Complet list of 3bbg con file
Complete list of 3bbg.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 177
C A 0001 ASP C 2.434 C A 0002 ASP CA
C A 0001 ASP C 3.217 C A 0002 ASP C
C A 0001 ASP C 3.628 C A 0002 ASP CB
C A 0002 ASP C 2.436 C A 0003 GLY CA
C A 0002 ASP C 3.714 C A 0003 GLY C
C A 0002 ASP C 3.423 C A 0040 THR CG2
C A 0002 ASP CB 3.773 C A 0040 THR CG2
C A 0003 GLY C 2.443 C A 0004 LEU CA
C A 0003 GLY C 3.580 C A 0004 LEU C
C A 0003 GLY C 3.359 C A 0004 LEU CB
C A 0003 GLY C 3.238 C A 0004 LEU CG
C A 0003 GLY C 3.701 C A 0004 LEU CD2
C A 0004 LEU C 2.448 C A 0005 CYS CA
C A 0004 LEU C 3.664 C A 0005 CYS C
C A 0004 LEU C 3.194 C A 0005 CYS CB
C A 0005 CYS C 2.426 C A 0006 TYR CA
C A 0005 CYS C 3.594 C A 0006 TYR C
C A 0005 CYS C 3.221 C A 0006 TYR CB
C A 0006 TYR C 2.421 C A 0007 GLU CA
C A 0006 TYR C 3.483 C A 0007 GLU C
C A 0006 TYR C 3.403 C A 0007 GLU CB
C A 0007 GLU C 2.427 C A 0008 GLY CA
C A 0007 GLU C 3.694 C A 0008 GLY C
C A 0007 GLU CA 3.616 C A 0013 LYS CE
C A 0007 GLU C 3.400 C A 0013 LYS CE
C A 0007 GLU CB 3.439 E A 0017 TYR CD1
C A 0008 GLY C 2.440 C A 0009 THR CA
C A 0008 GLY C 3.733 C A 0009 THR C
C A 0008 GLY C 3.054 C A 0009 THR CB
C A 0008 GLY CA 3.573 C A 0013 LYS CE
C A 0008 GLY C 3.426 C A 0013 LYS CE
C A 0009 THR C 2.447 C A 0010 ASN CA
C A 0009 THR C 3.179 C A 0010 ASN C
C A 0009 THR C 3.643 C A 0010 ASN CB
C A 0010 ASN C 2.420 C A 0011 CYS CA
C A 0010 ASN C 3.541 C A 0011 CYS C
C A 0010 ASN C 3.313 C A 0011 CYS CB
C A 0011 CYS CA 3.770 C A 0012 GLY CA
C A 0011 CYS C 2.396 C A 0012 GLY CA
C A 0011 CYS C 3.060 C A 0012 GLY C
C A 0012 GLY C 2.440 C A 0013 LYS CA
C A 0012 GLY C 3.276 C A 0013 LYS C
C A 0012 GLY C 3.555 C A 0013 LYS CB
C A 0013 LYS CA 3.794 C A 0014 VAL CA
C A 0013 LYS C 2.408 C A 0014 VAL CA
C A 0013 LYS C 2.970 C A 0014 VAL C
C A 0013 LYS C 3.631 C A 0014 VAL CB
C A 0013 LYS CD 3.496 E A 0017 TYR C
C A 0013 LYS CD 3.722 E A 0018 CYS CA
C A 0013 LYS CD 2.914 E A 0018 CYS CB
C A 0013 LYS CE 3.775 E A 0018 CYS CB
C A 0014 VAL C 2.430 C A 0015 GLY CA
C A 0014 VAL C 3.408 C A 0015 GLY C
C A 0015 GLY C 2.450 C A 0016 LYS CA
C A 0015 GLY C 3.582 C A 0016 LYS C
C A 0015 GLY C 3.326 C A 0016 LYS CB
C A 0015 GLY C 3.167 C A 0016 LYS CG
C A 0016 LYS C 2.441 E A 0017 TYR CA
C A 0016 LYS C 3.650 E A 0017 TYR C
C A 0016 LYS C 3.263 E A 0017 TYR CB
C A 0016 LYS C 3.002 E A 0017 TYR CG
C A 0016 LYS C 3.334 E A 0017 TYR CD1
C A 0016 LYS C 3.423 E A 0017 TYR CD2
