HB3     5.50                
  6 GLY  HA2    94 LEU  QD1     4.39                
  6 GLY  HA2    97 TYR  HN      4.17                
  6 GLY  HA2    97 TYR  HB2     3.79                
  6 GLY  HA2    97 TYR  HB3     4.42                
  7 LYS+ HN      7 LYS+ HA      3.30                
  7 LYS+ HN      7 LYS+ QB      4.24                
  7 LYS+ HN      7 LYS+ HG2     5.50                
  7 LYS+ HN      7 LYS+ HD2     3.45                
  7 LYS+ HN      8 LYS+ HN      3.14                
  7 LYS+ HN      9 ILE  HN      4.63                
  7 LYS+ HN     97 TYR  HB2     4.14                
  7 LYS+ HN     97 TYR  HB3     4.85                
  7 LYS+ HN     97 TYR  HD2     5.50                
  7 LYS+ HA      7 LYS+ QB      4.61                
  7 LYS+ HA      7 LYS+ HG2     3.45                
  7 LYS+ HA      7 LYS+ HG3     3.48                
  7 LYS+ HA      7 LYS+ HD2     3.42                
  7 LYS+ HA      8 LYS+ HN      4.17                
  7 LYS+ HA      9 ILE  HN      5.50                
  7 LYS+ HA     10 PHE  HN      4.01                
  7 LYS+ HA     10 PHE  HB2     3.89                
  7 LYS+ HA     10 PHE  HB3     3.45                
  7 LYS+ HA     11 VAL  HN      4.04                
  7 LYS+ HA     97 TYR  HD1     5.50                
  7 LYS+ HA     97 TYR  HD2     5.50                
  7 LYS+ HA     97 TYR  HE1     5.50                
  7 LYS+ QB      7 LYS+ HG2     4.76                
  7 LYS+ QB      7 LYS+ HG3     4.11                
  7 LYS+ QB      7 LYS+ HD2     3.37                
  7 LYS+ QB      8 LYS+ HN      4.45                
  7 LYS+ HG2     7 LYS+ HG3     2.40                
  7 LYS+ HG2     7 LYS+ HD2     2.86                
  7 LYS+ HG2     7 LYS+ QE      6.38                
  7 LYS+ HG2     8 LYS+ HN      5.50                
  7 LYS+ HG3     7 LYS+ QE      6.38                
  7 LYS+ HG3    97 TYR  HE1     5.50                
  7 LYS+ HD2     7 LYS+ QE      6.07                
  7 LYS+ HD2    97 TYR  HE1     5.50                
  8 LYS+ HN      8 LYS+ HA      3.17                
  8 LYS+ HN      8 LYS+ HB2     2.71                
  8 LYS+ HN      8 LYS+ HG2     4.32                
  8 LYS+ HN      9 ILE  HN      2.83                
  8 LYS+ HN     10 PHE  HN      4.07                
  8 LYS+ HA      8 LYS+ HB2     2.83                
  8 LYS+ HA      8 LYS+ HG2     3.45                
  8 LYS+ HA      8 LYS+ QE      6.38                
  8 LYS+ HA      9 ILE  HN      3.76                
  8 LYS+ HA     10 PHE  HN      4.97                
  8 LYS+ HA     11 VAL  HN      3.73                
  8 LYS+ HA     11 VAL  HB      2.71                
  8 LYS+ HA     11 VAL  QG1     5.41                
  8 LYS+ HA     12 GLN  HN      4.76                
  8 LYS+ HB2     8 LYS+ HG2     3.05                
  8 LYS+ HB2     8 LYS+ QE      5.76                
  8 LYS+ HB2     9 ILE  HN      3.17                
  8 LYS+ HB2     9 ILE  QD1     4.95                
  8 LYS+ HG2     8 LYS+ QE      6.38                
  9 ILE  HN      9 ILE  HA      3.36                
  9 ILE  HN      9 ILE  HB      2.90                
  9 ILE  HN      9 ILE  QG2     4.54                
  9 ILE  HN      9 ILE  HG12    3.92                
  9 ILE  HN      9 ILE  HG13    2.93                
  9 ILE  HN      9 ILE  QD1     4.73                
  9 ILE  HN     10 PHE  HN      3.08                
  9 ILE  HN     10 PHE  HB2     5.50                
  9 ILE  HN     10 PHE  HB3     5.10                
  9 ILE  HN     11 VAL  HN      5.50                
  9 ILE  HN     11 VAL  QG2     6.53                
  9 ILE  HN     12 GLN  HN      5.50                
  9 ILE  HN     94 LEU  QD1     5.47                
  9 ILE  HA      9 ILE  HB      2.99                
  9 ILE  HA      9 ILE  QG2     3.55                
  9 ILE  HA      9 ILE  HG12    3.42                
  9 ILE  HA      9 ILE  HG13    3.02                
  9 ILE  HA      9 ILE  QD1     4.73                
  9 ILE  HA     10 PHE  HN      3.79                
  9 ILE  HA     12 GLN  HN      3.61                
  9 ILE  HA     12 GLN  HB2     3.05                
  9 ILE  HA     12 GLN  HB3     4.48                
  9 ILE  HA     13 LYS+ HN      4.85                
  9 ILE  HB      9 ILE  QG2     3.43                
  9 ILE  HB      9 ILE  HG12    3.67                
  9 ILE  HB      9 ILE  QD1     3.43                
  9 ILE  HB     10 PHE  HN      3.05                
  9 ILE  HB     94 LEU  HB2     3.21                
  9 ILE  HB     94 LEU  HB3     4.79                
  9 ILE  HB     94 LEU  QD1     3.74                
  9 ILE  HB     94 LEU  QD2     4.85                
  9 ILE  QG2     9 ILE  HG12    3.92                
  9 ILE  QG2     9 ILE  HG13    4.05                
  9 ILE  QG2     9 ILE  QD1     6.10                
  9 ILE  QG2    10 PHE  HN      4.64                
  9 ILE  QG2    10 PHE  HA      5.88                
  9 ILE  QG2    12 GLN  HN      6.53                
  9 ILE  QG2    13 LYS+ HN      5.81                
  9 ILE  QG2    13 LYS+ HA      6.53                
  9 ILE  QG2    13 LYS+ HB2     4.64                
  9 ILE  QG2    13 LYS+ QE      6.32                
  9 ILE  QG2    85 ILE  QD1     4.67                
  9 ILE  QG2    90 GLU- HB3     3.43                
  9 ILE  QG2    90 GLU- HG3     6.53                
  9 ILE  QG2    94 LEU  HA      5.60                
  9 ILE  HG12    9 ILE  HG13    2.40                
  9 ILE  HG12    9 ILE  QD1     3.43                
  9 ILE  HG13    9 ILE  QD1     3.43                
  9 ILE  HG13   10 PHE  HN      5.50                
  9 ILE  QD1    10 PHE  HN      6.34                
  9 ILE  QD1    13 LYS+ QE      6.63                
  9 ILE  QD1    90 GLU- HA      3.71                
  9 ILE  QD1    90 GLU- HB2     4.61                
  9 ILE  QD1    90 GLU- HB3     3.58                
  9 ILE  QD1    90 GLU- HG2     3.74                
  9 ILE  QD1    90 GLU- HG3     4.79                
  9 ILE  QD1    93 ASP- HN      6.53                
  9 ILE  QD1    93 ASP- HB2     4.39                
  9 ILE  QD1    93 ASP- HB3     4.42                
  9 ILE  QD1    94 LEU  HN      4.67                
  9 ILE  QD1    94 LEU  HA      6.53                
 10 PHE  HN     10 PHE  HA      3.30                
 10 PHE  HN     10 PHE  HB2     2.99                
 10 PHE  HN     10 PHE  HB3     2.96                
 10 PHE  HN     11 VAL  HN      3.17                
 10 PHE  HN     12 GLN  HN      4.29                
 10 PHE  HN     94 LEU  QD1     3.89                
 10 PHE  HN     94 LEU  QD2     6.37                
 10 PHE  HA     10 PHE  HB2     3.30                
 10 PHE  HA     10 PHE  HB3     3.52                
 10 PHE  HA     10 PHE  HD1     5.50                
 10 PHE  HA     10 PHE  HD2     5.50                
 10 PHE  HA     12 GLN  HN      5.50                
 10 PHE  HA     13 LYS+ HN      4.23                
 10 PHE  HA     14 CYSS HN      4.57                
 10 PHE  HA     14 CYSS HB3     3.45                
 10 PHE  HA     94 LEU  QD1     4.23                
 10 PHE  HA     94 LEU  QD2     5.97                
 10 PHE  HB2    10 PHE  HB3     2.40                
 10 PHE  HB2    10 PHE  HD1     5.50                
 10 PHE  HB2    10 PHE  HD2     5.50                
 10 PHE  HB2    11 VAL  HN      3.83                
 10 PHE  HB2    94 LEU  QD1     3.58                
 10 PHE  HB2    94 LEU  QD2     5.29                
 10 PHE  HB2    97 TYR  HE2     5.50                
 10 PHE  HB2    98 LEU  QD2     6.53                
 10 PHE  HB3    10 PHE  HD1     4.97                
 10 PHE  HB3    10 PHE  HD2     5.50                
 10 PHE  HB3    11 VAL  HN      3.24                
 10 PHE  HB3    11 VAL  QG2     5.32                
 10 PHE  HB3    94 LEU  QD1     4.23                
 10 PHE  HB3    94 LEU  QD2     6.53                
 10 PHE  HB3    97 TYR  HD2     5.50                
 10 PHE  HB3    97 TYR  HE2     5.50                
 10 PHE  HD1    10 PHE  HD2     3.24                
 10 PHE  HD1    10 PHE  HE1     5.50                
 10 PHE  HD1    10 PHE  HZ      5.50                
 10 PHE  HD1    15 ALA  QB      6.06                
 10 PHE  HD1    98 LEU  QD2     6.00                
 10 PHE  HD2    10 PHE  HE1     5.50                
 10 PHE  HD2    10 PHE  HZ      5.50                
 10 PHE  HD2    98 LEU  QD2     6.19                
 10 PHE  HD2   135 HEMC QM1     6.37                
 10 PHE  HE1    10 PHE  HE2     2.86                
 10 PHE  HE1    10 PHE  HZ      2.86                
 10 PHE  HE1    15 ALA  QB      5.10                
 10 PHE  HE1    32 LEU  QD1     6.53                
 10 PHE  HE1    98 LEU  QD2     6.50                
 10 PHE  HE2    10 PHE  HZ      3.05                
 10 PHE  HE2    98 LEU  QD2     6.19                
 10 PHE  HE2   135 HEMC QM1     5.50                
 10 PHE  HZ     14 CYSS HB3     5.50                
 10 PHE  HZ     15 ALA  HA      4.66                
 10 PHE  HZ     15 ALA  QB      6.12                
 10 PHE  HZ     18 HIS  HN      5.50                
 10 PHE  HZ     18 HIS  HB2     3.70                
 10 PHE  HZ     18 HIS  HB3     3.45                
 10 PHE  HZ     19 THR  HA      5.19                
 10 PHE  HZ     20 VAL  HN      5.50                
 10 PHE  HZ     20 VAL  QG1     3.86                
 10 PHE  HZ     20 VAL  QG2     5.78                
 10 PHE  HZ     32 LEU  QD1     5.35                
 10 PHE  HZ     98 LEU  QD2     5.75                
 11 VAL  HN     11 VAL  HA      3.21                
 11 VAL  HN     11 VAL  HB      2.74                
 11 VAL  HN     11 VAL  QG1     4.45                
 11 VAL  HN     11 VAL  QG2     3.43                
 11 VAL  HN     12 GLN  HN      3.17                
 11 VAL  HN     12 GLN  HG3     5.50                
 11 VAL  HN     13 LYS+ HN      5.25                
 11 VAL  HN     94 LEU  QD1     6.53                
 11 VAL  HA     11 VAL  HB      2.96                
 11 VAL  HA     11 VAL  QG1     3.43                
 11 VAL  HA     11 VAL  QG2     3.49                
 11 VAL  HA     13 LYS+ HN      5.16                
 11 VAL  HA     14 CYSS HN      5.50                
 11 VAL  HA     15 ALA  HN      3.61                
 11 VAL  HA     15 ALA  HA      5.25                
 11 VAL  HA     15 ALA  QB      3.43                
 11 VAL  HB     11 VAL  QG1     3.43                
 11 VAL  HB     11 VAL  QG2     3.43                
 11 VAL  HB     12 GLN  HN      3.45                
 11 VAL  HB     12 GLN  HG2     4.63                
 11 VAL  HB     12 GLN  HG3     4.82                
 11 VAL  QG1    11 VAL  QG2     4.83                
 11 VAL  QG1    12 GLN  HN      4.95                
 11 VAL  QG1    12 GLN  HA      5.32                
 11 VAL  QG1    15 ALA  QB      5.54                
 11 VAL  QG2    12 GLN  HN      5.23                
 11 VAL  QG2    15 ALA  QB      5.51                
 12 GLN  HN     12 GLN  HA      3.36                
 12 GLN  HN     12 GLN  HB2     2.90                
 12 GLN  HN     12 GLN  HB3     3.76                
 12 GLN  HN     12 GLN  HG2     4.48                
 12 GLN  HN     12 GLN  HG3     3.86                
 12 GLN  HN     13 LYS+ HN      3.11                
 12 GLN  HN     13 LYS+ HB2     5.50                
 12 GLN  HN     14 CYSS HN      5.28                
 12 GLN  HA     12 GLN  HB2     3.17                
 12 GLN  HA     12 GLN  HB3     2.83                
 12 GLN  HA     12 GLN  HG2     3.05                
 12 GLN  HA     12 GLN  HG3     4.01                
 12 GLN  HA     13 LYS+ HN      3.89                
 12 GLN  HB2    12 GLN  HG2     3.48                
 12 GLN  HB2    12 GLN  HG3     3.36                
 12 GLN  HB2    13 LYS+ HN      3.55                
 12 GLN  HB3    12 GLN  HG2     3.39                
 12 GLN  HB3    12 GLN  HG3     3.76                
 12 GLN  HB3    13 LYS+ HN      4.23                
 12 GLN  HG2    12 GLN  HG3     2.55                
 12 GLN  HG3    12 GLN  HE21    5.50                
 12 GLN  HG3    12 GLN  HE22    5.50                
 12 GLN  HE21   12 GLN  HE22    2.40                
 13 LYS+ HN     13 LYS+ HA      3.64                
 13 LYS+ HN     13 LYS+ HB2     3.30                
 13 LYS+ HN     13 LYS+ QG      5.82                
 13 LYS+ HN     13 LYS+ QD      4.86                
 13 LYS+ HN     14 CYSS HN      3.05                
 13 LYS+ HN     15 ALA  HN      4.38                
 13 LYS+ HA     13 LYS+ HB2     3.24                
 13 LYS+ HA     13 LYS+ QG      4.11                
 13 LYS+ HA     13 LYS+ QD      4.45                
 13 LYS+ HA     13 LYS+ QE      6.38                
 13 LYS+ HA     14 CYSS HN      4.14                
 13 LYS+ HA    135 HEMC QT2     6.50                
 13 LYS+ HB2    13 LYS+ QG      3.49                
 13 LYS+ HB2    13 LYS+ QE      6.38                
 13 LYS+ HB2    85 ILE  QD1     5.60                
 13 LYS+ HB2   135 HEMC QT2     4.17                
 13 LYS+ QG     13 LYS+ QE      7.25                
 13 LYS+ QG     14 CYSS HN      6.38                
 13 LYS+ QG     85 ILE  QD1     5.95                
 13 LYS+ QG    135 HEMC QT2     5.30                
 13 LYS+ QD     13 LYS+ QE      5.55                
 13 LYS+ QD     14 CYSS HN      6.38                
 13 LYS+ QE     85 ILE  QG2     7.40                
 13 LYS+ QE     85 ILE  QD1     7.40                
 14 CYSS HN     14 CYSS HA      3.73                
 14 CYSS HN     14 CYSS HB2     4.79                
 14 CYSS HN     14 CYSS HB3     3.64                
 14 CYSS HN     15 ALA  HN      2.65                
 14 CYSS HN     15 ALA  HA      4.88                
 14 CYSS HN     15 ALA  QB      5.04                
 14 CYSS HN     16 GLN  HN      5.50                
 14 CYSS HN    135 HEMC HT2A    5.50                
 14 CYSS HA     15 ALA  HN      4.45                
 14 CYSS HA    135 HEMC HT2A    3.14                
 14 CYSS HA    135 HEMC QM3     3.80                
