Complet list of 1iwc con file
Complete list of 1iwc.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 110
C A 0001 MET C 2.422 C A 0002 GLY CA
C A 0001 MET C 3.345 C A 0002 GLY C
C A 0002 GLY C 2.423 C A 0003 LYS CA
C A 0002 GLY C 3.331 C A 0003 LYS C
C A 0002 GLY C 3.580 C A 0003 LYS CB
C A 0003 LYS C 2.421 H A 0004 ALA CA
C A 0003 LYS C 3.656 H A 0004 ALA C
C A 0003 LYS C 3.172 H A 0004 ALA CB
H A 0004 ALA C 2.421 H A 0005 GLU CA
H A 0004 ALA C 2.973 H A 0005 GLU C
H A 0004 ALA C 3.696 H A 0005 GLU CB
H A 0004 ALA CA 3.662 H A 0007 TYR CB
H A 0004 ALA C 3.716 H A 0007 TYR CB
H A 0004 ALA CB 3.267 H A 0007 TYR CB
H A 0005 GLU C 2.422 H A 0006 ASN CA
H A 0005 GLU C 3.096 H A 0006 ASN C
H A 0005 GLU C 3.678 H A 0006 ASN CB
H A 0006 ASN C 2.423 H A 0007 TYR CA
H A 0006 ASN C 3.073 H A 0007 TYR C
H A 0006 ASN C 3.684 H A 0007 TYR CB
H A 0007 TYR C 2.422 H A 0008 GLU CA
H A 0007 TYR C 2.971 H A 0008 GLU C
H A 0007 TYR C 3.696 H A 0008 GLU CB
H A 0007 TYR CD2 3.643 H A 0008 GLU CA
H A 0008 GLU C 2.423 H A 0009 LEU CA
H A 0008 GLU C 2.914 H A 0009 LEU C
H A 0008 GLU C 3.693 H A 0009 LEU CB
H A 0009 LEU C 2.422 H A 0010 TYR CA
H A 0009 LEU C 3.076 H A 0010 TYR C
H A 0009 LEU C 3.683 H A 0010 TYR CB
H A 0009 LEU CA 3.450 H A 0012 VAL CG1
H A 0009 LEU C 3.355 H A 0012 VAL CG1
H A 0010 TYR C 2.422 H A 0011 GLN CA
H A 0010 TYR C 3.012 H A 0011 GLN C
H A 0010 TYR C 3.694 H A 0011 GLN CB
H A 0010 TYR CD2 3.470 H A 0014 LEU CD2
H A 0010 TYR CE2 3.111 H A 0014 LEU CD2
H A 0010 TYR CZ 3.587 H A 0014 LEU CD2
H A 0011 GLN C 2.423 H A 0012 VAL CA
H A 0011 GLN C 2.982 H A 0012 VAL C
H A 0011 GLN C 3.693 H A 0012 VAL CB
H A 0012 VAL C 2.424 H A 0013 GLU CA
H A 0012 VAL C 3.142 H A 0013 GLU C
H A 0012 VAL C 3.667 H A 0013 GLU CB
H A 0013 GLU C 2.424 H A 0014 LEU CA
H A 0013 GLU C 3.150 H A 0014 LEU C
H A 0013 GLU C 3.667 H A 0014 LEU CB
H A 0014 LEU C 2.423 H A 0015 GLY CA
H A 0014 LEU C 3.223 H A 0015 GLY C
H A 0015 GLY CA 2.782 C A 0016 PRO CD
H A 0015 GLY C 2.442 C A 0016 PRO CA
H A 0015 GLY C 3.160 C A 0016 PRO C
H A 0015 GLY C 3.608 C A 0016 PRO CB
H A 0015 GLY C 3.648 C A 0016 PRO CG
H A 0015 GLY C 2.452 C A 0016 PRO CD
C A 0016 PRO C 2.420 C A 0017 GLY CA
