Complet list of 1bhi con file
Complete list of 1bhi.con file
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 156
C A 0001 MET C 2.442 C A 0002 SER CA
C A 0001 MET C 3.032 C A 0002 SER C
C A 0001 MET C 3.709 C A 0002 SER CB
C A 0002 SER C 2.456 C A 0003 ASP CA
C A 0002 SER C 3.478 C A 0003 ASP C
C A 0002 SER C 3.493 C A 0003 ASP CB
C A 0003 ASP C 2.446 C A 0004 ASP CA
C A 0003 ASP C 3.005 C A 0004 ASP C
C A 0003 ASP C 3.718 C A 0004 ASP CB
C A 0004 ASP C 2.458 C A 0005 LYS CA
C A 0004 ASP C 2.998 C A 0005 LYS C
C A 0004 ASP C 3.031 C A 0005 LYS CB
C A 0005 LYS CA 2.868 C A 0006 PRO CD
C A 0005 LYS C 2.450 C A 0006 PRO CA
C A 0005 LYS C 3.006 C A 0006 PRO C
C A 0005 LYS C 3.678 C A 0006 PRO CB
C A 0005 LYS C 3.685 C A 0006 PRO CG
C A 0005 LYS C 2.466 C A 0006 PRO CD
C A 0006 PRO C 2.444 E A 0007 PHE CA
C A 0006 PRO C 3.196 E A 0007 PHE C
C A 0006 PRO C 3.664 E A 0007 PHE CB
E A 0007 PHE C 2.450 E A 0008 LEU CA
E A 0007 PHE C 3.230 E A 0008 LEU C
E A 0007 PHE C 3.670 E A 0008 LEU CB
E A 0007 PHE CD1 3.667 C A 0019 THR C
E A 0007 PHE CD1 3.676 C A 0020 ASN CA
E A 0007 PHE CD1 3.509 C A 0020 ASN C
E A 0007 PHE CE1 3.558 C A 0020 ASN CA
E A 0007 PHE CE1 3.678 C A 0020 ASN C
E A 0007 PHE CD2 3.725 H A 0021 GLU CG
E A 0007 PHE CE2 3.523 H A 0021 GLU CB
E A 0007 PHE CE2 3.687 H A 0021 GLU CG
E A 0007 PHE C 3.774 H A 0024 LEU CD1
E A 0008 LEU C 2.449 E A 0009 CYS CA
E A 0008 LEU C 3.049 E A 0009 CYS C
E A 0008 LEU C 3.707 E A 0009 CYS CB
E A 0008 LEU CD2 3.778 E A 0017 ARG CG
E A 0009 CYS C 2.443 C A 0010 THR CA
E A 0009 CYS C 3.277 C A 0010 THR C
E A 0009 CYS C 3.623 C A 0010 THR CB
E A 0009 CYS CA 3.616 H A 0024 LEU CD1
E A 0009 CYS CB 3.676 H A 0024 LEU CD1
E A 0009 CYS CB 3.725 H A 0027 HIS CD2
C A 0010 THR C 2.452 C A 0011 ALA CA
C A 0010 THR C 3.605 C A 0011 ALA C
C A 0010 THR C 3.328 C A 0011 ALA CB
C A 0011 ALA CA 2.868 C A 0012 PRO CD
C A 0011 ALA C 2.456 C A 0012 PRO CA
C A 0011 ALA C 3.077 C A 0012 PRO C
C A 0011 ALA C 3.665 C A 0012 PRO CB
C A 0011 ALA C 3.664 C A 0012 PRO CG
C A 0011 ALA C 2.465 C A 0012 PRO CD
C A 0011 ALA CB 3.613 C A 0012 PRO CD
C A 0012 PRO C 2.446 C A 0013 GLY CA
C A 0012 PRO C 3.166 C A 0013 GLY C
C A 0013 GLY C 2.438 C A 0014 CYS CA
C A 0013 GLY C 3.122 C A 0014 CYS C
C A 0013 GLY C 3.689 C A 0014 CYS CB
C A 0014 CYS C 2.480 C A 0015 GLY CA
