Complet list of 1ba4 con file
Complete list of 1ba4.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 150
C A 0001 ASP C 2.436 C A 0002 ALA CA
C A 0001 ASP C 3.135 C A 0002 ALA C
C A 0001 ASP C 3.693 C A 0002 ALA CB
C A 0002 ALA C 2.430 C A 0003 GLU CA
C A 0002 ALA C 2.992 C A 0003 GLU C
C A 0002 ALA C 3.698 C A 0003 GLU CB
C A 0003 GLU C 2.472 C A 0004 PHE CA
C A 0003 GLU C 3.696 C A 0004 PHE C
C A 0003 GLU C 3.040 C A 0004 PHE CB
C A 0004 PHE C 2.455 C A 0005 ARG CA
C A 0004 PHE C 2.928 C A 0005 ARG C
C A 0004 PHE C 3.161 C A 0005 ARG CB
C A 0005 ARG C 2.481 C A 0006 HIS CA
C A 0005 ARG C 3.004 C A 0006 HIS C
C A 0005 ARG C 3.230 C A 0006 HIS CB
C A 0005 ARG C 3.055 C A 0006 HIS CG
C A 0005 ARG C 3.303 C A 0006 HIS CD2
C A 0005 ARG CD 3.796 C A 0006 HIS CE1
C A 0005 ARG CZ 3.496 C A 0006 HIS CE1
C A 0006 HIS C 2.453 C A 0007 ASP CA
C A 0006 HIS C 3.056 C A 0007 ASP C
C A 0006 HIS C 3.707 C A 0007 ASP CB
C A 0007 ASP C 2.441 C A 0008 SER CA
C A 0007 ASP C 3.089 C A 0008 SER C
C A 0007 ASP C 3.696 C A 0008 SER CB
C A 0008 SER C 2.430 C A 0009 GLY CA
C A 0008 SER C 3.657 C A 0009 GLY C
C A 0009 GLY C 2.457 C A 0010 TYR CA
C A 0009 GLY C 2.986 C A 0010 TYR C
C A 0009 GLY C 3.729 C A 0010 TYR CB
C A 0010 TYR C 2.479 C A 0011 GLU CA
C A 0010 TYR C 3.151 C A 0011 GLU C
C A 0010 TYR C 2.973 C A 0011 GLU CB
C A 0010 TYR CE1 3.683 C A 0011 GLU C
C A 0010 TYR CE2 3.725 C A 0011 GLU C
C A 0010 TYR CZ 3.613 C A 0011 GLU C
C A 0010 TYR CD2 3.656 C A 0012 VAL C
C A 0010 TYR CE2 3.481 C A 0012 VAL CA
C A 0010 TYR CE2 3.400 C A 0012 VAL C
C A 0011 GLU C 2.452 C A 0012 VAL CA
C A 0011 GLU C 3.636 C A 0012 VAL C
C A 0011 GLU C 3.320 C A 0012 VAL CB
C A 0011 GLU C 3.177 C A 0012 VAL CG1
C A 0011 GLU CB 3.731 H A 0016 LYS CD
C A 0011 GLU CB 3.725 H A 0016 LYS CE
C A 0011 GLU CD 3.576 H A 0016 LYS CD
C A 0011 GLU CD 3.765 H A 0019 PHE CD2
C A 0012 VAL C 2.458 C A 0013 HIS CA
C A 0012 VAL C 3.073 C A 0013 HIS C
C A 0012 VAL C 3.720 C A 0013 HIS CB
C A 0012 VAL CG2 3.641 H A 0015 GLN CA
C A 0012 VAL CG2 3.676 H A 0015 GLN C
C A 0012 VAL CG2 3.217 H A 0015 GLN CB
C A 0013 HIS C 2.449 C A 0014 HIS CA
C A 0013 HIS C 3.607 C A 0014 HIS C
C A 0013 HIS C 3.417 C A 0014 HIS CB
C A 0013 HIS C 3.307 C A 0014 HIS CG
C A 0013 HIS C 3.360 C A 0014 HIS CD2
C A 0013 HIS CB 3.677 C A 0014 HIS CE1
C A 0014 HIS C 2.426 H A 0015 GLN CA
C A 0014 HIS C 2.934 H A 0015 GLN C
C A 0014 HIS C 3.720 H A 0015 GLN CB
H A 0015 GLN C 2.443 H A 0016 LYS CA
H A 0015 GLN C 2.958 H A 0016 LYS C
