Complet list of 1qa5 con file
Complete list of 1qa5.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 0002 GLY C 2.451 C A 0003 GLY CA
C A 0002 GLY C 3.006 C A 0003 GLY C
C A 0003 GLY C 2.458 C A 0004 LYS CA
C A 0003 GLY C 2.944 C A 0004 LYS C
C A 0003 GLY C 3.084 C A 0004 LYS CB
C A 0004 LYS C 2.445 C A 0005 TRP CA
C A 0004 LYS C 3.317 C A 0005 TRP C
C A 0004 LYS C 3.631 C A 0005 TRP CB
C A 0004 LYS C 3.725 C A 0005 TRP CD1
C A 0005 TRP C 2.464 C A 0006 SER CA
C A 0005 TRP C 2.967 C A 0006 SER C
C A 0005 TRP C 3.096 C A 0006 SER CB
C A 0006 SER C 2.448 C A 0007 LYS CA
C A 0006 SER C 3.682 C A 0007 LYS C
C A 0006 SER C 3.207 C A 0007 LYS CB
C A 0006 SER C 3.715 C A 0007 LYS CG
C A 0007 LYS C 2.444 C A 0008 SER CA
C A 0007 LYS C 3.686 C A 0008 SER C
C A 0007 LYS C 3.203 C A 0008 SER CB
C A 0008 SER C 2.449 C A 0009 SER CA
C A 0008 SER C 3.520 C A 0009 SER C
C A 0008 SER C 3.472 C A 0009 SER CB
C A 0009 SER C 2.444 C A 0010 VAL CA
C A 0009 SER C 3.696 C A 0010 VAL C
C A 0009 SER C 3.180 C A 0010 VAL CB
C A 0010 VAL C 2.483 C A 0011 VAL CA
C A 0010 VAL C 3.074 C A 0011 VAL C
C A 0010 VAL C 3.088 C A 0011 VAL CB
C A 0010 VAL C 3.459 C A 0011 VAL CG1
C A 0011 VAL C 2.451 C A 0012 GLY CA
C A 0011 VAL C 3.689 C A 0012 GLY C
C A 0011 VAL CG1 3.294 C A 0013 TRP CZ3
C A 0012 GLY C 2.445 C A 0013 TRP CA
C A 0012 GLY C 3.701 C A 0013 TRP C
C A 0012 GLY C 3.171 C A 0013 TRP CB
C A 0012 GLY C 3.309 C A 0013 TRP CG
C A 0012 GLY C 3.420 C A 0013 TRP CD2
C A 0012 GLY C 3.474 C A 0013 TRP CE3
C A 0013 TRP CA 2.799 C A 0014 PRO CD
C A 0013 TRP C 2.462 C A 0014 PRO CA
C A 0013 TRP C 3.224 C A 0014 PRO C
C A 0013 TRP C 3.615 C A 0014 PRO CB
C A 0013 TRP C 3.656 C A 0014 PRO CG
C A 0013 TRP C 2.460 C A 0014 PRO CD
C A 0014 PRO C 2.445 C A 0015 ALA CA
C A 0014 PRO C 3.116 C A 0015 ALA C
C A 0014 PRO C 3.701 C A 0015 ALA CB
C A 0015 ALA C 2.452 H A 0016 VAL CA
C A 0015 ALA C 2.983 H A 0016 VAL C
C A 0015 ALA C 3.726 H A 0016 VAL CB
H A 0016 VAL C 2.461 H A 0017 ARG CA
H A 0016 VAL C 2.934 H A 0017 ARG C
H A 0016 VAL C 3.704 H A 0017 ARG CB
H A 0016 VAL C 3.663 H A 0020 MET CG
H A 0017 ARG C 2.442 H A 0018 GLU CA
H A 0017 ARG C 3.073 H A 0018 GLU C
H A 0017 ARG C 3.708 H A 0018 GLU CB
H A 0017 ARG CZ 3.563 H A 0018 GLU CG
H A 0017 ARG CA 3.285 H A 0020 MET CG
H A 0017 ARG C 3.551 H A 0020 MET CG
H A 0018 GLU C 2.446 H A 0019 ARG CA
H A 0018 GLU C 3.107 H A 0019 ARG C
H A 0018 GLU C 3.720 H A 0019 ARG CB
H A 0019 ARG C 2.445 H A 0020 MET CA
H A 0019 ARG C 3.115 H A 0020 MET C
