Complet list of 1e52 con file
Complete list of 1e52.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 227
C A 0008 LEU C 2.424 C A 0009 GLU CA
C A 0008 LEU C 2.924 C A 0009 GLU C
C A 0008 LEU C 2.924 C A 0009 GLU CB
C A 0008 LEU C 3.466 C A 0009 GLU CG
C A 0008 LEU C 3.336 C A 0010 PRO CD
C A 0009 GLU CA 2.879 C A 0010 PRO CD
C A 0009 GLU C 2.429 C A 0010 PRO CA
C A 0009 GLU C 3.098 C A 0010 PRO C
C A 0009 GLU C 3.614 C A 0010 PRO CB
C A 0009 GLU C 3.631 C A 0010 PRO CG
C A 0009 GLU C 2.493 C A 0010 PRO CD
C A 0009 GLU C 3.748 C A 0013 VAL CG2
C A 0010 PRO C 2.424 C A 0011 ASP CA
C A 0010 PRO C 2.977 C A 0011 ASP C
C A 0010 PRO C 3.640 C A 0011 ASP CB
C A 0011 ASP C 2.424 C A 0012 ASN CA
C A 0011 ASP C 3.397 C A 0012 ASN C
C A 0011 ASP C 3.487 C A 0012 ASN CB
C A 0012 ASN C 2.423 C A 0013 VAL CA
C A 0012 ASN C 3.227 C A 0013 VAL C
C A 0012 ASN C 3.587 C A 0013 VAL CB
C A 0012 ASN C 3.738 C A 0014 PRO CD
C A 0013 VAL CA 2.914 C A 0014 PRO CD
C A 0013 VAL C 2.423 C A 0014 PRO CA
C A 0013 VAL C 3.169 C A 0014 PRO C
C A 0013 VAL C 3.584 C A 0014 PRO CB
C A 0013 VAL C 3.641 C A 0014 PRO CG
C A 0013 VAL C 2.498 C A 0014 PRO CD
C A 0013 VAL CB 3.169 C A 0014 PRO CD
C A 0013 VAL CG1 3.600 C A 0014 PRO CD
C A 0014 PRO C 2.424 C A 0015 MET CA
C A 0014 PRO C 3.704 C A 0015 MET C
C A 0014 PRO C 2.914 C A 0015 MET CB
C A 0014 PRO C 3.664 C A 0015 MET CG
C A 0015 MET C 2.423 C A 0016 ASP CA
C A 0015 MET C 3.677 C A 0016 ASP C
C A 0015 MET C 3.069 C A 0016 ASP CB
C A 0016 ASP C 2.423 C A 0017 MET CA
C A 0016 ASP C 2.942 C A 0017 MET C
C A 0016 ASP C 3.637 C A 0017 MET CB
C A 0017 MET C 2.424 C A 0018 SER CA
C A 0017 MET C 3.672 C A 0018 SER C
C A 0017 MET C 3.092 C A 0018 SER CB
C A 0018 SER CA 2.882 C A 0019 PRO CD
C A 0018 SER C 2.432 C A 0019 PRO CA
C A 0018 SER C 3.095 C A 0019 PRO C
C A 0018 SER C 3.618 C A 0019 PRO CB
C A 0018 SER C 3.620 C A 0019 PRO CG
C A 0018 SER C 2.495 C A 0019 PRO CD
C A 0018 SER CB 3.311 C A 0019 PRO CD
C A 0019 PRO C 2.443 H A 0020 LYS CA
C A 0019 PRO C 3.048 H A 0020 LYS C
C A 0019 PRO C 2.883 H A 0020 LYS CB
C A 0019 PRO CG 3.486 H A 0022 LEU CB
C A 0019 PRO CG 3.754 H A 0022 LEU CG
C A 0019 PRO CG 3.602 H A 0022 LEU CD2
H A 0020 LYS C 2.427 H A 0021 ALA CA
H A 0020 LYS C 2.908 H A 0021 ALA C
H A 0020 LYS C 3.639 H A 0021 ALA CB
H A 0021 ALA C 2.421 H A 0022 LEU CA
H A 0021 ALA C 2.931 H A 0022 LEU C
H A 0021 ALA C 3.635 H A 0022 LEU CB
H A 0022 LEU C 2.430 H A 0023 GLN CA
H A 0022 LEU C 2.908 H A 0023 GLN C
H A 0022 LEU C 3.633 H A 0023 GLN CB
H A 0022 LEU CG 3.475 H A 0026 ILE CD1
H A 0022 LEU CD1 3.341 H A 0026 ILE CG1
H A 0022 LEU CD1 2.923 H A 0026 ILE CD1
H A 0022 LEU CD1 3.735 H A 0055 LEU CD2
H A 0022 LEU CD2 3.432 H A 0059 PHE CA
H A 0022 LEU CD2 3.377 H A 0062 ALA CB
H A 0023 GLN C 2.421 H A 0024 GLN CA
H A 0023 GLN C 3.077 H A 0024 GLN C
H A 0023 GLN C 3.629 H A 0024 GLN CB
H A 0024 GLN C 2.423 H A 0025 LYS CA
H A 0024 GLN C 3.074 H A 0025 LYS C
H A 0024 GLN C 3.631 H A 0025 LYS CB
H A 0025 LYS C 2.424 H A 0026 ILE CA
H A 0025 LYS C 2.932 H A 0026 ILE C
H A 0025 LYS C 3.638 H A 0026 ILE CB
H A 0026 ILE C 2.422 H A 0027 HIS CA
H A 0026 ILE C 2.982 H A 0027 HIS C
H A 0026 ILE C 3.638 H A 0027 HIS CB
H A 0026 ILE CG1 3.728 H A 0055 LEU CB
H A 0027 HIS C 2.424 H A 0028 GLU CA
H A 0027 HIS C 3.157 H A 0028 GLU C
H A 0027 HIS C 3.614 H A 0028 GLU CB
H A 0028 GLU C 2.425 H A 0029 LEU CA
H A 0028 GLU C 3.079 H A 0029 LEU C
H A 0028 GLU C 3.632 H A 0029 LEU CB
H A 0029 LEU C 2.423 H A 0030 GLU CA
H A 0029 LEU C 2.989 H A 0030 GLU C
H A 0029 LEU C 3.639 H A 0030 GLU CB
H A 0029 LEU C 3.637 H A 0048 ILE CG2
H A 0029 LEU CB 3.458 H A 0048 ILE CG2
H A 0029 LEU CD2 3.787 H A 0048 ILE CG2
H A 0029 LEU CA 3.715 H A 0052 LEU CD2
H A 0029 LEU C 3.343 H A 0052 LEU CD2
H A 0029 LEU CB 2.923 H A 0052 LEU CD2
H A 0029 LEU CD1 3.508 H A 0055 LEU CD1
H A 0030 GLU C 2.423 H A 0031 GLY CA
H A 0030 GLU C 3.016 H A 0031 GLY C
H A 0030 GLU CA 3.747 H A 0052 LEU CG
H A 0030 GLU CA 3.547 H A 0052 LEU CD2
H A 0030 GLU CB 3.730 H A 0052 LEU CG
H A 0030 GLU CB 3.613 H A 0052 LEU CD1
H A 0031 GLY C 2.424 H A 0032 LEU CA
H A 0031 GLY C 3.097 H A 0032 LEU C
H A 0031 GLY C 3.628 H A 0032 LEU CB
H A 0032 LEU C 2.424 H A 0033 MET CA
H A 0032 LEU C 2.926 H A 0033 MET C
H A 0032 LEU C 3.636 H A 0033 MET CB
H A 0032 LEU CD2 3.649 H A 0048 ILE CD1
H A 0033 MET C 2.431 H A 0034 MET CA
