Complet list of 1wjf con file
Complete list of 1wjf.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 192
C A 0001 PHE C 2.435 C A 0002 LEU CA
C A 0001 PHE C 3.319 C A 0002 LEU C
C A 0001 PHE C 3.612 C A 0002 LEU CB
C A 0001 PHE C 3.795 C A 0002 LEU CG
C A 0002 LEU C 2.427 H A 0003 ASP CA
C A 0002 LEU C 2.947 H A 0003 ASP C
C A 0002 LEU C 3.701 H A 0003 ASP CB
H A 0003 ASP C 2.439 H A 0004 GLY CA
H A 0003 ASP C 2.861 H A 0004 GLY C
H A 0004 GLY C 2.423 H A 0005 ILE CA
H A 0004 GLY C 2.927 H A 0005 ILE C
H A 0004 GLY C 3.691 H A 0005 ILE CB
H A 0005 ILE C 2.422 H A 0006 ASP CA
H A 0005 ILE C 2.953 H A 0006 ASP C
H A 0005 ILE C 3.695 H A 0006 ASP CB
H A 0005 ILE CG1 3.758 H A 0032 VAL CG1
H A 0005 ILE CD1 3.494 H A 0032 VAL CG1
H A 0006 ASP C 2.424 H A 0007 LYS CA
H A 0006 ASP C 2.987 H A 0007 LYS C
H A 0006 ASP C 3.701 H A 0007 LYS CB
H A 0007 LYS C 2.423 H A 0008 ALA CA
H A 0007 LYS C 2.957 H A 0008 ALA C
H A 0007 LYS C 3.693 H A 0008 ALA CB
H A 0008 ALA C 2.421 H A 0009 GLN CA
H A 0008 ALA C 2.957 H A 0009 GLN C
H A 0008 ALA C 3.693 H A 0009 GLN CB
H A 0008 ALA CA 3.705 H A 0026 PHE CZ
H A 0008 ALA CB 3.728 H A 0026 PHE CE1
H A 0008 ALA CB 3.622 H A 0026 PHE CZ
H A 0009 GLN C 2.428 H A 0010 GLU CA
H A 0009 GLN C 2.987 H A 0010 GLU C
H A 0009 GLN C 3.694 H A 0010 GLU CB
H A 0010 GLU C 2.435 H A 0011 GLU CA
H A 0010 GLU C 3.282 H A 0011 GLU C
H A 0010 GLU C 3.629 H A 0011 GLU CB
H A 0011 GLU C 2.420 H A 0012 CYS CA
H A 0011 GLU C 2.864 H A 0012 CYS C
H A 0011 GLU C 3.687 H A 0012 CYS CB
H A 0012 CYS C 2.426 H A 0013 GLU CA
H A 0012 CYS C 2.961 H A 0013 GLU C
H A 0012 CYS C 3.696 H A 0013 GLU CB
H A 0013 GLU C 2.427 H A 0014 LYS CA
H A 0013 GLU C 2.980 H A 0014 LYS C
H A 0013 GLU C 3.696 H A 0014 LYS CB
H A 0014 LYS C 2.425 H A 0015 TYR CA
H A 0014 LYS C 3.205 H A 0015 TYR C
H A 0014 LYS C 3.642 H A 0015 TYR CB
H A 0014 LYS C 3.732 C A 0016 HIS CD2
H A 0015 TYR C 2.432 C A 0016 HIS CA
H A 0015 TYR C 2.979 C A 0016 HIS C
H A 0015 TYR C 2.999 C A 0016 HIS CB
H A 0015 TYR C 3.309 C A 0016 HIS CG
H A 0015 TYR C 3.513 C A 0016 HIS CD2
C A 0016 HIS C 2.435 C A 0017 SER CA
C A 0016 HIS C 3.214 C A 0017 SER C
C A 0016 HIS C 3.656 C A 0017 SER CB
C A 0017 SER C 2.419 C A 0018 ASN CA
C A 0017 SER C 3.125 C A 0018 ASN C
C A 0017 SER C 3.668 C A 0018 ASN CB
C A 0018 ASN C 2.420 H A 0019 TRP CA
C A 0018 ASN C 3.049 H A 0019 TRP C
C A 0018 ASN C 3.690 H A 0019 TRP CB
H A 0019 TRP C 2.421 H A 0020 ARG CA
H A 0019 TRP C 2.966 H A 0020 ARG C
H A 0019 TRP C 3.693 H A 0020 ARG CB
H A 0019 TRP CD2 3.697 H A 0020 ARG CG
H A 0019 TRP CE2 3.454 H A 0020 ARG CG
H A 0019 TRP CE3 3.629 H A 0020 ARG CA
H A 0019 TRP CZ2 3.402 H A 0020 ARG CG
H A 0019 TRP CZ3 3.798 H A 0020 ARG CG
H A 0019 TRP CH2 3.579 H A 0020 ARG CG
H A 0019 TRP CZ3 3.768 H A 0030 PRO CB
H A 0019 TRP CE3 3.642 H A 0033 ALA CB
H A 0020 ARG C 2.417 H A 0021 ALA CA
H A 0020 ARG C 3.025 H A 0021 ALA C
H A 0020 ARG C 3.688 H A 0021 ALA CB
H A 0021 ALA C 2.421 H A 0022 MET CA
H A 0021 ALA C 2.994 H A 0022 MET C
H A 0021 ALA C 3.695 H A 0022 MET CB
H A 0022 MET C 2.419 H A 0023 ALA CA
H A 0022 MET C 2.938 H A 0023 ALA C
H A 0022 MET C 3.694 H A 0023 ALA CB
H A 0022 MET CG 3.675 H A 0026 PHE CD1
H A 0022 MET CE 3.677 H A 0036 ILE CD1
H A 0023 ALA C 2.430 H A 0024 SER CA
H A 0023 ALA C 3.027 H A 0024 SER C
H A 0023 ALA C 3.695 H A 0024 SER CB
H A 0024 SER C 2.422 H A 0025 ASP CA
H A 0024 SER C 3.041 H A 0025 ASP C
H A 0024 SER C 3.689 H A 0025 ASP CB
H A 0025 ASP C 2.430 H A 0026 PHE CA
H A 0025 ASP C 3.298 H A 0026 PHE C
H A 0025 ASP C 3.601 H A 0026 PHE CB
H A 0026 PHE C 2.433 C A 0027 ASN CA
H A 0026 PHE C 2.921 C A 0027 ASN C
H A 0026 PHE C 3.047 C A 0027 ASN CB