H A 0019 ARG C 3.711 H A 0020 MET CB
H A 0020 MET C 2.459 H A 0021 ARG CA
H A 0020 MET C 2.910 H A 0021 ARG C
H A 0020 MET C 3.714 H A 0021 ARG CB
H A 0020 MET CE 3.629 H A 0021 ARG CA
H A 0021 ARG C 2.437 H A 0022 ARG CA
H A 0021 ARG C 3.218 H A 0022 ARG C
H A 0021 ARG C 3.665 H A 0022 ARG CB
H A 0022 ARG C 2.473 C A 0023 ALA CA
H A 0022 ARG C 3.700 C A 0023 ALA C
H A 0022 ARG C 2.874 C A 0023 ALA CB
C A 0023 ALA C 2.458 C A 0024 GLU CA
C A 0023 ALA C 3.723 C A 0024 GLU C
C A 0023 ALA C 2.986 C A 0024 GLU CB
C A 0024 GLU CA 2.823 C A 0025 PRO CD
C A 0024 GLU C 2.451 C A 0025 PRO CA
C A 0024 GLU C 3.159 C A 0025 PRO C
C A 0024 GLU C 3.624 C A 0025 PRO CB
C A 0024 GLU C 3.662 C A 0025 PRO CG
C A 0024 GLU C 2.467 C A 0025 PRO CD
C A 0025 PRO C 2.445 C A 0026 ALA CA
C A 0025 PRO C 3.572 C A 0026 ALA C
C A 0025 PRO C 3.393 C A 0026 ALA CB
C A 0026 ALA C 2.442 C A 0027 ALA CA
C A 0026 ALA C 3.431 C A 0027 ALA C
C A 0026 ALA C 3.540 C A 0027 ALA CB
C A 0027 ALA C 2.461 C A 0028 ASP CA
C A 0027 ALA C 2.930 C A 0028 ASP C
C A 0027 ALA C 3.124 C A 0028 ASP CB
C A 0028 ASP C 2.444 C A 0029 GLY CA
C A 0028 ASP C 3.454 C A 0029 GLY C
C A 0029 GLY C 2.445 C A 0030 VAL CA
C A 0029 GLY C 3.647 C A 0030 VAL C
C A 0029 GLY C 3.289 C A 0030 VAL CB
C A 0029 GLY C 3.364 C A 0030 VAL CG1
C A 0029 GLY C 3.659 C A 0030 VAL CG2
C A 0030 VAL C 2.443 C A 0031 GLY CA
C A 0030 VAL C 3.200 C A 0031 GLY C
C A 0031 GLY C 2.443 C A 0032 ALA CA
C A 0031 GLY C 3.650 C A 0032 ALA C
C A 0031 GLY C 3.265 C A 0032 ALA CB
C A 0032 ALA C 2.438 C A 0033 ALA CA
C A 0032 ALA C 3.108 C A 0033 ALA C
C A 0032 ALA C 3.696 C A 0033 ALA CB
C A 0032 ALA CB 3.736 C A 0035 ARG C
C A 0032 ALA CB 3.497 C A 0036 ASP CA
C A 0032 ALA CB 3.703 C A 0036 ASP C
C A 0032 ALA CA 3.404 H A 0039 LYS CB
C A 0032 ALA CB 3.359 H A 0039 LYS CB
C A 0033 ALA C 2.435 C A 0034 SER CA
C A 0033 ALA C 3.211 C A 0034 SER C
C A 0033 ALA C 3.669 C A 0034 SER CB
C A 0033 ALA CB 3.352 H A 0038 GLU CD
C A 0034 SER C 2.436 C A 0035 ARG CA
C A 0034 SER C 3.340 C A 0035 ARG C
C A 0034 SER C 3.597 C A 0035 ARG CB
C A 0034 SER C 3.792 C A 0035 ARG CG
C A 0035 ARG C 2.452 C A 0036 ASP CA
C A 0035 ARG C 3.556 C A 0036 ASP C
C A 0035 ARG C 3.446 C A 0036 ASP CB
C A 0035 ARG C 3.458 C A 0036 ASP CG
C A 0036 ASP C 2.461 H A 0037 LEU CA
C A 0036 ASP C 3.062 H A 0037 LEU C
C A 0036 ASP C 3.723 H A 0037 LEU CB
H A 0037 LEU C 2.449 H A 0038 GLU CA
H A 0037 LEU C 2.924 H A 0038 GLU C
H A 0037 LEU C 3.713 H A 0038 GLU CB
H A 0038 GLU C 2.445 H A 0039 LYS CA
H A 0038 GLU C 2.951 H A 0039 LYS C