H A 0033 MET C 2.910 H A 0034 MET C
H A 0033 MET C 3.634 H A 0034 MET CB
H A 0033 MET C 3.782 H A 0037 ALA CB
H A 0034 MET C 2.424 H A 0035 GLN CA
H A 0034 MET C 2.920 H A 0035 GLN C
H A 0034 MET C 3.634 H A 0035 GLN CB
H A 0035 GLN C 2.425 H A 0036 HIS CA
H A 0035 GLN C 2.949 H A 0036 HIS C
H A 0035 GLN C 3.632 H A 0036 HIS CB
H A 0036 HIS C 2.438 H A 0037 ALA CA
H A 0036 HIS C 2.890 H A 0037 ALA C
H A 0036 HIS C 3.639 H A 0037 ALA CB
H A 0036 HIS CA 3.579 H A 0041 GLU CB
H A 0036 HIS CB 3.446 H A 0041 GLU C
H A 0036 HIS CB 3.473 H A 0041 GLU CB
H A 0036 HIS CG 3.762 H A 0041 GLU C
H A 0036 HIS CG 3.131 H A 0041 GLU CB
H A 0036 HIS CD2 3.609 H A 0041 GLU CB
H A 0036 HIS CE1 3.684 H A 0041 GLU CB
H A 0036 HIS CE1 3.659 H A 0044 GLU CG
H A 0036 HIS CE1 3.247 H A 0044 GLU CD
H A 0036 HIS CB 2.916 H A 0045 ALA CB
H A 0036 HIS CG 3.416 H A 0045 ALA CB
H A 0037 ALA C 2.424 H A 0038 GLN CA
H A 0037 ALA C 3.134 H A 0038 GLN C
H A 0037 ALA C 3.619 H A 0038 GLN CB
H A 0038 GLN C 2.426 H A 0039 ASN CA
H A 0038 GLN C 3.277 H A 0039 ASN C
H A 0038 GLN C 3.562 H A 0039 ASN CB
H A 0039 ASN C 2.432 C A 0040 LEU CA
H A 0039 ASN C 2.959 C A 0040 LEU C
H A 0039 ASN C 2.926 C A 0040 LEU CB
H A 0039 ASN C 3.791 C A 0040 LEU CG
H A 0039 ASN C 3.573 C A 0040 LEU CD1
C A 0040 LEU C 2.423 H A 0041 GLU CA
C A 0040 LEU C 3.402 H A 0041 GLU C
C A 0040 LEU C 3.479 H A 0041 GLU CB
C A 0040 LEU C 3.675 H A 0041 GLU CG
H A 0041 GLU C 2.438 H A 0042 PHE CA
H A 0041 GLU C 3.040 H A 0042 PHE C
H A 0041 GLU C 3.653 H A 0042 PHE CB
H A 0042 PHE C 2.427 H A 0043 GLU CA
H A 0042 PHE C 2.872 H A 0043 GLU C
H A 0042 PHE C 3.637 H A 0043 GLU CB
H A 0042 PHE CD1 3.774 H A 0043 GLU CA
H A 0042 PHE CA 3.394 H A 0045 ALA CB
H A 0043 GLU C 2.416 H A 0044 GLU CA
H A 0043 GLU C 3.149 H A 0044 GLU C
H A 0043 GLU C 3.604 H A 0044 GLU CB
H A 0044 GLU C 2.437 H A 0045 ALA CA
H A 0044 GLU C 3.163 H A 0045 ALA C
H A 0044 GLU C 3.625 H A 0045 ALA CB
H A 0044 GLU CA 3.766 H A 0047 GLN CG
H A 0044 GLU C 3.601 H A 0047 GLN CG
H A 0045 ALA C 2.423 H A 0046 ALA CA
H A 0045 ALA C 2.912 H A 0046 ALA C
H A 0045 ALA C 3.641 H A 0046 ALA CB
H A 0046 ALA C 2.417 H A 0047 GLN CA
H A 0046 ALA C 2.912 H A 0047 GLN C
H A 0046 ALA C 3.639 H A 0047 GLN CB
H A 0047 GLN C 2.425 H A 0048 ILE CA
H A 0047 GLN C 2.911 H A 0048 ILE C
H A 0047 GLN C 3.639 H A 0048 ILE CB
H A 0048 ILE C 2.433 H A 0049 ARG CA
H A 0048 ILE C 2.892 H A 0049 ARG C
H A 0048 ILE C 3.633 H A 0049 ARG CB
H A 0048 ILE CG2 3.484 H A 0052 LEU CD2
H A 0049 ARG C 2.420 H A 0050 ASP CA
H A 0049 ARG C 3.067 H A 0050 ASP C
H A 0049 ARG C 3.631 H A 0050 ASP CB
H A 0049 ARG CZ 3.037 H A 0050 ASP CA
H A 0049 ARG CZ 3.351 H A 0050 ASP CB
H A 0050 ASP C 2.423 H A 0051 GLN CA
H A 0050 ASP C 3.147 H A 0051 GLN C
H A 0050 ASP C 3.617 H A 0051 GLN CB
H A 0051 GLN C 2.425 H A 0052 LEU CA
H A 0051 GLN C 3.035 H A 0052 LEU C
H A 0051 GLN C 3.639 H A 0052 LEU CB
H A 0051 GLN C 3.536 H A 0055 LEU CD1
H A 0052 LEU C 2.423 H A 0053 HIS CA
H A 0052 LEU C 3.124 H A 0053 HIS C
H A 0052 LEU C 3.622 H A 0053 HIS CB
H A 0053 HIS C 2.424 H A 0054 GLN CA
H A 0053 HIS C 3.012 H A 0054 GLN C
H A 0053 HIS C 3.639 H A 0054 GLN CB
H A 0054 GLN C 2.423 H A 0055 LEU CA
H A 0054 GLN C 3.021 H A 0055 LEU C
H A 0054 GLN C 3.638 H A 0055 LEU CB
H A 0054 GLN C 3.726 H A 0058 LEU CD1
H A 0055 LEU C 2.424 H A 0056 ARG CA
H A 0055 LEU C 2.987 H A 0056 ARG C
H A 0055 LEU C 3.640 H A 0056 ARG CB
H A 0056 ARG C 2.423 H A 0057 GLU CA
H A 0056 ARG C 2.930 H A 0057 GLU C
H A 0056 ARG C 3.637 H A 0057 GLU CB
H A 0057 GLU C 2.423 H A 0058 LEU CA
H A 0057 GLU C 3.018 H A 0058 LEU C
H A 0057 GLU C 3.638 H A 0058 LEU CB
H A 0058 LEU C 2.426 H A 0059 PHE CA
H A 0058 LEU C 2.915 H A 0059 PHE C
H A 0058 LEU C 3.635 H A 0059 PHE CB
H A 0059 PHE C 2.423 H A 0060 ILE CA
H A 0059 PHE C 3.120 H A 0060 ILE C
H A 0059 PHE C 3.621 H A 0060 ILE CB
H A 0060 ILE C 2.423 H A 0061 ALA CA
H A 0060 ILE C 2.926 H A 0061 ALA C
H A 0060 ILE C 3.636 H A 0061 ALA CB
H A 0061 ALA C 2.423 H A 0062 ALA CA
H A 0061 ALA C 3.190 H A 0062 ALA C
H A 0061 ALA C 3.601 H A 0062 ALA CB
H A 0062 ALA C 2.423 H A 0063 SER CA
H A 0062 ALA C 3.697 H A 0063 SER C
H A 0062 ALA C 2.984 H A 0063 SER CB
CHARGE_ATTR 2.00 12.00 45
H A 0028 GLU OE1 10.61 H A 0020 LYS NZ
H A 0028 GLU OE2 9.239 H A 0020 LYS NZ
H A 0028 GLU OE1 8.472 H A 0025 LYS NZ