H A 0026 PHE C 3.723 C A 0027 ASN CG
H A 0026 PHE CB 3.490 C A 0028 LEU CD1
C A 0027 ASN C 2.443 C A 0028 LEU CA
C A 0027 ASN C 3.442 C A 0028 LEU C
C A 0027 ASN C 3.521 C A 0028 LEU CB
C A 0027 ASN C 3.699 C A 0028 LEU CG
C A 0028 LEU CA 2.922 C A 0029 PRO CD
C A 0028 LEU C 2.454 C A 0029 PRO CA
C A 0028 LEU C 3.127 C A 0029 PRO C
C A 0028 LEU C 3.642 C A 0029 PRO CB
C A 0028 LEU C 3.645 C A 0029 PRO CG
C A 0028 LEU C 2.493 C A 0029 PRO CD
C A 0028 LEU CB 3.518 C A 0029 PRO CD
C A 0029 PRO CA 2.924 H A 0030 PRO CD
C A 0029 PRO C 2.454 H A 0030 PRO CA
C A 0029 PRO C 2.930 H A 0030 PRO C
C A 0029 PRO C 3.615 H A 0030 PRO CB
C A 0029 PRO C 3.668 H A 0030 PRO CG
C A 0029 PRO C 2.490 H A 0030 PRO CD
C A 0029 PRO CB 3.650 H A 0030 PRO CD
H A 0030 PRO C 2.425 H A 0031 VAL CA
H A 0030 PRO C 2.973 H A 0031 VAL C
H A 0030 PRO C 3.701 H A 0031 VAL CB
H A 0031 VAL C 2.416 H A 0032 VAL CA
H A 0031 VAL C 3.076 H A 0032 VAL C
H A 0031 VAL C 3.675 H A 0032 VAL CB
H A 0032 VAL C 2.416 H A 0033 ALA CA
H A 0032 VAL C 2.950 H A 0033 ALA C
H A 0032 VAL C 3.687 H A 0033 ALA CB
H A 0033 ALA C 2.413 H A 0034 LYS CA
H A 0033 ALA C 2.954 H A 0034 LYS C
H A 0033 ALA C 3.699 H A 0034 LYS CB
H A 0034 LYS C 2.428 H A 0035 GLU CA
H A 0034 LYS C 3.009 H A 0035 GLU C
H A 0034 LYS C 3.698 H A 0035 GLU CB
H A 0035 GLU C 2.406 H A 0036 ILE CA
H A 0035 GLU C 2.907 H A 0036 ILE C
H A 0035 GLU C 3.687 H A 0036 ILE CB
H A 0035 GLU CA 3.764 H A 0038 ALA CB
H A 0036 ILE C 2.416 H A 0037 VAL CA
H A 0036 ILE C 2.991 H A 0037 VAL C
H A 0036 ILE C 3.683 H A 0037 VAL CB
H A 0037 VAL C 2.439 H A 0038 ALA CA
H A 0037 VAL C 3.028 H A 0038 ALA C
H A 0037 VAL C 3.701 H A 0038 ALA CB
H A 0038 ALA C 2.433 H A 0039 SER CA
H A 0038 ALA C 3.283 H A 0039 SER C
H A 0038 ALA C 3.621 H A 0039 SER CB
H A 0039 SER C 2.416 C A 0040 CYS CA
H A 0039 SER C 2.944 C A 0040 CYS C
H A 0039 SER C 3.687 C A 0040 CYS CB
C A 0040 CYS C 2.422 C A 0041 ASP CA
C A 0040 CYS C 3.137 C A 0041 ASP C
C A 0040 CYS C 3.671 C A 0041 ASP CB
C A 0041 ASP C 2.424 C A 0042 LYS CA
C A 0041 ASP C 3.140 C A 0042 LYS C
C A 0041 ASP C 3.670 C A 0042 LYS CB
C A 0042 LYS C 2.434 C A 0043 CYS CA
C A 0042 LYS C 3.224 C A 0043 CYS C
C A 0042 LYS C 3.657 C A 0043 CYS CB
C A 0043 CYS C 2.419 C A 0044 GLN CA
C A 0043 CYS C 2.983 C A 0044 GLN C
C A 0043 CYS C 3.694 C A 0044 GLN CB
C A 0044 GLN C 2.430 C A 0045 LEU CA
C A 0044 GLN C 3.234 C A 0045 LEU C
C A 0044 GLN C 3.637 C A 0045 LEU CB
C A 0045 LEU C 2.425 C A 0046 LYS CA
C A 0045 LEU C 3.122 C A 0046 LYS C
C A 0045 LEU C 3.678 C A 0046 LYS CB
C A 0046 LYS C 2.422 C A 0047 GLY CA
C A 0046 LYS C 2.875 C A 0047 GLY C
C A 0047 GLY C 2.423 C A 0048 GLU CA
C A 0047 GLY C 3.189 C A 0048 GLU C
C A 0047 GLY C 3.653 C A 0048 GLU CB
C A 0048 GLU C 2.421 C A 0049 ALA CA
C A 0048 GLU C 3.683 C A 0049 ALA C
C A 0048 GLU C 3.060 C A 0049 ALA CB
C A 0049 ALA C 2.424 C A 0050 MET CA
C A 0049 ALA C 3.137 C A 0050 MET C
C A 0049 ALA C 3.661 C A 0050 MET CB
C A 0050 MET C 2.428 C A 0051 HIS CA
C A 0050 MET C 3.191 C A 0051 HIS C
C A 0050 MET C 3.655 C A 0051 HIS CB
C A 0051 HIS C 2.428 C A 0052 GLY CA
C A 0051 HIS C 3.696 C A 0052 GLY C
C A 0052 GLY C 2.423 C A 0053 GLN CA
C A 0052 GLY C 3.145 C A 0053 GLN C
C A 0052 GLY C 3.666 C A 0053 GLN CB
C A 0052 GLY C 3.498 C A 0053 GLN CD
C A 0053 GLN C 2.437 C A 0054 VAL CA
C A 0053 GLN C 3.621 C A 0054 VAL C
C A 0053 GLN C 3.290 C A 0054 VAL CB
C A 0054 VAL C 2.437 C A 0055 ASP CA
C A 0054 VAL C 3.634 C A 0055 ASP C
C A 0054 VAL C 3.271 C A 0055 ASP CB
C A 0054 VAL C 3.253 C A 0055 ASP CG
CHARGE_ATTR 2.00 12.00 30
H A 0010 GLU OE1 7.021 H A 0007 LYS NZ
H A 0010 GLU OE2 8.744 H A 0007 LYS NZ
H A 0010 GLU OE1 11.40 H A 0014 LYS NZ
H A 0011 GLU OE1 6.120 H A 0007 LYS NZ