H A 0015 GLN C 3.709 H A 0016 LYS CB
H A 0015 GLN C 3.649 H A 0019 PHE CD2
H A 0015 GLN CD 3.575 H A 0019 PHE CE1
H A 0015 GLN CD 3.749 H A 0019 PHE CE2
H A 0015 GLN CD 3.215 H A 0019 PHE CZ
H A 0016 LYS C 2.431 H A 0017 LEU CA
H A 0016 LYS C 2.998 H A 0017 LEU C
H A 0016 LYS C 3.705 H A 0017 LEU CB
H A 0017 LEU C 2.442 H A 0018 VAL CA
H A 0017 LEU C 2.911 H A 0018 VAL C
H A 0017 LEU C 3.681 H A 0018 VAL CB
H A 0018 VAL C 2.446 H A 0019 PHE CA
H A 0018 VAL C 2.972 H A 0019 PHE C
H A 0018 VAL C 3.722 H A 0019 PHE CB
H A 0019 PHE C 2.445 H A 0020 PHE CA
H A 0019 PHE C 2.902 H A 0020 PHE C
H A 0019 PHE C 3.707 H A 0020 PHE CB
H A 0019 PHE CA 3.724 H A 0022 GLU CD
H A 0020 PHE C 2.448 H A 0021 ALA CA
H A 0020 PHE C 2.950 H A 0021 ALA C
H A 0020 PHE C 3.707 H A 0021 ALA CB
H A 0020 PHE C 3.738 H A 0024 VAL CG2
H A 0020 PHE CD1 3.436 H A 0024 VAL CG2
H A 0020 PHE CE1 3.252 H A 0024 VAL CG2
H A 0021 ALA C 2.436 H A 0022 GLU CA
H A 0021 ALA C 2.954 H A 0022 GLU C
H A 0021 ALA C 3.717 H A 0022 GLU CB
H A 0022 GLU C 2.464 H A 0023 ASP CA
H A 0022 GLU C 2.911 H A 0023 ASP C
H A 0022 GLU C 3.716 H A 0023 ASP CB
H A 0023 ASP C 2.464 H A 0024 VAL CA
H A 0023 ASP C 3.008 H A 0024 VAL C
H A 0023 ASP C 3.670 H A 0024 VAL CB
H A 0024 VAL C 2.454 H A 0025 GLY CA
H A 0024 VAL C 2.966 H A 0025 GLY C
H A 0025 GLY C 2.435 H A 0026 SER CA
H A 0025 GLY C 3.046 H A 0026 SER C
H A 0025 GLY C 3.718 H A 0026 SER CB
H A 0026 SER C 2.471 H A 0027 ASN CA
H A 0026 SER C 2.968 H A 0027 ASN C
H A 0026 SER C 3.687 H A 0027 ASN CB
H A 0027 ASN C 2.457 H A 0028 LYS CA
H A 0027 ASN C 2.920 H A 0028 LYS C
H A 0027 ASN C 3.652 H A 0028 LYS CB
H A 0027 ASN C 3.776 H A 0031 ILE CG1
H A 0027 ASN C 3.709 H A 0031 ILE CD1
H A 0027 ASN CB 3.794 H A 0031 ILE CD1
H A 0028 LYS C 2.438 H A 0029 GLY CA
H A 0028 LYS C 2.984 H A 0029 GLY C
H A 0028 LYS CA 3.772 H A 0031 ILE CB
H A 0028 LYS C 3.771 H A 0031 ILE CB
H A 0029 GLY C 2.439 H A 0030 ALA CA
H A 0029 GLY C 2.978 H A 0030 ALA C
H A 0029 GLY C 3.705 H A 0030 ALA CB
H A 0030 ALA C 2.452 H A 0031 ILE CA
H A 0030 ALA C 2.947 H A 0031 ILE C
H A 0030 ALA C 3.680 H A 0031 ILE CB
H A 0031 ILE C 2.434 H A 0032 ILE CA
H A 0031 ILE C 2.920 H A 0032 ILE C
H A 0031 ILE C 3.709 H A 0032 ILE CB
H A 0032 ILE C 2.436 H A 0033 GLY CA
H A 0032 ILE C 2.928 H A 0033 GLY C
H A 0033 GLY C 2.444 H A 0034 LEU CA
H A 0033 GLY C 2.997 H A 0034 LEU C
H A 0033 GLY C 3.714 H A 0034 LEU CB
H A 0034 LEU C 2.455 H A 0035 MET CA