C A 0014 CYS C 2.905 C A 0015 GLY C
C A 0015 GLY C 2.444 E A 0016 GLN CA
C A 0015 GLY C 3.151 E A 0016 GLN C
C A 0015 GLY C 3.691 E A 0016 GLN CB
E A 0016 GLN C 2.457 E A 0017 ARG CA
E A 0016 GLN C 3.533 E A 0017 ARG C
E A 0016 GLN C 3.427 E A 0017 ARG CB
E A 0016 GLN CB 3.631 E A 0018 PHE CE1
E A 0016 GLN CB 3.765 E A 0018 PHE CZ
E A 0016 GLN CD 3.582 H A 0027 HIS CE1
E A 0017 ARG CA 3.765 E A 0018 PHE CD1
E A 0017 ARG C 2.446 E A 0018 PHE CA
E A 0017 ARG C 3.607 E A 0018 PHE C
E A 0017 ARG C 3.322 E A 0018 PHE CB
E A 0017 ARG C 3.230 E A 0018 PHE CG
E A 0017 ARG C 3.109 E A 0018 PHE CD1
E A 0018 PHE C 2.450 C A 0019 THR CA
E A 0018 PHE C 3.204 C A 0019 THR C
E A 0018 PHE C 3.671 C A 0019 THR CB
E A 0018 PHE CG 3.779 H A 0023 HIS CB
E A 0018 PHE CD2 3.373 H A 0023 HIS CB
E A 0018 PHE CD1 3.458 H A 0024 LEU CD1
E A 0018 PHE CE1 3.770 H A 0027 HIS CG
E A 0018 PHE CE1 3.625 H A 0027 HIS CD2
E A 0018 PHE CZ 3.494 H A 0027 HIS CG
E A 0018 PHE CZ 3.752 H A 0027 HIS CD2
C A 0019 THR C 2.455 C A 0020 ASN CA
C A 0019 THR C 3.565 C A 0020 ASN C
C A 0019 THR C 3.423 C A 0020 ASN CB
C A 0019 THR C 3.325 C A 0020 ASN CG
C A 0020 ASN CA 3.793 H A 0021 GLU CA
C A 0020 ASN C 2.438 H A 0021 GLU CA
C A 0020 ASN C 3.109 H A 0021 GLU C
C A 0020 ASN C 3.689 H A 0021 GLU CB
H A 0021 GLU C 2.453 H A 0022 ASP CA
H A 0021 GLU C 2.979 H A 0022 ASP C
H A 0021 GLU C 3.712 H A 0022 ASP CB
H A 0022 ASP CA 3.793 H A 0023 HIS CA
H A 0022 ASP C 2.429 H A 0023 HIS CA
H A 0022 ASP C 3.045 H A 0023 HIS C
H A 0022 ASP C 3.690 H A 0023 HIS CB
H A 0023 HIS C 2.436 H A 0024 LEU CA
H A 0023 HIS C 3.050 H A 0024 LEU C
H A 0023 HIS C 3.696 H A 0024 LEU CB
H A 0023 HIS C 3.779 H A 0026 VAL CG2
H A 0024 LEU C 2.447 H A 0025 ALA CA
H A 0024 LEU C 3.007 H A 0025 ALA C
H A 0024 LEU C 3.711 H A 0025 ALA CB
H A 0025 ALA C 2.450 H A 0026 VAL CA
H A 0025 ALA C 3.006 H A 0026 VAL C
H A 0025 ALA C 3.738 H A 0026 VAL CB
H A 0026 VAL C 2.446 H A 0027 HIS CA
H A 0026 VAL C 3.040 H A 0027 HIS C
H A 0026 VAL C 3.680 H A 0027 HIS CB
H A 0027 HIS C 2.440 H A 0028 LYS CA
H A 0027 HIS C 3.084 H A 0028 LYS C
H A 0027 HIS C 3.695 H A 0028 LYS CB
H A 0027 HIS C 3.738 H A 0031 HIS CD2
H A 0027 HIS CD2 3.648 H A 0031 HIS CD2
H A 0028 LYS C 2.442 H A 0029 HIS CA
H A 0028 LYS C 2.956 H A 0029 HIS C
H A 0028 LYS C 3.705 H A 0029 HIS CB
H A 0029 HIS C 2.439 H A 0030 LYS CA