H A 0011 GLU OE2 4.879 H A 0007 LYS NZ
H A 0011 GLU OE1 5.240 H A 0014 LYS NZ
H A 0011 GLU OE2 5.689 H A 0014 LYS NZ
H A 0011 GLU OE1 11.35 C A 0016 HIS ND1
H A 0011 GLU OE1 10.76 C A 0016 HIS NE2
H A 0013 GLU OE1 11.31 H A 0014 LYS NZ
H A 0013 GLU OE2 11.59 H A 0014 LYS NZ
H A 0013 GLU OE1 7.036 C A 0016 HIS ND1
H A 0013 GLU OE1 7.946 C A 0016 HIS NE2
H A 0013 GLU OE2 6.120 C A 0016 HIS ND1
H A 0013 GLU OE2 6.938 C A 0016 HIS NE2
H A 0013 GLU OE1 6.771 C A 0042 LYS NZ
H A 0013 GLU OE2 7.619 C A 0042 LYS NZ
H A 0025 ASP OD1 10.87 H A 0007 LYS NZ
H A 0025 ASP OD2 10.37 H A 0007 LYS NZ
H A 0025 ASP OD1 8.724 H A 0014 LYS NZ
H A 0025 ASP OD2 7.459 H A 0014 LYS NZ
H A 0025 ASP OD2 11.38 C A 0016 HIS NE2
C A 0041 ASP OD1 8.065 C A 0042 LYS NZ
C A 0041 ASP OD2 6.985 C A 0042 LYS NZ
C A 0048 GLU OE1 6.441 C A 0051 HIS ND1
C A 0048 GLU OE1 5.933 C A 0051 HIS NE2
C A 0048 GLU OE2 8.174 C A 0051 HIS ND1
C A 0048 GLU OE2 7.210 C A 0051 HIS NE2
C A 0055 ASP OD1 11.24 C A 0051 HIS ND1
C A 0055 ASP OD1 11.76 C A 0051 HIS NE2
CHARGE_REPU 2.00 12.00 37
H A 0003 ASP OD1 6.476 H A 0006 ASP OD1
H A 0003 ASP OD1 5.373 H A 0006 ASP OD2
H A 0003 ASP OD2 7.867 H A 0006 ASP OD1
H A 0003 ASP OD2 6.329 H A 0006 ASP OD2
H A 0003 ASP OD1 11.59 H A 0035 GLU OE1
H A 0006 ASP OD1 9.221 H A 0010 GLU OE1
H A 0006 ASP OD1 8.268 H A 0010 GLU OE2
H A 0006 ASP OD2 9.245 H A 0010 GLU OE1
H A 0006 ASP OD2 8.151 H A 0010 GLU OE2
H A 0006 ASP OD1 8.133 H A 0035 GLU OE1
H A 0006 ASP OD1 8.628 H A 0035 GLU OE2
H A 0006 ASP OD2 10.13 H A 0035 GLU OE1
H A 0006 ASP OD2 10.61 H A 0035 GLU OE2
H A 0007 LYS NZ 9.650 H A 0014 LYS NZ
H A 0010 GLU OE1 7.507 H A 0011 GLU OE1
H A 0010 GLU OE1 6.208 H A 0011 GLU OE2
H A 0010 GLU OE2 9.508 H A 0011 GLU OE1
H A 0010 GLU OE2 8.337 H A 0011 GLU OE2
H A 0010 GLU OE1 10.85 H A 0013 GLU OE1
H A 0010 GLU OE2 11.52 H A 0013 GLU OE1
H A 0011 GLU OE1 10.83 H A 0013 GLU OE1
H A 0011 GLU OE1 11.97 H A 0013 GLU OE2
H A 0011 GLU OE2 11.02 H A 0013 GLU OE1
H A 0011 GLU OE1 7.987 H A 0025 ASP OD1
H A 0011 GLU OE1 6.437 H A 0025 ASP OD2
H A 0011 GLU OE2 9.637 H A 0025 ASP OD1
H A 0011 GLU OE2 8.321 H A 0025 ASP OD2
H A 0014 LYS NZ 10.61 C A 0016 HIS ND1
H A 0014 LYS NZ 9.106 C A 0016 HIS NE2
C A 0016 HIS ND1 10.98 C A 0042 LYS NZ
H A 0020 ARG NH1 9.743 H A 0034 LYS NZ
H A 0020 ARG NH2 7.860 H A 0034 LYS NZ
H A 0020 ARG NH1 10.72 C A 0046 LYS NZ
H A 0020 ARG NH2 9.796 C A 0046 LYS NZ
H A 0035 GLU OE1 11.34 C A 0041 ASP OD1
H A 0035 GLU OE2 10.08 C A 0041 ASP OD1
H A 0035 GLU OE2 11.53 C A 0041 ASP OD2
HB_MM 2.00 3.20 100
C A 0002 LEU N 2.202 C A 0001 PHE O
H A 0003 ASP N 2.198 C A 0002 LEU O
H A 0004 GLY N 2.205 H A 0003 ASP O
H A 0005 ILE N 2.915 C A 0002 LEU O
H A 0005 ILE N 2.392 H A 0003 ASP O
H A 0005 ILE N 2.199 H A 0004 GLY O
H A 0006 ASP N 2.619 H A 0003 ASP O
H A 0006 ASP N 3.100 H A 0004 GLY O
H A 0006 ASP N 2.196 H A 0005 ILE O
H A 0007 LYS N 2.893 H A 0004 GLY O
H A 0007 LYS N 2.196 H A 0006 ASP O
H A 0008 ALA N 3.044 H A 0005 ILE O
H A 0008 ALA N 2.196 H A 0007 LYS O
H A 0009 GLN N 3.181 H A 0005 ILE O
H A 0009 GLN N 3.136 H A 0006 ASP O
H A 0009 GLN N 3.161 H A 0007 LYS O
H A 0009 GLN N 2.195 H A 0008 ALA O
H A 0010 GLU N 3.001 H A 0007 LYS O
H A 0010 GLU N 2.197 H A 0009 GLN O
H A 0011 GLU N 3.111 H A 0008 ALA O
H A 0011 GLU N 2.197 H A 0010 GLU O
H A 0012 CYS N 2.848 H A 0008 ALA O
H A 0012 CYS N 3.069 H A 0009 GLN O
H A 0012 CYS N 2.192 H A 0011 GLU O
H A 0013 GLU N 2.945 H A 0011 GLU O
H A 0013 GLU N 2.197 H A 0012 CYS O
H A 0014 LYS N 2.671 H A 0011 GLU O
H A 0014 LYS N 2.198 H A 0013 GLU O
H A 0015 TYR N 3.114 H A 0011 GLU O
H A 0015 TYR N 3.091 H A 0012 CYS O
H A 0015 TYR N 2.195 H A 0014 LYS O