H A 0034 LEU C 2.936 H A 0035 MET C
H A 0034 LEU C 3.725 H A 0035 MET CB
H A 0035 MET C 2.453 H A 0036 VAL CA
H A 0035 MET C 2.974 H A 0036 VAL C
H A 0035 MET C 3.722 H A 0036 VAL CB
H A 0036 VAL C 2.455 C A 0037 GLY CA
H A 0036 VAL C 3.561 C A 0037 GLY C
H A 0036 VAL CG1 3.647 C A 0040 VAL CG1
C A 0037 GLY C 2.444 C A 0038 GLY CA
C A 0037 GLY C 3.009 C A 0038 GLY C
C A 0037 GLY CA 3.737 C A 0040 VAL CB
C A 0037 GLY CA 3.749 C A 0040 VAL CG2
C A 0038 GLY C 2.450 C A 0039 VAL CA
C A 0038 GLY C 3.305 C A 0039 VAL C
C A 0038 GLY C 3.644 C A 0039 VAL CB
C A 0038 GLY C 3.716 C A 0039 VAL CG2
C A 0039 VAL C 2.457 C A 0040 VAL CA
C A 0039 VAL C 3.604 C A 0040 VAL C
C A 0039 VAL C 3.382 C A 0040 VAL CB
C A 0039 VAL C 3.254 C A 0040 VAL CG2
CHARGE_ATTR 2.00 12.00 30
C A 0001 ASP OD2 11.14 C A 0006 HIS ND1
C A 0001 ASP OD2 11.93 C A 0006 HIS NE2
C A 0001 ASP OD1 6.587 H A 0016 LYS NZ
C A 0001 ASP OD2 7.502 H A 0016 LYS NZ
C A 0003 GLU OE1 10.13 C A 0006 HIS ND1
C A 0003 GLU OE1 11.68 C A 0006 HIS NE2
C A 0003 GLU OE2 10.83 C A 0006 HIS ND1
C A 0003 GLU OE1 3.164 H A 0016 LYS NZ
C A 0003 GLU OE2 4.649 H A 0016 LYS NZ
C A 0007 ASP OD1 9.072 C A 0005 ARG NH1
C A 0007 ASP OD1 10.41 C A 0005 ARG NH2
C A 0007 ASP OD2 9.840 C A 0005 ARG NH1
C A 0007 ASP OD2 11.41 C A 0005 ARG NH2
C A 0007 ASP OD1 6.862 C A 0006 HIS ND1
C A 0007 ASP OD1 8.174 C A 0006 HIS NE2
C A 0007 ASP OD2 7.976 C A 0006 HIS ND1
C A 0007 ASP OD2 9.532 C A 0006 HIS NE2
C A 0007 ASP OD1 7.748 H A 0016 LYS NZ
C A 0007 ASP OD2 7.303 H A 0016 LYS NZ
C A 0011 GLU OE1 10.21 C A 0013 HIS ND1
C A 0011 GLU OE1 11.63 C A 0013 HIS NE2
C A 0011 GLU OE1 9.909 C A 0014 HIS ND1
C A 0011 GLU OE1 10.94 C A 0014 HIS NE2
C A 0011 GLU OE2 11.94 C A 0014 HIS ND1
C A 0011 GLU OE1 4.634 H A 0016 LYS NZ
C A 0011 GLU OE2 3.206 H A 0016 LYS NZ
H A 0022 GLU OE1 10.79 H A 0016 LYS NZ
H A 0022 GLU OE2 10.70 H A 0016 LYS NZ
H A 0023 ASP OD1 10.32 H A 0016 LYS NZ
H A 0023 ASP OD2 8.706 H A 0016 LYS NZ
CHARGE_REPU 2.00 12.00 54
C A 0001 ASP OD1 4.901 C A 0003 GLU OE1
C A 0001 ASP OD1 3.040 C A 0003 GLU OE2
C A 0001 ASP OD2 5.001 C A 0003 GLU OE1
C A 0001 ASP OD2 2.991 C A 0003 GLU OE2
C A 0001 ASP OD1 8.619 C A 0007 ASP OD1
C A 0001 ASP OD1 9.771 C A 0007 ASP OD2
C A 0001 ASP OD2 7.305 C A 0007 ASP OD1
C A 0001 ASP OD2 8.811 C A 0007 ASP OD2
C A 0001 ASP OD1 10.01 C A 0011 GLU OE1
C A 0001 ASP OD1 8.164 C A 0011 GLU OE2
C A 0001 ASP OD2 11.41 C A 0011 GLU OE1
C A 0001 ASP OD2 9.448 C A 0011 GLU OE2
C A 0001 ASP OD1 9.996 H A 0022 GLU OE1
