Complet list of 1ioh con file
Complete list of 1ioh.con file
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 86
C A 0001 GLY C 2.421 H A 0002 ILE CA
C A 0001 GLY C 3.466 H A 0002 ILE C
C A 0001 GLY C 3.468 H A 0002 ILE CB
C A 0001 GLY C 3.363 H A 0002 ILE CG1
H A 0002 ILE C 2.423 H A 0003 VAL CA
H A 0002 ILE C 3.178 H A 0003 VAL C
H A 0002 ILE C 3.654 H A 0003 VAL CB
H A 0002 ILE CG2 3.465 H A 0016 LEU CD2
H A 0002 ILE CG1 3.509 H A 0019 TYR CD2
H A 0002 ILE CG1 3.335 H A 0019 TYR CE2
H A 0002 ILE CG2 3.748 H A 0019 TYR CE2
H A 0002 ILE CD1 3.340 H A 0019 TYR CD2
H A 0002 ILE CD1 3.771 H A 0019 TYR CE2
H A 0003 VAL C 2.420 H A 0004 GLU CA
H A 0003 VAL C 3.263 H A 0004 GLU C
H A 0003 VAL C 3.615 H A 0004 GLU CB
H A 0003 VAL C 3.672 H A 0004 GLU CG
H A 0003 VAL CG1 3.537 H A 0007 CYS CB
H A 0004 GLU C 2.420 H A 0005 GLN CA
H A 0004 GLU C 3.457 H A 0005 GLN C
H A 0004 GLU C 3.471 H A 0005 GLN CB
H A 0004 GLU C 3.289 H A 0005 GLN CD
H A 0004 GLU CA 3.579 C A 0008 HIS CG
H A 0004 GLU C 3.674 C A 0008 HIS CB
H A 0005 GLN C 2.420 H A 0006 CYS CA
H A 0005 GLN C 3.343 H A 0006 CYS C
H A 0005 GLN C 3.554 H A 0006 CYS CB
H A 0006 CYS C 2.421 H A 0007 CYS CA
H A 0006 CYS C 3.243 H A 0007 CYS C
H A 0006 CYS C 3.625 H A 0007 CYS CB
H A 0006 CYS CA 3.684 C A 0011 CYS CB
H A 0006 CYS CB 3.624 C A 0011 CYS CB
H A 0007 CYS C 2.419 C A 0008 HIS CA
H A 0007 CYS C 3.051 C A 0008 HIS C
H A 0007 CYS C 3.685 C A 0008 HIS CB
H A 0007 CYS C 3.775 C A 0008 HIS CD2
C A 0008 HIS C 2.423 C A 0009 SER CA
C A 0008 HIS C 3.618 C A 0009 SER C
C A 0008 HIS C 3.252 C A 0009 SER CB
C A 0009 SER C 2.415 C A 0010 ILE CA
C A 0009 SER C 3.333 C A 0010 ILE C
C A 0009 SER C 3.576 C A 0010 ILE CB
C A 0009 SER C 3.710 C A 0010 ILE CG1
C A 0009 SER C 3.060 C A 0010 ILE CD1
C A 0010 ILE C 2.426 C A 0011 CYS CA
C A 0010 ILE C 3.418 C A 0011 CYS C
C A 0010 ILE C 3.522 C A 0011 CYS CB
C A 0011 CYS C 2.417 H A 0012 SER CA
C A 0011 CYS C 3.147 H A 0012 SER C
C A 0011 CYS C 3.655 H A 0012 SER CB
H A 0012 SER C 2.424 H A 0013 LEU CA
H A 0012 SER C 3.685 H A 0013 LEU C
H A 0012 SER C 2.967 H A 0013 LEU CB
H A 0012 SER C 3.542 H A 0013 LEU CG