H A 0028 GLU OE2 6.494 H A 0025 LYS NZ
H A 0028 GLU OE1 7.518 H A 0027 HIS ND1
H A 0028 GLU OE1 8.949 H A 0027 HIS NE2
H A 0028 GLU OE2 8.612 H A 0027 HIS ND1
H A 0028 GLU OE2 10.31 H A 0027 HIS NE2
H A 0030 GLU OE1 6.986 H A 0027 HIS ND1
H A 0030 GLU OE1 5.487 H A 0027 HIS NE2
H A 0030 GLU OE2 7.302 H A 0027 HIS ND1
H A 0030 GLU OE2 5.770 H A 0027 HIS NE2
H A 0030 GLU OE1 9.084 H A 0053 HIS ND1
H A 0030 GLU OE1 10.18 H A 0053 HIS NE2
H A 0030 GLU OE2 9.871 H A 0053 HIS ND1
H A 0030 GLU OE2 10.87 H A 0053 HIS NE2
H A 0030 GLU OE1 10.58 H A 0056 ARG NH1
H A 0030 GLU OE1 8.978 H A 0056 ARG NH2
H A 0030 GLU OE2 10.72 H A 0056 ARG NH2
H A 0041 GLU OE1 5.384 H A 0036 HIS ND1
H A 0041 GLU OE1 5.814 H A 0036 HIS NE2
H A 0041 GLU OE2 4.809 H A 0036 HIS ND1
H A 0041 GLU OE2 4.423 H A 0036 HIS NE2
H A 0043 GLU OE1 6.969 H A 0036 HIS ND1
H A 0043 GLU OE1 8.282 H A 0036 HIS NE2
H A 0043 GLU OE2 8.800 H A 0036 HIS ND1
H A 0043 GLU OE2 10.16 H A 0036 HIS NE2
H A 0044 GLU OE1 3.612 H A 0036 HIS ND1
H A 0044 GLU OE1 4.321 H A 0036 HIS NE2
H A 0044 GLU OE2 4.315 H A 0036 HIS ND1
H A 0044 GLU OE2 4.527 H A 0036 HIS NE2
H A 0050 ASP OD1 4.696 H A 0049 ARG NH1
H A 0050 ASP OD1 4.206 H A 0049 ARG NH2
H A 0050 ASP OD2 4.701 H A 0049 ARG NH1
H A 0050 ASP OD2 3.216 H A 0049 ARG NH2
H A 0050 ASP OD1 7.675 H A 0053 HIS ND1
H A 0050 ASP OD1 8.796 H A 0053 HIS NE2
H A 0050 ASP OD2 8.739 H A 0053 HIS ND1
H A 0050 ASP OD2 9.488 H A 0053 HIS NE2
H A 0057 GLU OE1 10.56 H A 0053 HIS ND1
H A 0057 GLU OE1 11.06 H A 0053 HIS NE2
H A 0057 GLU OE1 6.813 H A 0056 ARG NH1
H A 0057 GLU OE1 8.350 H A 0056 ARG NH2
H A 0057 GLU OE2 8.922 H A 0056 ARG NH1
H A 0057 GLU OE2 10.36 H A 0056 ARG NH2
CHARGE_REPU 2.00 12.00 34
C A 0009 GLU OE1 9.550 C A 0011 ASP OD1
C A 0009 GLU OE1 8.394 C A 0011 ASP OD2
C A 0009 GLU OE2 11.28 C A 0011 ASP OD1
C A 0009 GLU OE2 10.17 C A 0011 ASP OD2
C A 0011 ASP OD1 8.036 C A 0016 ASP OD1
C A 0011 ASP OD1 8.955 C A 0016 ASP OD2
C A 0011 ASP OD2 8.835 C A 0016 ASP OD1
C A 0011 ASP OD2 9.287 C A 0016 ASP OD2
H A 0020 LYS NZ 7.297 H A 0025 LYS NZ
H A 0020 LYS NZ 10.84 H A 0027 HIS ND1
H A 0028 GLU OE1 11.12 H A 0030 GLU OE1
H A 0028 GLU OE1 10.47 H A 0030 GLU OE2
H A 0041 GLU OE1 5.866 H A 0043 GLU OE1
H A 0041 GLU OE1 6.711 H A 0043 GLU OE2
H A 0041 GLU OE2 6.801 H A 0043 GLU OE1
H A 0041 GLU OE2 8.065 H A 0043 GLU OE2
H A 0041 GLU OE1 7.673 H A 0044 GLU OE1
H A 0041 GLU OE1 6.785 H A 0044 GLU OE2
H A 0041 GLU OE2 6.954 H A 0044 GLU OE1
H A 0041 GLU OE2 5.917 H A 0044 GLU OE2
H A 0043 GLU OE1 6.591 H A 0044 GLU OE1
H A 0043 GLU OE1 5.645 H A 0044 GLU OE2
H A 0043 GLU OE2 8.720 H A 0044 GLU OE1
H A 0043 GLU OE2 7.779 H A 0044 GLU OE2
H A 0049 ARG NH1 4.925 H A 0053 HIS ND1
H A 0049 ARG NH1 4.998 H A 0053 HIS NE2
H A 0049 ARG NH2 6.989 H A 0053 HIS ND1
H A 0049 ARG NH2 7.154 H A 0053 HIS NE2
H A 0049 ARG NH1 10.44 H A 0056 ARG NH1
H A 0049 ARG NH1 11.71 H A 0056 ARG NH2
H A 0053 HIS ND1 6.717 H A 0056 ARG NH1
H A 0053 HIS ND1 7.360 H A 0056 ARG NH2
H A 0053 HIS NE2 6.466 H A 0056 ARG NH1
H A 0053 HIS NE2 7.291 H A 0056 ARG NH2
HB_MM 2.00 3.20 108
C A 0009 GLU N 2.196 C A 0008 LEU O
C A 0010 PRO N 2.227 C A 0009 GLU O
C A 0011 ASP N 2.197 C A 0010 PRO O
C A 0012 ASN N 2.918 C A 0010 PRO O
C A 0012 ASN N 2.195 C A 0011 ASP O
C A 0013 VAL N 2.874 C A 0010 PRO O
C A 0013 VAL N 2.196 C A 0012 ASN O
C A 0014 PRO N 2.224 C A 0013 VAL O
C A 0015 MET N 2.197 C A 0014 PRO O
C A 0016 ASP N 2.196 C A 0015 MET O
C A 0017 MET N 2.196 C A 0016 ASP O
C A 0018 SER N 3.137 C A 0016 ASP O
C A 0018 SER N 2.197 C A 0017 MET O
C A 0019 PRO N 2.227 C A 0018 SER O
H A 0020 LYS N 3.082 C A 0018 SER O
H A 0020 LYS N 2.198 C A 0019 PRO O
H A 0021 ALA N 2.500 C A 0019 PRO O
H A 0021 ALA N 2.195 H A 0020 LYS O
H A 0022 LEU N 2.196 H A 0021 ALA O
H A 0023 GLN N 2.198 H A 0022 LEU O
H A 0024 GLN N 2.531 H A 0020 LYS O
H A 0024 GLN N 3.059 H A 0021 ALA O
H A 0024 GLN N 2.869 H A 0022 LEU O
H A 0024 GLN N 2.196 H A 0023 GLN O
H A 0025 LYS N 2.852 H A 0021 ALA O
H A 0025 LYS N 2.733 H A 0022 LEU O
H A 0025 LYS N 2.197 H A 0024 GLN O
H A 0026 ILE N 2.899 H A 0022 LEU O
H A 0026 ILE N 2.196 H A 0025 LYS O
H A 0027 HIS N 2.196 H A 0026 ILE O
H A 0028 GLU N 2.869 H A 0025 LYS O
H A 0028 GLU N 2.979 H A 0026 ILE O
H A 0028 GLU N 2.197 H A 0027 HIS O
H A 0029 LEU N 2.834 H A 0025 LYS O
H A 0029 LEU N 3.162 H A 0026 ILE O
H A 0029 LEU N 2.196 H A 0028 GLU O