C A 0016 HIS N 2.667 H A 0012 CYS O
C A 0016 HIS N 3.080 H A 0013 GLU O
C A 0016 HIS N 2.198 H A 0015 TYR O
C A 0017 SER N 2.202 C A 0016 HIS O
C A 0018 ASN N 2.990 H A 0015 TYR O
C A 0018 ASN N 2.194 C A 0017 SER O
H A 0019 TRP N 2.810 C A 0017 SER O
H A 0019 TRP N 2.197 C A 0018 ASN O
H A 0020 ARG N 2.195 H A 0019 TRP O
H A 0021 ALA N 2.195 H A 0020 ARG O
H A 0022 MET N 3.160 H A 0019 TRP O
H A 0022 MET N 2.196 H A 0021 ALA O
H A 0023 ALA N 2.911 H A 0019 TRP O
H A 0023 ALA N 2.193 H A 0022 MET O
H A 0024 SER N 3.168 H A 0021 ALA O
H A 0024 SER N 3.185 H A 0022 MET O
H A 0024 SER N 2.199 H A 0023 ALA O
H A 0025 ASP N 3.148 H A 0021 ALA O
H A 0025 ASP N 3.068 H A 0022 MET O
H A 0025 ASP N 2.195 H A 0024 SER O
H A 0026 PHE N 2.951 H A 0022 MET O
H A 0026 PHE N 2.196 H A 0025 ASP O
C A 0027 ASN N 2.425 H A 0023 ALA O
C A 0027 ASN N 2.197 H A 0026 PHE O
C A 0028 LEU N 3.052 H A 0023 ALA O
C A 0028 LEU N 3.154 H A 0026 PHE O
C A 0028 LEU N 2.202 C A 0027 ASN O
C A 0029 PRO N 2.205 C A 0028 LEU O
H A 0030 PRO N 2.203 C A 0029 PRO O
H A 0031 VAL N 2.517 C A 0029 PRO O
H A 0031 VAL N 2.198 H A 0030 PRO O
H A 0032 VAL N 2.942 C A 0029 PRO O
H A 0032 VAL N 2.193 H A 0031 VAL O
H A 0033 ALA N 2.194 H A 0032 VAL O
H A 0034 LYS N 2.800 H A 0030 PRO O
H A 0034 LYS N 2.191 H A 0033 ALA O
H A 0035 GLU N 3.116 H A 0031 VAL O
H A 0035 GLU N 3.146 H A 0032 VAL O
H A 0035 GLU N 2.197 H A 0034 LYS O
H A 0036 ILE N 2.877 H A 0032 VAL O
H A 0036 ILE N 3.173 H A 0033 ALA O
H A 0036 ILE N 2.191 H A 0035 GLU O
H A 0037 VAL N 3.119 H A 0034 LYS O
H A 0037 VAL N 3.187 H A 0035 GLU O
H A 0037 VAL N 2.196 H A 0036 ILE O
H A 0038 ALA N 2.807 H A 0034 LYS O
H A 0038 ALA N 2.914 H A 0035 GLU O
H A 0038 ALA N 2.204 H A 0037 VAL O
H A 0039 SER N 2.900 H A 0035 GLU O
H A 0039 SER N 3.175 H A 0036 ILE O
H A 0039 SER N 3.033 H A 0037 VAL O
H A 0039 SER N 2.197 H A 0038 ALA O
C A 0040 CYS N 3.112 H A 0036 ILE O
C A 0040 CYS N 2.193 H A 0039 SER O
C A 0041 ASP N 2.195 C A 0040 CYS O
C A 0042 LYS N 2.193 C A 0041 ASP O
C A 0043 CYS N 2.197 C A 0042 LYS O
C A 0044 GLN N 2.192 C A 0043 CYS O
C A 0045 LEU N 2.195 C A 0044 GLN O
C A 0046 LYS N 2.196 C A 0045 LEU O
C A 0047 GLY N 2.197 C A 0046 LYS O
C A 0048 GLU N 2.196 C A 0047 GLY O
C A 0049 ALA N 2.196 C A 0048 GLU O
C A 0050 MET N 2.197 C A 0049 ALA O
C A 0051 HIS N 2.198 C A 0050 MET O
C A 0052 GLY N 2.199 C A 0051 HIS O
C A 0053 GLN N 2.196 C A 0052 GLY O
C A 0054 VAL N 2.200 C A 0053 GLN O
C A 0055 ASP N 2.199 C A 0054 VAL O
HB_MS 2.00 3.20 6
H A 0013 GLU O 2.596 C A 0016 HIS ND1
H A 0014 LYS O 3.071 C A 0016 HIS NE2
H A 0024 SER O 2.853 C A 0027 ASN ND2
H A 0035 GLU O 3.142 H A 0039 SER OG
H A 0036 ILE N 2.887 H A 0035 GLU OE1
H A 0038 ALA O 2.429 C A 0044 GLN NE2
HB_SS 2.00 3.20 2
H A 0025 ASP OD2 2.561 H A 0015 TYR OH
H A 0035 GLU OE2 2.379 H A 0039 SER OG
AROMATIC 0.00 8.00 3
H A 0007 LYS 7.221 H A 0026 PHE
H A 0020 ARG 5.858 H A 0019 TRP
H A 0034 LYS 5.633 H A 0019 TRP
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 16
C A 0001 PHE CE1 3.486 C B 0001 PHE CE1
C A 0001 PHE CD2 3.789 C B 0029 PRO CG
C A 0001 PHE CE2 3.348 C B 0029 PRO CG
C A 0001 PHE CZ 3.492 C B 0029 PRO CG
C A 0001 PHE CD1 3.750 H B 0031 VAL CG1
C A 0001 PHE CE1 3.663 H B 0032 VAL CG2
C A 0001 PHE CZ 3.709 H B 0032 VAL CG2
C A 0029 PRO CG 3.376 C B 0001 PHE CE2
C A 0029 PRO CG 3.492 C B 0001 PHE CZ
H A 0031 VAL CG1 3.783 C B 0001 PHE CD1
H A 0032 VAL CG2 3.700 C B 0001 PHE CE1
H A 0032 VAL CG2 3.759 C B 0001 PHE CZ
H A 0038 ALA CB 3.308 H B 0038 ALA CB
C A 0045 LEU CD2 3.800 C B 0045 LEU CD2
C A 0049 ALA CB 3.592 C B 0050 MET CE
C A 0050 MET CE 3.632 C B 0049 ALA CB
CHARGE_ATTR 2.00 12.00 16
H A 0006 ASP OD1 10.17 H B 0034 LYS NZ