H A 0029 HIS C 3.105 H A 0030 LYS C
H A 0029 HIS C 3.716 H A 0030 LYS CB
H A 0029 HIS CE1 3.718 C A 0033 MET CG
H A 0029 HIS CD2 3.537 C A 0036 LYS CE
H A 0030 LYS C 2.445 H A 0031 HIS CA
H A 0030 LYS C 3.017 H A 0031 HIS C
H A 0030 LYS C 3.721 H A 0031 HIS CB
H A 0031 HIS CA 3.796 H A 0032 GLU CA
H A 0031 HIS C 2.439 H A 0032 GLU CA
H A 0031 HIS C 3.052 H A 0032 GLU C
H A 0031 HIS C 3.693 H A 0032 GLU CB
H A 0032 GLU C 2.441 C A 0033 MET CA
H A 0032 GLU C 3.194 C A 0033 MET C
H A 0032 GLU C 3.676 C A 0033 MET CB
C A 0033 MET C 2.446 C A 0034 THR CA
C A 0033 MET C 3.019 C A 0034 THR C
C A 0033 MET C 3.716 C A 0034 THR CB
C A 0034 THR C 2.455 C A 0035 LEU CA
C A 0034 THR C 3.122 C A 0035 LEU C
C A 0034 THR C 3.711 C A 0035 LEU CB
C A 0035 LEU C 2.448 C A 0036 LYS CA
C A 0035 LEU C 2.971 C A 0036 LYS C
C A 0035 LEU C 3.716 C A 0036 LYS CB
C A 0036 LYS C 2.462 C A 0037 PHE CA
C A 0036 LYS C 3.021 C A 0037 PHE C
C A 0036 LYS C 3.036 C A 0037 PHE CB
C A 0036 LYS C 3.439 C A 0037 PHE CG
C A 0036 LYS C 3.779 C A 0037 PHE CD2
C A 0036 LYS CG 3.708 C A 0037 PHE CD2
C A 0036 LYS CG 3.717 C A 0037 PHE CE2
C A 0036 LYS CD 3.387 C A 0037 PHE CE2
C A 0036 LYS CD 3.556 C A 0037 PHE CZ
C A 0037 PHE C 2.445 C A 0038 GLY CA
C A 0037 PHE C 3.711 C A 0038 GLY C
CHARGE_ATTR 2.00 12.00 44
C A 0003 ASP OD1 3.079 C A 0005 LYS NZ
C A 0003 ASP OD2 2.715 C A 0005 LYS NZ
C A 0003 ASP OD1 11.41 E A 0017 ARG NH1
C A 0004 ASP OD1 10.02 C A 0005 LYS NZ
C A 0004 ASP OD2 9.998 C A 0005 LYS NZ
C A 0004 ASP OD1 8.961 E A 0017 ARG NH1
C A 0004 ASP OD1 10.36 E A 0017 ARG NH2
C A 0004 ASP OD2 8.287 E A 0017 ARG NH1
C A 0004 ASP OD2 9.658 E A 0017 ARG NH2
H A 0021 GLU OE1 9.031 H A 0023 HIS ND1
H A 0021 GLU OE1 10.27 H A 0023 HIS NE2
H A 0021 GLU OE2 9.159 H A 0023 HIS ND1
H A 0021 GLU OE2 10.38 H A 0023 HIS NE2
H A 0021 GLU OE1 11.90 H A 0027 HIS ND1
H A 0021 GLU OE2 10.32 H A 0027 HIS ND1
H A 0021 GLU OE2 10.28 H A 0027 HIS NE2
H A 0021 GLU OE1 10.57 H A 0028 LYS NZ
H A 0021 GLU OE2 8.629 H A 0028 LYS NZ
H A 0021 GLU OE1 10.83 H A 0029 HIS ND1
H A 0021 GLU OE2 10.54 H A 0029 HIS ND1
H A 0021 GLU OE2 11.66 H A 0031 HIS NE2
H A 0022 ASP OD1 4.897 H A 0023 HIS ND1
H A 0022 ASP OD1 6.518 H A 0023 HIS NE2
H A 0022 ASP OD2 2.761 H A 0023 HIS ND1
H A 0022 ASP OD2 4.606 H A 0023 HIS NE2
H A 0022 ASP OD2 10.75 H A 0027 HIS ND1