C A 0001 ASP OD1 10.68 H A 0022 GLU OE2
C A 0001 ASP OD1 4.510 H A 0023 ASP OD1
C A 0001 ASP OD1 3.038 H A 0023 ASP OD2
C A 0001 ASP OD2 5.781 H A 0023 ASP OD1
C A 0001 ASP OD2 4.695 H A 0023 ASP OD2
C A 0003 GLU OE1 5.232 C A 0007 ASP OD1
C A 0003 GLU OE1 5.581 C A 0007 ASP OD2
C A 0003 GLU OE2 5.915 C A 0007 ASP OD1
C A 0003 GLU OE2 6.806 C A 0007 ASP OD2
C A 0003 GLU OE1 7.734 C A 0011 GLU OE1
C A 0003 GLU OE1 5.991 C A 0011 GLU OE2
C A 0003 GLU OE2 8.793 C A 0011 GLU OE1
C A 0003 GLU OE2 6.825 C A 0011 GLU OE2
C A 0003 GLU OE2 11.48 H A 0022 GLU OE1
C A 0003 GLU OE1 9.190 H A 0023 ASP OD1
C A 0003 GLU OE1 7.726 H A 0023 ASP OD2
C A 0003 GLU OE2 7.530 H A 0023 ASP OD1
C A 0003 GLU OE2 5.978 H A 0023 ASP OD2
C A 0005 ARG NH1 5.087 C A 0006 HIS ND1
C A 0005 ARG NH1 4.384 C A 0006 HIS NE2
C A 0005 ARG NH2 5.051 C A 0006 HIS ND1
C A 0005 ARG NH2 3.653 C A 0006 HIS NE2
C A 0007 ASP OD1 10.32 C A 0011 GLU OE2
C A 0007 ASP OD2 11.11 C A 0011 GLU OE1
C A 0007 ASP OD2 9.636 C A 0011 GLU OE2
C A 0007 ASP OD1 11.64 H A 0023 ASP OD2
C A 0011 GLU OE1 9.424 H A 0022 GLU OE1
C A 0011 GLU OE1 8.944 H A 0022 GLU OE2
C A 0011 GLU OE2 9.071 H A 0022 GLU OE1
C A 0011 GLU OE2 9.021 H A 0022 GLU OE2
C A 0011 GLU OE1 11.14 H A 0023 ASP OD2
C A 0011 GLU OE2 11.37 H A 0023 ASP OD1
C A 0011 GLU OE2 9.519 H A 0023 ASP OD2
C A 0013 HIS ND1 5.517 C A 0014 HIS ND1
C A 0013 HIS ND1 4.759 C A 0014 HIS NE2
C A 0013 HIS NE2 5.786 C A 0014 HIS ND1
C A 0013 HIS NE2 4.257 C A 0014 HIS NE2
H A 0022 GLU OE1 9.377 H A 0023 ASP OD1
H A 0022 GLU OE1 8.294 H A 0023 ASP OD2
H A 0022 GLU OE2 10.08 H A 0023 ASP OD1
H A 0022 GLU OE2 9.187 H A 0023 ASP OD2
HB_MM 2.00 3.20 79
C A 0002 ALA N 2.228 C A 0001 ASP O
C A 0003 GLU N 2.229 C A 0002 ALA O
C A 0004 PHE N 3.013 C A 0002 ALA O
C A 0004 PHE N 2.239 C A 0003 GLU O
C A 0005 ARG N 2.222 C A 0004 PHE O
C A 0006 HIS N 2.234 C A 0005 ARG O
C A 0007 ASP N 2.961 C A 0004 PHE O
C A 0007 ASP N 2.779 C A 0005 ARG O
C A 0007 ASP N 2.225 C A 0006 HIS O
C A 0008 SER N 2.234 C A 0007 ASP O
C A 0009 GLY N 2.227 C A 0008 SER O
C A 0010 TYR N 2.237 C A 0009 GLY O
C A 0011 GLU N 2.904 C A 0009 GLY O
C A 0011 GLU N 2.245 C A 0010 TYR O
C A 0012 VAL N 2.853 C A 0010 TYR O
C A 0012 VAL N 2.224 C A 0011 GLU O
C A 0013 HIS N 2.234 C A 0012 VAL O
C A 0014 HIS N 2.229 C A 0013 HIS O
H A 0015 GLN N 2.215 C A 0014 HIS O
H A 0016 LYS N 3.032 C A 0014 HIS O
H A 0016 LYS N 2.222 H A 0015 GLN O
H A 0017 LEU N 2.937 C A 0014 HIS O