H A 0006 ASP OD2 11.73 H B 0034 LYS NZ
H A 0034 LYS NZ 10.26 H B 0006 ASP OD1
H A 0034 LYS NZ 11.84 H B 0006 ASP OD2
H A 0034 LYS NZ 7.309 H B 0035 GLU OE1
H A 0034 LYS NZ 5.240 H B 0035 GLU OE2
H A 0034 LYS NZ 9.205 C B 0041 ASP OD1
H A 0034 LYS NZ 10.33 C B 0041 ASP OD2
H A 0035 GLU OE1 7.251 H B 0034 LYS NZ
H A 0035 GLU OE2 5.191 H B 0034 LYS NZ
C A 0041 ASP OD1 9.206 H B 0034 LYS NZ
C A 0041 ASP OD2 10.32 H B 0034 LYS NZ
C A 0041 ASP OD1 9.846 C B 0046 LYS NZ
C A 0041 ASP OD2 10.64 C B 0046 LYS NZ
C A 0046 LYS NZ 9.944 C B 0041 ASP OD1
C A 0046 LYS NZ 10.74 C B 0041 ASP OD2
CHARGE_REPU 2.00 12.00 5
H A 0035 GLU OE1 9.246 H B 0035 GLU OE1
H A 0035 GLU OE1 9.360 H B 0035 GLU OE2
H A 0035 GLU OE2 9.353 H B 0035 GLU OE1
H A 0035 GLU OE2 9.729 H B 0035 GLU OE2
C A 0051 HIS ND1 9.992 C B 0051 HIS ND1
HB_SS 2.00 3.20 1
C A 0044 GLN OE1 3.011 C B 0044 GLN NE2
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 192
C B 0001 PHE C 2.435 C B 0002 LEU CA
C B 0001 PHE C 3.318 C B 0002 LEU C
C B 0001 PHE C 3.613 C B 0002 LEU CB
C B 0001 PHE C 3.797 C B 0002 LEU CG
C B 0002 LEU C 2.427 H B 0003 ASP CA
C B 0002 LEU C 2.948 H B 0003 ASP C
C B 0002 LEU C 3.701 H B 0003 ASP CB
H B 0003 ASP C 2.438 H B 0004 GLY CA
H B 0003 ASP C 2.860 H B 0004 GLY C
H B 0004 GLY C 2.422 H B 0005 ILE CA
H B 0004 GLY C 2.926 H B 0005 ILE C
H B 0004 GLY C 3.691 H B 0005 ILE CB
H B 0005 ILE C 2.423 H B 0006 ASP CA
H B 0005 ILE C 2.954 H B 0006 ASP C
H B 0005 ILE C 3.695 H B 0006 ASP CB
H B 0005 ILE CG1 3.760 H B 0032 VAL CG1
H B 0005 ILE CD1 3.496 H B 0032 VAL CG1
H B 0006 ASP C 2.424 H B 0007 LYS CA
H B 0006 ASP C 2.987 H B 0007 LYS C
H B 0006 ASP C 3.700 H B 0007 LYS CB
H B 0007 LYS C 2.424 H B 0008 ALA CA
H B 0007 LYS C 2.957 H B 0008 ALA C
H B 0007 LYS C 3.693 H B 0008 ALA CB
H B 0008 ALA C 2.421 H B 0009 GLN CA
H B 0008 ALA C 2.957 H B 0009 GLN C
H B 0008 ALA C 3.694 H B 0009 GLN CB
H B 0008 ALA CA 3.703 H B 0026 PHE CZ
H B 0008 ALA CB 3.726 H B 0026 PHE CE1
H B 0008 ALA CB 3.620 H B 0026 PHE CZ
H B 0009 GLN C 2.429 H B 0010 GLU CA
H B 0009 GLN C 2.989 H B 0010 GLU C
H B 0009 GLN C 3.695 H B 0010 GLU CB
H B 0010 GLU C 2.435 H B 0011 GLU CA
H B 0010 GLU C 3.282 H B 0011 GLU C
H B 0010 GLU C 3.629 H B 0011 GLU CB
H B 0011 GLU C 2.421 H B 0012 CYS CA
H B 0011 GLU C 2.864 H B 0012 CYS C
H B 0011 GLU C 3.688 H B 0012 CYS CB
H B 0012 CYS C 2.426 H B 0013 GLU CA
H B 0012 CYS C 2.961 H B 0013 GLU C
H B 0012 CYS C 3.696 H B 0013 GLU CB
H B 0013 GLU C 2.427 H B 0014 LYS CA
H B 0013 GLU C 2.982 H B 0014 LYS C
H B 0013 GLU C 3.697 H B 0014 LYS CB
H B 0014 LYS C 2.425 H B 0015 TYR CA
H B 0014 LYS C 3.204 H B 0015 TYR C
H B 0014 LYS C 3.642 H B 0015 TYR CB
H B 0014 LYS C 3.736 C B 0016 HIS CD2
H B 0015 TYR C 2.432 C B 0016 HIS CA
H B 0015 TYR C 2.980 C B 0016 HIS C
H B 0015 TYR C 2.999 C B 0016 HIS CB
H B 0015 TYR C 3.308 C B 0016 HIS CG
H B 0015 TYR C 3.513 C B 0016 HIS CD2
C B 0016 HIS C 2.435 C B 0017 SER CA
C B 0016 HIS C 3.215 C B 0017 SER C
C B 0016 HIS C 3.655 C B 0017 SER CB
C B 0017 SER C 2.417 C B 0018 ASN CA
C B 0017 SER C 3.123 C B 0018 ASN C
C B 0017 SER C 3.666 C B 0018 ASN CB
C B 0018 ASN C 2.420 H B 0019 TRP CA
C B 0018 ASN C 3.047 H B 0019 TRP C
C B 0018 ASN C 3.690 H B 0019 TRP CB
H B 0019 TRP C 2.421 H B 0020 ARG CA
H B 0019 TRP C 2.965 H B 0020 ARG C
H B 0019 TRP C 3.692 H B 0020 ARG CB
H B 0019 TRP CD2 3.698 H B 0020 ARG CG
H B 0019 TRP CE2 3.454 H B 0020 ARG CG
H B 0019 TRP CE3 3.630 H B 0020 ARG CA
H B 0019 TRP CZ2 3.402 H B 0020 ARG CG
H B 0019 TRP CZ3 3.799 H B 0020 ARG CG
H B 0019 TRP CH2 3.580 H B 0020 ARG CG
H B 0019 TRP CZ3 3.766 H B 0030 PRO CB
H B 0019 TRP CE3 3.642 H B 0033 ALA CB
H B 0020 ARG C 2.416 H B 0021 ALA CA
H B 0020 ARG C 3.023 H B 0021 ALA C