 14 CYSS HB2   135 HEMC QM1     6.53                
 14 CYSS HB3    15 ALA  HN      3.36                
 14 CYSS HB3   135 HEMC QM1     5.94                
 14 CYSS SG    135 HEMC CAB     2.10  5.00E+00                 
 15 ALA  HN     15 ALA  HA      3.17                
 15 ALA  HN     15 ALA  QB      3.43                
 15 ALA  HN     16 GLN  HN      3.83                
 15 ALA  HN     17 CYSS HN      5.50                
 15 ALA  HA     15 ALA  QB      3.43                
 15 ALA  HA     16 GLN  HN      4.23                
 15 ALA  HA     17 CYSS HN      4.38                
 15 ALA  HA     18 HIS  HN      3.48                
 15 ALA  HA     18 HIS  HB3     5.50                
 15 ALA  QB     16 GLN  HN      4.85                
 15 ALA  QB     18 HIS  HN      6.53                
 16 GLN  HN     16 GLN  HA      3.58                
 16 GLN  HN     16 GLN  HB2     3.33                
 16 GLN  HN     16 GLN  HB3     3.55                
 16 GLN  HN     16 GLN  HG2     5.50                
 16 GLN  HN     16 GLN  HG3     4.57                
 16 GLN  HN     17 CYSS HN      3.52                
 16 GLN  HN     18 HIS  HN      3.89                
 16 GLN  HA     16 GLN  HB2     2.96                
 16 GLN  HA     16 GLN  HG2     4.72                
 16 GLN  HA     16 GLN  HG3     5.10                
 16 GLN  HA     17 CYSS HN      5.50                
 16 GLN  HB2    16 GLN  HG2     3.02                
 16 GLN  HB2    16 GLN  HG3     2.40                
 16 GLN  HB2    17 CYSS HN      4.97                
 16 GLN  HB2   135 HEMC QT4     6.53                
 16 GLN  HB3    17 CYSS HN      4.57                
 16 GLN  HG2    16 GLN  HG3     2.40                
 16 GLN  HG2    16 GLN  HE21    5.28                
 16 GLN  HG2    16 GLN  HE22    5.50                
 16 GLN  HG2    17 CYSS HN      5.50                
 16 GLN  HG2   135 HEMC QM3     6.53                
 16 GLN  HG2   135 HEMC QT4     6.53                
 16 GLN  HG3    16 GLN  HE21    5.25                
 16 GLN  HG3    16 GLN  HE22    5.50                
 16 GLN  HG3    17 CYSS HN      5.50                
 16 GLN  HG3   135 HEMC QM3     6.53                
 16 GLN  HG3   135 HEMC QT4     6.53                
 16 GLN  HE21   16 GLN  HE22    2.40                
 16 GLN  HE21  135 HEMC QM3     6.53                
 16 GLN  HE21  135 HEMC HT4A    5.50                
 16 GLN  HE21  135 HEMC QT4     6.53                
 16 GLN  HE22  135 HEMC HT4A    5.50                
 16 GLN  HE22  135 HEMC QT4     6.53                
 17 CYSS HN     17 CYSS HA      4.11                
 17 CYSS HN     18 HIS  HN      2.83                
 17 CYSS HA     27 LYS+ HA      5.50                
 17 CYSS HA     27 LYS+ HB2     3.73                
 17 CYSS HA     27 LYS+ HD2     5.50                
 17 CYSS HA     27 LYS+ QE      6.38                
 17 CYSS HA     28 THR  HN      5.50                
 17 CYSS HA     28 THR  HA      5.50                
 17 CYSS HA     28 THR  HB      3.92                
 17 CYSS HA     28 THR  QG2     6.53                
 17 CYSS SG    135 HEMC CAC     2.10  5.00E+00                 
 18 HIS  HN     18 HIS  HA      2.99                
 18 HIS  HN     18 HIS  HB2     3.89                
 18 HIS  HN     18 HIS  HB3     5.50                
 18 HIS  HA     18 HIS  HB2     3.55                
 18 HIS  HA     18 HIS  HB3     3.24                
 18 HIS  HA     19 THR  HA      4.97                
 18 HIS  HA     19 THR  HB      5.50                
 18 HIS  HA     27 LYS+ QB      6.25                
 18 HIS  HA     27 LYS+ HD2     4.57                
 18 HIS  HA     27 LYS+ QD      4.64                
 18 HIS  HA     31 ASN  HA      5.13                
 18 HIS  HB2    18 HIS  HB3     2.40                
 18 HIS  HB2    32 LEU  HG      5.07                
 18 HIS  HB3    20 VAL  QG1     6.53                
 18 HIS  HB3    32 LEU  HG      3.70                
 18 HIS  HB3    32 LEU  QD1     4.02                
 18 HIS  HB3    32 LEU  QD2     6.53                
 18 HIS  HD1    32 LEU  HG      3.00                
 18 HIS  HD1    32 LEU  QD1     5.50                
 18 HIS  HD1    32 LEU  QD2     4.00                
 18 HIS  NE2   135 HEMC FE      2.20  5.00E+00                 
 18 HIS  HD2   135 HEMC QM1     6.00  5.00E+00                 
 18 HIS  HD2   135 HEMC QM3     6.00  5.00E+00                 
 19 THR  HN     19 THR  HA      3.42                
 19 THR  HN     19 THR  HB      5.50                
 19 THR  HN     19 THR  QG2     4.08                
 19 THR  HN     19 THR  HG1     5.50                
 19 THR  HN     31 ASN  HA      3.24                
 19 THR  HN     32 LEU  HN      5.31                
 19 THR  HA     19 THR  HB      2.83                
 19 THR  HA     19 THR  QG2     3.43                
 19 THR  HA     19 THR  HG1     5.50                
 19 THR  HA     20 VAL  HN      2.68                
 19 THR  HA     20 VAL  HA      5.50                
 19 THR  HA     20 VAL  QG1     4.88                
 19 THR  HA     20 VAL  QG2     4.82                
 19 THR  HA     21 GLU- HN      4.97                
 19 THR  HB     19 THR  QG2     3.43                
 19 THR  HB     19 THR  HG1     3.95                
 19 THR  HB     20 VAL  HN      3.14                
 19 THR  HB     20 VAL  QG1     6.53                
 19 THR  HB     20 VAL  QG2     6.34                
 19 THR  HB     21 GLU- HN      4.17                
 19 THR  HB     21 GLU- HG2     5.50                
 19 THR  HB     24 GLY  HN      5.50                
 19 THR  HB     24 GLY  HA1     5.50                
 19 THR  HB     24 GLY  HA2     5.47                
 19 THR  HB     31 ASN  HA      5.07                
 19 THR  HB     31 ASN  HB2     5.44                
 19 THR  HB     31 ASN  HB3     5.50                
 19 THR  HB     31 ASN  QD2     6.37                
 19 THR  QG2    19 THR  HG1     5.63                
 19 THR  QG2    20 VAL  HN      4.70                
 19 THR  QG2    20 VAL  QG1     7.56                
 19 THR  QG2    21 GLU- HN      6.53                
 19 THR  QG2    24 GLY  HA1     5.88                
 19 THR  QG2    24 GLY  HA2     6.53                
 19 THR  QG2    31 ASN  HA      5.04                
 19 THR  HG1    20 VAL  HA      5.50                
 19 THR  HG1    24 GLY  HN      4.85                
 19 THR  HG1    24 GLY  HA2     4.01                
 19 THR  HG1    31 ASN  HN      5.50                
 19 THR  HG1    31 ASN  HA      3.48                
 19 THR  HG1    31 ASN  HB2     3.33                
 19 THR  HG1    31 ASN  HB3     4.76                
 20 VAL  HN     20 VAL  HA      3.55                
 20 VAL  HN     20 VAL  HB      4.32                
 20 VAL  HN     20 VAL  QG1     4.36                
 20 VAL  HN     20 VAL  QG2     3.43                
 20 VAL  HN     21 GLU- HN      2.96                
 20 VAL  HN     21 GLU- HA      5.50                
 20 VAL  HN     21 GLU- HB2     4.51                
 20 VAL  HN     21 GLU- HG2     5.50                
 20 VAL  HN    101 ALA  QB      6.53                
 20 VAL  HA     20 VAL  HB      2.71                
 20 VAL  HA     20 VAL  QG1     3.58                
 20 VAL  HA     20 VAL  QG2     4.02                
 20 VAL  HA     31 ASN  QD2     6.37                
 20 VAL  HA     32 LEU  HN      3.36                
 20 VAL  HA     32 LEU  HB2     3.83                
 20 VAL  HA     32 LEU  HB3     5.50                
 20 VAL  HA     33 HIS  HN      4.60                
 20 VAL  HA     33 HIS  HB2     5.50                
 20 VAL  HA    101 ALA  QB      6.53                
 20 VAL  HB     20 VAL  QG1     3.43                
 20 VAL  HB     20 VAL  QG2     3.43                
 20 VAL  HB     98 LEU  QD2     5.94                
 20 VAL  HB    101 ALA  HN      5.50                
 20 VAL  HB    101 ALA  QB      3.99                
 20 VAL  HB    102 THR  QG2     3.43                
 20 VAL  QG1    20 VAL  QG2     6.07                
 20 VAL  QG1    32 LEU  HN      6.12                
 20 VAL  QG1    32 LEU  QD1     7.56                
 20 VAL  QG1    97 TYR  HE1     6.53                
 20 VAL  QG1    97 TYR  HE2     6.53                
 20 VAL  QG1    98 LEU  HA      5.29                
 20 VAL  QG1    98 LEU  QD2     6.04                
 20 VAL  QG1   102 THR  HA      6.09                
 20 VAL  QG2    21 GLU- HN      4.64                
 20 VAL  QG2    21 GLU- HA      6.53                
 20 VAL  QG2    21 GLU- HB2     4.98                
 20 VAL  QG2    21 GLU- HG2     4.70                
 20 VAL  QG2    32 LEU  HN      6.53                
 20 VAL  QG2    97 TYR  HE1     5.41                
 20 VAL  QG2    97 TYR  HE2     6.53                
 20 VAL  QG2    98 LEU  QD2     5.39                
 20 VAL  QG2   101 ALA  QB      4.46                
 20 VAL  QG2   102 THR  HA      5.01                
 21 GLU- HN     21 GLU- HA      4.51                
 21 GLU- HN     21 GLU- HB2     3.33                
 21 GLU- HN     21 GLU- HG2     4.45                
 21 GLU- HA     21 GLU- HB2     2.74                
 21 GLU- HA     21 GLU- HG2     3.55                
 21 GLU- HA     22 LYS+ HN      2.74                
 21 GLU- HA     22 LYS+ HG3     5.50                
 21 GLU- HB2    21 GLU- HG2     2.40                
 21 GLU- HB2    22 LYS+ HN      2.86                
 21 GLU- HB2    24 GLY  HN      3.92                
 21 GLU- HG2    22 LYS+ HN      4.57                
 21 GLU- HG2    24 GLY  HN      3.79                
 21 GLU- HG2    24 GLY  HA1     5.44                
 21 GLU- HG2    24 GLY  HA2     4.69                
 22 LYS+ HN     22 LYS+ HA      3.39                
 22 LYS+ HN     22 LYS+ HB2     2.96                
 22 LYS+ HN     22 LYS+ HG2     5.50                
 22 LYS+ HN     22 LYS+ HG3     3.11                
 22 LYS+ HN     22 LYS+ HD2     5.50                
 22 LYS+ HN     22 LYS+ HD3     5.50                
 22 LYS+ HN     22 LYS+ HE2     5.50                
 22 LYS+ HN     24 GLY  HN      5.50                
 22 LYS+ HN     33 HIS  HB2     5.50                
 22 LYS+ HN     33 HIS  HD2     5.50                
 22 LYS+ HA     22 LYS+ HB2     3.39                
 22 LYS+ HA     22 LYS+ HG2     3.55                
 22 LYS+ HA     22 LYS+ HG3     3.39                
 22 LYS+ HA     22 LYS+ HD2     4.35                
 22 LYS+ HA     22 LYS+ HD3     4.29                
 22 LYS+ HA     22 LYS+ HE2     5.38                
 22 LYS+ HA     23 GLY  HN      3.08                
 22 LYS+ HA     24 GLY  HN      4.26                
 22 LYS+ HA     33 HIS  HB3     4.23                
 22 LYS+ HB2    22 LYS+ HG2     4.07                
 22 LYS+ HB2    22 LYS+ HG3     2.40                
 22 LYS+ HB2    22 LYS+ HE2     3.39                
 22 LYS+ HG2    22 LYS+ HG3     2.55                
 22 LYS+ HG2    22 LYS+ HD2     2.96                
 22 LYS+ HG2    22 LYS+ HE2     4.54                
 22 LYS+ HG2    23 GLY  HN      5.22                
 22 LYS+ HG3    22 LYS+ HD2     3.08                
 22 LYS+ HG3    22 LYS+ HE2     5.50                
 22 LYS+ HD2    22 LYS+ HE2     2.43                
 22 LYS+ HD3    22 LYS+ HE2     5.10                
 23 GLY  HN     23 GLY  HA1     3.86                
 23 GLY  HN     23 GLY  HA2     3.48                
 23 GLY  HN     24 GLY  HN      3.95                
 23 GLY  HN     31 ASN  QD2     6.37                
 23 GLY  HA1    23 GLY  HA2     2.49                
 23 GLY  HA1    24 GLY  HN      4.23                
 23 GLY  HA2    24 GLY  HN      3.33                
 24 GLY  HN     24 GLY  HA1     3.17                
 24 GLY  HN     24 GLY  HA2     2.74                
 24 GLY  HN     25 LYS+ HN      4.66                
 24 GLY  HN     31 ASN  QD2     5.78                
 24 GLY  HA1    24 GLY  HA2     2.52                
 24 GLY  HA1    25 LYS+ HN      2.83                
 24 GLY  HA2    25 LYS+ HN      3.14                
 24 GLY  HA2    31 ASN  QD2     6.30                
 25 LYS+ HN     25 LYS+ HA      3.36                
 25 LYS+ HN     25 LYS+ HB2     3.64                
 25 LYS+ HN     25 LYS+ HB3     3.17                
 25 LYS+ HN     25 LYS+ HG2     3.17                
 25 LYS+ HN     25 LYS+ HD2     5.47                
 25 LYS+ HN     25 LYS+ QE      6.38                
 25 LYS+ HN     26 HIS  HN      5.47                
 25 LYS+ HA     25 LYS+ HB2     3.08                
 25 LYS+ HA     25 LYS+ HB3     3.48                
 25 LYS+ HA     25 LYS+ HG2     3.73                
 25 LYS+ HA     25 LYS+ HD2     4.57                
 25 LYS+ HA     26 HIS  HN      2.80                
 25 LYS+ HB2    25 LYS+ HG2     3.42                
 25 LYS+ HB2    25 LYS+ QE      6.38                
 25 LYS+ HB3    25 LYS+ QE      5.94                
 25 LYS+ HB3    26 HIS  HN      3.95                
 25 LYS+ HG2    25 LYS+ QE      5.07                
 25 LYS+ HG2    26 HIS  HN      5.50                
 25 LYS+ HG2    27 LYS+ HG2     2.71                
 25 LYS+ HD2    25 LYS+ QE      3.93                
 26 HIS  HN     26 HIS  HA      3.73                
 26 HIS  HN     26 HIS  HB2     3.89                
 26 HIS  HN     26 HIS  HB3     3.48                
 26 HIS  HN     27 LYS+ HN      4.48                
 26 HIS  HN     31 ASN  HB2     4.69                
 26 HIS  HA     26 HIS  HB2     3.45                
 26 HIS  HA     26 HIS  HB3     3.30                
 26 HIS  HA     26 HIS  HD2     5.50                
 26 HIS  HA     26 HIS  HE1     5.50                
 26 HIS  HA     27 LYS+ HN      2.80                
 26 HIS  HA     30 PRO  HA      4.45                
 26 HIS  HA     31 ASN  HN      3.92                
 26 HIS  HB2    26 HIS  HB3     2.62                
 26 HIS  HB2    26 HIS  HD2     4.26                
 26 HIS  HB2    27 LYS+ HN      4.69                
 26 HIS  HB2    30 PRO  HA      5.50                
 26 HIS  HB3    26 HIS  HD2     4.07                
 26 HIS  HB3    27 LYS+ HN      4.42                
 26 HIS  HB3    30 PRO  HA      3.83                