H A 0038 GLU C 3.715 H A 0039 LYS CB
H A 0039 LYS C 2.447 H A 0040 HIS CA
H A 0039 LYS C 3.164 H A 0040 HIS C
H A 0039 LYS C 3.693 H A 0040 HIS CB
H A 0039 LYS CD 3.608 H A 0040 HIS CD2
H A 0040 HIS C 2.453 H A 0041 GLY CA
H A 0040 HIS C 3.012 H A 0041 GLY C
H A 0041 GLY C 2.446 C A 0042 ALA CA
H A 0041 GLY C 3.137 C A 0042 ALA C
H A 0041 GLY C 3.698 C A 0042 ALA CB
C A 0042 ALA C 2.450 C A 0043 ILE CA
C A 0042 ALA C 3.631 C A 0043 ILE C
C A 0042 ALA C 3.299 C A 0043 ILE CB
C A 0042 ALA C 3.308 C A 0043 ILE CG1
C A 0043 ILE C 2.438 C A 0044 THR CA
C A 0043 ILE C 3.470 C A 0044 THR C
C A 0043 ILE C 3.506 C A 0044 THR CB
C A 0044 THR C 2.439 C A 0045 SER CA
C A 0044 THR C 3.554 C A 0045 SER C
C A 0044 THR C 3.395 C A 0045 SER CB
C A 0045 SER C 2.443 C A 0046 SER CA
C A 0045 SER C 3.553 C A 0046 SER C
C A 0045 SER C 3.412 C A 0046 SER CB
C A 0046 SER C 2.441 C A 0047 ASN CA
C A 0046 SER C 3.460 C A 0047 ASN C
C A 0046 SER C 3.512 C A 0047 ASN CB
C A 0047 ASN C 2.441 C A 0048 THR CA
C A 0047 ASN C 3.298 C A 0048 THR C
C A 0047 ASN C 3.635 C A 0048 THR CB
C A 0048 THR C 2.451 C A 0049 ALA CA
C A 0048 THR C 2.952 C A 0049 ALA C
C A 0048 THR C 3.055 C A 0049 ALA CB
C A 0049 ALA C 2.459 C A 0050 ALA CA
C A 0049 ALA C 2.971 C A 0050 ALA C
C A 0049 ALA C 3.054 C A 0050 ALA CB
C A 0050 ALA C 2.446 C A 0051 ASN CA
C A 0050 ALA C 3.654 C A 0051 ASN C
C A 0050 ALA C 3.279 C A 0051 ASN CB
C A 0051 ASN C 2.468 C A 0052 ASN CA
C A 0051 ASN C 2.926 C A 0052 ASN C
C A 0051 ASN C 3.157 C A 0052 ASN CB
C A 0052 ASN C 2.443 C A 0053 ALA CA
C A 0052 ASN C 3.053 C A 0053 ALA C
C A 0052 ASN C 3.711 C A 0053 ALA CB
C A 0053 ALA C 2.454 C A 0054 ALA CA
C A 0053 ALA C 2.999 C A 0054 ALA C
C A 0053 ALA C 3.015 C A 0054 ALA CB
C A 0054 ALA C 2.461 C A 0055 CYS CA
C A 0054 ALA C 2.930 C A 0055 CYS C
C A 0054 ALA C 3.116 C A 0055 CYS CB
C A 0055 CYS C 2.445 C A 0056 ALA CA
C A 0055 CYS C 3.701 C A 0056 ALA C
C A 0055 CYS C 3.131 C A 0056 ALA CB
C A 0056 ALA C 2.455 C A 0057 TRP CA
C A 0056 ALA C 2.985 C A 0057 TRP C
C A 0056 ALA C 3.036 C A 0057 TRP CB
C A 0056 ALA C 3.599 C A 0057 TRP CG
C A 0056 ALA C 3.796 C A 0057 TRP CD1
CHARGE_ATTR 2.00 12.00 36
H A 0018 GLU OE1 5.574 H A 0017 ARG NH1
H A 0018 GLU OE1 5.036 H A 0017 ARG NH2
H A 0018 GLU OE2 4.077 H A 0017 ARG NH1
H A 0018 GLU OE2 3.472 H A 0017 ARG NH2
H A 0018 GLU OE1 11.22 H A 0019 ARG NH2
H A 0018 GLU OE2 11.19 H A 0019 ARG NH2
H A 0018 GLU OE1 11.94 H A 0021 ARG NH1
H A 0018 GLU OE1 10.60 H A 0021 ARG NH2
H A 0018 GLU OE2 11.52 H A 0021 ARG NH1