H B 0020 ARG C 3.687 H B 0021 ALA CB
H B 0021 ALA C 2.421 H B 0022 MET CA
H B 0021 ALA C 2.994 H B 0022 MET C
H B 0021 ALA C 3.695 H B 0022 MET CB
H B 0022 MET C 2.419 H B 0023 ALA CA
H B 0022 MET C 2.938 H B 0023 ALA C
H B 0022 MET C 3.693 H B 0023 ALA CB
H B 0022 MET CG 3.674 H B 0026 PHE CD1
H B 0022 MET CE 3.678 H B 0036 ILE CD1
H B 0023 ALA C 2.430 H B 0024 SER CA
H B 0023 ALA C 3.026 H B 0024 SER C
H B 0023 ALA C 3.696 H B 0024 SER CB
H B 0024 SER C 2.422 H B 0025 ASP CA
H B 0024 SER C 3.041 H B 0025 ASP C
H B 0024 SER C 3.688 H B 0025 ASP CB
H B 0025 ASP C 2.430 H B 0026 PHE CA
H B 0025 ASP C 3.298 H B 0026 PHE C
H B 0025 ASP C 3.600 H B 0026 PHE CB
H B 0026 PHE C 2.432 C B 0027 ASN CA
H B 0026 PHE C 2.921 C B 0027 ASN C
H B 0026 PHE C 3.047 C B 0027 ASN CB
H B 0026 PHE C 3.722 C B 0027 ASN CG
H B 0026 PHE CB 3.490 C B 0028 LEU CD1
C B 0027 ASN C 2.444 C B 0028 LEU CA
C B 0027 ASN C 3.441 C B 0028 LEU C
C B 0027 ASN C 3.520 C B 0028 LEU CB
C B 0027 ASN C 3.699 C B 0028 LEU CG
C B 0028 LEU CA 2.921 C B 0029 PRO CD
C B 0028 LEU C 2.453 C B 0029 PRO CA
C B 0028 LEU C 3.127 C B 0029 PRO C
C B 0028 LEU C 3.642 C B 0029 PRO CB
C B 0028 LEU C 3.644 C B 0029 PRO CG
C B 0028 LEU C 2.493 C B 0029 PRO CD
C B 0028 LEU CB 3.519 C B 0029 PRO CD
C B 0029 PRO CA 2.923 H B 0030 PRO CD
C B 0029 PRO C 2.454 H B 0030 PRO CA
C B 0029 PRO C 2.930 H B 0030 PRO C
C B 0029 PRO C 3.616 H B 0030 PRO CB
C B 0029 PRO C 3.668 H B 0030 PRO CG
C B 0029 PRO C 2.490 H B 0030 PRO CD
C B 0029 PRO CB 3.647 H B 0030 PRO CD
H B 0030 PRO C 2.424 H B 0031 VAL CA
H B 0030 PRO C 2.973 H B 0031 VAL C
H B 0030 PRO C 3.702 H B 0031 VAL CB
H B 0031 VAL C 2.415 H B 0032 VAL CA
H B 0031 VAL C 3.075 H B 0032 VAL C
H B 0031 VAL C 3.675 H B 0032 VAL CB
H B 0032 VAL C 2.415 H B 0033 ALA CA
H B 0032 VAL C 2.949 H B 0033 ALA C
H B 0032 VAL C 3.686 H B 0033 ALA CB
H B 0033 ALA C 2.412 H B 0034 LYS CA
H B 0033 ALA C 2.953 H B 0034 LYS C
H B 0033 ALA C 3.700 H B 0034 LYS CB
H B 0034 LYS C 2.427 H B 0035 GLU CA
H B 0034 LYS C 3.008 H B 0035 GLU C
H B 0034 LYS C 3.699 H B 0035 GLU CB
H B 0035 GLU C 2.407 H B 0036 ILE CA
H B 0035 GLU C 2.908 H B 0036 ILE C
H B 0035 GLU C 3.687 H B 0036 ILE CB
H B 0035 GLU CA 3.768 H B 0038 ALA CB
H B 0036 ILE C 2.417 H B 0037 VAL CA
H B 0036 ILE C 2.992 H B 0037 VAL C
H B 0036 ILE C 3.683 H B 0037 VAL CB
H B 0037 VAL C 2.439 H B 0038 ALA CA
H B 0037 VAL C 3.028 H B 0038 ALA C
H B 0037 VAL C 3.701 H B 0038 ALA CB
H B 0038 ALA C 2.432 H B 0039 SER CA
H B 0038 ALA C 3.283 H B 0039 SER C
H B 0038 ALA C 3.621 H B 0039 SER CB
H B 0039 SER C 2.416 C B 0040 CYS CA
H B 0039 SER C 2.946 C B 0040 CYS C
H B 0039 SER C 3.688 C B 0040 CYS CB
C B 0040 CYS C 2.422 C B 0041 ASP CA
C B 0040 CYS C 3.137 C B 0041 ASP C
C B 0040 CYS C 3.671 C B 0041 ASP CB
C B 0041 ASP C 2.423 C B 0042 LYS CA
C B 0041 ASP C 3.140 C B 0042 LYS C
C B 0041 ASP C 3.671 C B 0042 LYS CB
C B 0042 LYS C 2.434 C B 0043 CYS CA
C B 0042 LYS C 3.225 C B 0043 CYS C
C B 0042 LYS C 3.657 C B 0043 CYS CB
C B 0043 CYS C 2.420 C B 0044 GLN CA
C B 0043 CYS C 2.984 C B 0044 GLN C
C B 0043 CYS C 3.695 C B 0044 GLN CB
C B 0044 GLN C 2.431 C B 0045 LEU CA
C B 0044 GLN C 3.235 C B 0045 LEU C
C B 0044 GLN C 3.638 C B 0045 LEU CB
C B 0045 LEU C 2.425 C B 0046 LYS CA
C B 0045 LEU C 3.123 C B 0046 LYS C
C B 0045 LEU C 3.678 C B 0046 LYS CB
C B 0046 LYS C 2.422 C B 0047 GLY CA
C B 0046 LYS C 2.875 C B 0047 GLY C
C B 0047 GLY C 2.422 C B 0048 GLU CA
C B 0047 GLY C 3.189 C B 0048 GLU C
C B 0047 GLY C 3.651 C B 0048 GLU CB
C B 0048 GLU C 2.422 C B 0049 ALA CA
C B 0048 GLU C 3.684 C B 0049 ALA C
C B 0048 GLU C 3.060 C B 0049 ALA CB
C B 0049 ALA C 2.424 C B 0050 MET CA
C B 0049 ALA C 3.137 C B 0050 MET C