C A 0016 LYS CB 3.773 E A 0029 TYR C
C A 0016 LYS CD 3.767 E A 0029 TYR C
C A 0016 LYS CD 3.228 C A 0030 ASP CA
C A 0016 LYS CD 3.285 C A 0030 ASP CB
E A 0017 TYR C 2.445 E A 0018 CYS CA
E A 0017 TYR C 3.649 E A 0018 CYS C
E A 0017 TYR C 3.299 E A 0018 CYS CB
E A 0017 TYR CD2 3.788 H A 0032 LYS CA
E A 0017 TYR CD2 3.557 H A 0032 LYS CB
E A 0018 CYS CA 3.790 E A 0019 CYS CA
E A 0018 CYS C 2.429 E A 0019 CYS CA
E A 0018 CYS C 3.570 E A 0019 CYS C
E A 0018 CYS C 3.232 E A 0019 CYS CB
E A 0019 CYS C 2.421 C A 0020 SER CA
E A 0019 CYS C 3.709 C A 0020 SER C
E A 0019 CYS C 3.000 C A 0020 SER CB
E A 0019 CYS CB 3.523 C A 0039 CYS CB
C A 0020 SER CA 2.918 C A 0021 PRO CD
C A 0020 SER C 2.422 C A 0021 PRO CA
C A 0020 SER C 3.050 C A 0021 PRO C
C A 0020 SER C 3.615 C A 0021 PRO CB
C A 0020 SER C 3.635 C A 0021 PRO CG
C A 0020 SER C 2.506 C A 0021 PRO CD
C A 0021 PRO C 2.447 C A 0022 ILE CA
C A 0021 PRO C 3.642 C A 0022 ILE C
C A 0021 PRO C 3.226 C A 0022 ILE CB
C A 0021 PRO C 3.748 C A 0022 ILE CG2
C A 0021 PRO CG 3.693 C A 0025 TYR CD2
C A 0021 PRO CD 3.487 C A 0025 TYR CD2
C A 0022 ILE C 2.445 C A 0023 GLY CA
C A 0022 ILE C 3.719 C A 0023 GLY C
C A 0023 GLY C 2.443 C A 0024 LYS CA
C A 0023 GLY C 2.918 C A 0024 LYS C
C A 0023 GLY C 3.670 C A 0024 LYS CB
C A 0024 LYS C 2.431 C A 0025 TYR CA
C A 0024 LYS C 3.325 C A 0025 TYR C
C A 0024 LYS C 3.546 C A 0025 TYR CB
C A 0024 LYS C 3.754 C A 0025 TYR CG
C A 0024 LYS CG 3.027 C A 0025 TYR CD2
C A 0024 LYS CG 3.181 C A 0025 TYR CE2
C A 0024 LYS CD 3.763 C A 0025 TYR CD2
C A 0024 LYS CD 3.358 C A 0025 TYR CE2
C A 0024 LYS CE 3.493 C A 0025 TYR CE2
C A 0025 TYR C 2.485 C A 0026 CYS CA
C A 0025 TYR C 2.908 C A 0026 CYS C
C A 0025 TYR C 3.109 C A 0026 CYS CB
C A 0025 TYR CA 3.776 E A 0027 VAL CG2
C A 0025 TYR C 3.261 E A 0027 VAL CG2
C A 0025 TYR CD1 3.735 C A 0040 THR CA
C A 0025 TYR CE1 3.591 C A 0040 THR CA
C A 0026 CYS C 2.424 E A 0027 VAL CA
C A 0026 CYS C 3.451 E A 0027 VAL C
C A 0026 CYS C 3.434 E A 0027 VAL CB
C A 0026 CYS C 3.354 E A 0027 VAL CG2
E A 0027 VAL C 2.427 E A 0028 CYS CA
E A 0027 VAL C 3.472 E A 0028 CYS C
E A 0027 VAL C 3.440 E A 0028 CYS CB
E A 0027 VAL CG1 3.012 E A 0029 TYR CE1
E A 0027 VAL CG1 3.215 E A 0029 TYR CZ
E A 0028 CYS CA 3.793 E A 0029 TYR CA
E A 0028 CYS CA 3.676 E A 0029 TYR CD1
E A 0028 CYS C 2.419 E A 0029 TYR CA
E A 0028 CYS C 3.632 E A 0029 TYR C
E A 0028 CYS C 3.163 E A 0029 TYR CB
E A 0028 CYS C 3.048 E A 0029 TYR CG
E A 0028 CYS C 2.930 E A 0029 TYR CD1