H A 0013 LEU C 2.418 H A 0014 TYR CA
H A 0013 LEU C 2.907 H A 0014 TYR C
H A 0013 LEU C 3.693 H A 0014 TYR CB
H A 0014 TYR C 2.423 H A 0015 GLN CA
H A 0014 TYR C 3.041 H A 0015 GLN C
H A 0014 TYR C 3.686 H A 0015 GLN CB
H A 0015 GLN C 2.421 H A 0016 LEU CA
H A 0015 GLN C 3.183 H A 0016 LEU C
H A 0015 GLN C 3.652 H A 0016 LEU CB
H A 0015 GLN C 3.756 H A 0019 TYR CE2
H A 0016 LEU C 2.423 H A 0017 GLU CA
H A 0016 LEU C 3.137 H A 0017 GLU C
H A 0016 LEU C 3.670 H A 0017 GLU CB
H A 0016 LEU CA 3.418 H A 0019 TYR CD2
H A 0016 LEU CA 3.654 H A 0019 TYR CE2
H A 0016 LEU CD2 3.564 H A 0019 TYR CD2
H A 0016 LEU CD2 3.426 H A 0019 TYR CE2
H A 0017 GLU C 2.424 H A 0018 ASN CA
H A 0017 GLU C 3.307 H A 0018 ASN C
H A 0017 GLU C 3.608 H A 0018 ASN CB
H A 0017 GLU C 3.649 H A 0018 ASN CG
H A 0018 ASN C 2.421 H A 0019 TYR CA
H A 0018 ASN C 3.231 H A 0019 TYR C
H A 0018 ASN C 3.632 H A 0019 TYR CB
H A 0018 ASN C 3.755 H A 0019 TYR CG
H A 0018 ASN C 3.278 H A 0019 TYR CD1
H A 0019 TYR C 2.423 C A 0020 CYS CA
H A 0019 TYR C 3.187 C A 0020 CYS C
H A 0019 TYR C 3.648 C A 0020 CYS CB
C A 0020 CYS C 2.423 C A 0021 ASN CA
C A 0020 CYS C 2.972 C A 0021 ASN C
C A 0020 CYS C 3.694 C A 0021 ASN CB
CHARGE_ATTR 2.00 12.00 4
H A 0004 GLU OE1 5.816 C A 0008 HIS ND1
H A 0004 GLU OE1 6.650 C A 0008 HIS NE2
H A 0004 GLU OE2 6.033 C A 0008 HIS ND1
H A 0004 GLU OE2 6.158 C A 0008 HIS NE2
HB_MM 2.00 3.20 24
H A 0002 ILE N 2.196 C A 0001 GLY O
H A 0003 VAL N 2.196 H A 0002 ILE O
H A 0004 GLU N 2.192 H A 0003 VAL O
H A 0005 GLN N 2.195 H A 0004 GLU O
H A 0006 CYS N 2.869 H A 0002 ILE O
H A 0006 CYS N 2.197 H A 0005 GLN O
H A 0007 CYS N 2.198 H A 0006 CYS O
C A 0008 HIS N 2.198 H A 0007 CYS O
C A 0009 SER N 2.197 C A 0008 HIS O
C A 0010 ILE N 2.193 C A 0009 SER O
C A 0011 CYS N 2.198 C A 0010 ILE O
H A 0012 SER N 2.194 C A 0011 CYS O
H A 0013 LEU N 2.196 H A 0012 SER O
H A 0014 TYR N 2.197 H A 0013 LEU O
H A 0015 GLN N 2.863 H A 0013 LEU O
H A 0015 GLN N 2.199 H A 0014 TYR O
H A 0016 LEU N 2.795 H A 0013 LEU O
H A 0016 LEU N 2.197 H A 0015 GLN O
H A 0017 GLU N 3.037 H A 0013 LEU O
H A 0017 GLU N 2.197 H A 0016 LEU O
H A 0018 ASN N 2.196 H A 0017 GLU O
H A 0019 TYR N 2.196 H A 0018 ASN O