H A 0018 GLU OE2 10.37 H A 0021 ARG NH2
C A 0024 GLU OE1 7.628 H A 0019 ARG NH1
C A 0024 GLU OE1 7.674 H A 0019 ARG NH2
C A 0024 GLU OE2 7.706 H A 0019 ARG NH1
C A 0024 GLU OE2 7.283 H A 0019 ARG NH2
C A 0024 GLU OE2 10.55 H A 0021 ARG NH2
C A 0024 GLU OE2 11.38 H A 0022 ARG NH2
C A 0024 GLU OE1 10.56 H A 0039 LYS NZ
C A 0036 ASP OD1 8.923 C A 0035 ARG NH1
C A 0036 ASP OD1 10.61 C A 0035 ARG NH2
C A 0036 ASP OD2 7.455 C A 0035 ARG NH1
C A 0036 ASP OD2 9.033 C A 0035 ARG NH2
C A 0036 ASP OD1 8.263 H A 0039 LYS NZ
C A 0036 ASP OD2 9.873 H A 0039 LYS NZ
C A 0036 ASP OD1 9.456 H A 0040 HIS ND1
C A 0036 ASP OD1 10.58 H A 0040 HIS NE2
C A 0036 ASP OD2 10.56 H A 0040 HIS ND1
C A 0036 ASP OD2 11.91 H A 0040 HIS NE2
H A 0038 GLU OE1 5.978 C A 0035 ARG NH1
H A 0038 GLU OE1 5.940 C A 0035 ARG NH2
H A 0038 GLU OE2 6.955 C A 0035 ARG NH1
H A 0038 GLU OE2 7.339 C A 0035 ARG NH2
H A 0038 GLU OE1 11.42 H A 0039 LYS NZ
H A 0038 GLU OE2 10.46 H A 0039 LYS NZ
H A 0038 GLU OE1 11.89 H A 0040 HIS ND1
H A 0038 GLU OE2 10.66 H A 0040 HIS ND1
H A 0038 GLU OE2 11.05 H A 0040 HIS NE2
CHARGE_REPU 2.00 12.00 26
C A 0004 LYS NZ 6.822 C A 0007 LYS NZ
H A 0017 ARG NH1 10.88 H A 0019 ARG NH2
H A 0017 ARG NH1 8.315 H A 0021 ARG NH1
H A 0017 ARG NH1 7.734 H A 0021 ARG NH2
H A 0017 ARG NH2 10.21 H A 0021 ARG NH1
H A 0017 ARG NH2 9.726 H A 0021 ARG NH2
H A 0019 ARG NH1 10.47 H A 0021 ARG NH2
H A 0019 ARG NH2 10.33 H A 0021 ARG NH1
H A 0019 ARG NH2 8.258 H A 0021 ARG NH2
H A 0019 ARG NH2 11.11 H A 0022 ARG NH1
H A 0019 ARG NH2 11.58 H A 0022 ARG NH2
H A 0019 ARG NH1 8.904 H A 0039 LYS NZ
H A 0019 ARG NH2 10.92 H A 0039 LYS NZ
H A 0019 ARG NH1 10.51 H A 0040 HIS ND1
H A 0019 ARG NH1 9.955 H A 0040 HIS NE2
H A 0021 ARG NH1 6.770 H A 0022 ARG NH1
H A 0021 ARG NH1 7.332 H A 0022 ARG NH2
H A 0021 ARG NH2 7.392 H A 0022 ARG NH1
H A 0021 ARG NH2 7.866 H A 0022 ARG NH2
C A 0035 ARG NH1 11.81 H A 0040 HIS ND1
C A 0036 ASP OD1 10.83 H A 0038 GLU OE1
C A 0036 ASP OD1 11.37 H A 0038 GLU OE2
C A 0036 ASP OD2 10.29 H A 0038 GLU OE1
C A 0036 ASP OD2 11.11 H A 0038 GLU OE2
H A 0039 LYS NZ 3.929 H A 0040 HIS ND1
H A 0039 LYS NZ 3.190 H A 0040 HIS NE2
HB_MM 2.00 3.20 71
C A 0003 GLY N 2.212 C A 0002 GLY O
C A 0004 LYS N 2.216 C A 0003 GLY O
C A 0005 TRP N 2.951 C A 0003 GLY O
C A 0005 TRP N 2.210 C A 0004 LYS O
C A 0006 SER N 2.218 C A 0005 TRP O
C A 0007 LYS N 2.210 C A 0006 SER O
C A 0008 SER N 2.209 C A 0007 LYS O
C A 0009 SER N 2.211 C A 0008 SER O
C A 0010 VAL N 2.210 C A 0009 SER O
C A 0011 VAL N 2.221 C A 0010 VAL O