C B 0049 ALA C 3.661 C B 0050 MET CB
C B 0050 MET C 2.427 C B 0051 HIS CA
C B 0050 MET C 3.189 C B 0051 HIS C
C B 0050 MET C 3.654 C B 0051 HIS CB
C B 0051 HIS C 2.429 C B 0052 GLY CA
C B 0051 HIS C 3.696 C B 0052 GLY C
C B 0052 GLY C 2.423 C B 0053 GLN CA
C B 0052 GLY C 3.145 C B 0053 GLN C
C B 0052 GLY C 3.667 C B 0053 GLN CB
C B 0052 GLY C 3.500 C B 0053 GLN CD
C B 0053 GLN C 2.437 C B 0054 VAL CA
C B 0053 GLN C 3.621 C B 0054 VAL C
C B 0053 GLN C 3.291 C B 0054 VAL CB
C B 0054 VAL C 2.436 C B 0055 ASP CA
C B 0054 VAL C 3.633 C B 0055 ASP C
C B 0054 VAL C 3.272 C B 0055 ASP CB
C B 0054 VAL C 3.256 C B 0055 ASP CG
CHARGE_ATTR 2.00 12.00 30
H B 0010 GLU OE1 7.021 H B 0007 LYS NZ
H B 0010 GLU OE2 8.748 H B 0007 LYS NZ
H B 0010 GLU OE1 11.40 H B 0014 LYS NZ
H B 0011 GLU OE1 6.120 H B 0007 LYS NZ
H B 0011 GLU OE2 4.875 H B 0007 LYS NZ
H B 0011 GLU OE1 5.238 H B 0014 LYS NZ
H B 0011 GLU OE2 5.694 H B 0014 LYS NZ
H B 0011 GLU OE1 11.35 C B 0016 HIS ND1
H B 0011 GLU OE1 10.76 C B 0016 HIS NE2
H B 0013 GLU OE1 11.31 H B 0014 LYS NZ
H B 0013 GLU OE2 11.59 H B 0014 LYS NZ
H B 0013 GLU OE1 7.033 C B 0016 HIS ND1
H B 0013 GLU OE1 7.947 C B 0016 HIS NE2
H B 0013 GLU OE2 6.119 C B 0016 HIS ND1
H B 0013 GLU OE2 6.939 C B 0016 HIS NE2
H B 0013 GLU OE1 6.771 C B 0042 LYS NZ
H B 0013 GLU OE2 7.621 C B 0042 LYS NZ
H B 0025 ASP OD1 10.87 H B 0007 LYS NZ
H B 0025 ASP OD2 10.37 H B 0007 LYS NZ
H B 0025 ASP OD1 8.726 H B 0014 LYS NZ
H B 0025 ASP OD2 7.464 H B 0014 LYS NZ
H B 0025 ASP OD2 11.38 C B 0016 HIS NE2
C B 0041 ASP OD1 8.062 C B 0042 LYS NZ
C B 0041 ASP OD2 6.982 C B 0042 LYS NZ
C B 0048 GLU OE1 6.441 C B 0051 HIS ND1
C B 0048 GLU OE1 5.933 C B 0051 HIS NE2
C B 0048 GLU OE2 8.175 C B 0051 HIS ND1
C B 0048 GLU OE2 7.211 C B 0051 HIS NE2
C B 0055 ASP OD1 11.24 C B 0051 HIS ND1
C B 0055 ASP OD1 11.76 C B 0051 HIS NE2
CHARGE_REPU 2.00 12.00 37
H B 0003 ASP OD1 6.484 H B 0006 ASP OD1
H B 0003 ASP OD1 5.371 H B 0006 ASP OD2
H B 0003 ASP OD2 7.873 H B 0006 ASP OD1
H B 0003 ASP OD2 6.325 H B 0006 ASP OD2
H B 0003 ASP OD1 11.60 H B 0035 GLU OE1
H B 0006 ASP OD1 9.216 H B 0010 GLU OE1
H B 0006 ASP OD1 8.269 H B 0010 GLU OE2
H B 0006 ASP OD2 9.243 H B 0010 GLU OE1
H B 0006 ASP OD2 8.159 H B 0010 GLU OE2
H B 0006 ASP OD1 8.138 H B 0035 GLU OE1
H B 0006 ASP OD1 8.628 H B 0035 GLU OE2
H B 0006 ASP OD2 10.13 H B 0035 GLU OE1
H B 0006 ASP OD2 10.60 H B 0035 GLU OE2
H B 0007 LYS NZ 9.648 H B 0014 LYS NZ
H B 0010 GLU OE1 7.506 H B 0011 GLU OE1
H B 0010 GLU OE1 6.203 H B 0011 GLU OE2
H B 0010 GLU OE2 9.510 H B 0011 GLU OE1
H B 0010 GLU OE2 8.333 H B 0011 GLU OE2
H B 0010 GLU OE1 10.86 H B 0013 GLU OE1
H B 0010 GLU OE2 11.52 H B 0013 GLU OE1
H B 0011 GLU OE1 10.83 H B 0013 GLU OE1
H B 0011 GLU OE1 11.97 H B 0013 GLU OE2
H B 0011 GLU OE2 11.02 H B 0013 GLU OE1
H B 0011 GLU OE1 7.987 H B 0025 ASP OD1
H B 0011 GLU OE1 6.439 H B 0025 ASP OD2
H B 0011 GLU OE2 9.639 H B 0025 ASP OD1
H B 0011 GLU OE2 8.325 H B 0025 ASP OD2
H B 0014 LYS NZ 10.60 C B 0016 HIS ND1
H B 0014 LYS NZ 9.105 C B 0016 HIS NE2
C B 0016 HIS ND1 10.98 C B 0042 LYS NZ
H B 0020 ARG NH1 9.743 H B 0034 LYS NZ
H B 0020 ARG NH2 7.860 H B 0034 LYS NZ
H B 0020 ARG NH1 10.72 C B 0046 LYS NZ
H B 0020 ARG NH2 9.798 C B 0046 LYS NZ
H B 0035 GLU OE1 11.34 C B 0041 ASP OD1
H B 0035 GLU OE2 10.08 C B 0041 ASP OD1
H B 0035 GLU OE2 11.53 C B 0041 ASP OD2
HB_MM 2.00 3.20 100
C B 0002 LEU N 2.202 C B 0001 PHE O
H B 0003 ASP N 2.199 C B 0002 LEU O
H B 0004 GLY N 2.204 H B 0003 ASP O
H B 0005 ILE N 2.916 C B 0002 LEU O
H B 0005 ILE N 2.392 H B 0003 ASP O
H B 0005 ILE N 2.197 H B 0004 GLY O
H B 0006 ASP N 2.621 H B 0003 ASP O
H B 0006 ASP N 3.098 H B 0004 GLY O
H B 0006 ASP N 2.196 H B 0005 ILE O