C A 0016 PRO C 3.068 C A 0017 GLY C
C A 0017 GLY CA 2.792 C A 0018 PRO CD
C A 0017 GLY C 2.441 C A 0018 PRO CA
C A 0017 GLY C 3.161 C A 0018 PRO C
C A 0017 GLY C 3.606 C A 0018 PRO CB
C A 0017 GLY C 3.649 C A 0018 PRO CG
C A 0017 GLY C 2.454 C A 0018 PRO CD
C A 0018 PRO C 2.422 C A 0019 SER CA
C A 0018 PRO C 3.270 C A 0019 SER C
C A 0018 PRO C 3.611 C A 0019 SER CB
C A 0019 SER C 2.423 C A 0020 GLY CA
C A 0019 SER C 3.411 C A 0020 GLY C
C A 0020 GLY C 2.422 C A 0021 ASP CA
C A 0020 GLY C 3.645 C A 0021 ASP C
C A 0020 GLY C 3.202 C A 0021 ASP CB
C A 0021 ASP C 2.421 C A 0022 MET CA
C A 0021 ASP C 3.695 C A 0022 MET C
C A 0021 ASP C 2.913 C A 0022 MET CB
C A 0022 MET C 2.422 H A 0023 ALA CA
C A 0022 MET C 3.420 H A 0023 ALA C
C A 0022 MET C 3.511 H A 0023 ALA CB
H A 0023 ALA C 2.422 H A 0024 ALA CA
H A 0023 ALA C 3.110 H A 0024 ALA C
H A 0023 ALA C 3.675 H A 0024 ALA CB
H A 0024 ALA C 2.423 H A 0025 LYS CA
H A 0024 ALA C 3.016 H A 0025 LYS C
H A 0024 ALA C 3.693 H A 0025 LYS CB
H A 0025 LYS C 2.423 H A 0026 MET CA
H A 0025 LYS C 3.211 H A 0026 MET C
H A 0025 LYS C 3.642 H A 0026 MET CB
H A 0025 LYS C 3.799 H A 0026 MET CG
H A 0026 MET C 2.421 H A 0027 SER CA
H A 0026 MET C 3.080 H A 0027 SER C
H A 0026 MET C 3.682 H A 0027 SER CB
H A 0026 MET C 3.717 H A 0030 LYS CG
H A 0027 SER C 2.421 H A 0028 LYS CA
H A 0027 SER C 3.165 H A 0028 LYS C
H A 0027 SER C 3.659 H A 0028 LYS CB
H A 0028 LYS C 2.421 H A 0029 LYS CA
H A 0028 LYS C 2.986 H A 0029 LYS C
H A 0028 LYS C 3.694 H A 0029 LYS CB
H A 0029 LYS C 2.423 H A 0030 LYS CA
H A 0029 LYS C 3.523 H A 0030 LYS C
H A 0029 LYS C 3.407 H A 0030 LYS CB
H A 0030 LYS C 2.422 C A 0031 ALA CA
H A 0030 LYS C 3.329 C A 0031 ALA C
H A 0030 LYS C 3.578 C A 0031 ALA CB
C A 0031 ALA C 2.422 C A 0032 GLY CA
C A 0031 ALA C 2.845 C A 0032 GLY C
C A 0032 GLY C 2.423 C A 0033 ARG CA
C A 0032 GLY C 3.019 C A 0033 ARG C
C A 0032 GLY C 3.692 C A 0033 ARG CB
C A 0033 ARG C 2.423 C A 0034 GLY CA
C A 0033 ARG C 3.442 C A 0034 GLY C
CHARGE_ATTR 2.00 12.00 6
H A 0005 GLU OE1 9.963 C A 0003 LYS NZ
H A 0005 GLU OE2 11.34 C A 0003 LYS NZ
C A 0021 ASP OD1 7.388 H A 0025 LYS NZ
C A 0021 ASP OD2 9.248 H A 0025 LYS NZ