H A 0022 ASP OD1 11.99 H A 0029 HIS ND1
H A 0022 ASP OD2 11.05 H A 0030 LYS NZ
H A 0032 GLU OE1 11.17 H A 0027 HIS ND1
H A 0032 GLU OE1 10.88 H A 0027 HIS NE2
H A 0032 GLU OE2 10.14 H A 0027 HIS ND1
H A 0032 GLU OE2 9.475 H A 0027 HIS NE2
H A 0032 GLU OE1 4.919 H A 0028 LYS NZ
H A 0032 GLU OE2 2.708 H A 0028 LYS NZ
H A 0032 GLU OE1 6.125 H A 0029 HIS ND1
H A 0032 GLU OE1 8.259 H A 0029 HIS NE2
H A 0032 GLU OE2 7.750 H A 0029 HIS ND1
H A 0032 GLU OE2 9.868 H A 0029 HIS NE2
H A 0032 GLU OE1 9.215 H A 0031 HIS ND1
H A 0032 GLU OE1 9.749 H A 0031 HIS NE2
H A 0032 GLU OE2 8.424 H A 0031 HIS ND1
H A 0032 GLU OE2 8.642 H A 0031 HIS NE2
H A 0032 GLU OE1 9.968 C A 0036 LYS NZ
H A 0032 GLU OE2 11.52 C A 0036 LYS NZ
CHARGE_REPU 2.00 12.00 42
C A 0003 ASP OD1 7.414 C A 0004 ASP OD1
C A 0003 ASP OD1 7.165 C A 0004 ASP OD2
C A 0003 ASP OD2 8.358 C A 0004 ASP OD1
C A 0003 ASP OD2 8.605 C A 0004 ASP OD2
H A 0021 GLU OE1 7.411 H A 0022 ASP OD1
H A 0021 GLU OE1 8.098 H A 0022 ASP OD2
H A 0021 GLU OE2 8.570 H A 0022 ASP OD1
H A 0021 GLU OE2 8.757 H A 0022 ASP OD2
H A 0021 GLU OE1 10.53 H A 0032 GLU OE1
H A 0021 GLU OE1 10.14 H A 0032 GLU OE2
H A 0021 GLU OE2 9.362 H A 0032 GLU OE1
H A 0021 GLU OE2 8.590 H A 0032 GLU OE2
H A 0023 HIS ND1 9.668 H A 0027 HIS ND1
H A 0023 HIS ND1 10.99 H A 0027 HIS NE2
H A 0023 HIS NE2 10.95 H A 0027 HIS ND1
H A 0023 HIS ND1 10.86 H A 0030 LYS NZ
H A 0027 HIS ND1 9.187 H A 0028 LYS NZ
H A 0027 HIS NE2 7.988 H A 0028 LYS NZ
H A 0027 HIS ND1 11.20 H A 0029 HIS ND1
H A 0027 HIS ND1 11.95 H A 0029 HIS NE2
H A 0027 HIS ND1 5.763 H A 0030 LYS NZ
H A 0027 HIS NE2 7.813 H A 0030 LYS NZ
H A 0027 HIS ND1 5.450 H A 0031 HIS ND1
H A 0027 HIS ND1 3.504 H A 0031 HIS NE2
H A 0027 HIS NE2 5.176 H A 0031 HIS ND1
H A 0027 HIS NE2 2.945 H A 0031 HIS NE2
H A 0028 LYS NZ 9.931 H A 0029 HIS ND1
H A 0028 LYS NZ 11.94 H A 0029 HIS NE2
H A 0028 LYS NZ 7.759 H A 0031 HIS ND1
H A 0028 LYS NZ 7.556 H A 0031 HIS NE2
H A 0029 HIS ND1 9.922 H A 0030 LYS NZ
H A 0029 HIS NE2 9.529 H A 0030 LYS NZ
H A 0029 HIS ND1 10.32 H A 0031 HIS ND1
H A 0029 HIS ND1 10.90 H A 0031 HIS NE2
H A 0029 HIS NE2 11.15 H A 0031 HIS ND1
H A 0029 HIS NE2 11.83 H A 0031 HIS NE2
H A 0029 HIS ND1 4.680 C A 0036 LYS NZ
H A 0029 HIS NE2 2.813 C A 0036 LYS NZ
H A 0030 LYS NZ 7.298 H A 0031 HIS ND1