 26 HIS  HD2    26 HIS  HE1     5.50                
 26 HIS  HD2    30 PRO  HA      5.50                
 26 HIS  HD2    30 PRO  HB2     5.10                
 26 HIS  HD2    45 GLY  HA1     5.50                
 26 HIS  HD2    45 GLY  HA2     5.50                
 26 HIS  HD2    46 PHE  HA      4.88                
 26 HIS  HE1    30 PRO  HA      4.63                
 26 HIS  HE1    30 PRO  HB2     4.66                
 26 HIS  HE1    30 PRO  HB3     5.50                
 26 HIS  HE1    31 ASN  HN      3.45                
 26 HIS  HE1    31 ASN  HA      5.50                
 26 HIS  HE1    31 ASN  HB2     4.38                
 26 HIS  HE1    31 ASN  HB3     3.64                
 26 HIS  HE1    43 ALA  QB      3.43                
 26 HIS  HE1    46 PHE  HB3     4.88                
 27 LYS+ HN     27 LYS+ HA      3.55                
 27 LYS+ HN     27 LYS+ HB2     3.52                
 27 LYS+ HN     27 LYS+ HB3     3.52                
 27 LYS+ HN     27 LYS+ HG2     5.50                
 27 LYS+ HN     28 THR  HN      5.50                
 27 LYS+ HN     30 PRO  HA      5.50                
 27 LYS+ HA     27 LYS+ HB2     2.80                
 27 LYS+ HA     27 LYS+ HG2     2.90                
 27 LYS+ HA     27 LYS+ HD2     5.50                
 27 LYS+ HB2    27 LYS+ HG2     3.05                
 27 LYS+ HB2    27 LYS+ HD2     3.86                
 27 LYS+ HB2    27 LYS+ QE      6.38                
 27 LYS+ HB2    28 THR  HN      4.11                
 27 LYS+ HG2    27 LYS+ QE      6.38                
 27 LYS+ HD2    27 LYS+ QE      6.38                
 28 THR  HN     28 THR  HA      4.57                
 28 THR  HN     28 THR  HB      3.67                
 28 THR  HN     28 THR  QG2     5.69                
 28 THR  HA     28 THR  HB      3.30                
 28 THR  HA     28 THR  QG2     3.52                
 28 THR  HB     28 THR  QG2     3.43                
 28 THR  HB    135 HEMC HT4A    5.00                
 28 THR  HB    135 HEMC QT4     6.53                
 28 THR  QG2   135 HEMC HT4A    3.89                
 28 THR  QG2   135 HEMC QT4     5.70                
 28 THR  QG2   135 HEMC QM5     5.63                
 30 PRO  HA     30 PRO  HB2     3.67                
 30 PRO  HA     30 PRO  HB3     2.99                
 30 PRO  HA     31 ASN  HN      3.14                
 30 PRO  HA     31 ASN  HB2     4.69                
 30 PRO  HA     31 ASN  HB3     5.50                
 30 PRO  HA     46 PHE  HB2     4.66                
 30 PRO  HA     46 PHE  HB3     5.50                
 30 PRO  HB2    30 PRO  HB3     2.40                
 30 PRO  HB2    31 ASN  HN      4.54                
 30 PRO  HB2    43 ALA  QB      3.43                
 30 PRO  HB2    46 PHE  HB2     3.30                
 30 PRO  HB2    46 PHE  HB3     4.35                
 30 PRO  HB3    31 ASN  HN      4.85                
 30 PRO  HB3    43 ALA  QB      3.95                
 30 PRO  HB3    46 PHE  HB2     5.28                
 30 PRO  HB3    46 PHE  HB3     4.45                
 31 ASN  HN     31 ASN  HA      3.67                
 31 ASN  HN     31 ASN  HB2     3.21                
 31 ASN  HN     31 ASN  HB3     3.05                
 31 ASN  HN     32 LEU  HN      5.50                
 31 ASN  HN     43 ALA  QB      5.63                
 31 ASN  HA     31 ASN  HB2     2.99                
 31 ASN  HA     31 ASN  HB3     3.30                
 31 ASN  HA     31 ASN  QD2     6.37                
 31 ASN  HA     32 LEU  HN      2.65                
 31 ASN  HA     32 LEU  HB2     5.31                
 31 ASN  HA     33 HIS  HN      4.79                
 31 ASN  HB2    31 ASN  HB3     2.40                
 31 ASN  HB2    31 ASN  QD2     5.81                
 31 ASN  HB2    32 LEU  HN      4.26                
 31 ASN  HB3    31 ASN  QD2     6.37                
 31 ASN  HB3    32 LEU  HN      5.38                
 31 ASN  QD2    32 LEU  HN      6.37                
 32 LEU  HN     32 LEU  HA      3.73                
 32 LEU  HN     32 LEU  HB2     3.17                
 32 LEU  HN     32 LEU  HB3     3.92                
 32 LEU  HN     32 LEU  HG      3.79                
 32 LEU  HN     32 LEU  QD1     6.53                
 32 LEU  HN     32 LEU  QD2     6.53                
 32 LEU  HN     33 HIS  HN      3.52                
 32 LEU  HA     32 LEU  HB2     3.11                
 32 LEU  HA     32 LEU  HB3     3.05                
 32 LEU  HA     32 LEU  QD1     6.53                
 32 LEU  HA     32 LEU  QD2     4.26                
 32 LEU  HA     33 HIS  HN      3.67                
 32 LEU  HA     35 LEU  QD1     6.43                
 32 LEU  HA     35 LEU  QD2     6.53                
 32 LEU  HA     43 ALA  QB      4.48                
 32 LEU  HB2    32 LEU  QD1     4.85                
 32 LEU  HB2    32 LEU  QD2     6.53                
 32 LEU  HB2    35 LEU  QD1     6.53                
 32 LEU  HB2    35 LEU  QD2     6.53                
 32 LEU  HG     32 LEU  QD1     5.13                
 32 LEU  HG     32 LEU  QD2     5.78                
 32 LEU  QD1    32 LEU  QD2     7.21                
 32 LEU  QD1    98 LEU  QD2     6.32                
 32 LEU  QD1   135 HEMC QM8     7.56                
 32 LEU  QD1   135 HEMC QM1     7.43                
 32 LEU  QD2   135 HEMC QM8     6.53                
 33 HIS  HN     33 HIS  HA      3.14                
 33 HIS  HN     33 HIS  HB2     2.93                
 33 HIS  HN     33 HIS  HB3     3.08                
 33 HIS  HN     34 GLY  HN      5.50                
 33 HIS  HN    102 THR  QG2     6.53                
 33 HIS  HA     33 HIS  HB2     3.14                
 33 HIS  HA     33 HIS  HB3     4.04                
 33 HIS  HA     34 GLY  HN      2.80                
 33 HIS  HA    102 THR  QG2     5.04                
 33 HIS  HB2    33 HIS  HB3     2.40                
 33 HIS  HB2    33 HIS  HD2     5.50                
 33 HIS  HB2    34 GLY  HN      5.50                
 33 HIS  HB3    33 HIS  HD2     5.50                
 33 HIS  HB3    34 GLY  HN      5.00                
 33 HIS  HD2   102 THR  HA      5.38                
 34 GLY  HN     34 GLY  HA1     3.42                
 34 GLY  HN     34 GLY  HA2     3.02                
 34 GLY  HN     35 LEU  HN      3.33                
 34 GLY  HN     35 LEU  HB2     5.50                
 34 GLY  HN    102 THR  HA      3.98                
 34 GLY  HN    102 THR  HB      3.30                
 34 GLY  HA1    34 GLY  HA2     2.46                
 34 GLY  HA1    35 LEU  HN      4.11                
 34 GLY  HA2    35 LEU  HN      4.35                
 35 LEU  HN     35 LEU  HA      3.17                
 35 LEU  HN     35 LEU  HB2     2.77                
 35 LEU  HN     35 LEU  HB3     2.86                
 35 LEU  HN     35 LEU  HG      5.50                
 35 LEU  HN     35 LEU  QD1     5.19                
 35 LEU  HN     35 LEU  QD2     5.54                
 35 LEU  HN     36 PHE  HN      3.92                
 35 LEU  HN    102 THR  HB      3.02                
 35 LEU  HN    102 THR  QG2     5.57                
 35 LEU  HA     35 LEU  HB2     2.86                
 35 LEU  HA     35 LEU  HB3     3.14                
 35 LEU  HA     35 LEU  HG      4.14                
 35 LEU  HA     35 LEU  QD1     3.43                
 35 LEU  HA     35 LEU  QD2     5.41                
 35 LEU  HA     36 PHE  HN      4.04                
 35 LEU  HA     36 PHE  QD      7.62                
 35 LEU  HA     38 ARG+ HE      5.50                
 35 LEU  HA     59 TRP  HD1     5.50                
 35 LEU  HB2    35 LEU  HB3     2.40                
 35 LEU  HB2    35 LEU  HG      3.86                
 35 LEU  HB2    35 LEU  QD1     3.80                
 35 LEU  HB2    35 LEU  QD2     3.77                
 35 LEU  HB2    36 PHE  QD      7.50                
 35 LEU  HB3    35 LEU  HG      3.14                
 35 LEU  HB3    35 LEU  QD1     3.86                
 35 LEU  HB3    35 LEU  QD2     3.43                
 35 LEU  HB3    36 PHE  HN      3.33                
 35 LEU  HB3    36 PHE  QD      6.04                
 35 LEU  HB3    36 PHE  QE      7.53                
 35 LEU  HG     35 LEU  QD1     3.43                
 35 LEU  HG     35 LEU  QD2     3.43                
 35 LEU  HG     36 PHE  HN      5.50                
 35 LEU  HG     36 PHE  HA      5.50                
 35 LEU  HG     36 PHE  QD      7.62                
 35 LEU  HG     38 ARG+ HB3     5.50                
 35 LEU  HG     59 TRP  HB2     4.07                
 35 LEU  HG     59 TRP  HB3     3.95                
 35 LEU  HG     59 TRP  HD1     5.34                
 35 LEU  HG     59 TRP  HE1     5.50                
 35 LEU  HG     64 LEU  QD1     5.57                
 35 LEU  HG     64 LEU  QD2     5.75                
 35 LEU  QD1    35 LEU  QD2     4.77                
 35 LEU  QD1    36 PHE  HN      6.53                
 35 LEU  QD1    36 PHE  QD      8.65                
 35 LEU  QD1    36 PHE  QE      7.84                
 35 LEU  QD1    38 ARG+ HB3     5.07                
 35 LEU  QD1    38 ARG+ HE      6.00                
 35 LEU  QD1    59 TRP  HB2     4.73                
 35 LEU  QD1    59 TRP  HB3     4.70                
 35 LEU  QD1    59 TRP  HD1     3.77                
 35 LEU  QD1    59 TRP  HE1     5.19                
 35 LEU  QD1    59 TRP  HZ2     6.53                
 35 LEU  QD1   135 HEMC QM8     5.48                
 35 LEU  QD2    36 PHE  HN      6.53                
 35 LEU  QD2    36 PHE  QD      7.69                
 35 LEU  QD2    36 PHE  QE      7.41                
 35 LEU  QD2    36 PHE  HZ      6.47                
 35 LEU  QD2    59 TRP  HB2     6.53                
 35 LEU  QD2    59 TRP  HB3     5.75                
 35 LEU  QD2    59 TRP  HD1     6.12                
 35 LEU  QD2    59 TRP  HE1     6.53                
 35 LEU  QD2    64 LEU  QD2     6.35                
 35 LEU  QD2    98 LEU  HB2     4.76                
 35 LEU  QD2    98 LEU  HB3     5.10                
 35 LEU  QD2    98 LEU  QD1     6.38                
 35 LEU  QD2    98 LEU  QD2     7.56                
 35 LEU  QD2   102 THR  HB      6.53                
 35 LEU  QD2   135 HEMC QM8     5.39                
 36 PHE  HN     36 PHE  HA      3.42                
 36 PHE  HN     36 PHE  HB2     2.99                
 36 PHE  HN     36 PHE  HB3     3.48                
 36 PHE  HN     36 PHE  QD      5.64                
 36 PHE  HN     36 PHE  QE      7.62                
 36 PHE  HN     37 GLY  HN      4.42                
 36 PHE  HA     36 PHE  HB2     4.01                
 36 PHE  HA     36 PHE  HB3     3.45                
 36 PHE  HA     36 PHE  QD      7.28                
 36 PHE  HA     37 GLY  HN      2.68                
 36 PHE  HA     37 GLY  HA1     5.50                
 36 PHE  HA     59 TRP  HB2     5.50                
 36 PHE  HB2    36 PHE  HB3     2.40                
 36 PHE  HB2    36 PHE  QD      5.95                
 36 PHE  HB2    36 PHE  QE      7.59                
 36 PHE  HB2    37 GLY  HN      5.50                
 36 PHE  HB3    36 PHE  QD      5.70                
 36 PHE  HB3    36 PHE  QE      7.62                
 36 PHE  HB3    37 GLY  HN      4.57                
 36 PHE  QD     36 PHE  QE      7.73                
 36 PHE  QD     36 PHE  HZ      7.56                
 36 PHE  QD     37 GLY  HN      7.62                
 36 PHE  QD     60 LYS+ HA      6.23                
 36 PHE  QD     60 LYS+ HB2     7.62                
 36 PHE  QD     60 LYS+ HB3     7.62                
 36 PHE  QD     61 GLU- HN      7.62                
 36 PHE  QD     61 GLU- HA      7.62                
 36 PHE  QD     61 GLU- HB3     7.62                
 36 PHE  QD     64 LEU  QD1     8.65                
 36 PHE  QD     95 ILE  QG2     8.65                
 36 PHE  QD     99 LYS+ HA      7.25                
 36 PHE  QD     99 LYS+ HG2     7.62                
 36 PHE  QD     99 LYS+ HG3     7.62                
 36 PHE  QD     99 LYS+ QD      8.50                
 36 PHE  QE     36 PHE  HZ      5.02                
 36 PHE  QE     60 LYS+ HA      7.62                
 36 PHE  QE     61 GLU- HN      7.62                
 36 PHE  QE     61 GLU- HA      7.00                
 36 PHE  QE     61 GLU- HB2     7.62                
 36 PHE  QE     61 GLU- HB3     6.97                
 36 PHE  QE     61 GLU- QG      8.50                
 36 PHE  QE     64 LEU  QD1     6.98                
 36 PHE  QE     64 LEU  QD2     8.65                
 36 PHE  QE     95 ILE  HA      7.62                
 36 PHE  QE     95 ILE  QG2     5.95                
 36 PHE  QE     95 ILE  QD1     8.65                
 36 PHE  QE     98 LEU  HN      7.62                
 36 PHE  QE     98 LEU  HA      7.62                
 36 PHE  QE     98 LEU  HB2     6.32                
 36 PHE  QE     98 LEU  HB3     6.07                
 36 PHE  QE     98 LEU  HG      7.62                
 36 PHE  QE     98 LEU  QD2     8.65                
 36 PHE  QE     99 LYS+ HN      7.62                
 36 PHE  QE     99 LYS+ HA      6.32                
 36 PHE  QE     99 LYS+ QB      8.50                
 36 PHE  QE     99 LYS+ HG2     6.82                
 36 PHE  QE     99 LYS+ HG3     7.62                
 36 PHE  QE     99 LYS+ QD      8.50                
 36 PHE  HZ     61 GLU- HA      5.50                
 36 PHE  HZ     61 GLU- HB3     5.50                
 36 PHE  HZ     64 LEU  HB2     5.50                
 36 PHE  HZ     64 LEU  QD1     4.05                
 36 PHE  HZ     64 LEU  QD2     5.10                
 36 PHE  HZ     95 ILE  HA      4.35                
 36 PHE  HZ     95 ILE  QG2     3.43                
 36 PHE  HZ     95 ILE  HG12    5.50                
 36 PHE  HZ     95 ILE  QD1     6.53                
 36 PHE  HZ     98 LEU  HB2     4.04                
 36 PHE  HZ     98 LEU  HB3     3.42                
 36 PHE  HZ     98 LEU  QD1     5.35                
 36 PHE  HZ     99 LYS+ HN      4.82                
 36 PHE  HZ     99 LYS+ HA      5.16                
 36 PHE  HZ     99 LYS+ QB      6.38                
 36 PHE  HZ     99 LYS+ HG2     3.98                