C A 0021 ASP OD1 11.16 H A 0029 LYS NZ
C A 0021 ASP OD2 11.45 H A 0029 LYS NZ
CHARGE_REPU 2.00 12.00 8
H A 0005 GLU OE1 11.15 H A 0008 GLU OE1
H A 0005 GLU OE1 9.900 H A 0008 GLU OE2
H A 0005 GLU OE2 11.33 H A 0008 GLU OE1
H A 0005 GLU OE2 10.23 H A 0008 GLU OE2
H A 0008 GLU OE1 11.87 H A 0013 GLU OE1
H A 0025 LYS NZ 5.685 H A 0028 LYS NZ
H A 0025 LYS NZ 8.988 H A 0029 LYS NZ
H A 0029 LYS NZ 6.441 H A 0030 LYS NZ
HB_MM 2.00 3.20 49
C A 0002 GLY N 2.196 C A 0001 MET O
C A 0003 LYS N 2.198 C A 0002 GLY O
H A 0004 ALA N 2.197 C A 0003 LYS O
H A 0005 GLU N 2.196 H A 0004 ALA O
H A 0006 ASN N 2.197 H A 0005 GLU O
H A 0007 TYR N 3.052 H A 0004 ALA O
H A 0007 TYR N 2.199 H A 0006 ASN O
H A 0008 GLU N 3.120 H A 0004 ALA O
H A 0008 GLU N 2.196 H A 0007 TYR O
H A 0009 LEU N 2.195 H A 0008 GLU O
H A 0010 TYR N 3.197 H A 0006 ASN O
H A 0010 TYR N 3.001 H A 0007 TYR O
H A 0010 TYR N 2.898 H A 0008 GLU O
H A 0010 TYR N 2.197 H A 0009 LEU O
H A 0011 GLN N 2.862 H A 0008 GLU O
H A 0011 GLN N 2.198 H A 0010 TYR O
H A 0012 VAL N 3.070 H A 0008 GLU O
H A 0012 VAL N 2.196 H A 0011 GLN O
H A 0013 GLU N 3.147 H A 0010 TYR O
H A 0013 GLU N 3.061 H A 0011 GLN O
H A 0013 GLU N 2.196 H A 0012 VAL O
H A 0014 LEU N 3.096 H A 0010 TYR O
H A 0014 LEU N 2.961 H A 0011 GLN O
H A 0014 LEU N 2.196 H A 0013 GLU O
H A 0015 GLY N 2.196 H A 0014 LEU O
C A 0016 PRO N 2.227 H A 0015 GLY O
C A 0017 GLY N 2.198 C A 0016 PRO O
C A 0018 PRO N 2.226 C A 0017 GLY O
C A 0019 SER N 2.196 C A 0018 PRO O
C A 0020 GLY N 2.196 C A 0019 SER O
C A 0021 ASP N 2.196 C A 0020 GLY O
C A 0022 MET N 2.195 C A 0021 ASP O
H A 0023 ALA N 2.196 C A 0022 MET O
H A 0024 ALA N 2.197 H A 0023 ALA O
H A 0025 LYS N 2.197 H A 0024 ALA O
H A 0026 MET N 2.198 H A 0025 LYS O
H A 0027 SER N 2.974 H A 0023 ALA O
H A 0027 SER N 3.133 H A 0024 ALA O
H A 0027 SER N 2.196 H A 0026 MET O
H A 0028 LYS N 2.195 H A 0027 SER O
H A 0029 LYS N 2.198 H A 0028 LYS O
H A 0030 LYS N 3.164 H A 0026 MET O
H A 0030 LYS N 2.198 H A 0029 LYS O
C A 0031 ALA N 2.196 H A 0030 LYS O
C A 0032 GLY N 2.195 C A 0031 ALA O
C A 0033 ARG N 2.776 C A 0031 ALA O
C A 0033 ARG N 2.196 C A 0032 GLY O
C A 0034 GLY N 2.802 C A 0032 GLY O
C A 0034 GLY N 2.198 C A 0033 ARG O