C A 0020 CYS N 2.196 H A 0019 TYR O
C A 0021 ASN N 2.197 C A 0020 CYS O
HB_MS 2.00 3.20 4
C A 0001 GLY O 2.352 H A 0019 TYR OH
H A 0005 GLN O 2.781 C A 0009 SER OG
C A 0010 ILE N 2.471 C A 0009 SER OG
H A 0015 GLN O 2.737 H A 0018 ASN ND2
SS_BOND 1.50 2.80 1
H A 0006 CYS SG 2.020 C A 0011 CYS SG
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 26
H A 0002 ILE CG2 3.218 H B 0011 LEU CD2
H A 0006 CYS CB 3.574 H B 0011 LEU CD1
C A 0009 SER CA 3.257 C B 0005 HIS CD2
C A 0009 SER C 3.133 C B 0005 HIS CD2
C A 0010 ILE CG1 3.619 C B 0003 ASN C
C A 0010 ILE CG2 3.294 C B 0003 ASN CA
C A 0010 ILE CG2 3.220 C B 0003 ASN C
C A 0010 ILE CG2 3.648 C B 0003 ASN CB
C A 0010 ILE CG1 3.796 C B 0004 GLN CA
C A 0010 ILE CG2 3.739 C B 0004 GLN CA
C A 0010 ILE CG2 3.641 C B 0004 GLN C
C A 0010 ILE CD1 3.433 C B 0004 GLN CA
C A 0010 ILE CD1 3.147 C B 0004 GLN C
C A 0010 ILE CD1 3.615 C B 0005 HIS CA
C A 0010 ILE CD1 3.365 C B 0005 HIS CG
C A 0010 ILE CD1 3.044 C B 0005 HIS CD2
C A 0010 ILE CD1 3.522 C B 0005 HIS CE1
H A 0013 LEU CD2 3.761 H B 0018 VAL CB
H A 0013 LEU CD2 3.225 H B 0018 VAL CG1
H A 0013 LEU CD2 3.037 H B 0018 VAL CG2
H A 0016 LEU CD1 3.654 H B 0011 LEU CD1
H A 0016 LEU CD2 3.685 H B 0011 LEU CD1
H A 0016 LEU CB 3.413 H B 0015 LEU CD2
C A 0020 CYS CB 3.643 H B 0019 CYS CA
C A 0020 CYS CB 3.390 H B 0019 CYS CB
C A 0021 ASN CG 3.786 C B 0022 ARG CB
CHARGE_REPU 2.00 12.00 4
C A 0008 HIS ND1 10.42 C B 0005 HIS ND1
C A 0008 HIS ND1 9.284 C B 0005 HIS NE2
C A 0008 HIS NE2 10.39 C B 0005 HIS ND1
C A 0008 HIS NE2 9.696 C B 0005 HIS NE2
HB_MM 2.00 3.20 1
H A 0006 CYS O 2.857 C B 0006 LEU N
SS_BOND 1.50 2.80 2
H A 0007 CYS SG 2.020 C B 0007 CYS SG
C A 0020 CYS SG 2.021 H B 0019 CYS SG
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 119
C B 0001 GLU C 2.427 C B 0002 VAL CA
C B 0001 GLU C 2.846 C B 0002 VAL C
C B 0001 GLU C 3.107 C B 0002 VAL CB
C B 0001 GLU C 3.594 C B 0002 VAL CG2
C B 0002 VAL C 2.418 C B 0003 ASN CA
C B 0002 VAL C 3.537 C B 0003 ASN C
C B 0002 VAL C 3.381 C B 0003 ASN CB
C B 0002 VAL C 3.706 C B 0003 ASN CG
C B 0003 ASN C 2.421 C B 0004 GLN CA
C B 0003 ASN C 3.634 C B 0004 GLN C