H A 0030 GLU N 2.973 H A 0026 ILE O
H A 0030 GLU N 2.196 H A 0029 LEU O
H A 0031 GLY N 2.196 H A 0030 GLU O
H A 0032 LEU N 2.997 H A 0029 LEU O
H A 0032 LEU N 3.121 H A 0030 GLU O
H A 0032 LEU N 2.195 H A 0031 GLY O
H A 0033 MET N 2.197 H A 0032 LEU O
H A 0034 MET N 2.198 H A 0033 MET O
H A 0035 GLN N 3.046 H A 0032 LEU O
H A 0035 GLN N 3.058 H A 0033 MET O
H A 0035 GLN N 2.195 H A 0034 MET O
H A 0036 HIS N 2.195 H A 0035 GLN O
H A 0037 ALA N 2.772 H A 0033 MET O
H A 0037 ALA N 2.202 H A 0036 HIS O
H A 0038 GLN N 2.783 H A 0034 MET O
H A 0038 GLN N 2.931 H A 0035 GLN O
H A 0038 GLN N 2.730 H A 0036 HIS O
H A 0038 GLN N 2.199 H A 0037 ALA O
H A 0039 ASN N 2.981 H A 0035 GLN O
H A 0039 ASN N 2.573 H A 0036 HIS O
H A 0039 ASN N 2.199 H A 0038 GLN O
C A 0040 LEU N 2.803 H A 0036 HIS O
C A 0040 LEU N 2.199 H A 0039 ASN O
H A 0041 GLU N 2.765 H A 0036 HIS O
H A 0041 GLU N 2.981 H A 0039 ASN O
H A 0041 GLU N 2.195 C A 0040 LEU O
H A 0042 PHE N 2.202 H A 0041 GLU O
H A 0043 GLU N 2.864 H A 0041 GLU O
H A 0043 GLU N 2.192 H A 0042 PHE O
H A 0044 GLU N 2.194 H A 0043 GLU O
H A 0045 ALA N 3.176 H A 0042 PHE O
H A 0045 ALA N 2.202 H A 0044 GLU O
H A 0046 ALA N 2.520 H A 0042 PHE O
H A 0046 ALA N 2.194 H A 0045 ALA O
H A 0047 GLN N 2.730 H A 0045 ALA O
H A 0047 GLN N 2.193 H A 0046 ALA O
H A 0048 ILE N 2.782 H A 0045 ALA O
H A 0048 ILE N 2.954 H A 0046 ALA O
H A 0048 ILE N 2.199 H A 0047 GLN O
H A 0049 ARG N 2.728 H A 0046 ALA O
H A 0049 ARG N 2.873 H A 0047 GLN O
H A 0049 ARG N 2.201 H A 0048 ILE O
H A 0050 ASP N 2.853 H A 0047 GLN O
H A 0050 ASP N 2.834 H A 0048 ILE O
H A 0050 ASP N 2.196 H A 0049 ARG O
H A 0051 GLN N 2.673 H A 0048 ILE O
H A 0051 GLN N 2.197 H A 0050 ASP O
H A 0052 LEU N 2.617 H A 0048 ILE O
H A 0052 LEU N 2.198 H A 0051 GLN O
H A 0053 HIS N 3.104 H A 0049 ARG O
H A 0053 HIS N 2.196 H A 0052 LEU O
H A 0054 GLN N 3.191 H A 0050 ASP O
H A 0054 GLN N 2.196 H A 0053 HIS O
H A 0055 LEU N 2.898 H A 0051 GLN O
H A 0055 LEU N 2.195 H A 0054 GLN O
H A 0056 ARG N 3.148 H A 0053 HIS O
H A 0056 ARG N 3.148 H A 0054 GLN O
H A 0056 ARG N 2.196 H A 0055 LEU O
H A 0057 GLU N 2.196 H A 0056 ARG O
H A 0058 LEU N 3.062 H A 0056 ARG O
H A 0058 LEU N 2.197 H A 0057 GLU O
H A 0059 PHE N 3.077 H A 0055 LEU O
H A 0059 PHE N 2.725 H A 0056 ARG O
H A 0059 PHE N 3.063 H A 0057 GLU O
H A 0059 PHE N 2.196 H A 0058 LEU O
H A 0060 ILE N 3.100 H A 0058 LEU O
H A 0060 ILE N 2.195 H A 0059 PHE O
H A 0061 ALA N 2.197 H A 0060 ILE O
H A 0062 ALA N 2.820 H A 0058 LEU O
H A 0062 ALA N 2.813 H A 0060 ILE O
H A 0062 ALA N 2.197 H A 0061 ALA O
H A 0063 SER N 2.196 H A 0062 ALA O
HB_MS 2.00 3.20 5
C A 0017 MET O 2.610 C A 0018 SER OG
H A 0034 MET O 2.974 H A 0038 GLN NE2
H A 0041 GLU O 2.713 H A 0036 HIS ND1
H A 0049 ARG O 3.048 H A 0053 HIS ND1
H A 0062 ALA O 2.512 H A 0063 SER OG
AROMATIC 0.00 8.00 1
H A 0049 ARG 4.504 H A 0053 HIS
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 34
H A 0033 MET CE 3.400 C B 0040 LEU CD2
H A 0033 MET CG 3.771 H B 0042 PHE CE2
H A 0033 MET CE 3.172 H B 0042 PHE CE2
H A 0033 MET CE 3.334 H B 0042 PHE CZ
H A 0034 MET CE 3.401 H B 0038 GLN CA
H A 0034 MET CE 3.540 H B 0038 GLN C
H A 0038 GLN CA 3.340 H B 0034 MET CE
H A 0038 GLN C 3.465 H B 0034 MET CE
C A 0040 LEU CG 3.745 H B 0033 MET CE
C A 0040 LEU CD2 3.288 H B 0033 MET CE
H A 0042 PHE CE2 3.685 H B 0033 MET CG
H A 0042 PHE CE2 3.149 H B 0033 MET CE
H A 0042 PHE CZ 3.768 H B 0033 MET CG
H A 0042 PHE CZ 3.309 H B 0033 MET CE
H A 0042 PHE CG 3.720 H B 0046 ALA CB
H A 0042 PHE CD1 3.645 H B 0046 ALA CA
H A 0042 PHE CD1 2.911 H B 0046 ALA CB
H A 0042 PHE CE1 3.087 H B 0046 ALA CA
H A 0042 PHE CE1 3.627 H B 0046 ALA C
H A 0042 PHE CE1 2.910 H B 0046 ALA CB
H A 0042 PHE CZ 3.366 H B 0046 ALA CA
H A 0042 PHE CZ 3.711 H B 0046 ALA CB
H A 0042 PHE CE1 3.643 H B 0049 ARG CB
H A 0042 PHE CZ 3.670 H B 0049 ARG CB
H A 0046 ALA CA 3.699 H B 0042 PHE CD1
H A 0046 ALA CA 3.150 H B 0042 PHE CE1
H A 0046 ALA CA 3.429 H B 0042 PHE CZ
H A 0046 ALA C 3.697 H B 0042 PHE CE1
H A 0046 ALA CB 3.735 H B 0042 PHE CG
H A 0046 ALA CB 2.925 H B 0042 PHE CD1
H A 0046 ALA CB 2.919 H B 0042 PHE CE1
H A 0046 ALA CB 3.718 H B 0042 PHE CZ
H A 0049 ARG CB 3.691 H B 0042 PHE CE1
H A 0049 ARG CB 3.693 H B 0042 PHE CZ
CHARGE_ATTR 2.00 12.00 32
H A 0041 GLU OE1 10.30 H B 0049 ARG NH1
H A 0041 GLU OE1 11.67 H B 0049 ARG NH2
