Complet list of 2cti con file
Complete list of 2cti.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 102
C A 0001 ARG C 2.429 C A 0002 VAL CA
C A 0001 ARG C 3.125 C A 0002 VAL C
C A 0001 ARG C 3.674 C A 0002 VAL CB
C A 0002 VAL CA 3.780 C A 0003 CYS CA
C A 0002 VAL C 2.431 C A 0003 CYS CA
C A 0002 VAL C 3.652 C A 0003 CYS C
C A 0002 VAL C 3.208 C A 0003 CYS CB
C A 0003 CYS CA 2.891 C A 0004 PRO CD
C A 0003 CYS C 2.452 C A 0004 PRO CA
C A 0003 CYS C 2.956 C A 0004 PRO C
C A 0003 CYS C 3.677 C A 0004 PRO CB
C A 0003 CYS C 3.690 C A 0004 PRO CG
C A 0003 CYS C 2.495 C A 0004 PRO CD
C A 0004 PRO C 2.441 C A 0005 ARG CA
C A 0004 PRO C 3.171 C A 0005 ARG C
C A 0004 PRO C 3.677 C A 0005 ARG CB
C A 0005 ARG C 2.471 C A 0006 ILE CA
C A 0005 ARG C 3.581 C A 0006 ILE C
C A 0005 ARG C 3.420 C A 0006 ILE CB
C A 0005 ARG C 3.270 C A 0006 ILE CG1
C A 0006 ILE C 2.465 C A 0007 LEU CA
C A 0006 ILE C 3.435 C A 0007 LEU C
C A 0006 ILE C 3.572 C A 0007 LEU CB
C A 0006 ILE C 3.195 C A 0007 LEU CD2
C A 0007 LEU C 2.473 C A 0008 MET CA
C A 0007 LEU C 3.464 C A 0008 MET C
C A 0007 LEU C 3.561 C A 0008 MET CB
C A 0008 MET C 2.430 C A 0009 GLU CA
C A 0008 MET C 3.074 C A 0009 GLU C
C A 0008 MET C 3.699 C A 0009 GLU CB
C A 0008 MET C 3.276 C A 0027 TYR CD2
C A 0009 GLU C 2.447 C A 0010 CYS CA
C A 0009 GLU C 3.696 C A 0010 CYS C
C A 0009 GLU C 3.171 C A 0010 CYS CB
C A 0009 GLU CA 3.798 C A 0027 TYR CD2
C A 0009 GLU CG 3.456 C A 0027 TYR CE2
C A 0009 GLU CG 3.480 C A 0027 TYR CZ
C A 0010 CYS C 2.461 C A 0011 LYS CA
C A 0010 CYS C 3.307 C A 0011 LYS C
C A 0010 CYS C 3.646 C A 0011 LYS CB
C A 0011 LYS C 2.447 H A 0012 LYS CA
C A 0011 LYS C 3.635 H A 0012 LYS C
C A 0011 LYS C 3.262 H A 0012 LYS CB
C A 0011 LYS C 3.710 H A 0012 LYS CG
H A 0012 LYS CA 3.792 H A 0013 ASP CA
H A 0012 LYS C 2.415 H A 0013 ASP CA
H A 0012 LYS C 2.974 H A 0013 ASP C
H A 0012 LYS C 3.679 H A 0013 ASP CB
H A 0012 LYS C 3.718 C A 0022 CYS CB
H A 0013 ASP C 2.423 H A 0014 SER CA
H A 0013 ASP C 3.042 H A 0014 SER C
H A 0013 ASP C 3.706 H A 0014 SER CB
H A 0014 SER C 2.414 H A 0015 ASP CA
H A 0014 SER C 2.960 H A 0015 ASP C
H A 0014 SER C 3.682 H A 0015 ASP CB
H A 0015 ASP C 2.438 H A 0016 CYS CA
H A 0015 ASP C 3.177 H A 0016 CYS C
H A 0015 ASP C 3.668 H A 0016 CYS CB
H A 0016 CYS C 2.443 C A 0017 LEU CA
H A 0016 CYS C 3.161 C A 0017 LEU C