C A 0012 GLY N 2.210 C A 0011 VAL O
C A 0013 TRP N 2.209 C A 0012 GLY O
C A 0014 PRO N 2.236 C A 0013 TRP O
C A 0015 ALA N 2.949 C A 0013 TRP O
C A 0015 ALA N 2.206 C A 0014 PRO O
H A 0016 VAL N 2.214 C A 0015 ALA O
H A 0017 ARG N 3.092 C A 0015 ALA O
H A 0017 ARG N 2.216 H A 0016 VAL O
H A 0018 GLU N 3.101 C A 0015 ALA O
H A 0018 GLU N 2.884 H A 0016 VAL O
H A 0018 GLU N 2.208 H A 0017 ARG O
H A 0019 ARG N 3.087 H A 0016 VAL O
H A 0019 ARG N 2.209 H A 0018 GLU O
H A 0020 MET N 2.695 H A 0016 VAL O
H A 0020 MET N 2.207 H A 0019 ARG O
H A 0021 ARG N 3.128 H A 0017 ARG O
H A 0021 ARG N 2.215 H A 0020 MET O
H A 0022 ARG N 2.208 H A 0021 ARG O
C A 0023 ALA N 2.222 H A 0022 ARG O
C A 0024 GLU N 2.216 C A 0023 ALA O
C A 0025 PRO N 2.236 C A 0024 GLU O
C A 0026 ALA N 3.111 C A 0024 GLU O
C A 0026 ALA N 2.212 C A 0025 PRO O
C A 0027 ALA N 2.210 C A 0026 ALA O
C A 0028 ASP N 2.218 C A 0027 ALA O
C A 0029 GLY N 2.210 C A 0028 ASP O
C A 0030 VAL N 2.210 C A 0029 GLY O
C A 0031 GLY N 2.210 C A 0030 VAL O
C A 0032 ALA N 2.211 C A 0031 GLY O
C A 0033 ALA N 2.210 C A 0032 ALA O
C A 0034 SER N 2.208 C A 0033 ALA O
C A 0035 ARG N 2.210 C A 0034 SER O
C A 0036 ASP N 2.212 C A 0035 ARG O
H A 0037 LEU N 2.217 C A 0036 ASP O
H A 0038 GLU N 2.209 H A 0037 LEU O
H A 0039 LYS N 2.926 H A 0037 LEU O
H A 0039 LYS N 2.211 H A 0038 GLU O
H A 0040 HIS N 2.926 H A 0037 LEU O
H A 0040 HIS N 2.209 H A 0039 LYS O
H A 0041 GLY N 2.601 H A 0037 LEU O
H A 0041 GLY N 2.213 H A 0040 HIS O
C A 0042 ALA N 2.835 H A 0038 GLU O
C A 0042 ALA N 3.081 H A 0040 HIS O
C A 0042 ALA N 2.210 H A 0041 GLY O
C A 0043 ILE N 2.695 H A 0041 GLY O
C A 0043 ILE N 2.211 C A 0042 ALA O
C A 0044 THR N 2.209 C A 0043 ILE O
C A 0045 SER N 2.210 C A 0044 THR O
C A 0046 SER N 2.211 C A 0045 SER O
C A 0047 ASN N 2.210 C A 0046 SER O
C A 0048 THR N 2.208 C A 0047 ASN O
C A 0049 ALA N 2.216 C A 0048 THR O
C A 0050 ALA N 2.214 C A 0049 ALA O
C A 0051 ASN N 2.210 C A 0050 ALA O
C A 0052 ASN N 2.219 C A 0051 ASN O
C A 0053 ALA N 2.211 C A 0052 ASN O
C A 0054 ALA N 2.216 C A 0053 ALA O
C A 0055 CYS N 2.215 C A 0054 ALA O
C A 0056 ALA N 2.880 C A 0054 ALA O
C A 0056 ALA N 2.212 C A 0055 CYS O
C A 0057 TRP N 2.217 C A 0056 ALA O
HB_MS 2.00 3.20 5
C A 0004 LYS O 2.719 C A 0007 LYS NZ
C A 0023 ALA O 2.687 H A 0019 ARG NH2
C A 0034 SER N 3.090 H A 0038 GLU OE1
C A 0035 ARG N 2.618 C A 0034 SER OG
C A 0056 ALA O 3.052 C A 0045 SER OG
HB_SS 2.00 3.20 1
H A 0038 GLU OE1 3.008 C A 0034 SER OG
AROMATIC 0.00 8.00 1
H A 0039 LYS 3.616 H A 0040 HIS