H A 0041 GLU OE1 8.943 H B 0053 HIS ND1
H A 0041 GLU OE1 7.163 H B 0053 HIS NE2
H A 0041 GLU OE2 11.01 H B 0053 HIS ND1
H A 0041 GLU OE2 9.158 H B 0053 HIS NE2
H A 0041 GLU OE1 11.12 H B 0056 ARG NH1
H A 0041 GLU OE1 11.13 H B 0056 ARG NH2
H A 0043 GLU OE1 8.071 H B 0049 ARG NH1
H A 0043 GLU OE1 8.585 H B 0049 ARG NH2
H A 0043 GLU OE2 6.072 H B 0049 ARG NH1
H A 0043 GLU OE2 6.691 H B 0049 ARG NH2
H A 0043 GLU OE1 9.770 H B 0053 HIS ND1
H A 0043 GLU OE1 7.976 H B 0053 HIS NE2
H A 0043 GLU OE2 8.266 H B 0053 HIS ND1
H A 0043 GLU OE2 6.591 H B 0053 HIS NE2
H A 0049 ARG NH1 10.49 H B 0041 GLU OE1
H A 0049 ARG NH2 11.82 H B 0041 GLU OE1
H A 0049 ARG NH1 8.301 H B 0043 GLU OE1
H A 0049 ARG NH1 6.315 H B 0043 GLU OE2
H A 0049 ARG NH2 8.782 H B 0043 GLU OE1
H A 0049 ARG NH2 6.901 H B 0043 GLU OE2
H A 0053 HIS ND1 9.203 H B 0041 GLU OE1
H A 0053 HIS ND1 11.28 H B 0041 GLU OE2
H A 0053 HIS NE2 7.416 H B 0041 GLU OE1
H A 0053 HIS NE2 9.428 H B 0041 GLU OE2
H A 0053 HIS ND1 10.00 H B 0043 GLU OE1
H A 0053 HIS ND1 8.487 H B 0043 GLU OE2
H A 0053 HIS NE2 8.210 H B 0043 GLU OE1
H A 0053 HIS NE2 6.796 H B 0043 GLU OE2
H A 0056 ARG NH1 11.37 H B 0041 GLU OE1
H A 0056 ARG NH2 11.39 H B 0041 GLU OE1
CHARGE_REPU 2.00 12.00 8
H A 0036 HIS ND1 11.76 H B 0053 HIS NE2
H A 0043 GLU OE1 11.76 H B 0050 ASP OD2
H A 0043 GLU OE2 10.56 H B 0050 ASP OD1
H A 0043 GLU OE2 9.834 H B 0050 ASP OD2
H A 0050 ASP OD1 10.79 H B 0043 GLU OE2
H A 0050 ASP OD2 11.95 H B 0043 GLU OE1
H A 0050 ASP OD2 10.04 H B 0043 GLU OE2
H A 0053 HIS NE2 11.97 H B 0036 HIS ND1
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 227
C B 0008 LEU C 2.424 C B 0009 GLU CA
C B 0008 LEU C 2.925 C B 0009 GLU C
C B 0008 LEU C 2.925 C B 0009 GLU CB
C B 0008 LEU C 3.466 C B 0009 GLU CG
C B 0008 LEU C 3.336 C B 0010 PRO CD
C B 0009 GLU CA 2.881 C B 0010 PRO CD
C B 0009 GLU C 2.429 C B 0010 PRO CA
C B 0009 GLU C 3.098 C B 0010 PRO C
C B 0009 GLU C 3.614 C B 0010 PRO CB
C B 0009 GLU C 3.630 C B 0010 PRO CG
C B 0009 GLU C 2.494 C B 0010 PRO CD
C B 0009 GLU C 3.748 C B 0013 VAL CG2
C B 0010 PRO C 2.424 C B 0011 ASP CA
C B 0010 PRO C 2.977 C B 0011 ASP C
C B 0010 PRO C 3.640 C B 0011 ASP CB
C B 0011 ASP C 2.423 C B 0012 ASN CA
C B 0011 ASP C 3.397 C B 0012 ASN C
C B 0011 ASP C 3.488 C B 0012 ASN CB
C B 0012 ASN C 2.423 C B 0013 VAL CA
C B 0012 ASN C 3.227 C B 0013 VAL C
C B 0012 ASN C 3.588 C B 0013 VAL CB
C B 0012 ASN C 3.736 C B 0014 PRO CD
C B 0013 VAL CA 2.915 C B 0014 PRO CD
C B 0013 VAL C 2.421 C B 0014 PRO CA
C B 0013 VAL C 3.169 C B 0014 PRO C
C B 0013 VAL C 3.583 C B 0014 PRO CB
C B 0013 VAL C 3.640 C B 0014 PRO CG
C B 0013 VAL C 2.497 C B 0014 PRO CD
C B 0013 VAL CB 3.172 C B 0014 PRO CD
C B 0013 VAL CG1 3.604 C B 0014 PRO CD
C B 0014 PRO C 2.423 C B 0015 MET CA
C B 0014 PRO C 3.704 C B 0015 MET C
C B 0014 PRO C 2.916 C B 0015 MET CB
C B 0014 PRO C 3.663 C B 0015 MET CG
C B 0015 MET C 2.424 C B 0016 ASP CA
C B 0015 MET C 3.678 C B 0016 ASP C
C B 0015 MET C 3.071 C B 0016 ASP CB
C B 0016 ASP C 2.423 C B 0017 MET CA
C B 0016 ASP C 2.942 C B 0017 MET C
C B 0016 ASP C 3.638 C B 0017 MET CB
C B 0017 MET C 2.424 C B 0018 SER CA
C B 0017 MET C 3.672 C B 0018 SER C
C B 0017 MET C 3.093 C B 0018 SER CB
C B 0018 SER CA 2.882 C B 0019 PRO CD
C B 0018 SER C 2.433 C B 0019 PRO CA
C B 0018 SER C 3.096 C B 0019 PRO C
C B 0018 SER C 3.618 C B 0019 PRO CB
C B 0018 SER C 3.621 C B 0019 PRO CG
C B 0018 SER C 2.495 C B 0019 PRO CD
C B 0018 SER CB 3.311 C B 0019 PRO CD
C B 0019 PRO C 2.443 H B 0020 LYS CA
C B 0019 PRO C 3.048 H B 0020 LYS C
C B 0019 PRO C 2.883 H B 0020 LYS CB
C B 0019 PRO CG 3.483 H B 0022 LEU CB
C B 0019 PRO CG 3.750 H B 0022 LEU CG
C B 0019 PRO CG 3.602 H B 0022 LEU CD2
H B 0020 LYS C 2.427 H B 0021 ALA CA
H B 0020 LYS C 2.909 H B 0021 ALA C
H B 0020 LYS C 3.638 H B 0021 ALA CB
H B 0021 ALA C 2.421 H B 0022 LEU CA
H B 0021 ALA C 2.931 H B 0022 LEU C
H B 0021 ALA C 3.635 H B 0022 LEU CB
H B 0022 LEU C 2.429 H B 0023 GLN CA
H B 0022 LEU C 2.907 H B 0023 GLN C
H B 0022 LEU C 3.632 H B 0023 GLN CB
H B 0022 LEU CG 3.479 H B 0026 ILE CD1
H B 0022 LEU CD1 3.342 H B 0026 ILE CG1
H B 0022 LEU CD1 2.924 H B 0026 ILE CD1
H B 0022 LEU CD1 3.735 H B 0055 LEU CD2
H B 0022 LEU CD2 3.433 H B 0059 PHE CA
H B 0022 LEU CD2 3.377 H B 0062 ALA CB
H B 0023 GLN C 2.422 H B 0024 GLN CA
H B 0023 GLN C 3.077 H B 0024 GLN C
H B 0023 GLN C 3.629 H B 0024 GLN CB