H A 0016 CYS C 3.708 C A 0017 LEU CB
H A 0016 CYS CB 3.799 C A 0028 CYS CB
C A 0017 LEU C 2.425 C A 0018 ALA CA
C A 0017 LEU C 2.950 C A 0018 ALA C
C A 0017 LEU C 3.029 C A 0018 ALA CB
C A 0018 ALA C 2.449 C A 0019 GLU CA
C A 0018 ALA C 3.203 C A 0019 GLU C
C A 0018 ALA C 3.655 C A 0019 GLU CB
C A 0019 GLU C 2.428 C A 0020 CYS CA
C A 0019 GLU C 3.052 C A 0020 CYS C
C A 0019 GLU C 3.711 C A 0020 CYS CB
C A 0020 CYS C 2.466 C A 0021 VAL CA
C A 0020 CYS C 3.619 C A 0021 VAL C
C A 0020 CYS C 3.347 C A 0021 VAL CB
C A 0020 CYS C 3.213 C A 0021 VAL CG1
C A 0021 VAL C 2.452 C A 0022 CYS CA
C A 0021 VAL C 3.225 C A 0022 CYS C
C A 0021 VAL C 3.686 C A 0022 CYS CB
C A 0022 CYS C 2.454 C A 0023 LEU CA
C A 0022 CYS C 3.189 C A 0023 LEU C
C A 0022 CYS C 3.691 C A 0023 LEU CB
C A 0023 LEU C 2.453 C A 0024 GLU CA
C A 0023 LEU C 3.033 C A 0024 GLU C
C A 0023 LEU C 3.723 C A 0024 GLU CB
C A 0023 LEU CD1 3.524 C A 0029 GLY CA
C A 0024 GLU C 2.422 C A 0025 HIS CA
C A 0024 GLU C 3.065 C A 0025 HIS C
C A 0024 GLU C 3.686 C A 0025 HIS CB
C A 0025 HIS CA 3.799 C A 0026 GLY CA
C A 0025 HIS C 2.438 C A 0026 GLY CA
C A 0025 HIS C 3.228 C A 0026 GLY C
C A 0025 HIS C 3.715 C A 0027 TYR CD1
C A 0026 GLY C 2.481 C A 0027 TYR CA
C A 0026 GLY C 3.503 C A 0027 TYR C
C A 0026 GLY C 3.559 C A 0027 TYR CB
C A 0026 GLY C 3.720 C A 0027 TYR CG
C A 0026 GLY C 3.367 C A 0027 TYR CD1
C A 0027 TYR C 2.438 C A 0028 CYS CA
C A 0027 TYR C 3.118 C A 0028 CYS C
C A 0027 TYR C 3.676 C A 0028 CYS CB
C A 0028 CYS C 2.431 C A 0029 GLY CA
C A 0028 CYS C 3.091 C A 0029 GLY C
CHARGE_ATTR 2.00 12.00 16
C A 0009 GLU OE1 10.16 C A 0011 LYS NZ
C A 0009 GLU OE2 10.04 C A 0011 LYS NZ
C A 0009 GLU OE2 11.86 C A 0025 HIS ND1
H A 0013 ASP OD1 9.449 H A 0012 LYS NZ
H A 0013 ASP OD2 8.160 H A 0012 LYS NZ
H A 0015 ASP OD1 4.378 C A 0011 LYS NZ
H A 0015 ASP OD2 6.199 C A 0011 LYS NZ
H A 0015 ASP OD1 7.834 H A 0012 LYS NZ
H A 0015 ASP OD2 9.173 H A 0012 LYS NZ
C A 0019 GLU OE1 11.92 C A 0001 ARG NH1
C A 0019 GLU OE1 10.97 C A 0001 ARG NH2
C A 0019 GLU OE2 10.97 C A 0001 ARG NH2
C A 0024 GLU OE1 7.526 C A 0025 HIS ND1
C A 0024 GLU OE1 7.729 C A 0025 HIS NE2
C A 0024 GLU OE2 7.582 C A 0025 HIS ND1
C A 0024 GLU OE2 8.368 C A 0025 HIS NE2
CHARGE_REPU 2.00 12.00 17
C A 0009 GLU OE1 9.960 H A 0015 ASP OD1
C A 0009 GLU OE1 9.065 H A 0015 ASP OD2
C A 0009 GLU OE2 10.16 H A 0015 ASP OD1