H A 0030 LYS NZ 7.020 H A 0031 HIS NE2
H A 0030 LYS NZ 9.136 C A 0036 LYS NZ
H A 0031 HIS ND1 11.12 C A 0036 LYS NZ
HB_MM 2.00 3.20 53
C A 0002 SER N 2.255 C A 0001 MET O
C A 0003 ASP N 2.264 C A 0002 SER O
C A 0004 ASP N 2.258 C A 0003 ASP O
C A 0005 LYS N 2.263 C A 0004 ASP O
C A 0006 PRO N 2.254 C A 0005 LYS O
E A 0007 PHE N 3.094 C A 0005 LYS O
E A 0007 PHE N 2.258 C A 0006 PRO O
E A 0008 LEU N 2.260 E A 0007 PHE O
E A 0009 CYS N 2.253 E A 0008 LEU O
E A 0009 CYS N 2.876 E A 0016 GLN O
C A 0010 THR N 2.251 E A 0009 CYS O
C A 0011 ALA N 2.263 C A 0010 THR O
C A 0012 PRO N 2.261 C A 0011 ALA O
C A 0013 GLY N 2.256 C A 0012 PRO O
C A 0014 CYS N 2.783 C A 0012 PRO O
C A 0014 CYS N 2.251 C A 0013 GLY O
C A 0015 GLY N 3.141 C A 0011 ALA O
C A 0015 GLY N 2.267 C A 0014 CYS O
E A 0016 GLN N 2.992 C A 0014 CYS O
E A 0016 GLN N 2.253 C A 0015 GLY O
E A 0017 ARG N 2.262 E A 0016 GLN O
E A 0018 PHE N 2.260 E A 0017 ARG O
C A 0019 THR N 2.262 E A 0018 PHE O
C A 0020 ASN N 2.260 C A 0019 THR O
H A 0021 GLU N 2.259 C A 0020 ASN O
H A 0022 ASP N 2.251 H A 0021 GLU O
H A 0023 HIS N 2.251 H A 0022 ASP O
H A 0024 LEU N 3.121 H A 0021 GLU O
H A 0024 LEU N 2.250 H A 0023 HIS O
H A 0025 ALA N 2.726 H A 0021 GLU O
H A 0025 ALA N 2.254 H A 0024 LEU O
H A 0026 VAL N 2.252 H A 0025 ALA O
H A 0027 HIS N 3.114 H A 0023 HIS O
H A 0027 HIS N 2.256 H A 0026 VAL O
H A 0028 LYS N 2.797 H A 0024 LEU O
H A 0028 LYS N 2.248 H A 0027 HIS O
H A 0029 HIS N 2.787 H A 0025 ALA O
H A 0029 HIS N 2.250 H A 0028 LYS O
H A 0030 LYS N 2.249 H A 0029 HIS O
H A 0031 HIS N 3.055 H A 0028 LYS O
H A 0031 HIS N 2.253 H A 0030 LYS O
H A 0032 GLU N 2.847 H A 0028 LYS O
H A 0032 GLU N 2.254 H A 0031 HIS O
C A 0033 MET N 2.826 H A 0029 HIS O
C A 0033 MET N 2.254 H A 0032 GLU O
C A 0034 THR N 2.943 H A 0032 GLU O
C A 0034 THR N 2.256 C A 0033 MET O
C A 0035 LEU N 3.028 C A 0033 MET O
C A 0035 LEU N 2.259 C A 0034 THR O
C A 0036 LYS N 2.946 C A 0033 MET O
C A 0036 LYS N 2.257 C A 0035 LEU O
C A 0037 PHE N 2.262 C A 0036 LYS O
C A 0038 GLY N 2.257 C A 0037 PHE O
HB_MS 2.00 3.20 2
C A 0001 MET N 2.703 C A 0004 ASP OD1
C A 0010 THR O 2.933 H A 0028 LYS NZ
HB_SS 2.00 3.20 1
H A 0028 LYS NZ 2.880 C A 0010 THR OG1
AROMATIC 0.00 8.00 4
H A 0027 HIS 4.267 H A 0031 HIS
H A 0028 LYS 6.980 H A 0031 HIS
H A 0030 LYS 6.867 H A 0027 HIS
C A 0036 LYS 3.759 H A 0029 HIS