 36 PHE  HZ     99 LYS+ HG3     5.50                
 36 PHE  HZ     99 LYS+ QD      6.38                
 37 GLY  HN     37 GLY  HA1     3.21                
 37 GLY  HN     37 GLY  HA2     3.33                
 37 GLY  HN     38 ARG+ HN      2.40                
 37 GLY  HN     38 ARG+ HB3     5.50                
 37 GLY  HN     58 THR  QG2     4.88                
 37 GLY  HN     59 TRP  HN      5.25                
 37 GLY  HN     59 TRP  HB2     5.50                
 37 GLY  HN     59 TRP  HB3     5.50                
 37 GLY  HA1    37 GLY  HA2     2.40                
 37 GLY  HA1    38 ARG+ HN      3.79                
 37 GLY  HA1    58 THR  QG2     4.05                
 37 GLY  HA2    38 ARG+ HN      3.48                
 37 GLY  HA2    58 THR  QG2     4.82                
 38 ARG+ HN     38 ARG+ HA      3.21                
 38 ARG+ HN     38 ARG+ HB2     3.52                
 38 ARG+ HN     38 ARG+ HB3     2.96                
 38 ARG+ HN     58 THR  QG2     5.10                
 38 ARG+ HN     59 TRP  HN      3.64                
 38 ARG+ HN     59 TRP  HD1     5.50                
 38 ARG+ HA     38 ARG+ HB2     3.05                
 38 ARG+ HA     38 ARG+ HB3     2.96                
 38 ARG+ HA     38 ARG+ HG2     4.04                
 38 ARG+ HA     38 ARG+ QD      6.38                
 38 ARG+ HA     39 LYS+ HN      2.68                
 38 ARG+ HA     58 THR  QG2     6.22                
 38 ARG+ HB2    38 ARG+ HB3     2.40                
 38 ARG+ HB2    38 ARG+ QD      5.60                
 38 ARG+ HB2    38 ARG+ HE      3.98                
 38 ARG+ HB2    39 LYS+ HN      4.04                
 38 ARG+ HB2    59 TRP  HD1     5.50                
 38 ARG+ HB3    38 ARG+ QD      4.73                
 38 ARG+ HB3    38 ARG+ HE      4.54                
 38 ARG+ HB3    39 LYS+ HN      3.33                
 38 ARG+ HB3    42 GLN  HB3     2.80                
 38 ARG+ HB3    59 TRP  HD1     3.98                
 38 ARG+ HG2    38 ARG+ HE      4.07                
 38 ARG+ HG2    39 LYS+ HN      4.54                
 38 ARG+ HG2    42 GLN  HE21    5.50                
 38 ARG+ HG2    59 TRP  HD1     4.97                
 38 ARG+ QD     38 ARG+ HE      5.14                
 38 ARG+ HE     59 TRP  HD1     5.50                
 39 LYS+ HN     39 LYS+ HA      3.95                
 39 LYS+ HN     39 LYS+ HB2     2.93                
 39 LYS+ HN     39 LYS+ HB3     3.73                
 39 LYS+ HN     39 LYS+ HG2     3.42                
 39 LYS+ HN     39 LYS+ HG3     4.17                
 39 LYS+ HN     40 THR  HN      5.50                
 39 LYS+ HN     42 GLN  HB3     4.69                
 39 LYS+ HN     42 GLN  HG2     4.72                
 39 LYS+ HN     42 GLN  HG3     4.82                
 39 LYS+ HN     58 THR  HA      4.66                
 39 LYS+ HN     58 THR  QG2     5.50                
 39 LYS+ HA     39 LYS+ HB2     3.55                
 39 LYS+ HA     39 LYS+ HB3     3.30                
 39 LYS+ HA     39 LYS+ HG2     5.13                
 39 LYS+ HA     40 THR  HN      3.27                
 39 LYS+ HA     58 THR  HA      3.36                
 39 LYS+ HB2    39 LYS+ HG2     2.40                
 39 LYS+ HB2    40 THR  HN      3.95                
 39 LYS+ HB2    40 THR  HA      4.54                
 39 LYS+ HB2    42 GLN  HE21    5.50                
 39 LYS+ HB2    42 GLN  HE22    5.50                
 39 LYS+ HB2    56 GLY  HA1     5.28                
 39 LYS+ HB3    39 LYS+ HG2     2.62                
 39 LYS+ HB3    40 THR  HN      3.30                
 39 LYS+ HB3    42 GLN  HE21    5.50                
 39 LYS+ HB3    42 GLN  HE22    5.50                
 39 LYS+ HG2    40 THR  HN      5.50                
 40 THR  HN     40 THR  HA      3.39                
 40 THR  HN     40 THR  HB      4.42                
 40 THR  HN     40 THR  QG2     3.64                
 40 THR  HN     55 LYS+ HB2     5.50                
 40 THR  HN     56 GLY  HA1     4.54                
 40 THR  HN     57 ILE  HG13    5.16                
 40 THR  HA     40 THR  HB      5.22                
 40 THR  HA     40 THR  QG2     3.61                
 40 THR  HA     41 GLY  HN      2.99                
 40 THR  HA     59 TRP  HD1     4.69                
 40 THR  HA     59 TRP  HE1     3.05                
 40 THR  HB     40 THR  QG2     3.49                
 40 THR  HB     41 GLY  HN      3.73                
 40 THR  HB     55 LYS+ HN      5.47                
 40 THR  HB     59 TRP  HE1     5.50                
 40 THR  HB     59 TRP  HZ2     5.50                
 40 THR  QG2    41 GLY  HN      6.53                
 40 THR  QG2    52 ASN  HD22    6.53                
 40 THR  QG2    55 LYS+ HN      6.53                
 40 THR  QG2    55 LYS+ HB2     4.36                
 40 THR  QG2    55 LYS+ HB3     4.26                
 40 THR  QG2    55 LYS+ HD2     4.30                
 40 THR  QG2    55 LYS+ HD3     4.30                
 40 THR  QG2    56 GLY  HN      5.57                
 40 THR  QG2    56 GLY  HA1     6.28                
 40 THR  QG2    57 ILE  HA      6.53                
 40 THR  QG2    57 ILE  QD1     6.04                
 40 THR  QG2    59 TRP  HE1     4.11                
 40 THR  QG2    59 TRP  HZ2     3.77                
 41 GLY  HN     41 GLY  HA1     3.17                
 41 GLY  HN     41 GLY  HA2     3.30                
 41 GLY  HN     43 ALA  HN      4.38                
 41 GLY  HN     59 TRP  HE1     5.50                
 41 GLY  HA1    41 GLY  HA2     2.46                
 41 GLY  HA1    48 TYR  QD      7.64                
 41 GLY  HA2    42 GLN  HN      4.17                
 41 GLY  HA2    48 TYR  QD      7.64                
 42 GLN  HN     42 GLN  HA      3.64                
 42 GLN  HN     42 GLN  HB2     3.33                
 42 GLN  HN     42 GLN  HB3     4.01                
 42 GLN  HN     42 GLN  HG2     4.79                
 42 GLN  HN     42 GLN  HG3     4.20                
 42 GLN  HN     43 ALA  HN      3.45                
 42 GLN  HN     48 TYR  QD      7.64                
 42 GLN  HA     42 GLN  HB2     3.30                
 42 GLN  HA     42 GLN  HB3     3.05                
 42 GLN  HA     42 GLN  HE21    5.50                
 42 GLN  HA     43 ALA  HN      4.17                
 42 GLN  HB2    42 GLN  HB3     2.40                
 42 GLN  HB3    43 ALA  HN      5.50                
 42 GLN  HG2    42 GLN  HE21    4.85                
 42 GLN  HG2    42 GLN  HE22    4.45                
 42 GLN  HG2    43 ALA  HN      5.50                
 42 GLN  HG3    42 GLN  HE21    3.95                
 42 GLN  HG3    42 GLN  HE22    4.26                
 42 GLN  HG3    43 ALA  HN      5.50                
 42 GLN  HE21   42 GLN  HE22    2.40                
 43 ALA  HN     43 ALA  HA      3.79                
 43 ALA  HN     43 ALA  QB      3.52                
 43 ALA  HN     44 PRO  HD2     5.50                
 43 ALA  HN     44 PRO  HD3     5.50                
 43 ALA  HN     48 TYR  QD      7.64                
 43 ALA  HA     43 ALA  QB      3.43                
 43 ALA  HA     44 PRO  HG2     5.34                
 43 ALA  HA     44 PRO  HG3     5.50                
 43 ALA  HA     44 PRO  HD2     3.45                
 43 ALA  HA     44 PRO  HD3     3.64                
 43 ALA  QB     44 PRO  HD3     5.81                
 43 ALA  QB     46 PHE  HN      6.16                
 43 ALA  QB     48 TYR  QD      8.36                
 44 PRO  HA     44 PRO  HB2     3.02                
 44 PRO  HA     44 PRO  HG2     5.50                
 44 PRO  HA     44 PRO  HG3     5.04                
 44 PRO  HA     44 PRO  HD3     5.50                
 44 PRO  HA     45 GLY  HN      5.38                
 44 PRO  HA     45 GLY  HA2     5.50                
 44 PRO  HB2    44 PRO  HG2     2.99                
 44 PRO  HB2    44 PRO  HG3     3.21                
 44 PRO  HB2    44 PRO  HD2     4.85                
 44 PRO  HB2    44 PRO  HD3     5.41                
 44 PRO  HG2    44 PRO  HG3     2.68                
 44 PRO  HG2    44 PRO  HD2     3.58                
 44 PRO  HG2    44 PRO  HD3     4.11                
 44 PRO  HG3    44 PRO  HD2     4.14                
 44 PRO  HG3    44 PRO  HD3     4.17                
 44 PRO  HD2    44 PRO  HD3     2.59                
 45 GLY  HN     45 GLY  HA1     4.57                
 45 GLY  HN     45 GLY  HA2     4.97                
 45 GLY  HA1    45 GLY  HA2     2.59                
 46 PHE  HN     46 PHE  HA      3.55                
 46 PHE  HN     46 PHE  HB2     3.08                
 46 PHE  HN     46 PHE  HB3     3.27                
 46 PHE  HA     46 PHE  HB2     3.58                
 46 PHE  HA     46 PHE  HB3     3.21                
 46 PHE  HA     47 THR  HN      3.02                
 46 PHE  HB2    46 PHE  HB3     2.40                
 46 PHE  HB2    46 PHE  QD      7.62                
 46 PHE  HB2    47 THR  HN      5.50                
 46 PHE  HB2    48 TYR  QD      7.64                
 46 PHE  HB2    48 TYR  QE      6.73                
 46 PHE  HB2   135 HEMC QM5     6.53                
 46 PHE  HB3    46 PHE  QD      7.62                
 46 PHE  HB3    47 THR  HN      5.50                
 46 PHE  HB3    48 TYR  QD      7.64                
 46 PHE  HB3   135 HEMC QM5     6.53                
 46 PHE  QD     46 PHE  QE      9.74                
 46 PHE  QD     46 PHE  HZ      7.62                
 46 PHE  QD     48 TYR  HN      7.53                
 46 PHE  QE     46 PHE  HZ      6.32                
 47 THR  HN     47 THR  HA      4.85                
 47 THR  HN     47 THR  HB      3.58                
 47 THR  HN     47 THR  QG2     6.53                
 47 THR  HN     48 TYR  QD      7.64                
 47 THR  HA     47 THR  HB      4.20                
 47 THR  HA     47 THR  QG2     3.61                
 47 THR  HA     48 TYR  HB2     5.50                
 47 THR  HA     48 TYR  QD      7.64                
 47 THR  HB     47 THR  QG2     3.43                
 47 THR  HB     48 TYR  HN      5.50                
 47 THR  QG2    48 TYR  HN      4.73                
 47 THR  QG2    48 TYR  HA      6.53                
 47 THR  QG2    48 TYR  QD      8.67                
 48 TYR  HN     48 TYR  HA      3.30                
 48 TYR  HN     48 TYR  HB2     3.14                
 48 TYR  HN     48 TYR  HB3     3.42                
 48 TYR  HN     48 TYR  QD      5.53                
 48 TYR  HN     49 THR  HN      5.50                
 48 TYR  HA     48 TYR  HB2     3.73                
 48 TYR  HA     48 TYR  HB3     3.27                
 48 TYR  HA     48 TYR  QD      6.12                
 48 TYR  HA     48 TYR  QE      7.29                
 48 TYR  HA     49 THR  HN      2.96                
 48 TYR  HA     49 THR  QG2     4.64                
 48 TYR  HB2    48 TYR  HB3     2.40                
 48 TYR  HB2    48 TYR  QD      5.50                
 48 TYR  HB2    49 THR  HN      4.54                
 48 TYR  HB2    52 ASN  HB2     5.50                
 48 TYR  HB2    52 ASN  HB3     5.50                
 48 TYR  HB3    48 TYR  QD      5.50                
 48 TYR  HB3    49 THR  HN      3.58                
 48 TYR  HB3    52 ASN  HB2     3.98                
 48 TYR  HB3    52 ASN  HB3     5.50                
 48 TYR  QD     48 TYR  QE      9.77                
 48 TYR  QD     49 THR  HN      7.64                
 48 TYR  QD     52 ASN  HB2     7.14                
 48 TYR  QD     52 ASN  HB3     7.64                
 48 TYR  QD     52 ASN  HD22    7.64                
 49 THR  HN     49 THR  HA      4.23                
 49 THR  HN     49 THR  HB      5.50                
 49 THR  HN     49 THR  QG2     3.99                
 49 THR  HN     50 ASP- HN      5.50                
 49 THR  HA     49 THR  HB      3.30                
 49 THR  HA     49 THR  QG2     3.74                
 49 THR  HA     50 ASP- HN      2.96                
 49 THR  HA     50 ASP- HB2     5.50                
 49 THR  HA     50 ASP- HB3     5.50                
 49 THR  HA     51 ALA  HN      5.38                
 49 THR  HB     49 THR  QG2     3.46                
 49 THR  HB     50 ASP- HN      3.33                
 49 THR  HB     51 ALA  HN      3.39                
 49 THR  HB     51 ALA  QB      3.99                
 49 THR  QG2    50 ASP- HN      4.95                
 50 ASP- HN     50 ASP- HA      3.67                
 50 ASP- HN     50 ASP- HB2     3.55                
 50 ASP- HN     50 ASP- HB3     3.89                
 50 ASP- HN     51 ALA  HN      3.55                
 50 ASP- HN     51 ALA  QB      5.38                
 50 ASP- HA     50 ASP- HB2     3.27                
 50 ASP- HA     50 ASP- HB3     3.17                
 50 ASP- HA     51 ALA  HN      4.23                
 50 ASP- HA     53 LYS+ HN      4.01                
 50 ASP- HA     53 LYS+ HB2     3.39                
 50 ASP- HA     53 LYS+ HG2     5.50                
 50 ASP- HA     54 ASN  HN      4.82                
 50 ASP- HB2    51 ALA  HN      3.70                
 50 ASP- HB2    51 ALA  HA      5.47                
 50 ASP- HB3    51 ALA  HN      4.01                
 50 ASP- HB3    51 ALA  HA      5.50                
 50 ASP- HB3    54 ASN  HD21    5.50                
 51 ALA  HN     51 ALA  HA      3.52                
 51 ALA  HN     51 ALA  QB      3.43                
 51 ALA  HN     52 ASN  HN      3.98                
 51 ALA  HN     54 ASN  HN      4.29                
 51 ALA  HA     51 ALA  QB      3.43                
 51 ALA  HA     52 ASN  HN      4.29                
 51 ALA  HA     53 LYS+ HN      5.50                
 51 ALA  HA     54 ASN  HN      3.89                
 51 ALA  HA     54 ASN  HB2     4.04                
 51 ALA  HA     54 ASN  HB3     4.60                
 51 ALA  HA     55 LYS+ HN      4.45                
 51 ALA  QB     52 ASN  HN      3.80                
 51 ALA  QB     53 LYS+ HN      6.53                
 51 ALA  QB     54 ASN  HN      6.53                
 51 ALA  QB     75 ILE  HA      5.50                
 51 ALA  QB     76 PRO  HD2     3.99                