C A 0009 GLU OE2 9.380 H A 0015 ASP OD2
C A 0011 LYS NZ 8.710 H A 0012 LYS NZ
H A 0013 ASP OD1 10.38 H A 0015 ASP OD1
H A 0013 ASP OD1 9.587 H A 0015 ASP OD2
H A 0013 ASP OD2 10.66 H A 0015 ASP OD1
H A 0013 ASP OD2 10.31 H A 0015 ASP OD2
H A 0013 ASP OD1 9.996 C A 0019 GLU OE1
H A 0013 ASP OD1 8.165 C A 0019 GLU OE2
H A 0013 ASP OD2 10.82 C A 0019 GLU OE1
H A 0013 ASP OD2 9.217 C A 0019 GLU OE2
H A 0013 ASP OD1 9.576 C A 0024 GLU OE1
H A 0013 ASP OD1 10.47 C A 0024 GLU OE2
H A 0013 ASP OD2 10.06 C A 0024 GLU OE1
H A 0013 ASP OD2 10.75 C A 0024 GLU OE2
HB_MM 2.00 3.20 42
C A 0002 VAL N 2.218 C A 0001 ARG O
C A 0003 CYS N 2.971 C A 0001 ARG O
C A 0003 CYS N 2.203 C A 0002 VAL O
C A 0004 PRO N 2.229 C A 0003 CYS O
C A 0005 ARG N 2.221 C A 0004 PRO O
C A 0006 ILE N 3.038 C A 0004 PRO O
C A 0006 ILE N 2.227 C A 0005 ARG O
C A 0007 LEU N 2.225 C A 0006 ILE O
C A 0008 MET N 2.225 C A 0007 LEU O
C A 0009 GLU N 2.216 C A 0008 MET O
C A 0010 CYS N 2.220 C A 0009 GLU O
C A 0010 CYS N 2.696 C A 0026 GLY O
C A 0011 LYS N 2.226 C A 0010 CYS O
H A 0012 LYS N 2.224 C A 0011 LYS O
H A 0013 ASP N 2.214 H A 0012 LYS O
H A 0014 SER N 3.124 H A 0012 LYS O
H A 0014 SER N 2.211 H A 0013 ASP O
H A 0015 ASP N 2.904 H A 0012 LYS O
H A 0015 ASP N 3.147 H A 0013 ASP O
H A 0015 ASP N 2.214 H A 0014 SER O
H A 0016 CYS N 3.062 H A 0014 SER O
H A 0016 CYS N 2.220 H A 0015 ASP O
C A 0017 LEU N 2.221 H A 0016 CYS O
C A 0018 ALA N 2.221 C A 0017 LEU O
C A 0019 GLU N 3.063 C A 0002 VAL O
C A 0019 GLU N 2.223 C A 0018 ALA O
C A 0020 CYS N 3.123 C A 0018 ALA O
C A 0020 CYS N 2.212 C A 0019 GLU O
C A 0021 VAL N 2.229 C A 0020 CYS O
C A 0022 CYS N 2.220 C A 0021 VAL O
C A 0023 LEU N 2.226 C A 0022 CYS O
C A 0023 LEU N 2.764 C A 0027 TYR O
C A 0024 GLU N 2.226 C A 0023 LEU O
C A 0025 HIS N 2.992 C A 0023 LEU O
C A 0025 HIS N 2.201 C A 0024 GLU O
C A 0026 GLY N 2.814 C A 0023 LEU O
C A 0026 GLY N 2.970 C A 0024 GLU O
C A 0026 GLY N 2.216 C A 0025 HIS O
C A 0027 TYR N 2.232 C A 0026 GLY O
C A 0028 CYS N 2.220 C A 0027 TYR O
C A 0029 GLY N 3.043 C A 0021 VAL O
C A 0029 GLY N 2.221 C A 0028 CYS O
HB_MS 2.00 3.20 2
H A 0015 ASP N 2.942 H A 0014 SER OG
C A 0022 CYS N 2.719 H A 0013 ASP OD1
SS_BOND 1.50 2.80 3
C A 0003 CYS SG 2.019 C A 0020 CYS SG
C A 0010 CYS SG 2.023 C A 0022 CYS SG
H A 0016 CYS SG 2.014 C A 0028 CYS SG