H B 0024 GLN C 2.423 H B 0025 LYS CA
H B 0024 GLN C 3.076 H B 0025 LYS C
H B 0024 GLN C 3.632 H B 0025 LYS CB
H B 0025 LYS C 2.423 H B 0026 ILE CA
H B 0025 LYS C 2.932 H B 0026 ILE C
H B 0025 LYS C 3.637 H B 0026 ILE CB
H B 0026 ILE C 2.422 H B 0027 HIS CA
H B 0026 ILE C 2.982 H B 0027 HIS C
H B 0026 ILE C 3.637 H B 0027 HIS CB
H B 0026 ILE CG1 3.728 H B 0055 LEU CB
H B 0027 HIS C 2.425 H B 0028 GLU CA
H B 0027 HIS C 3.157 H B 0028 GLU C
H B 0027 HIS C 3.613 H B 0028 GLU CB
H B 0028 GLU C 2.424 H B 0029 LEU CA
H B 0028 GLU C 3.077 H B 0029 LEU C
H B 0028 GLU C 3.631 H B 0029 LEU CB
H B 0029 LEU C 2.424 H B 0030 GLU CA
H B 0029 LEU C 2.989 H B 0030 GLU C
H B 0029 LEU C 3.639 H B 0030 GLU CB
H B 0029 LEU C 3.637 H B 0048 ILE CG2
H B 0029 LEU CB 3.459 H B 0048 ILE CG2
H B 0029 LEU CD2 3.786 H B 0048 ILE CG2
H B 0029 LEU CA 3.718 H B 0052 LEU CD2
H B 0029 LEU C 3.347 H B 0052 LEU CD2
H B 0029 LEU CB 2.924 H B 0052 LEU CD2
H B 0029 LEU CD1 3.508 H B 0055 LEU CD1
H B 0030 GLU C 2.423 H B 0031 GLY CA
H B 0030 GLU C 3.016 H B 0031 GLY C
H B 0030 GLU CA 3.749 H B 0052 LEU CG
H B 0030 GLU CA 3.549 H B 0052 LEU CD2
H B 0030 GLU CB 3.730 H B 0052 LEU CG
H B 0030 GLU CB 3.617 H B 0052 LEU CD1
H B 0031 GLY C 2.423 H B 0032 LEU CA
H B 0031 GLY C 3.096 H B 0032 LEU C
H B 0031 GLY C 3.628 H B 0032 LEU CB
H B 0032 LEU C 2.425 H B 0033 MET CA
H B 0032 LEU C 2.924 H B 0033 MET C
H B 0032 LEU C 3.636 H B 0033 MET CB
H B 0032 LEU CD2 3.651 H B 0048 ILE CD1
H B 0033 MET C 2.430 H B 0034 MET CA
H B 0033 MET C 2.909 H B 0034 MET C
H B 0033 MET C 3.633 H B 0034 MET CB
H B 0033 MET C 3.788 H B 0037 ALA CB
H B 0034 MET C 2.424 H B 0035 GLN CA
H B 0034 MET C 2.919 H B 0035 GLN C
H B 0034 MET C 3.633 H B 0035 GLN CB
H B 0035 GLN C 2.425 H B 0036 HIS CA
H B 0035 GLN C 2.949 H B 0036 HIS C
H B 0035 GLN C 3.631 H B 0036 HIS CB
H B 0036 HIS C 2.438 H B 0037 ALA CA
H B 0036 HIS C 2.891 H B 0037 ALA C
H B 0036 HIS C 3.638 H B 0037 ALA CB
H B 0036 HIS CA 3.578 H B 0041 GLU CB
H B 0036 HIS CB 3.449 H B 0041 GLU C
H B 0036 HIS CB 3.473 H B 0041 GLU CB
H B 0036 HIS CG 3.767 H B 0041 GLU C
H B 0036 HIS CG 3.135 H B 0041 GLU CB
H B 0036 HIS CD2 3.613 H B 0041 GLU CB
H B 0036 HIS CE1 3.689 H B 0041 GLU CB
H B 0036 HIS CE1 3.659 H B 0044 GLU CG
H B 0036 HIS CE1 3.245 H B 0044 GLU CD
H B 0036 HIS CB 2.917 H B 0045 ALA CB
H B 0036 HIS CG 3.416 H B 0045 ALA CB
H B 0037 ALA C 2.423 H B 0038 GLN CA
H B 0037 ALA C 3.129 H B 0038 GLN C
H B 0037 ALA C 3.617 H B 0038 GLN CB
H B 0038 GLN C 2.426 H B 0039 ASN CA
H B 0038 GLN C 3.278 H B 0039 ASN C
H B 0038 GLN C 3.563 H B 0039 ASN CB
H B 0039 ASN C 2.431 C B 0040 LEU CA
H B 0039 ASN C 2.959 C B 0040 LEU C
H B 0039 ASN C 2.925 C B 0040 LEU CB
H B 0039 ASN C 3.791 C B 0040 LEU CG
H B 0039 ASN C 3.572 C B 0040 LEU CD1
C B 0040 LEU C 2.423 H B 0041 GLU CA
C B 0040 LEU C 3.400 H B 0041 GLU C
C B 0040 LEU C 3.480 H B 0041 GLU CB
C B 0040 LEU C 3.677 H B 0041 GLU CG
H B 0041 GLU C 2.437 H B 0042 PHE CA
H B 0041 GLU C 3.040 H B 0042 PHE C
H B 0041 GLU C 3.653 H B 0042 PHE CB
H B 0042 PHE C 2.427 H B 0043 GLU CA
H B 0042 PHE C 2.874 H B 0043 GLU C
H B 0042 PHE C 3.637 H B 0043 GLU CB
H B 0042 PHE CD1 3.787 H B 0043 GLU CA
H B 0042 PHE CA 3.397 H B 0045 ALA CB
H B 0043 GLU C 2.416 H B 0044 GLU CA
H B 0043 GLU C 3.149 H B 0044 GLU C
H B 0043 GLU C 3.605 H B 0044 GLU CB
H B 0044 GLU C 2.435 H B 0045 ALA CA
H B 0044 GLU C 3.159 H B 0045 ALA C
H B 0044 GLU C 3.625 H B 0045 ALA CB
H B 0044 GLU CA 3.768 H B 0047 GLN CG
H B 0044 GLU C 3.605 H B 0047 GLN CG
H B 0045 ALA C 2.422 H B 0046 ALA CA
H B 0045 ALA C 2.911 H B 0046 ALA C
H B 0045 ALA C 3.636 H B 0046 ALA CB
H B 0046 ALA C 2.416 H B 0047 GLN CA
H B 0046 ALA C 2.911 H B 0047 GLN C
H B 0046 ALA C 3.637 H B 0047 GLN CB
H B 0047 GLN C 2.425 H B 0048 ILE CA
H B 0047 GLN C 2.910 H B 0048 ILE C
H B 0047 GLN C 3.639 H B 0048 ILE CB
H B 0048 ILE C 2.432 H B 0049 ARG CA
H B 0048 ILE C 2.891 H B 0049 ARG C
H B 0048 ILE C 3.633 H B 0049 ARG CB
H B 0048 ILE CG2 3.487 H B 0052 LEU CD2
H B 0049 ARG C 2.422 H B 0050 ASP CA
H B 0049 ARG C 3.067 H B 0050 ASP C
H B 0049 ARG C 3.631 H B 0050 ASP CB
H B 0049 ARG CZ 3.037 H B 0050 ASP CA
H B 0049 ARG CZ 3.350 H B 0050 ASP CB
H B 0050 ASP C 2.425 H B 0051 GLN CA
H B 0050 ASP C 3.148 H B 0051 GLN C
H B 0050 ASP C 3.617 H B 0051 GLN CB
H B 0051 GLN C 2.426 H B 0052 LEU CA
H B 0051 GLN C 3.036 H B 0052 LEU C