C B 0003 ASN C 3.230 C B 0004 GLN CB
C B 0004 GLN C 2.427 C B 0005 HIS CA
C B 0004 GLN C 2.982 C B 0005 HIS C
C B 0004 GLN C 3.688 C B 0005 HIS CB
C B 0005 HIS C 2.421 C B 0006 LEU CA
C B 0005 HIS C 3.244 C B 0006 LEU C
C B 0005 HIS C 3.630 C B 0006 LEU CB
C B 0006 LEU C 2.421 C B 0007 CYS CA
C B 0006 LEU C 3.498 C B 0007 CYS C
C B 0006 LEU C 3.440 C B 0007 CYS CB
C B 0006 LEU CA 3.563 H B 0010 GLU CG
C B 0006 LEU C 3.651 H B 0010 GLU CG
C B 0007 CYS C 2.426 C B 0008 GLY CA
C B 0007 CYS C 3.371 C B 0008 GLY C
C B 0008 GLY C 2.422 H B 0009 SER CA
C B 0008 GLY C 3.626 H B 0009 SER C
C B 0008 GLY C 3.241 H B 0009 SER CB
H B 0009 SER C 2.426 H B 0010 GLU CA
H B 0009 SER C 2.832 H B 0010 GLU C
H B 0009 SER C 3.670 H B 0010 GLU CB
H B 0010 GLU C 2.418 H B 0011 LEU CA
H B 0010 GLU C 2.998 H B 0011 LEU C
H B 0010 GLU C 3.693 H B 0011 LEU CB
H B 0011 LEU C 2.419 H B 0012 VAL CA
H B 0011 LEU C 2.964 H B 0012 VAL C
H B 0011 LEU C 3.701 H B 0012 VAL CB
H B 0011 LEU CG 3.493 H B 0015 LEU CD1
H B 0011 LEU CD2 3.606 H B 0015 LEU CD1
H B 0011 LEU CD2 3.306 C B 0026 TYR CE1
H B 0011 LEU CD2 3.321 C B 0026 TYR CE2
H B 0011 LEU CD2 2.957 C B 0026 TYR CZ
H B 0012 VAL C 2.419 H B 0013 GLU CA
H B 0012 VAL C 3.000 H B 0013 GLU C
H B 0012 VAL C 3.693 H B 0013 GLU CB
H B 0012 VAL CG2 3.663 C B 0024 PHE CE2
H B 0012 VAL CG2 3.775 C B 0024 PHE CZ
H B 0013 GLU C 2.420 H B 0014 ALA CA
H B 0013 GLU C 3.276 H B 0014 ALA C
H B 0013 GLU C 3.606 H B 0014 ALA CB
H B 0014 ALA C 2.422 H B 0015 LEU CA
H B 0014 ALA C 3.192 H B 0015 LEU C
H B 0014 ALA C 3.646 H B 0015 LEU CB
H B 0014 ALA C 3.746 H B 0018 VAL CG2
H B 0015 LEU C 2.422 H B 0016 GLU CA
H B 0015 LEU C 3.216 H B 0016 GLU C
H B 0015 LEU C 3.638 H B 0016 GLU CB
H B 0015 LEU C 3.534 C B 0024 PHE CE1
H B 0015 LEU C 3.667 C B 0024 PHE CZ
H B 0015 LEU CB 3.493 C B 0024 PHE CD2
H B 0015 LEU CB 3.205 C B 0024 PHE CE2
H B 0015 LEU CB 3.621 C B 0024 PHE CZ
H B 0015 LEU CD1 3.646 C B 0026 TYR CB
H B 0015 LEU CD1 3.421 C B 0026 TYR CG
H B 0015 LEU CD1 3.185 C B 0026 TYR CD2
H B 0016 GLU C 2.423 H B 0017 LEU CA
H B 0016 GLU C 3.311 H B 0017 LEU C
H B 0016 GLU C 3.591 H B 0017 LEU CB
H B 0016 GLU CA 3.128 C B 0024 PHE CE1