 52 ASN  HN     52 ASN  HA      3.83                
 52 ASN  HN     52 ASN  HB2     3.30                
 52 ASN  HN     52 ASN  HB3     3.21                
 52 ASN  HN     53 LYS+ HN      3.64                
 52 ASN  HN     75 ILE  QG2     5.47                
 52 ASN  HA     52 ASN  HB2     3.61                
 52 ASN  HA     52 ASN  HB3     4.11                
 52 ASN  HA     53 LYS+ HN      4.63                
 52 ASN  HA     55 LYS+ HN      5.50                
 52 ASN  HA     75 ILE  QG2     4.23                
 52 ASN  HB2    52 ASN  HB3     2.40                
 52 ASN  HB2    52 ASN  HD21    4.29                
 52 ASN  HB2    52 ASN  HD22    5.50                
 52 ASN  HB2    53 LYS+ HN      4.04                
 52 ASN  HB3    52 ASN  HD21    4.97                
 52 ASN  HB3    52 ASN  HD22    5.50                
 52 ASN  HB3    53 LYS+ HN      3.70                
 52 ASN  HB3    53 LYS+ HA      4.85                
 52 ASN  HB3    53 LYS+ HB2     5.50                
 52 ASN  HD21   52 ASN  HD22    2.55                
 52 ASN  HD21   59 TRP  HZ2     5.50                
 52 ASN  HD22   59 TRP  HE1     5.50                
 53 LYS+ HN     53 LYS+ HA      3.36                
 53 LYS+ HN     53 LYS+ HB2     3.36                
 53 LYS+ HN     53 LYS+ HG2     3.98                
 53 LYS+ HN     54 ASN  HN      3.55                
 53 LYS+ HA     53 LYS+ HB2     3.08                
 53 LYS+ HA     53 LYS+ HG2     4.66                
 53 LYS+ HA     54 ASN  HN      4.97                
 53 LYS+ HB2    53 LYS+ HG2     3.27                
 53 LYS+ HB2    54 ASN  HN      3.45                
 53 LYS+ HG2    54 ASN  HN      5.50                
 54 ASN  HN     54 ASN  HA      4.20                
 54 ASN  HN     54 ASN  HB2     3.08                
 54 ASN  HN     54 ASN  HB3     3.64                
 54 ASN  HN     54 ASN  HD21    5.50                
 54 ASN  HN     55 LYS+ HN      3.67                
 54 ASN  HA     54 ASN  HB2     3.45                
 54 ASN  HA     54 ASN  HB3     3.11                
 54 ASN  HA     55 LYS+ HN      4.07                
 54 ASN  HB2    54 ASN  HD21    3.89                
 54 ASN  HB2    54 ASN  HD22    5.22                
 54 ASN  HB2    55 LYS+ HN      5.50                
 54 ASN  HB3    54 ASN  HD21    4.60                
 54 ASN  HB3    54 ASN  HD22    5.41                
 54 ASN  HB3    55 LYS+ HN      5.50                
 54 ASN  HD21   54 ASN  HD22    2.40                
 55 LYS+ HN     55 LYS+ HA      3.52                
 55 LYS+ HN     55 LYS+ HB2     3.27                
 55 LYS+ HN     55 LYS+ HB3     3.52                
 55 LYS+ HN     55 LYS+ HD2     5.47                
 55 LYS+ HN     55 LYS+ HD3     5.50                
 55 LYS+ HN     56 GLY  HN      3.05                
 55 LYS+ HA     55 LYS+ HB2     3.08                
 55 LYS+ HA     55 LYS+ HB3     3.24                
 55 LYS+ HA     55 LYS+ HG2     3.21                
 55 LYS+ HA     55 LYS+ HG3     5.00                
 55 LYS+ HA     55 LYS+ HD2     4.32                
 55 LYS+ HA     55 LYS+ HD3     4.26                
 55 LYS+ HA     55 LYS+ QE      6.38                
 55 LYS+ HA     56 GLY  HN      4.20                
 55 LYS+ HA     56 GLY  HA1     4.94                
 55 LYS+ HB2    56 GLY  HN      5.50                
 55 LYS+ HB2    75 ILE  HA      5.50                
 55 LYS+ HB3    56 GLY  HN      5.50                
 55 LYS+ HB3    75 ILE  HA      5.50                
 55 LYS+ HG2    55 LYS+ QE      5.23                
 55 LYS+ HG2    75 ILE  HA      5.50                
 55 LYS+ HG3    55 LYS+ QE      6.16                
 55 LYS+ HG3    57 ILE  HN      5.50                
 55 LYS+ HD2    55 LYS+ QE      6.38                
 55 LYS+ HD3    55 LYS+ QE      5.57                
 55 LYS+ HD3    75 ILE  HA      5.50                
 55 LYS+ QE     57 ILE  HG13    5.42                
 55 LYS+ QE     74 TYR  QE      8.51                
 56 GLY  HN     56 GLY  HA1     3.14                
 56 GLY  HN     57 ILE  HG12    5.50                
 56 GLY  HN     57 ILE  HG13    5.50                
 56 GLY  HA1    57 ILE  HN      3.95                
 56 GLY  HA1    57 ILE  HG13    5.50                
 57 ILE  HN     57 ILE  HA      4.35                
 57 ILE  HN     57 ILE  HB      4.26                
 57 ILE  HN     57 ILE  HG12    4.54                
 57 ILE  HN     57 ILE  HG13    3.11                
 57 ILE  HA     57 ILE  HB      3.05                
 57 ILE  HA     57 ILE  HG12    5.50                
 57 ILE  HA     57 ILE  HG13    4.17                
 57 ILE  HA     57 ILE  QD1     6.53                
 57 ILE  HA     58 THR  HN      2.83                
 57 ILE  HB     57 ILE  HG13    3.39                
 57 ILE  HB     57 ILE  QD1     4.23                
 57 ILE  HB     58 THR  HN      2.77                
 57 ILE  HB     74 TYR  QD      7.64                
 57 ILE  HB     74 TYR  QE      7.63                
 57 ILE  HG12   57 ILE  HG13    2.49                
 57 ILE  HG12   57 ILE  QD1     4.08                
 57 ILE  HG12   58 THR  HN      5.50                
 57 ILE  HG12   74 TYR  QE      6.58                
 57 ILE  HG13   57 ILE  QD1     3.74                
 57 ILE  HG13   58 THR  HN      3.70                
 57 ILE  HG13   63 THR  HB      5.50                
 57 ILE  HG13   74 TYR  QE      7.07                
 57 ILE  QD1    58 THR  HN      6.06                
 57 ILE  QD1    59 TRP  HE3     6.12                
 57 ILE  QD1    59 TRP  HZ3     6.53                
 57 ILE  QD1    63 THR  HB      4.26                
 57 ILE  QD1    63 THR  QG2     6.56                
 57 ILE  QD1    74 TYR  QD      8.67                
 57 ILE  QD1    74 TYR  QE      6.86                
 58 THR  HN     58 THR  HA      3.61                
 58 THR  HN     58 THR  HB      3.24                
 58 THR  HN     58 THR  QG2     5.01                
 58 THR  HA     58 THR  HB      3.48                
 58 THR  HA     58 THR  QG2     3.43                
 58 THR  HA     59 TRP  HN      2.74                
 58 THR  HB     58 THR  QG2     3.43                
 58 THR  HB     59 TRP  HN      4.01                
 58 THR  QG2    59 TRP  HN      3.83                
 59 TRP  HN     59 TRP  HA      3.67                
 59 TRP  HN     59 TRP  HB2     3.27                
 59 TRP  HN     59 TRP  HB3     3.79                
 59 TRP  HN     59 TRP  HD1     4.17                
 59 TRP  HN     59 TRP  HE3     5.50                
 59 TRP  HN     60 LYS+ HN      4.72                
 59 TRP  HA     59 TRP  HB2     3.61                
 59 TRP  HA     59 TRP  HB3     3.21                
 59 TRP  HA     59 TRP  HE3     2.77                
 59 TRP  HA     60 LYS+ HN      2.74                
 59 TRP  HA     63 THR  QG2     3.89                
 59 TRP  HB2    59 TRP  HB3     2.40                
 59 TRP  HB2    59 TRP  HD1     3.48                
 59 TRP  HB2    59 TRP  HE3     5.13                
 59 TRP  HB2    59 TRP  HE1     5.50                
 59 TRP  HB2    60 LYS+ HN      5.50                
 59 TRP  HB2    64 LEU  QD1     6.53                
 59 TRP  HB2    64 LEU  QD2     6.53                
 59 TRP  HB3    59 TRP  HD1     4.35                
 59 TRP  HB3    59 TRP  HE3     4.11                
 59 TRP  HB3    59 TRP  HE1     5.50                
 59 TRP  HB3    60 LYS+ HN      4.11                
 59 TRP  HB3    64 LEU  QD1     5.63                
 59 TRP  HB3    64 LEU  QD2     5.78                
 59 TRP  HD1    59 TRP  HE1     2.99                
 59 TRP  HE3    59 TRP  HZ3     2.93                
 59 TRP  HE3    59 TRP  HZ2     5.50                
 59 TRP  HE3    59 TRP  HH2     5.47                
 59 TRP  HE3    60 LYS+ HN      3.45                
 59 TRP  HE3    64 LEU  HA      4.63                
 59 TRP  HE3    64 LEU  QD1     5.41                
 59 TRP  HE3    64 LEU  QD2     4.23                
 59 TRP  HE3    67 TYR  HB2     5.50                
 59 TRP  HE3    67 TYR  HB3     5.50                
 59 TRP  HE1    59 TRP  HZ2     3.52                
 59 TRP  HE1   135 HEMC HAP72   5.50                
 59 TRP  HE1   135 HEMC HBP74   5.50                
 59 TRP  HZ3    59 TRP  HZ2     3.92                
 59 TRP  HZ3    59 TRP  HH2     2.40                
 59 TRP  HZ3    63 THR  HB      4.07                
 59 TRP  HZ3    63 THR  QG2     6.53                
 59 TRP  HZ3    64 LEU  HN      5.50                
 59 TRP  HZ3    64 LEU  HA      3.27                
 59 TRP  HZ3    64 LEU  HG      5.50                
 59 TRP  HZ3    64 LEU  QD1     6.53                
 59 TRP  HZ3    64 LEU  QD2     5.01                
 59 TRP  HZ3    67 TYR  HN      5.47                
 59 TRP  HZ3    67 TYR  HB2     3.17                
 59 TRP  HZ3    67 TYR  HB3     3.48                
 59 TRP  HZ3    67 TYR  QD      7.42                
 59 TRP  HZ3    74 TYR  QD      7.64                
 59 TRP  HZ2    59 TRP  HH2     2.71                
 59 TRP  HZ2   135 HEMC HAP71   4.66                
 59 TRP  HZ2   135 HEMC HAP72   4.29                
 59 TRP  HZ2   135 HEMC HBP74   5.50                
 59 TRP  HZ2   135 HEMC QM8     4.26                
 59 TRP  HH2    67 TYR  QD      7.64                
 59 TRP  HH2    74 TYR  QD      7.08                
 59 TRP  HH2   135 HEMC QM8     4.51                
 60 LYS+ HN     60 LYS+ HA      3.39                
 60 LYS+ HN     60 LYS+ HB2     4.14                
 60 LYS+ HN     60 LYS+ HB3     4.51                
 60 LYS+ HN     60 LYS+ HG2     4.51                
 60 LYS+ HN     60 LYS+ HG3     4.85                
 60 LYS+ HN     63 THR  HN      3.79                
 60 LYS+ HN     64 LEU  HN      4.11                
 60 LYS+ HN     64 LEU  QD1     6.53                
 60 LYS+ HN     64 LEU  QD2     6.53                
 60 LYS+ HA     60 LYS+ HB2     3.89                
 60 LYS+ HA     60 LYS+ HB3     3.08                
 60 LYS+ HA     60 LYS+ HG2     3.89                
 60 LYS+ HA     61 GLU- HN      4.42                
 60 LYS+ HA     62 GLU- HN      5.50                
 60 LYS+ HA     64 LEU  QD1     6.53                
 60 LYS+ HB2    60 LYS+ HG2     3.52                
 60 LYS+ HB2    61 GLU- HN      5.44                
 60 LYS+ HB2    62 GLU- HN      4.42                
 60 LYS+ HB3    60 LYS+ HG2     3.33                
 60 LYS+ HB3    61 GLU- HN      4.04                
 60 LYS+ HB3    62 GLU- HN      4.91                
 60 LYS+ HG2    62 GLU- HN      5.50                
 60 LYS+ HG2    63 THR  HN      4.23                
 60 LYS+ HG3    62 GLU- HN      3.79                
 60 LYS+ HG3    63 THR  HN      3.52                
 61 GLU- HN     61 GLU- HA      4.17                
 61 GLU- HN     61 GLU- HB2     4.04                
 61 GLU- HN     61 GLU- HB3     4.17                
 61 GLU- HN     62 GLU- HN      4.94                
 61 GLU- HA     61 GLU- HB2     3.27                
 61 GLU- HA     61 GLU- HB3     3.21                
 61 GLU- HA     61 GLU- QG      6.38                
 61 GLU- HA     62 GLU- HN      4.48                
 61 GLU- HA     62 GLU- HA      5.16                
 61 GLU- HA     64 LEU  HN      4.66                
 61 GLU- HA     64 LEU  HB2     3.67                
 61 GLU- HA     64 LEU  HB3     4.88                
 61 GLU- HA     64 LEU  QD1     4.79                
 61 GLU- HA     65 MET  HN      5.28                
 61 GLU- HA     95 ILE  QG2     3.89                
 61 GLU- HA     95 ILE  QD1     4.54                
 61 GLU- HB2    61 GLU- QG      4.42                
 61 GLU- HB2    95 ILE  QG2     4.67                
 61 GLU- HB3    61 GLU- QG      3.28                
 61 GLU- HB3    95 ILE  QG2     3.86                
 61 GLU- QG     95 ILE  QG2     5.98                
 62 GLU- HN     62 GLU- HA      3.17                
 62 GLU- HN     62 GLU- HB2     2.62                
 62 GLU- HN     62 GLU- HG2     4.29                
 62 GLU- HN     62 GLU- HG3     4.38                
 62 GLU- HN     63 THR  HN      3.39                
 62 GLU- HN     63 THR  QG2     6.53                
 62 GLU- HN     64 LEU  HN      5.50                
 62 GLU- HN     65 MET  HN      5.50                
 62 GLU- HA     62 GLU- HB2     2.68                
 62 GLU- HA     62 GLU- HG2     4.23                
 62 GLU- HA     62 GLU- HG3     3.64                
 62 GLU- HA     63 THR  HN      4.01                
 62 GLU- HA     65 MET  HN      3.95                
 62 GLU- HA     65 MET  HB2     3.33                
 62 GLU- HA     65 MET  HB3     3.36                
 62 GLU- HA     66 GLU- HN      5.50                
 62 GLU- HB2    62 GLU- HG2     3.27                
 62 GLU- HB2    63 THR  HN      3.36                
 62 GLU- HB2    64 LEU  HN      5.50                
 62 GLU- HG2    63 THR  HN      5.50                
 62 GLU- HG3    63 THR  HN      5.50                
 63 THR  HN     63 THR  HA      3.70                
 63 THR  HN     63 THR  HB      3.89                
 63 THR  HN     63 THR  QG2     3.61                
 63 THR  HN     64 LEU  HN      3.17                
 63 THR  HN     65 MET  HN      4.76                
 63 THR  HA     63 THR  HB      4.23                
 63 THR  HA     63 THR  QG2     3.52                
 63 THR  HA     64 LEU  HN      5.50                
 63 THR  HA     66 GLU- HN      4.29                
 63 THR  HA     66 GLU- HB2     3.55                
 63 THR  HA     74 TYR  QE      7.63                
 63 THR  HB     63 THR  QG2     3.43                
 63 THR  QG2    74 TYR  QD      8.67                
 63 THR  QG2    74 TYR  QE      7.82                
 64 LEU  HN     64 LEU  HA      3.42                
 64 LEU  HN     64 LEU  HB2     2.86                
 64 LEU  HN     64 LEU  HB3     3.64                
 64 LEU  HN     64 LEU  HG      3.27                
 64 LEU  HN     64 LEU  QD1     5.54                
 64 LEU  HN     64 LEU  QD2     5.91                
 64 LEU  HN     65 MET  HN      3.24                
 64 LEU  HN     66 GLU- HN      5.50                