E A 0028 CYS C 3.800 E A 0029 TYR CE1
E A 0029 TYR C 2.416 C A 0030 ASP CA
E A 0029 TYR C 3.153 C A 0030 ASP C
E A 0029 TYR C 3.604 C A 0030 ASP CB
E A 0029 TYR CB 3.363 H A 0034 ILE CG2
E A 0029 TYR CG 2.986 H A 0034 ILE CG2
E A 0029 TYR CD1 3.464 H A 0034 ILE CG2
E A 0029 TYR CD2 3.000 H A 0034 ILE CG2
E A 0029 TYR CE2 3.504 H A 0034 ILE CG2
C A 0030 ASP C 2.429 C A 0031 SER CA
C A 0030 ASP C 3.119 C A 0031 SER C
C A 0030 ASP C 3.625 C A 0031 SER CB
C A 0031 SER C 2.466 H A 0032 LYS CA
C A 0031 SER C 2.877 H A 0032 LYS C
C A 0031 SER C 3.711 H A 0032 LYS CB
C A 0031 SER CB 3.651 H A 0034 ILE CB
C A 0031 SER CB 3.357 H A 0034 ILE CG1
C A 0031 SER CB 3.456 H A 0034 ILE CD1
H A 0032 LYS C 2.434 H A 0033 ALA CA
H A 0032 LYS C 3.011 H A 0033 ALA C
H A 0032 LYS C 3.653 H A 0033 ALA CB
H A 0033 ALA C 2.439 H A 0034 ILE CA
H A 0033 ALA C 2.964 H A 0034 ILE C
H A 0033 ALA C 3.641 H A 0034 ILE CB
H A 0034 ILE CA 3.795 H A 0035 CYS CA
H A 0034 ILE C 2.414 H A 0035 CYS CA
H A 0034 ILE C 2.936 H A 0035 CYS C
H A 0034 ILE C 3.660 H A 0035 CYS CB
H A 0034 ILE CG2 3.635 C A 0038 ASN CB
H A 0035 CYS C 2.426 H A 0036 ASN CA
H A 0035 CYS C 2.958 H A 0036 ASN C
H A 0035 CYS C 3.660 H A 0036 ASN CB
H A 0035 CYS C 3.700 C A 0039 CYS CB
H A 0036 ASN C 2.464 C A 0037 LYS CA
H A 0036 ASN C 3.197 C A 0037 LYS C
H A 0036 ASN C 3.648 C A 0037 LYS CB
C A 0037 LYS C 2.463 C A 0038 ASN CA
C A 0037 LYS C 3.118 C A 0038 ASN C
C A 0037 LYS C 3.609 C A 0038 ASN CB
C A 0037 LYS CD 3.606 C A 0038 ASN CA
C A 0037 LYS CD 3.489 C A 0038 ASN CG
C A 0038 ASN CA 3.794 C A 0039 CYS CA
C A 0038 ASN C 2.410 C A 0039 CYS CA
C A 0038 ASN C 3.005 C A 0039 CYS C
C A 0038 ASN C 3.587 C A 0039 CYS CB
C A 0039 CYS C 2.419 C A 0040 THR CA
C A 0039 CYS C 3.085 C A 0040 THR C
C A 0039 CYS C 3.637 C A 0040 THR CB
CHARGE_ATTR 2.00 12.00 12
C A 0001 ASP OD1 8.307 C A 0037 LYS NZ
C A 0001 ASP OD2 6.408 C A 0037 LYS NZ
C A 0002 ASP OD1 11.14 C A 0024 LYS NZ
C A 0002 ASP OD2 9.959 C A 0024 LYS NZ
C A 0002 ASP OD1 10.39 C A 0037 LYS NZ
C A 0007 GLU OE1 8.585 C A 0013 LYS NZ
C A 0007 GLU OE2 8.813 C A 0013 LYS NZ
C A 0007 GLU OE1 6.774 H A 0032 LYS NZ
C A 0007 GLU OE2 7.958 H A 0032 LYS NZ
C A 0030 ASP OD1 6.502 C A 0016 LYS NZ
C A 0030 ASP OD2 7.605 C A 0016 LYS NZ
C A 0030 ASP OD2 11.28 H A 0032 LYS NZ
CHARGE_REPU 2.00 12.00 5
C A 0001 ASP OD1 6.314 C A 0002 ASP OD1
C A 0001 ASP OD1 8.049 C A 0002 ASP OD2
C A 0001 ASP OD2 5.995 C A 0002 ASP OD1
C A 0001 ASP OD2 8.025 C A 0002 ASP OD2