H B 0016 GLU CA 3.651 C B 0024 PHE CZ
H B 0016 GLU CB 3.251 C B 0024 PHE CE1
H B 0016 GLU CB 3.532 C B 0024 PHE CZ
H B 0017 LEU C 2.423 H B 0018 VAL CA
H B 0017 LEU C 3.267 H B 0018 VAL C
H B 0017 LEU C 3.639 H B 0018 VAL CB
H B 0017 LEU C 3.785 H B 0018 VAL CG2
H B 0018 VAL C 2.421 H B 0019 CYS CA
H B 0018 VAL C 3.205 H B 0019 CYS C
H B 0018 VAL C 3.647 H B 0019 CYS CB
H B 0019 CYS C 2.422 C B 0020 GLY CA
H B 0019 CYS C 3.520 C B 0020 GLY C
C B 0020 GLY C 2.422 C B 0021 GLU CA
C B 0020 GLY C 3.218 C B 0021 GLU C
C B 0020 GLY C 3.640 C B 0021 GLU CB
C B 0021 GLU C 2.425 C B 0022 ARG CA
C B 0021 GLU C 3.326 C B 0022 ARG C
C B 0021 GLU C 3.587 C B 0022 ARG CB
C B 0021 GLU C 3.698 C B 0022 ARG CG
C B 0022 ARG C 2.423 C B 0023 GLY CA
C B 0022 ARG C 3.433 C B 0023 GLY C
C B 0023 GLY C 2.421 C B 0024 PHE CA
C B 0023 GLY C 3.547 C B 0024 PHE C
C B 0023 GLY C 3.374 C B 0024 PHE CB
C B 0023 GLY C 3.747 C B 0024 PHE CG
C B 0023 GLY C 3.466 C B 0024 PHE CD1
C B 0024 PHE C 2.422 C B 0025 PHE CA
C B 0024 PHE C 3.245 C B 0025 PHE C
C B 0024 PHE C 3.623 C B 0025 PHE CB
C B 0024 PHE C 3.732 C B 0025 PHE CG
C B 0024 PHE C 3.686 C B 0025 PHE CD1
C B 0025 PHE C 2.420 C B 0026 TYR CA
C B 0025 PHE C 3.675 C B 0026 TYR C
C B 0025 PHE C 3.105 C B 0026 TYR CB
C B 0026 TYR C 2.419 C B 0027 GLU CA
C B 0026 TYR C 3.634 C B 0027 GLU C
C B 0026 TYR C 3.219 C B 0027 GLU CB
C B 0026 TYR C 3.568 C B 0027 GLU CG
C B 0026 TYR C 3.369 C B 0028 PRO CD
C B 0026 TYR CD1 3.740 C B 0028 PRO CD
C B 0027 GLU CA 2.800 C B 0028 PRO CD
C B 0027 GLU C 2.461 C B 0028 PRO CA
C B 0027 GLU C 3.089 C B 0028 PRO C
C B 0027 GLU C 3.665 C B 0028 PRO CB
C B 0027 GLU C 3.672 C B 0028 PRO CG
C B 0027 GLU C 2.464 C B 0028 PRO CD
C B 0027 GLU C 3.644 C B 0029 LYS CG
C B 0028 PRO C 2.413 C B 0029 LYS CA
C B 0028 PRO C 3.527 C B 0029 LYS C
C B 0028 PRO C 3.384 C B 0029 LYS CB
C B 0028 PRO C 3.649 C B 0029 LYS CG
CHARGE_ATTR 2.00 12.00 9
H B 0010 GLU OE1 10.25 C B 0005 HIS ND1
H B 0010 GLU OE2 8.098 C B 0005 HIS ND1
H B 0010 GLU OE2 10.05 C B 0005 HIS NE2
C B 0021 GLU OE1 8.215 C B 0022 ARG NH1
C B 0021 GLU OE1 7.851 C B 0022 ARG NH2
C B 0021 GLU OE2 10.15 C B 0022 ARG NH1