 64 LEU  HN     95 ILE  QD1     5.44                
 64 LEU  HA     64 LEU  HB2     3.55                
 64 LEU  HA     64 LEU  HB3     3.39                
 64 LEU  HA     64 LEU  HG      4.17                
 64 LEU  HA     64 LEU  QD1     5.19                
 64 LEU  HA     64 LEU  QD2     3.74                
 64 LEU  HA     67 TYR  HN      3.70                
 64 LEU  HA     67 TYR  HB2     3.89                
 64 LEU  HA     67 TYR  HB3     3.42                
 64 LEU  HA     68 LEU  HN      3.45                
 64 LEU  HB2    64 LEU  HB3     2.46                
 64 LEU  HB2    64 LEU  HG      3.24                
 64 LEU  HB2    64 LEU  QD1     3.58                
 64 LEU  HB2    64 LEU  QD2     4.23                
 64 LEU  HB2    65 MET  HN      3.64                
 64 LEU  HB2    68 LEU  HN      4.94                
 64 LEU  HB3    64 LEU  HG      4.11                
 64 LEU  HB3    64 LEU  QD1     4.14                
 64 LEU  HB3    64 LEU  QD2     3.99                
 64 LEU  HB3    65 MET  HN      3.95                
 64 LEU  HB3    68 LEU  QD1     4.79                
 64 LEU  HG     64 LEU  QD1     3.49                
 64 LEU  HG     64 LEU  QD2     3.55                
 64 LEU  QD1    64 LEU  QD2     4.98                
 64 LEU  QD1    65 MET  HN      6.53                
 64 LEU  QD1    95 ILE  HA      6.53                
 64 LEU  QD1    95 ILE  HB      6.53                
 64 LEU  QD1    95 ILE  QG2     6.41                
 64 LEU  QD1    95 ILE  HG12    4.79                
 64 LEU  QD1    95 ILE  QD1     6.69                
 64 LEU  QD2    65 MET  HN      6.53                
 64 LEU  QD2    67 TYR  HB2     6.53                
 64 LEU  QD2    67 TYR  HB3     6.53                
 64 LEU  QD2    67 TYR  QD      8.67                
 64 LEU  QD2    68 LEU  HG      5.94                
 64 LEU  QD2    95 ILE  HA      6.53                
 64 LEU  QD2    95 ILE  QG2     7.56                
 64 LEU  QD2    95 ILE  HG12    5.69                
 64 LEU  QD2    95 ILE  QD1     7.09                
 64 LEU  QD2    98 LEU  QD1     6.32                
 64 LEU  QD2   135 HEMC QM8     6.16                
 64 LEU  QD2   135 HEMC QM1     7.56                
 65 MET  HN     65 MET  HA      3.21                
 65 MET  HN     65 MET  HB2     2.80                
 65 MET  HN     65 MET  HB3     3.39                
 65 MET  HN     65 MET  HG2     4.51                
 65 MET  HN     65 MET  HG3     3.36                
 65 MET  HN     66 GLU- HN      3.48                
 65 MET  HN     67 TYR  HN      4.32                
 65 MET  HN     68 LEU  QD1     6.53                
 65 MET  HN     95 ILE  QG2     6.53                
 65 MET  HN     95 ILE  QD1     4.23                
 65 MET  HA     65 MET  HB2     3.36                
 65 MET  HA     65 MET  HB3     3.42                
 65 MET  HA     65 MET  HG2     4.72                
 65 MET  HA     65 MET  HG3     4.69                
 65 MET  HA     66 GLU- HN      4.60                
 65 MET  HA     68 LEU  HB2     3.79                
 65 MET  HA     68 LEU  HG      5.50                
 65 MET  HA     68 LEU  QD1     5.23                
 65 MET  HA     91 ARG+ HB2     5.22                
 65 MET  HA     91 ARG+ HB3     4.69                
 65 MET  HA     91 ARG+ HG2     5.50                
 65 MET  HA     95 ILE  QD1     3.52                
 65 MET  HB2    66 GLU- HN      3.86                
 65 MET  HB2    95 ILE  QD1     3.95                
 65 MET  HB3    66 GLU- HN      3.73                
 65 MET  HG2    91 ARG+ HB2     3.89                
 65 MET  HG2    91 ARG+ HB3     3.67                
 65 MET  HG2    95 ILE  QD1     5.01                
 65 MET  HG3    91 ARG+ HB2     4.01                
 65 MET  HG3    91 ARG+ HB3     4.29                
 65 MET  HG3    95 ILE  QD1     4.30                
 66 GLU- HN     66 GLU- HA      3.61                
 66 GLU- HN     66 GLU- HB2     2.90                
 66 GLU- HN     66 GLU- HG2     5.50                
 66 GLU- HN     66 GLU- HG3     5.16                
 66 GLU- HN     67 TYR  HN      3.36                
 66 GLU- HA     66 GLU- HB2     2.65                
 66 GLU- HA     66 GLU- HG2     4.29                
 66 GLU- HA     66 GLU- HG3     4.07                
 66 GLU- HA     67 TYR  HN      3.73                
 66 GLU- HB2    66 GLU- HG3     4.07                
 66 GLU- HB2    67 TYR  HN      2.71                
 66 GLU- HB2    74 TYR  QD      6.40                
 66 GLU- HB2    74 TYR  QE      5.77                
 66 GLU- HG2    66 GLU- HG3     2.40                
 66 GLU- HG2    74 TYR  QD      7.45                
 66 GLU- HG2    74 TYR  QE      6.73                
 66 GLU- HG3    74 TYR  QD      7.64                
 66 GLU- HG3    74 TYR  QE      7.63                
 67 TYR  HN     67 TYR  HA      3.55                
 67 TYR  HN     67 TYR  HB2     3.08                
 67 TYR  HN     67 TYR  HB3     3.08                
 67 TYR  HN     69 GLU- HN      3.48                
 67 TYR  HN     74 TYR  QD      7.64                
 67 TYR  HN     74 TYR  QE      7.63                
 67 TYR  HA     67 TYR  HB2     3.48                
 67 TYR  HA     67 TYR  HB3     3.70                
 67 TYR  HA     67 TYR  QD      6.86                
 67 TYR  HA     71 PRO  HA      4.69                
 67 TYR  HA     74 TYR  QD      6.90                
 67 TYR  HB2    67 TYR  HB3     2.52                
 67 TYR  HB2    67 TYR  QD      7.14                
 67 TYR  HB2    68 LEU  HN      4.85                
 67 TYR  HB2    74 TYR  QD      6.99                
 67 TYR  HB2    74 TYR  QE      7.63                
 67 TYR  HB3    67 TYR  QD      6.00                
 67 TYR  HB3    68 LEU  HN      3.30                
 67 TYR  HB3    74 TYR  QD      7.64                
 67 TYR  HB3    74 TYR  QE      7.63                
 67 TYR  QD     67 TYR  QE      9.49                
 67 TYR  QD     68 LEU  QD1     8.67                
 67 TYR  QD     68 LEU  QD2     7.80                
 67 TYR  QD     71 PRO  HA      7.39                
 67 TYR  QD     74 TYR  HB2     7.55                
 67 TYR  QD     74 TYR  HB3     7.64                
 67 TYR  QD     74 TYR  QD      8.57                
 67 TYR  QD     74 TYR  QE      9.77                
 67 TYR  QD    135 HEMC QM8     8.67                
 67 TYR  QE    135 HEMC QM8     7.39                
 68 LEU  HN     68 LEU  HA      3.55                
 68 LEU  HN     68 LEU  HB2     2.99                
 68 LEU  HN     68 LEU  HB3     3.55                
 68 LEU  HN     68 LEU  HG      3.08                
 68 LEU  HN     68 LEU  QD1     5.35                
 68 LEU  HN     68 LEU  QD2     5.66                
 68 LEU  HN     69 GLU- HN      2.99                
 68 LEU  HN     74 TYR  QD      7.64                
 68 LEU  HA     68 LEU  HB2     3.45                
 68 LEU  HA     68 LEU  HB3     3.48                
 68 LEU  HA     68 LEU  HG      4.11                
 68 LEU  HA     68 LEU  QD1     6.31                
 68 LEU  HA     68 LEU  QD2     3.77                
 68 LEU  HA     69 GLU- HN      3.95                
 68 LEU  HA     82 PHE  QD      7.62                
 68 LEU  HA     82 PHE  QE      7.28                
 68 LEU  HA     85 ILE  QD1     6.53                
 68 LEU  HB2    68 LEU  HG      3.24                
 68 LEU  HB2    68 LEU  QD1     3.71                
 68 LEU  HB2    68 LEU  QD2     4.67                
 68 LEU  HB2    69 GLU- HN      4.04                
 68 LEU  HB3    68 LEU  QD1     3.71                
 68 LEU  HB3    68 LEU  QD2     4.05                
 68 LEU  HB3    69 GLU- HN      5.50                
 68 LEU  HG     68 LEU  QD1     3.43                
 68 LEU  HG     68 LEU  QD2     3.52                
 68 LEU  HG     69 GLU- HN      5.50                
 68 LEU  QD1    68 LEU  QD2     5.32                
 68 LEU  QD1    85 ILE  HG13    4.64                
 68 LEU  QD1    91 ARG+ HA      4.57                
 68 LEU  QD1    91 ARG+ HG2     4.11                
 68 LEU  QD1    94 LEU  HB2     4.45                
 68 LEU  QD1    95 ILE  HG12    3.99                
 68 LEU  QD1    95 ILE  HG13    3.71                
 68 LEU  QD1    95 ILE  QD1     5.42                
 68 LEU  QD1   135 HEMC QM1     6.66                
 68 LEU  QD2    82 PHE  QD      8.65                
 68 LEU  QD2    82 PHE  QE      8.53                
 68 LEU  QD2    85 ILE  QG2     7.56                
 68 LEU  QD2    85 ILE  HG13    6.53                
 68 LEU  QD2    85 ILE  QD1     7.34                
 68 LEU  QD2    94 LEU  QD2     6.19                
 68 LEU  QD2   135 HEMC QM1     5.57                
 68 LEU  QD2   135 HEMC QT2     7.56                
 69 GLU- HN     69 GLU- HA      3.27                
 69 GLU- HN     69 GLU- HB2     3.02                
 69 GLU- HN     69 GLU- HB3     2.93                
 69 GLU- HN     69 GLU- HG2     3.73                
 69 GLU- HA     69 GLU- HB3     3.21                
 69 GLU- HA     69 GLU- HG2     2.80                
 69 GLU- HB2    69 GLU- HB3     2.40                
 69 GLU- HB2    69 GLU- HG2     2.96                
 69 GLU- HB2    70 ASN  HB2     5.22                
 69 GLU- HB2    70 ASN  HB3     5.50                
 69 GLU- HG2    70 ASN  HB3     4.88                
 70 ASN  HN     70 ASN  HA      3.33                
 70 ASN  HN     70 ASN  HB2     4.48                
 70 ASN  HN     70 ASN  HB3     3.55                
 70 ASN  HN     71 PRO  HD2     5.50                
 70 ASN  HN     71 PRO  HD3     5.07                
 70 ASN  HA     70 ASN  HB2     3.30                
 70 ASN  HA     70 ASN  HB3     3.11                
 70 ASN  HA     70 ASN  HD21    5.50                
 70 ASN  HA     70 ASN  HD22    5.50                
 70 ASN  HA     71 PRO  HA      5.13                
 70 ASN  HA     71 PRO  HD2     3.58                
 70 ASN  HA     71 PRO  HD3     4.11                
 70 ASN  HA     72 LYS+ HN      3.48                
 70 ASN  HA     84 GLY  HA1     5.50                
 70 ASN  HA     84 GLY  HA2     3.95                
 70 ASN  HB2    70 ASN  HB3     2.40                
 70 ASN  HB2    70 ASN  HD21    4.29                
 70 ASN  HB2    70 ASN  HD22    5.50                
 70 ASN  HB2    73 LYS+ HN      5.50                
 70 ASN  HB2    73 LYS+ HB2     3.02                
 70 ASN  HB2    73 LYS+ HB3     5.50                
 70 ASN  HB3    70 ASN  HD21    3.67                
 70 ASN  HB3    70 ASN  HD22    3.61                
 70 ASN  HB3    73 LYS+ HB2     5.50                
 70 ASN  HD21   70 ASN  HD22    2.40                
 70 ASN  HD22   73 LYS+ HB2     4.48                
 70 ASN  HD22   73 LYS+ HB3     5.50                
 71 PRO  HA     71 PRO  QB      6.38                
 71 PRO  HA     71 PRO  HD2     5.50                
 71 PRO  HA     71 PRO  HD3     5.50                
 71 PRO  HA     72 LYS+ HN      4.85                
 71 PRO  HA     74 TYR  HN      5.50                
 71 PRO  HA     74 TYR  HB2     5.50                
 71 PRO  HA     74 TYR  HB2     3.50                
 71 PRO  HA     74 TYR  HB3     5.50                
 71 PRO  HA     74 TYR  HB3     4.00                
 71 PRO  HA     74 TYR  QD      7.64                
 71 PRO  HA     78 THR  HB      6.00                
 71 PRO  QB     72 LYS+ HN      5.51                
 71 PRO  QB     78 THR  HB      6.00                
 71 PRO  HD2    71 PRO  HD3     3.61                
 71 PRO  HD2    72 LYS+ HN      5.04                
 71 PRO  HD3    72 LYS+ HN      5.50                
 71 PRO  HD3    72 LYS+ QG      6.38                
 72 LYS+ HN     72 LYS+ HA      3.17                
 72 LYS+ HN     72 LYS+ HB2     3.48                
 72 LYS+ HN     72 LYS+ HB3     3.33                
 72 LYS+ HN     72 LYS+ QG      4.98                
 72 LYS+ HN     73 LYS+ HN      3.39                
 72 LYS+ HN     77 GLY  HN      5.50                
 72 LYS+ HA     72 LYS+ HB2     3.08                
 72 LYS+ HA     72 LYS+ HB3     3.11                
 72 LYS+ HA     72 LYS+ QG      4.14                
 72 LYS+ HA     73 LYS+ HN      4.01                
 72 LYS+ HA     75 ILE  HN      3.86                
 72 LYS+ HA     78 THR  QG2     4.76                
 72 LYS+ HB2    72 LYS+ HB3     2.40                
 72 LYS+ HB2    72 LYS+ QG      3.65                
 72 LYS+ HB2    73 LYS+ HN      4.38                
 72 LYS+ HB2    76 PRO  HA      3.05                
 72 LYS+ HB2    77 GLY  HN      5.50                
 72 LYS+ HB3    72 LYS+ QG      4.08                
 72 LYS+ HB3    72 LYS+ QD      6.38                
 72 LYS+ HB3    73 LYS+ HN      4.17                
 72 LYS+ QG     72 LYS+ QD      5.64                
 72 LYS+ QG     73 LYS+ HN      6.38                
 73 LYS+ HN     73 LYS+ HA      3.52                
 73 LYS+ HN     73 LYS+ HB2     2.83                
 73 LYS+ HN     74 TYR  HN      3.30                
 73 LYS+ HN     75 ILE  HN      5.50                
 73 LYS+ HA     73 LYS+ HB2     2.80                
 73 LYS+ HA     73 LYS+ HB3     5.50                
 73 LYS+ HA     74 TYR  HN      5.50                
 73 LYS+ HA     76 PRO  HG2     5.50                
 74 TYR  HN     74 TYR  HA      4.11                
 74 TYR  HN     74 TYR  HB2     3.39                
 74 TYR  HN     74 TYR  HB3     3.27                
 74 TYR  HN     74 TYR  QD      7.64                
 74 TYR  HN     75 ILE  HN      3.11                
 74 TYR  HA     74 TYR  HB2     5.50                
 74 TYR  HA     74 TYR  HB3     3.70                
 74 TYR  HA     74 TYR  QD      5.59                
 74 TYR  HA     74 TYR  QE      7.63                
 74 TYR  HA     75 ILE  HN      4.38                
 74 TYR  HB2    74 TYR  QD      5.69                
 74 TYR  HB2    74 TYR  QE      7.63                
 74 TYR  HB2    75 ILE  HN      3.67                
 74 TYR  HB3    74 TYR  QD      5.97                
 74 TYR  HB3    74 TYR  QE      7.63                
 74 TYR  QD     74 TYR  QE      7.54                