H B 0051 GLN C 3.639 H B 0052 LEU CB
H B 0051 GLN C 3.536 H B 0055 LEU CD1
H B 0052 LEU C 2.424 H B 0053 HIS CA
H B 0052 LEU C 3.125 H B 0053 HIS C
H B 0052 LEU C 3.622 H B 0053 HIS CB
H B 0053 HIS C 2.424 H B 0054 GLN CA
H B 0053 HIS C 3.013 H B 0054 GLN C
H B 0053 HIS C 3.640 H B 0054 GLN CB
H B 0054 GLN C 2.423 H B 0055 LEU CA
H B 0054 GLN C 3.022 H B 0055 LEU C
H B 0054 GLN C 3.639 H B 0055 LEU CB
H B 0054 GLN C 3.725 H B 0058 LEU CD1
H B 0055 LEU C 2.424 H B 0056 ARG CA
H B 0055 LEU C 2.987 H B 0056 ARG C
H B 0055 LEU C 3.641 H B 0056 ARG CB
H B 0056 ARG C 2.423 H B 0057 GLU CA
H B 0056 ARG C 2.930 H B 0057 GLU C
H B 0056 ARG C 3.636 H B 0057 GLU CB
H B 0057 GLU C 2.424 H B 0058 LEU CA
H B 0057 GLU C 3.018 H B 0058 LEU C
H B 0057 GLU C 3.639 H B 0058 LEU CB
H B 0058 LEU C 2.427 H B 0059 PHE CA
H B 0058 LEU C 2.916 H B 0059 PHE C
H B 0058 LEU C 3.636 H B 0059 PHE CB
H B 0059 PHE C 2.423 H B 0060 ILE CA
H B 0059 PHE C 3.121 H B 0060 ILE C
H B 0059 PHE C 3.621 H B 0060 ILE CB
H B 0060 ILE C 2.423 H B 0061 ALA CA
H B 0060 ILE C 2.925 H B 0061 ALA C
H B 0060 ILE C 3.635 H B 0061 ALA CB
H B 0061 ALA C 2.424 H B 0062 ALA CA
H B 0061 ALA C 3.190 H B 0062 ALA C
H B 0061 ALA C 3.601 H B 0062 ALA CB
H B 0062 ALA C 2.423 H B 0063 SER CA
H B 0062 ALA C 3.696 H B 0063 SER C
H B 0062 ALA C 2.984 H B 0063 SER CB
CHARGE_ATTR 2.00 12.00 45
H B 0028 GLU OE1 10.60 H B 0020 LYS NZ
H B 0028 GLU OE2 9.236 H B 0020 LYS NZ
H B 0028 GLU OE1 8.471 H B 0025 LYS NZ
H B 0028 GLU OE2 6.493 H B 0025 LYS NZ
H B 0028 GLU OE1 7.519 H B 0027 HIS ND1
H B 0028 GLU OE1 8.949 H B 0027 HIS NE2
H B 0028 GLU OE2 8.614 H B 0027 HIS ND1
H B 0028 GLU OE2 10.31 H B 0027 HIS NE2
H B 0030 GLU OE1 6.986 H B 0027 HIS ND1
H B 0030 GLU OE1 5.487 H B 0027 HIS NE2
H B 0030 GLU OE2 7.302 H B 0027 HIS ND1
H B 0030 GLU OE2 5.770 H B 0027 HIS NE2
H B 0030 GLU OE1 9.084 H B 0053 HIS ND1
H B 0030 GLU OE1 10.18 H B 0053 HIS NE2
H B 0030 GLU OE2 9.870 H B 0053 HIS ND1
H B 0030 GLU OE2 10.87 H B 0053 HIS NE2
H B 0030 GLU OE1 10.58 H B 0056 ARG NH1
H B 0030 GLU OE1 8.978 H B 0056 ARG NH2
H B 0030 GLU OE2 10.72 H B 0056 ARG NH2
H B 0041 GLU OE1 5.386 H B 0036 HIS ND1
H B 0041 GLU OE1 5.816 H B 0036 HIS NE2
H B 0041 GLU OE2 4.809 H B 0036 HIS ND1
H B 0041 GLU OE2 4.423 H B 0036 HIS NE2
H B 0043 GLU OE1 6.971 H B 0036 HIS ND1
H B 0043 GLU OE1 8.283 H B 0036 HIS NE2
H B 0043 GLU OE2 8.803 H B 0036 HIS ND1
H B 0043 GLU OE2 10.16 H B 0036 HIS NE2
H B 0044 GLU OE1 3.610 H B 0036 HIS ND1
H B 0044 GLU OE1 4.320 H B 0036 HIS NE2
H B 0044 GLU OE2 4.316 H B 0036 HIS ND1
H B 0044 GLU OE2 4.526 H B 0036 HIS NE2
H B 0050 ASP OD1 4.697 H B 0049 ARG NH1
H B 0050 ASP OD1 4.209 H B 0049 ARG NH2
H B 0050 ASP OD2 4.700 H B 0049 ARG NH1
H B 0050 ASP OD2 3.219 H B 0049 ARG NH2
H B 0050 ASP OD1 7.674 H B 0053 HIS ND1
H B 0050 ASP OD1 8.793 H B 0053 HIS NE2
H B 0050 ASP OD2 8.738 H B 0053 HIS ND1
H B 0050 ASP OD2 9.485 H B 0053 HIS NE2
H B 0057 GLU OE1 10.56 H B 0053 HIS ND1
H B 0057 GLU OE1 11.06 H B 0053 HIS NE2
H B 0057 GLU OE1 6.814 H B 0056 ARG NH1
H B 0057 GLU OE1 8.351 H B 0056 ARG NH2
H B 0057 GLU OE2 8.923 H B 0056 ARG NH1
H B 0057 GLU OE2 10.36 H B 0056 ARG NH2
CHARGE_REPU 2.00 12.00 34
C B 0009 GLU OE1 9.552 C B 0011 ASP OD1
C B 0009 GLU OE1 8.393 C B 0011 ASP OD2
C B 0009 GLU OE2 11.28 C B 0011 ASP OD1
C B 0009 GLU OE2 10.17 C B 0011 ASP OD2
C B 0011 ASP OD1 8.037 C B 0016 ASP OD1
C B 0011 ASP OD1 8.955 C B 0016 ASP OD2
C B 0011 ASP OD2 8.835 C B 0016 ASP OD1
C B 0011 ASP OD2 9.285 C B 0016 ASP OD2
H B 0020 LYS NZ 7.296 H B 0025 LYS NZ
H B 0020 LYS NZ 10.84 H B 0027 HIS ND1
H B 0028 GLU OE1 11.12 H B 0030 GLU OE1
H B 0028 GLU OE1 10.47 H B 0030 GLU OE2
H B 0041 GLU OE1 5.866 H B 0043 GLU OE1
H B 0041 GLU OE1 6.711 H B 0043 GLU OE2
H B 0041 GLU OE2 6.802 H B 0043 GLU OE1
H B 0041 GLU OE2 8.066 H B 0043 GLU OE2
H B 0041 GLU OE1 7.672 H B 0044 GLU OE1
H B 0041 GLU OE1 6.785 H B 0044 GLU OE2
H B 0041 GLU OE2 6.953 H B 0044 GLU OE1
H B 0041 GLU OE2 5.917 H B 0044 GLU OE2
H B 0043 GLU OE1 6.591 H B 0044 GLU OE1
H B 0043 GLU OE1 5.646 H B 0044 GLU OE2
H B 0043 GLU OE2 8.721 H B 0044 GLU OE1
H B 0043 GLU OE2 7.780 H B 0044 GLU OE2
H B 0049 ARG NH1 4.927 H B 0053 HIS ND1
H B 0049 ARG NH1 4.998 H B 0053 HIS NE2
H B 0049 ARG NH2 6.990 H B 0053 HIS ND1
H B 0049 ARG NH2 7.152 H B 0053 HIS NE2
H B 0049 ARG NH1 10.44 H B 0056 ARG NH1
H B 0049 ARG NH1 11.71 H B 0056 ARG NH2