H B 0007 LYS N 2.893 H B 0004 GLY O
H B 0007 LYS N 2.195 H B 0006 ASP O
H B 0008 ALA N 3.045 H B 0005 ILE O
H B 0008 ALA N 2.196 H B 0007 LYS O
H B 0009 GLN N 3.180 H B 0005 ILE O
H B 0009 GLN N 3.138 H B 0006 ASP O
H B 0009 GLN N 3.163 H B 0007 LYS O
H B 0009 GLN N 2.195 H B 0008 ALA O
H B 0010 GLU N 3.002 H B 0007 LYS O
H B 0010 GLU N 2.197 H B 0009 GLN O
H B 0011 GLU N 3.110 H B 0008 ALA O
H B 0011 GLU N 2.197 H B 0010 GLU O
H B 0012 CYS N 2.849 H B 0008 ALA O
H B 0012 CYS N 3.072 H B 0009 GLN O
H B 0012 CYS N 2.193 H B 0011 GLU O
H B 0013 GLU N 2.945 H B 0011 GLU O
H B 0013 GLU N 2.198 H B 0012 CYS O
H B 0014 LYS N 2.672 H B 0011 GLU O
H B 0014 LYS N 2.199 H B 0013 GLU O
H B 0015 TYR N 3.113 H B 0011 GLU O
H B 0015 TYR N 3.092 H B 0012 CYS O
H B 0015 TYR N 2.195 H B 0014 LYS O
C B 0016 HIS N 2.667 H B 0012 CYS O
C B 0016 HIS N 3.077 H B 0013 GLU O
C B 0016 HIS N 2.199 H B 0015 TYR O
C B 0017 SER N 2.201 C B 0016 HIS O
C B 0018 ASN N 2.989 H B 0015 TYR O
C B 0018 ASN N 2.194 C B 0017 SER O
H B 0019 TRP N 2.808 C B 0017 SER O
H B 0019 TRP N 2.197 C B 0018 ASN O
H B 0020 ARG N 2.196 H B 0019 TRP O
H B 0021 ALA N 2.194 H B 0020 ARG O
H B 0022 MET N 3.161 H B 0019 TRP O
H B 0022 MET N 2.196 H B 0021 ALA O
H B 0023 ALA N 2.914 H B 0019 TRP O
H B 0023 ALA N 2.193 H B 0022 MET O
H B 0024 SER N 3.166 H B 0021 ALA O
H B 0024 SER N 3.185 H B 0022 MET O
H B 0024 SER N 2.198 H B 0023 ALA O
H B 0025 ASP N 3.148 H B 0021 ALA O
H B 0025 ASP N 3.068 H B 0022 MET O
H B 0025 ASP N 2.194 H B 0024 SER O
H B 0026 PHE N 2.950 H B 0022 MET O
H B 0026 PHE N 2.195 H B 0025 ASP O
C B 0027 ASN N 2.426 H B 0023 ALA O
C B 0027 ASN N 2.198 H B 0026 PHE O
C B 0028 LEU N 3.054 H B 0023 ALA O
C B 0028 LEU N 3.156 H B 0026 PHE O
C B 0028 LEU N 2.201 C B 0027 ASN O
C B 0029 PRO N 2.205 C B 0028 LEU O
H B 0030 PRO N 2.203 C B 0029 PRO O
H B 0031 VAL N 2.520 C B 0029 PRO O
H B 0031 VAL N 2.197 H B 0030 PRO O
H B 0032 VAL N 2.944 C B 0029 PRO O
H B 0032 VAL N 2.194 H B 0031 VAL O
H B 0033 ALA N 2.194 H B 0032 VAL O
H B 0034 LYS N 2.799 H B 0030 PRO O
H B 0034 LYS N 2.191 H B 0033 ALA O
H B 0035 GLU N 3.111 H B 0031 VAL O
H B 0035 GLU N 3.146 H B 0032 VAL O
H B 0035 GLU N 2.198 H B 0034 LYS O
H B 0036 ILE N 2.875 H B 0032 VAL O
H B 0036 ILE N 3.171 H B 0033 ALA O
H B 0036 ILE N 2.191 H B 0035 GLU O
H B 0037 VAL N 3.119 H B 0034 LYS O
H B 0037 VAL N 3.184 H B 0035 GLU O
H B 0037 VAL N 2.197 H B 0036 ILE O
H B 0038 ALA N 2.810 H B 0034 LYS O
H B 0038 ALA N 2.909 H B 0035 GLU O
H B 0038 ALA N 2.204 H B 0037 VAL O
H B 0039 SER N 2.901 H B 0035 GLU O
H B 0039 SER N 3.176 H B 0036 ILE O
H B 0039 SER N 3.033 H B 0037 VAL O
H B 0039 SER N 2.197 H B 0038 ALA O
C B 0040 CYS N 3.113 H B 0036 ILE O
C B 0040 CYS N 2.194 H B 0039 SER O
C B 0041 ASP N 2.195 C B 0040 CYS O
C B 0042 LYS N 2.194 C B 0041 ASP O
C B 0043 CYS N 2.196 C B 0042 LYS O
C B 0044 GLN N 2.191 C B 0043 CYS O
C B 0045 LEU N 2.196 C B 0044 GLN O
C B 0046 LYS N 2.196 C B 0045 LEU O
C B 0047 GLY N 2.196 C B 0046 LYS O
C B 0048 GLU N 2.195 C B 0047 GLY O
C B 0049 ALA N 2.197 C B 0048 GLU O
C B 0050 MET N 2.195 C B 0049 ALA O
C B 0051 HIS N 2.197 C B 0050 MET O
C B 0052 GLY N 2.198 C B 0051 HIS O
C B 0053 GLN N 2.197 C B 0052 GLY O
C B 0054 VAL N 2.200 C B 0053 GLN O
C B 0055 ASP N 2.199 C B 0054 VAL O
HB_MS 2.00 3.20 5
H B 0013 GLU O 2.589 C B 0016 HIS ND1
H B 0014 LYS O 3.070 C B 0016 HIS NE2
H B 0024 SER O 2.854 C B 0027 ASN ND2
H B 0035 GLU O 3.142 H B 0039 SER OG
H B 0036 ILE N 2.889 H B 0035 GLU OE1
HB_SS 2.00 3.20 2
H B 0025 ASP OD2 2.559 H B 0015 TYR OH
H B 0035 GLU OE2 2.381 H B 0039 SER OG
AROMATIC 0.00 8.00 3
H B 0007 LYS 7.222 H B 0026 PHE
H B 0020 ARG 5.859 H B 0019 TRP
H B 0034 LYS 5.631 H B 0019 TRP