 74 TYR  QD     75 ILE  HN      7.64                
 74 TYR  QD     75 ILE  QD1     6.40                
 74 TYR  QE     75 ILE  QD1     8.66                
 75 ILE  HN     75 ILE  HA      3.48                
 75 ILE  HN     75 ILE  HB      3.52                
 75 ILE  HN     75 ILE  QG2     6.53                
 75 ILE  HN     75 ILE  QD1     5.01                
 75 ILE  HN     76 PRO  HD2     4.48                
 75 ILE  HN     76 PRO  HD3     5.50                
 75 ILE  HA     75 ILE  HB      3.89                
 75 ILE  HA     75 ILE  QG2     3.86                
 75 ILE  HA     75 ILE  QD1     6.19                
 75 ILE  HA     76 PRO  HG2     4.82                
 75 ILE  HA     76 PRO  HD2     3.92                
 75 ILE  HA     76 PRO  HD3     3.52                
 75 ILE  HA     78 THR  QG2     5.26                
 75 ILE  HB     75 ILE  QG2     4.23                
 76 PRO  HA     76 PRO  HG2     3.86                
 76 PRO  HA     76 PRO  HD2     5.50                
 76 PRO  HA     76 PRO  HD3     5.50                
 76 PRO  HA     77 GLY  HN      3.21                
 76 PRO  HG2    76 PRO  HD3     3.02                
 76 PRO  HD2    76 PRO  HD3     2.77                
 77 GLY  HN     77 GLY  HA1     5.50                
 77 GLY  HN     77 GLY  HA2     4.14                
 77 GLY  HA1    77 GLY  HA2     3.02                
 78 THR  HA     78 THR  HB      5.50                
 79 LYS+ HA     79 LYS+ HB2     3.14                
 79 LYS+ HA     79 LYS+ HG2     4.23                
 79 LYS+ HA     80 MET  HA      5.50                
 79 LYS+ HA     80 MET  HB2     5.50                
 79 LYS+ HB2    79 LYS+ QE      6.38                
 79 LYS+ HB2   135 HEMC QM5     6.53                
 79 LYS+ HG2    79 LYS+ QE      6.07                
 79 LYS+ HG2   135 HEMC QM5     6.53                
 80 MET  HA     80 MET  HB2     5.50                
 81 ILE  HA     82 PHE  HN      3.61                
 82 PHE  HN     82 PHE  HA      4.35                
 82 PHE  HN     82 PHE  HB2     3.73                
 82 PHE  HN     82 PHE  HB3     4.07                
 82 PHE  HN     82 PHE  QD      7.62                
 82 PHE  HB2    82 PHE  HB3     4.38                
 82 PHE  HB2    82 PHE  QD      7.62                
 82 PHE  HB2    82 PHE  QE      7.62                
 82 PHE  HB2   135 HEMC QM3     6.53                
 82 PHE  HB3    82 PHE  QD      7.62                
 82 PHE  HB3    82 PHE  QE      7.62                
 82 PHE  HB3    83 ALA  HN      4.17                
 82 PHE  HB3    84 GLY  HN      3.95                
 82 PHE  QD     82 PHE  QE      8.47                
 82 PHE  QD     84 GLY  HA1     7.62                
 82 PHE  QD     84 GLY  HA2     7.62                
 82 PHE  QD     85 ILE  HG12    7.31                
 82 PHE  QD     85 ILE  HG13    7.62                
 82 PHE  QD     85 ILE  QD1     8.49                
 82 PHE  QD    135 HEMC QT2     8.40                
 82 PHE  QD    135 HEMC QM3     8.65                
 82 PHE  QE     84 GLY  HA2     7.62                
 82 PHE  QE     85 ILE  HG12    7.59                
 82 PHE  QE     85 ILE  HG13    7.62                
 82 PHE  QE     85 ILE  QD1     8.49                
 82 PHE  QE    135 HEMC QT2     7.84                
 83 ALA  HN     83 ALA  HA      5.50                
 83 ALA  HN     83 ALA  QB      3.99                
 83 ALA  HA     83 ALA  QB      3.43                
 83 ALA  HA     84 GLY  HN      3.79                
 83 ALA  QB     84 GLY  HN      4.64                
 84 GLY  HN     84 GLY  HA1     3.58                
 84 GLY  HN     84 GLY  HA2     4.11                
 84 GLY  HA1    84 GLY  HA2     2.49                
 84 GLY  HA1    85 ILE  HN      3.27                
 84 GLY  HA2    85 ILE  HN      3.24                
 85 ILE  HN     85 ILE  HA      3.21                
 85 ILE  HN     85 ILE  HB      3.17                
 85 ILE  HN     85 ILE  QG2     5.41                
 85 ILE  HN     85 ILE  HG12    4.54                
 85 ILE  HN     85 ILE  HG13    5.50                
 85 ILE  HN     85 ILE  QD1     6.43                
 85 ILE  HA     85 ILE  HB      3.48                
 85 ILE  HA     85 ILE  QG2     3.74                
 85 ILE  HA     85 ILE  HG12    5.41                
 85 ILE  HA     85 ILE  HG13    5.50                
 85 ILE  HA     85 ILE  QD1     5.16                
 85 ILE  HA     86 LYS+ HN      3.61                
 85 ILE  HA     91 ARG+ HG3     4.69                
 85 ILE  HB     85 ILE  QG2     3.71                
 85 ILE  QG2    85 ILE  QD1     5.32                
 85 ILE  QG2    87 LYS+ HN      3.95                
 85 ILE  QG2    90 GLU- HN      4.45                
 85 ILE  QG2    90 GLU- HB2     3.49                
 85 ILE  QG2    90 GLU- HB3     3.77                
 85 ILE  QG2    91 ARG+ HN      4.45                
 85 ILE  QG2    91 ARG+ HA      4.67                
 85 ILE  QG2    92 GLU- HN      6.28                
 85 ILE  HG12   85 ILE  QD1     3.43                
 85 ILE  HG12  135 HEMC QT2     5.23                
 85 ILE  HG13   85 ILE  QD1     3.68                
 85 ILE  HG13  135 HEMC QT2     5.44                
 85 ILE  QD1    90 GLU- HB3     4.45                
 85 ILE  QD1    91 ARG+ HA      6.00                
 85 ILE  QD1   135 HEMC QT2     5.17                
 86 LYS+ HN     86 LYS+ HA      4.69                
 86 LYS+ HN     86 LYS+ HB2     3.33                
 86 LYS+ HN     86 LYS+ HB3     4.76                
 86 LYS+ HN     87 LYS+ HN      5.13                
 86 LYS+ HN     87 LYS+ HA      5.50                
 86 LYS+ HA     86 LYS+ HB2     3.61                
 86 LYS+ HA     86 LYS+ HB3     3.21                
 86 LYS+ HA     86 LYS+ QG      5.54                
 87 LYS+ HN     87 LYS+ HA      3.73                
 87 LYS+ HN     87 LYS+ HB2     3.52                
 87 LYS+ HN     87 LYS+ HB3     3.02                
 87 LYS+ HN     87 LYS+ HD2     3.89                
 87 LYS+ HN     90 GLU- HN      5.50                
 87 LYS+ HA     87 LYS+ HB2     3.45                
 87 LYS+ HA     87 LYS+ HB3     3.58                
 87 LYS+ HA     87 LYS+ HG2     4.57                
 87 LYS+ HA     87 LYS+ HD2     5.50                
 87 LYS+ HA     90 GLU- HN      5.50                
 87 LYS+ HB2    87 LYS+ HB3     2.55                
 87 LYS+ HB2    90 GLU- HN      3.70                
 87 LYS+ HB3    89 THR  HN      4.32                
 87 LYS+ HB3    90 GLU- HN      3.36                
 87 LYS+ HG2    87 LYS+ QE      6.35                
 87 LYS+ HG2    89 THR  HN      5.16                
 87 LYS+ HG2    90 GLU- HN      5.50                
 88 LYS+ HN     88 LYS+ HA      5.50                
 88 LYS+ HA     88 LYS+ HB2     2.96                
 88 LYS+ HA     88 LYS+ HG2     3.08                
 88 LYS+ HA     89 THR  HN      5.04                
 88 LYS+ HA     90 GLU- HN      4.48                
 88 LYS+ HA     91 ARG+ HN      4.07                
 88 LYS+ HB2    89 THR  HN      3.05                
 88 LYS+ HG2    92 GLU- HG2     3.73                
 89 THR  HN     89 THR  HA      2.93                
 89 THR  HN     89 THR  HB      4.23                
 89 THR  HN     89 THR  QG2     3.77                
 89 THR  HN     90 GLU- HN      3.45                
 89 THR  HA     89 THR  HB      4.42                
 89 THR  HA     89 THR  QG2     3.80                
 89 THR  HA     90 GLU- HN      4.57                
 89 THR  HA     91 ARG+ HN      5.50                
 89 THR  HA     92 GLU- HN      3.61                
 89 THR  HA     92 GLU- HB2     3.42                
 89 THR  HA     92 GLU- HG2     5.50                
 89 THR  HA     92 GLU- HG3     5.16                
 89 THR  HB     89 THR  QG2     3.43                
 89 THR  HB     90 GLU- HN      4.04                
 89 THR  QG2    90 GLU- HN      5.75                
 90 GLU- HN     90 GLU- HA      3.61                
 90 GLU- HN     90 GLU- HB2     2.99                
 90 GLU- HN     90 GLU- HB3     3.48                
 90 GLU- HN     90 GLU- HG2     4.48                
 90 GLU- HN     90 GLU- HG3     3.70                
 90 GLU- HN     91 ARG+ HN      3.08                
 90 GLU- HN     91 ARG+ HA      5.50                
 90 GLU- HN     91 ARG+ HB2     4.54                
 90 GLU- HN     91 ARG+ HG3     5.50                
 90 GLU- HN     92 GLU- HN      4.60                
 90 GLU- HA     90 GLU- HB2     4.23                
 90 GLU- HA     90 GLU- HB3     2.83                
 90 GLU- HA     90 GLU- HG2     3.33                
 90 GLU- HA     90 GLU- HG3     4.11                
 90 GLU- HA     91 ARG+ HN      4.23                
 90 GLU- HA     93 ASP- HB2     3.42                
 90 GLU- HA     93 ASP- HB3     3.95                
 90 GLU- HA     94 LEU  HN      3.64                
 90 GLU- HB2    91 ARG+ HN      3.76                
 90 GLU- HB3    91 ARG+ HN      3.73                
 90 GLU- HG2    91 ARG+ HN      5.50                
 90 GLU- HG3    91 ARG+ HN      5.50                
 91 ARG+ HN     91 ARG+ HA      3.45                
 91 ARG+ HN     91 ARG+ HB2     3.14                
 91 ARG+ HN     91 ARG+ HB3     4.38                
 91 ARG+ HN     91 ARG+ HG2     3.89                
 91 ARG+ HN     91 ARG+ HG3     4.54                
 91 ARG+ HN     91 ARG+ QD      5.76                
 91 ARG+ HN     92 GLU- HN      2.96                
 91 ARG+ HA     91 ARG+ HB2     3.33                
 91 ARG+ HA     91 ARG+ HG2     3.33                
 91 ARG+ HA     91 ARG+ HG3     3.52                
 91 ARG+ HA     91 ARG+ QD      5.17                
 91 ARG+ HA     92 GLU- HN      4.11                
 91 ARG+ HA     94 LEU  HN      4.11                
 91 ARG+ HA     94 LEU  HB2     3.24                
 91 ARG+ HA     94 LEU  HB3     3.58                
 91 ARG+ HA     94 LEU  QD2     5.29                
 91 ARG+ HA     95 ILE  HN      5.10                
 91 ARG+ HA     95 ILE  QD1     6.53                
 91 ARG+ HB2    91 ARG+ HG2     3.36                
 91 ARG+ HB2    91 ARG+ HG3     4.26                
 91 ARG+ HB2    95 ILE  QD1     4.57                
 91 ARG+ HB3    92 GLU- HN      3.76                
 91 ARG+ HB3    95 ILE  QD1     3.86                
 92 GLU- HN     92 GLU- HA      3.30                
 92 GLU- HN     92 GLU- HB2     2.65                
 92 GLU- HN     92 GLU- HB3     3.55                
 92 GLU- HN     92 GLU- HG2     3.30                
 92 GLU- HN     92 GLU- HG3     3.08                
 92 GLU- HN     95 ILE  QD1     6.53                
 92 GLU- HA     92 GLU- HB2     3.05                
 92 GLU- HA     92 GLU- HB3     2.86                
 92 GLU- HA     92 GLU- HG2     3.33                
 92 GLU- HA     92 GLU- HG3     3.36                
 92 GLU- HA     94 LEU  HN      5.50                
 92 GLU- HA     95 ILE  HN      4.04                
 92 GLU- HA     95 ILE  HB      2.93                
 92 GLU- HA     95 ILE  QG2     6.12                
 92 GLU- HA     95 ILE  QD1     4.36                
 92 GLU- HA     96 ALA  HN      4.01                
 92 GLU- HB3    93 ASP- HN      3.30                
 92 GLU- HG2    92 GLU- HG3     2.40                
 92 GLU- HG3    95 ILE  QD1     4.92                
 93 ASP- HN     93 ASP- HA      3.17                
 93 ASP- HN     93 ASP- HB2     3.14                
 93 ASP- HN     93 ASP- HB3     3.45                
 93 ASP- HN     94 LEU  HN      3.17                
 93 ASP- HN     94 LEU  HB3     4.85                
 93 ASP- HA     93 ASP- HB2     3.17                
 93 ASP- HA     93 ASP- HB3     2.90                
 93 ASP- HA     96 ALA  HN      4.01                
 93 ASP- HA     96 ALA  QB      4.08                
 93 ASP- HB2    94 LEU  HN      3.45                
 93 ASP- HB3    94 LEU  HN      3.42                
 94 LEU  HN     94 LEU  HA      3.33                
 94 LEU  HN     94 LEU  HB2     2.99                
 94 LEU  HN     94 LEU  HB3     2.90                
 94 LEU  HN     94 LEU  HG      5.50                
 94 LEU  HN     94 LEU  QD1     5.57                
 94 LEU  HN     94 LEU  QD2     5.88                
 94 LEU  HN     95 ILE  HN      3.24                
 94 LEU  HN     96 ALA  HN      5.50                
 94 LEU  HA     94 LEU  HB2     3.52                
 94 LEU  HA     94 LEU  HB3     3.24                
 94 LEU  HA     94 LEU  HG      4.88                
 94 LEU  HA     94 LEU  QD1     3.58                
 94 LEU  HA     94 LEU  QD2     5.13                
 94 LEU  HA     95 ILE  HN      4.32                
 94 LEU  HA     97 TYR  HN      4.11                
 94 LEU  HA     97 TYR  HB2     4.07                
 94 LEU  HA     97 TYR  HB3     3.70                
 94 LEU  HA     98 LEU  HN      5.50                
 94 LEU  HB2    94 LEU  HB3     2.40                
 94 LEU  HB2    94 LEU  HG      3.33                
 94 LEU  HB2    94 LEU  QD1     3.68                
 94 LEU  HB2    94 LEU  QD2     3.71                
 94 LEU  HB2    95 ILE  HN      3.33                
 94 LEU  HB3    94 LEU  HG      2.83                
 94 LEU  HB3    94 LEU  QD1     3.95                
 94 LEU  HB3    94 LEU  QD2     3.74                
 94 LEU  HB3    98 LEU  QD1     5.10                
 94 LEU  HG     94 LEU  QD1     3.43                
 94 LEU  HG     94 LEU  QD2     3.46                
 94 LEU  HG     95 ILE  HN      5.50                
 94 LEU  HG     95 ILE  HA      5.50                
 94 LEU  HG     98 LEU  QD1     3.99                
 94 LEU  HG    135 HEMC QM1     5.72                
 94 LEU  QD1    94 LEU  QD2     4.73                
 94 LEU  QD1    95 ILE  HN      6.53                
 94 LEU  QD1    95 ILE  HA      6.53                
 94 LEU  QD1    97 TYR  HN      6.53                
 94 LEU  QD1    97 TYR  HD2     4.76                
 94 LEU  QD1    98 LEU  HN      5.16                
 94 LEU  QD1    98 LEU  QD1     5.79                
 94 LEU  QD1   135 HEMC QM1     5.57                
 94 LEU  QD2    95 ILE  HN      6.53                