H B 0053 HIS ND1 6.716 H B 0056 ARG NH1
H B 0053 HIS ND1 7.358 H B 0056 ARG NH2
H B 0053 HIS NE2 6.466 H B 0056 ARG NH1
H B 0053 HIS NE2 7.291 H B 0056 ARG NH2
HB_MM 2.00 3.20 108
C B 0009 GLU N 2.197 C B 0008 LEU O
C B 0010 PRO N 2.228 C B 0009 GLU O
C B 0011 ASP N 2.197 C B 0010 PRO O
C B 0012 ASN N 2.917 C B 0010 PRO O
C B 0012 ASN N 2.197 C B 0011 ASP O
C B 0013 VAL N 2.873 C B 0010 PRO O
C B 0013 VAL N 2.196 C B 0012 ASN O
C B 0014 PRO N 2.224 C B 0013 VAL O
C B 0015 MET N 2.196 C B 0014 PRO O
C B 0016 ASP N 2.196 C B 0015 MET O
C B 0017 MET N 2.196 C B 0016 ASP O
C B 0018 SER N 3.136 C B 0016 ASP O
C B 0018 SER N 2.196 C B 0017 MET O
C B 0019 PRO N 2.227 C B 0018 SER O
H B 0020 LYS N 3.082 C B 0018 SER O
H B 0020 LYS N 2.197 C B 0019 PRO O
H B 0021 ALA N 2.499 C B 0019 PRO O
H B 0021 ALA N 2.195 H B 0020 LYS O
H B 0022 LEU N 2.196 H B 0021 ALA O
H B 0023 GLN N 2.197 H B 0022 LEU O
H B 0024 GLN N 2.530 H B 0020 LYS O
H B 0024 GLN N 3.061 H B 0021 ALA O
H B 0024 GLN N 2.869 H B 0022 LEU O
H B 0024 GLN N 2.196 H B 0023 GLN O
H B 0025 LYS N 2.853 H B 0021 ALA O
H B 0025 LYS N 2.733 H B 0022 LEU O
H B 0025 LYS N 2.197 H B 0024 GLN O
H B 0026 ILE N 2.899 H B 0022 LEU O
H B 0026 ILE N 2.197 H B 0025 LYS O
H B 0027 HIS N 2.196 H B 0026 ILE O
H B 0028 GLU N 2.871 H B 0025 LYS O
H B 0028 GLU N 2.979 H B 0026 ILE O
H B 0028 GLU N 2.196 H B 0027 HIS O
H B 0029 LEU N 2.834 H B 0025 LYS O
H B 0029 LEU N 3.165 H B 0026 ILE O
H B 0029 LEU N 2.196 H B 0028 GLU O
H B 0030 GLU N 2.974 H B 0026 ILE O
H B 0030 GLU N 2.195 H B 0029 LEU O
H B 0031 GLY N 2.196 H B 0030 GLU O
H B 0032 LEU N 2.998 H B 0029 LEU O
H B 0032 LEU N 3.122 H B 0030 GLU O
H B 0032 LEU N 2.196 H B 0031 GLY O
H B 0033 MET N 2.197 H B 0032 LEU O
H B 0034 MET N 2.198 H B 0033 MET O
H B 0035 GLN N 3.038 H B 0032 LEU O
H B 0035 GLN N 3.061 H B 0033 MET O
H B 0035 GLN N 2.195 H B 0034 MET O
H B 0036 HIS N 2.196 H B 0035 GLN O
H B 0037 ALA N 2.776 H B 0033 MET O
H B 0037 ALA N 2.201 H B 0036 HIS O
H B 0038 GLN N 2.781 H B 0034 MET O
H B 0038 GLN N 2.930 H B 0035 GLN O
H B 0038 GLN N 2.738 H B 0036 HIS O
H B 0038 GLN N 2.199 H B 0037 ALA O
H B 0039 ASN N 2.983 H B 0035 GLN O
H B 0039 ASN N 2.577 H B 0036 HIS O
H B 0039 ASN N 2.199 H B 0038 GLN O
C B 0040 LEU N 2.804 H B 0036 HIS O
C B 0040 LEU N 2.200 H B 0039 ASN O
H B 0041 GLU N 2.759 H B 0036 HIS O
H B 0041 GLU N 2.978 H B 0039 ASN O
H B 0041 GLU N 2.195 C B 0040 LEU O
H B 0042 PHE N 2.202 H B 0041 GLU O
H B 0043 GLU N 2.864 H B 0041 GLU O
H B 0043 GLU N 2.191 H B 0042 PHE O
H B 0044 GLU N 2.193 H B 0043 GLU O
H B 0045 ALA N 3.184 H B 0042 PHE O
H B 0045 ALA N 2.201 H B 0044 GLU O
H B 0046 ALA N 2.521 H B 0042 PHE O
H B 0046 ALA N 2.194 H B 0045 ALA O
H B 0047 GLN N 2.727 H B 0045 ALA O
H B 0047 GLN N 2.192 H B 0046 ALA O
H B 0048 ILE N 2.777 H B 0045 ALA O
H B 0048 ILE N 2.957 H B 0046 ALA O
H B 0048 ILE N 2.199 H B 0047 GLN O
H B 0049 ARG N 2.731 H B 0046 ALA O
H B 0049 ARG N 2.870 H B 0047 GLN O
H B 0049 ARG N 2.202 H B 0048 ILE O
H B 0050 ASP N 2.852 H B 0047 GLN O
H B 0050 ASP N 2.835 H B 0048 ILE O
H B 0050 ASP N 2.196 H B 0049 ARG O
H B 0051 GLN N 2.675 H B 0048 ILE O
H B 0051 GLN N 2.197 H B 0050 ASP O
H B 0052 LEU N 2.618 H B 0048 ILE O
H B 0052 LEU N 2.197 H B 0051 GLN O
H B 0053 HIS N 3.106 H B 0049 ARG O
H B 0053 HIS N 2.196 H B 0052 LEU O
H B 0054 GLN N 3.192 H B 0050 ASP O
H B 0054 GLN N 2.196 H B 0053 HIS O
H B 0055 LEU N 2.899 H B 0051 GLN O
H B 0055 LEU N 2.196 H B 0054 GLN O
H B 0056 ARG N 3.148 H B 0053 HIS O
H B 0056 ARG N 3.149 H B 0054 GLN O
H B 0056 ARG N 2.196 H B 0055 LEU O
H B 0057 GLU N 2.196 H B 0056 ARG O
H B 0058 LEU N 3.060 H B 0056 ARG O
H B 0058 LEU N 2.196 H B 0057 GLU O
H B 0059 PHE N 3.078 H B 0055 LEU O
H B 0059 PHE N 2.722 H B 0056 ARG O
H B 0059 PHE N 3.061 H B 0057 GLU O
H B 0059 PHE N 2.198 H B 0058 LEU O
H B 0060 ILE N 3.100 H B 0058 LEU O
H B 0060 ILE N 2.197 H B 0059 PHE O
H B 0061 ALA N 2.196 H B 0060 ILE O
H B 0062 ALA N 2.818 H B 0058 LEU O
H B 0062 ALA N 2.813 H B 0060 ILE O
H B 0062 ALA N 2.197 H B 0061 ALA O
H B 0063 SER N 2.197 H B 0062 ALA O
HB_MS 2.00 3.20 5
C B 0017 MET O 2.611 C B 0018 SER OG
H B 0034 MET O 2.980 H B 0038 GLN NE2
H B 0041 GLU O 2.718 H B 0036 HIS ND1
H B 0049 ARG O 3.049 H B 0053 HIS ND1
H B 0062 ALA O 2.512 H B 0063 SER OG
AROMATIC 0.00 8.00 1
H B 0049 ARG 4.505 H B 0053 HIS