C A 0013 LYS NZ 10.53 C A 0016 LYS NZ
HB_MM 2.00 3.20 53
C A 0002 ASP N 2.204 C A 0001 ASP O
C A 0003 GLY N 3.003 C A 0001 ASP O
C A 0003 GLY N 2.205 C A 0002 ASP O
C A 0004 LEU N 2.207 C A 0003 GLY O
C A 0005 CYS N 2.208 C A 0004 LEU O
C A 0006 TYR N 2.204 C A 0005 CYS O
C A 0007 GLU N 2.206 C A 0006 TYR O
C A 0008 GLY N 2.206 C A 0007 GLU O
C A 0009 THR N 2.212 C A 0008 GLY O
C A 0010 ASN N 2.198 C A 0009 THR O
C A 0011 CYS N 2.184 C A 0010 ASN O
C A 0012 GLY N 2.204 C A 0011 CYS O
C A 0013 LYS N 2.201 C A 0012 GLY O
C A 0014 VAL N 3.059 C A 0012 GLY O
C A 0014 VAL N 2.188 C A 0013 LYS O
C A 0015 GLY N 3.018 C A 0013 LYS O
C A 0015 GLY N 2.210 C A 0014 VAL O
C A 0016 LYS N 3.133 C A 0013 LYS O
C A 0016 LYS N 2.208 C A 0015 GLY O
E A 0017 TYR N 2.212 C A 0016 LYS O
E A 0018 CYS N 2.234 E A 0017 TYR O
E A 0019 CYS N 2.200 E A 0018 CYS O
E A 0019 CYS N 3.072 E A 0027 VAL O
C A 0020 SER N 2.209 E A 0019 CYS O
C A 0021 PRO N 2.227 C A 0020 SER O
C A 0022 ILE N 2.209 C A 0021 PRO O
C A 0023 GLY N 2.196 C A 0022 ILE O
C A 0024 LYS N 2.212 C A 0023 GLY O
C A 0025 TYR N 2.681 C A 0023 GLY O
C A 0025 TYR N 2.209 C A 0024 LYS O
C A 0026 CYS N 2.223 C A 0025 TYR O
E A 0027 VAL N 2.204 C A 0026 CYS O
E A 0028 CYS N 2.201 E A 0027 VAL O
E A 0029 TYR N 2.208 E A 0028 CYS O
C A 0030 ASP N 2.203 E A 0029 TYR O
C A 0031 SER N 2.206 C A 0030 ASP O
H A 0032 LYS N 2.215 C A 0031 SER O
H A 0033 ALA N 2.731 C A 0031 SER O
H A 0033 ALA N 2.204 H A 0032 LYS O
H A 0034 ILE N 2.577 C A 0031 SER O
H A 0034 ILE N 2.207 H A 0033 ALA O
H A 0035 CYS N 3.171 C A 0031 SER O
H A 0035 CYS N 3.173 H A 0032 LYS O
H A 0035 CYS N 3.070 H A 0033 ALA O
H A 0035 CYS N 2.191 H A 0034 ILE O
H A 0036 ASN N 2.171 H A 0035 CYS O
C A 0037 LYS N 2.828 H A 0033 ALA O
C A 0037 LYS N 2.200 H A 0036 ASN O
C A 0038 ASN N 2.802 H A 0034 ILE O
C A 0038 ASN N 2.207 C A 0037 LYS O
C A 0039 CYS N 3.140 C A 0037 LYS O
C A 0039 CYS N 2.183 C A 0038 ASN O
C A 0040 THR N 2.194 C A 0039 CYS O
HB_MS 2.00 3.20 2
C A 0008 GLY O 2.548 C A 0009 THR OG1
C A 0031 SER N 3.084 C A 0030 ASP OD2
HB_SS 2.00 3.20 3
C A 0010 ASN ND2 3.014 C A 0006 TYR OH
C A 0010 ASN ND2 2.995 C A 0020 SER OG
C A 0030 ASP OD2 3.057 C A 0031 SER OG
AROMATIC 0.00 8.00 2
C A 0024 LYS 5.771 C A 0025 TYR
C A 0013 LYS 3.782 C A 0006 TYR
SS_BOND 1.50 2.80 4
C A 0005 CYS SG 2.019 H A 0035 CYS SG
C A 0011 CYS SG 2.029 C A 0026 CYS SG
E A 0018 CYS SG 2.010 E A 0028 CYS SG
E A 0019 CYS SG 2.001 C A 0039 CYS SG