C B 0021 GLU OE2 9.772 C B 0022 ARG NH2
C B 0027 GLU OE1 3.845 C B 0029 LYS NZ
C B 0027 GLU OE2 5.564 C B 0029 LYS NZ
CHARGE_REPU 2.00 12.00 10
H B 0010 GLU OE1 9.846 H B 0013 GLU OE1
H B 0010 GLU OE1 10.51 H B 0013 GLU OE2
H B 0010 GLU OE2 11.19 H B 0013 GLU OE1
H B 0013 GLU OE1 6.205 H B 0016 GLU OE1
H B 0013 GLU OE1 4.185 H B 0016 GLU OE2
H B 0013 GLU OE2 4.844 H B 0016 GLU OE1
H B 0013 GLU OE2 2.774 H B 0016 GLU OE2
H B 0016 GLU OE1 11.46 C B 0021 GLU OE1
H B 0016 GLU OE1 10.24 C B 0021 GLU OE2
H B 0016 GLU OE2 10.76 C B 0021 GLU OE2
HB_MM 2.00 3.20 41
C B 0002 VAL N 2.198 C B 0001 GLU O
C B 0003 ASN N 3.066 C B 0001 GLU O
C B 0003 ASN N 2.196 C B 0002 VAL O
C B 0004 GLN N 2.196 C B 0003 ASN O
C B 0005 HIS N 2.199 C B 0004 GLN O
C B 0006 LEU N 3.117 C B 0004 GLN O
C B 0006 LEU N 2.197 C B 0005 HIS O
C B 0007 CYS N 2.195 C B 0006 LEU O
C B 0008 GLY N 2.199 C B 0007 CYS O
H B 0009 SER N 2.196 C B 0008 GLY O
H B 0010 GLU N 2.198 H B 0009 SER O
H B 0011 LEU N 2.646 H B 0009 SER O
H B 0011 LEU N 2.196 H B 0010 GLU O
H B 0012 VAL N 2.644 H B 0009 SER O
H B 0012 VAL N 2.196 H B 0011 LEU O
H B 0013 GLU N 3.034 H B 0009 SER O
H B 0013 GLU N 3.159 H B 0011 LEU O
H B 0013 GLU N 2.197 H B 0012 VAL O
H B 0014 ALA N 3.136 H B 0010 GLU O
H B 0014 ALA N 2.872 H B 0011 LEU O
H B 0014 ALA N 2.198 H B 0013 GLU O
H B 0015 LEU N 2.700 H B 0011 LEU O
H B 0015 LEU N 3.065 H B 0012 VAL O
H B 0015 LEU N 2.197 H B 0014 ALA O
H B 0016 GLU N 3.059 H B 0012 VAL O
H B 0016 GLU N 2.197 H B 0015 LEU O
H B 0017 LEU N 2.197 H B 0016 GLU O
H B 0018 VAL N 2.197 H B 0017 LEU O
H B 0019 CYS N 2.194 H B 0018 VAL O
C B 0020 GLY N 2.195 H B 0019 CYS O
C B 0021 GLU N 2.198 C B 0020 GLY O
C B 0022 ARG N 3.117 C B 0020 GLY O
C B 0022 ARG N 2.197 C B 0021 GLU O
C B 0023 GLY N 2.198 C B 0022 ARG O
C B 0024 PHE N 2.196 C B 0023 GLY O
C B 0025 PHE N 2.197 C B 0024 PHE O
C B 0026 TYR N 2.197 C B 0025 PHE O
C B 0027 GLU N 2.196 C B 0026 TYR O
C B 0028 PRO N 2.228 C B 0027 GLU O
C B 0029 LYS N 2.742 C B 0027 GLU O
C B 0029 LYS N 2.192 C B 0028 PRO O
HB_MS 2.00 3.20 2
C B 0001 GLU O 2.820 C B 0003 ASN ND2
H B 0010 GLU N 2.829 H B 0009 SER OG