H A 0017 LEU N 2.224 H A 0016 LYS O
H A 0018 VAL N 3.116 H A 0015 GLN O
H A 0018 VAL N 2.213 H A 0017 LEU O
H A 0019 PHE N 2.919 H A 0015 GLN O
H A 0019 PHE N 2.218 H A 0018 VAL O
H A 0020 PHE N 2.992 H A 0016 LYS O
H A 0020 PHE N 3.014 H A 0017 LEU O
H A 0020 PHE N 2.222 H A 0019 PHE O
H A 0021 ALA N 2.867 H A 0017 LEU O
H A 0021 ALA N 3.146 H A 0018 VAL O
H A 0021 ALA N 2.219 H A 0020 PHE O
H A 0022 GLU N 3.137 H A 0018 VAL O
H A 0022 GLU N 2.991 H A 0019 PHE O
H A 0022 GLU N 2.211 H A 0021 ALA O
H A 0023 ASP N 2.973 H A 0019 PHE O
H A 0023 ASP N 3.000 H A 0020 PHE O
H A 0023 ASP N 2.232 H A 0022 GLU O
H A 0024 VAL N 2.929 H A 0020 PHE O
H A 0024 VAL N 3.199 H A 0021 ALA O
H A 0024 VAL N 2.225 H A 0023 ASP O
H A 0025 GLY N 2.862 H A 0021 ALA O
H A 0025 GLY N 3.073 H A 0022 GLU O
H A 0025 GLY N 2.229 H A 0024 VAL O
H A 0026 SER N 3.029 H A 0022 GLU O
H A 0026 SER N 2.231 H A 0025 GLY O
H A 0027 ASN N 2.862 H A 0023 ASP O
H A 0027 ASN N 2.228 H A 0026 SER O
H A 0028 LYS N 3.116 H A 0024 VAL O
H A 0028 LYS N 2.996 H A 0026 SER O
H A 0028 LYS N 2.229 H A 0027 ASN O
H A 0029 GLY N 3.030 H A 0026 SER O
H A 0029 GLY N 2.758 H A 0027 ASN O
H A 0029 GLY N 2.217 H A 0028 LYS O
H A 0030 ALA N 2.784 H A 0027 ASN O
H A 0030 ALA N 2.227 H A 0029 GLY O
H A 0031 ILE N 2.890 H A 0027 ASN O
H A 0031 ILE N 2.220 H A 0030 ALA O
H A 0032 ILE N 2.962 H A 0028 LYS O
H A 0032 ILE N 2.219 H A 0031 ILE O
H A 0033 GLY N 3.176 H A 0029 GLY O
H A 0033 GLY N 3.052 H A 0030 ALA O
H A 0033 GLY N 2.226 H A 0032 ILE O
H A 0034 LEU N 2.865 H A 0030 ALA O
H A 0034 LEU N 3.052 H A 0031 ILE O
H A 0034 LEU N 2.220 H A 0033 GLY O
H A 0035 MET N 2.936 H A 0031 ILE O
H A 0035 MET N 3.096 H A 0032 ILE O
H A 0035 MET N 2.235 H A 0034 LEU O
H A 0036 VAL N 2.981 H A 0032 ILE O
H A 0036 VAL N 2.236 H A 0035 MET O
C A 0037 GLY N 2.901 H A 0033 GLY O
C A 0037 GLY N 3.063 H A 0034 LEU O
C A 0037 GLY N 2.233 H A 0036 VAL O
C A 0038 GLY N 2.229 C A 0037 GLY O
C A 0039 VAL N 2.233 C A 0038 GLY O
C A 0040 VAL N 3.034 C A 0037 GLY O
C A 0040 VAL N 2.229 C A 0039 VAL O
HB_MS 2.00 3.20 7
C A 0002 ALA N 3.018 C A 0001 ASP OD2
C A 0004 PHE N 2.779 C A 0007 ASP OD1
C A 0005 ARG O 2.880 C A 0006 HIS ND1
H A 0022 GLU O 3.063 H A 0026 SER OG
H A 0023 ASP O 2.591 H A 0026 SER OG
H A 0023 ASP O 2.778 H A 0027 ASN ND2
H A 0027 ASN N 2.885 H A 0026 SER OG
HB_SS 2.00 3.20 1
H A 0023 ASP OD1 2.898 H A 0027 ASN ND2
AROMATIC 0.00 8.00 2
C A 0005 ARG 4.749 C A 0006 HIS
H A 0016 LYS 7.246 H A 0019 PHE