 94 LEU  QD2    98 LEU  QD1     5.42                
 94 LEU  QD2   135 HEMC QM1     4.83                
 94 LEU  QD2   135 HEMC QT2     4.98                
 95 ILE  HN     95 ILE  HA      3.33                
 95 ILE  HN     95 ILE  HB      2.74                
 95 ILE  HN     95 ILE  QG2     4.85                
 95 ILE  HN     95 ILE  HG12    4.17                
 95 ILE  HN     95 ILE  HG13    2.83                
 95 ILE  HN     95 ILE  QD1     4.76                
 95 ILE  HN     96 ALA  HN      3.21                
 95 ILE  HN     96 ALA  QB      5.94                
 95 ILE  HN     98 LEU  HN      5.50                
 95 ILE  HA     95 ILE  HB      3.33                
 95 ILE  HA     95 ILE  QG2     3.55                
 95 ILE  HA     95 ILE  HG12    3.33                
 95 ILE  HA     95 ILE  HG13    3.36                
 95 ILE  HA     95 ILE  QD1     4.76                
 95 ILE  HA     96 ALA  HN      4.14                
 95 ILE  HA     98 LEU  HN      3.79                
 95 ILE  HA     98 LEU  QD1     3.80                
 95 ILE  HA     98 LEU  QD2     6.53                
 95 ILE  HA     99 LYS+ HN      4.69                
 95 ILE  HB     95 ILE  QG2     3.43                
 95 ILE  HB     95 ILE  HG12    4.07                
 95 ILE  HB     95 ILE  HG13    2.90                
 95 ILE  HB     95 ILE  QD1     3.43                
 95 ILE  HB     96 ALA  HN      3.17                
 95 ILE  QG2    95 ILE  HG12    4.02                
 95 ILE  QG2    95 ILE  HG13    3.92                
 95 ILE  QG2    95 ILE  QD1     5.17                
 95 ILE  QG2    96 ALA  HN      4.76                
 95 ILE  QG2    96 ALA  HA      4.70                
 95 ILE  QG2    97 TYR  HN      6.50                
 95 ILE  QG2    98 LEU  HN      6.31                
 95 ILE  QG2    99 LYS+ HN      4.92                
 95 ILE  HG12   95 ILE  HG13    2.40                
 95 ILE  HG12   95 ILE  QD1     3.43                
 95 ILE  HG13   95 ILE  QD1     3.43                
 95 ILE  QD1    96 ALA  HN      6.53                
 96 ALA  HN     96 ALA  HA      2.96                
 96 ALA  HN     96 ALA  QB      3.43                
 96 ALA  HN     97 TYR  HN      3.61                
 96 ALA  HN     97 TYR  HB3     5.50                
 96 ALA  HN     99 LYS+ HN      5.50                
 96 ALA  HA     96 ALA  QB      3.43                
 96 ALA  HA     97 TYR  HN      4.07                
 96 ALA  HA     98 LEU  HN      5.50                
 96 ALA  HA     99 LYS+ HN      3.76                
 96 ALA  HA     99 LYS+ QB      4.64                
 96 ALA  HA    100 LYS+ HN      5.50                
 96 ALA  QB     97 TYR  HN      3.68                
 96 ALA  QB     99 LYS+ HN      6.53                
 97 TYR  HN     97 TYR  HA      3.39                
 97 TYR  HN     97 TYR  HB2     3.02                
 97 TYR  HN     97 TYR  HB3     2.90                
 97 TYR  HN     97 TYR  HD1     5.50                
 97 TYR  HN     98 LEU  HN      3.14                
 97 TYR  HN     99 LYS+ HN      5.50                
 97 TYR  HA     97 TYR  HB2     3.17                
 97 TYR  HA     97 TYR  HB3     3.39                
 97 TYR  HA     97 TYR  HD1     4.29                
 97 TYR  HA     97 TYR  HD2     5.50                
 97 TYR  HA     98 LEU  HN      4.85                
 97 TYR  HA    100 LYS+ HN      4.85                
 97 TYR  HA    101 ALA  HN      5.16                
 97 TYR  HB2    97 TYR  HB3     2.40                
 97 TYR  HB2    97 TYR  HD1     4.17                
 97 TYR  HB2    97 TYR  HD2     3.61                
 97 TYR  HB2    98 LEU  HN      3.89                
 97 TYR  HB3    97 TYR  HD1     4.23                
 97 TYR  HB3    97 TYR  HD2     3.48                
 97 TYR  HB3    98 LEU  HN      3.36                
 97 TYR  HD1    97 TYR  HD2     2.40                
 97 TYR  HD1    97 TYR  HE1     3.73                
 97 TYR  HD1    97 TYR  HE2     3.95                
 97 TYR  HD1    98 LEU  HN      5.50                
 97 TYR  HD1    98 LEU  HA      4.23                
 97 TYR  HD1    98 LEU  QD2     6.25                
 97 TYR  HD1   100 LYS+ HB2     4.82                
 97 TYR  HD2    97 TYR  HE1     3.89                
 97 TYR  HD2    97 TYR  HE2     4.72                
 97 TYR  HD2    98 LEU  HN      5.50                
 97 TYR  HD2    98 LEU  HG      3.76                
 97 TYR  HD2    98 LEU  QD2     6.12                
 97 TYR  HE1    97 TYR  HE2     2.40                
 97 TYR  HE1    98 LEU  QD2     6.53                
 97 TYR  HE1   100 LYS+ HB3     4.54                
 97 TYR  HE1   101 ALA  QB      4.70                
 97 TYR  HE2    98 LEU  QD2     6.53                
 97 TYR  HE2   101 ALA  QB      5.85                
 98 LEU  HN     98 LEU  HA      3.36                
 98 LEU  HN     98 LEU  HB2     2.96                
 98 LEU  HN     98 LEU  HB3     3.76                
 98 LEU  HN     98 LEU  HG      2.86                
 98 LEU  HN     98 LEU  QD1     5.19                
 98 LEU  HN     98 LEU  QD2     5.26                
 98 LEU  HN     99 LYS+ HN      3.17                
 98 LEU  HN    100 LYS+ HN      5.50                
 98 LEU  HN    102 THR  QG2     6.53                
 98 LEU  HA     98 LEU  HB2     3.02                
 98 LEU  HA     98 LEU  HB3     3.02                
 98 LEU  HA     98 LEU  HG      3.39                
 98 LEU  HA     98 LEU  QD1     4.76                
 98 LEU  HA     98 LEU  QD2     3.43                
 98 LEU  HA     99 LYS+ HN      4.35                
 98 LEU  HA    100 LYS+ HN      4.29                
 98 LEU  HA    101 ALA  HN      3.76                
 98 LEU  HA    101 ALA  QB      3.80                
 98 LEU  HA    102 THR  HN      3.98                
 98 LEU  HA    102 THR  QG2     4.02                
 98 LEU  HB2    98 LEU  HB3     2.40                
 98 LEU  HB2    98 LEU  HG      2.65                
 98 LEU  HB2    98 LEU  QD1     3.46                
 98 LEU  HB2    98 LEU  QD2     4.42                
 98 LEU  HB2    99 LYS+ HN      3.36                
 98 LEU  HB3    98 LEU  HG      3.30                
 98 LEU  HB3    98 LEU  QD1     3.52                
 98 LEU  HB3    98 LEU  QD2     3.92                
 98 LEU  HB3    99 LYS+ HN      4.17                
 98 LEU  HG     98 LEU  QD1     3.43                
 98 LEU  HG     98 LEU  QD2     3.43                
 98 LEU  HG    135 HEMC QM1     6.50                
 98 LEU  QD1    98 LEU  QD2     4.92                
 98 LEU  QD1    99 LYS+ HN      6.53                
 98 LEU  QD2    99 LYS+ HN      6.53                
 98 LEU  QD2   135 HEMC QM1     7.37                
 99 LYS+ HN     99 LYS+ HA      3.27                
 99 LYS+ HN     99 LYS+ QB      4.24                
 99 LYS+ HN     99 LYS+ HG2     2.90                
 99 LYS+ HN     99 LYS+ HG3     5.19                
 99 LYS+ HN     99 LYS+ QD      6.38                
 99 LYS+ HN    100 LYS+ HN      3.30                
 99 LYS+ HN    100 LYS+ HB3     4.69                
 99 LYS+ HN    100 LYS+ HG3     5.50                
 99 LYS+ HN    101 ALA  HN      4.69                
 99 LYS+ HN    102 THR  QG2     6.53                
 99 LYS+ HA     99 LYS+ QB      4.36                
 99 LYS+ HA     99 LYS+ HG2     2.68                
 99 LYS+ HA     99 LYS+ HG3     3.21                
 99 LYS+ HA     99 LYS+ QD      5.01                
 99 LYS+ HA    100 LYS+ HN      4.38                
 99 LYS+ HA    102 THR  HN      5.10                
 99 LYS+ HA    103 ASN  HD21    5.50                
 99 LYS+ QB     99 LYS+ HG2     3.28                
 99 LYS+ QB     99 LYS+ HG3     4.73                
 99 LYS+ QB     99 LYS+ QD      7.25                
 99 LYS+ QB    100 LYS+ HN      4.83                
 99 LYS+ HG2    99 LYS+ HG3     2.40                
 99 LYS+ HG2    99 LYS+ QD      4.89                
 99 LYS+ HG2   100 LYS+ HN      4.91                
 99 LYS+ HG3    99 LYS+ QD      3.56                
100 LYS+ HN    100 LYS+ HA      3.33                
100 LYS+ HN    100 LYS+ HB2     3.17                
100 LYS+ HN    100 LYS+ HB3     3.27                
100 LYS+ HN    100 LYS+ HG2     5.50                
100 LYS+ HN    100 LYS+ HG3     5.50                
100 LYS+ HN    100 LYS+ QD      6.38                
100 LYS+ HN    101 ALA  HN      3.05                
100 LYS+ HN    101 ALA  QB      5.41                
100 LYS+ HN    102 THR  HN      5.50                
100 LYS+ HA    100 LYS+ HB2     3.14                
100 LYS+ HA    100 LYS+ HB3     2.83                
100 LYS+ HA    100 LYS+ HG2     3.39                
100 LYS+ HA    100 LYS+ HG3     4.20                
100 LYS+ HA    101 ALA  HN      3.95                
100 LYS+ HA    103 ASN  HN      4.82                
100 LYS+ HB2   100 LYS+ HG2     3.11                
100 LYS+ HB2   100 LYS+ HG3     3.89                
100 LYS+ HB2   101 ALA  HN      3.24                
100 LYS+ HB3   100 LYS+ HG2     3.17                
100 LYS+ HB3   100 LYS+ HG3     3.27                
100 LYS+ HB3   101 ALA  HN      3.30                
100 LYS+ HG2   100 LYS+ QE      5.91                
100 LYS+ HG2   101 ALA  HN      5.50                
100 LYS+ HG3   100 LYS+ QE      5.85                
100 LYS+ HG3   101 ALA  HN      5.50                
100 LYS+ QD    101 ALA  HN      6.38                
101 ALA  HN    101 ALA  HA      3.42                
101 ALA  HN    101 ALA  QB      3.43                
101 ALA  HN    102 THR  HN      3.27                
101 ALA  HN    102 THR  QG2     5.66                
101 ALA  HN    103 ASN  HN      5.19                
101 ALA  HA    101 ALA  QB      3.74                
101 ALA  HA    102 THR  HN      3.58                
101 ALA  HA    102 THR  HA      5.04                
101 ALA  HA    102 THR  QG2     6.31                
101 ALA  HA    103 ASN  HN      4.42                
101 ALA  HA    104 GLU- HN      4.79                
101 ALA  QB    102 THR  HN      4.05                
101 ALA  QB    102 THR  HA      6.34                
101 ALA  QB    103 ASN  HN      5.60                
102 THR  HN    102 THR  HA      3.61                
102 THR  HN    102 THR  HB      3.83                
102 THR  HN    102 THR  QG2     3.43                
102 THR  HN    103 ASN  HN      3.05                
102 THR  HN    104 GLU- HN      4.04                
102 THR  HA    102 THR  HB      3.98                
102 THR  HA    102 THR  QG2     3.99                
102 THR  HA    103 ASN  HN      4.23                
102 THR  HB    102 THR  QG2     3.43                
103 ASN  HN    103 ASN  HA      3.36                
103 ASN  HN    103 ASN  HB2     3.39                
103 ASN  HN    103 ASN  HB3     3.17                
103 ASN  HN    103 ASN  HD21    5.50                
103 ASN  HN    103 ASN  HD22    3.05                
103 ASN  HN    104 GLU- HN      2.96                
103 ASN  HN    104 GLU- QG      6.38                
103 ASN  HA    103 ASN  HB2     3.17                
103 ASN  HA    103 ASN  HB3     3.21                
103 ASN  HA    103 ASN  HD21    5.50                
103 ASN  HA    103 ASN  HD22    5.50                
103 ASN  HA    104 GLU- HN      3.73                
103 ASN  HB2   103 ASN  HB3     2.40                
103 ASN  HB2   103 ASN  HD21    4.32                
103 ASN  HB2   103 ASN  HD22    4.42                
103 ASN  HB2   104 GLU- HN      4.01                
103 ASN  HB3   103 ASN  HD21    4.04                
103 ASN  HB3   103 ASN  HD22    5.50                
103 ASN  HB3   104 GLU- HN      5.50                
103 ASN  HD21  103 ASN  HD22    2.40                
104 GLU- HN    104 GLU- HA      3.52                
104 GLU- HN    104 GLU- HB2     3.64                
104 GLU- HN    104 GLU- HB3     3.58                
104 GLU- HN    104 GLU- QG      5.45                
104 GLU- HA    104 GLU- HB2     3.64                
104 GLU- HA    104 GLU- HB3     3.70                
104 GLU- HA    104 GLU- QG      6.38                
104 GLU- HB2   104 GLU- QG      3.90                
104 GLU- HB3   104 GLU- QG      4.52                
135 HEMC FE    135 HEMC CCN     2.20  5.00E+00                 
135 HEMC HAP71 135 HEMC HAP72   2.96                
135 HEMC HAP71 135 HEMC HBP73   3.39                
135 HEMC HAP71 135 HEMC HBP74   3.73                
135 HEMC HAP71 135 HEMC QM8     4.92                
135 HEMC HAP71 135 HEMC HGM     2.46                
135 HEMC HAP72 135 HEMC HBP73   3.83                
135 HEMC HAP72 135 HEMC HBP74   3.30                
135 HEMC HAP72 135 HEMC QM8     3.99                
135 HEMC HAP72 135 HEMC HGM     4.35                
135 HEMC HBP73 135 HEMC HBP74   2.49                
135 HEMC HBP73 135 HEMC QM8     5.69                
135 HEMC HBP73 135 HEMC HGM     3.86                
135 HEMC HBP74 135 HEMC QM8     3.89                
135 HEMC HBP74 135 HEMC HGM     5.22                
135 HEMC QM8   135 HEMC HDM     3.83                
135 HEMC QM8   135 HEMC QM1     7.55                
135 HEMC HDM   135 HEMC QM1     3.43                
135 HEMC QM1   135 HEMC HT2A    5.26                
135 HEMC QM1   135 HEMC QT2     4.49                
135 HEMC HT2A  135 HEMC QT2     3.43                
135 HEMC HT2A  135 HEMC HAM     2.40                
135 HEMC HT2A  135 HEMC QM3     5.44                
135 HEMC HAM   135 HEMC QM3     3.92                
135 HEMC QM3   135 HEMC HT4A    6.34                
135 HEMC QM3   135 HEMC QT4     4.86                
135 HEMC HT4A  135 HEMC QT4     3.43                
135 HEMC HT4A  135 HEMC QM5     5.60                
135 HEMC QM5   135 HEMC HAP61   6.53                
135 HEMC QM5   135 HEMC HAP62   3.68                
135 HEMC QM5   135 HEMC HBP63   6.53                
135 HEMC QM5   135 HEMC HBP64   6.53                
135 HEMC HGM   135 HEMC HAP61   2.71                
135 HEMC HGM   135 HEMC HAP62   5.34                
135 HEMC HAP61 135 HEMC HAP62   2.59                
 

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