Complet list of 1lir con file
Complete list of 1lir.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 163
C A 0002 PHE CA 3.796 C A 0003 THR CA
C A 0002 PHE C 2.451 C A 0003 THR CA
C A 0002 PHE C 3.530 C A 0003 THR C
C A 0002 PHE C 3.457 C A 0003 THR CB
C A 0002 PHE C 3.517 C A 0003 THR CG2
C A 0002 PHE CZ 3.646 E A 0032 LYS CE
C A 0002 PHE CD1 3.741 E A 0034 ARG CB
C A 0002 PHE CD1 3.744 E A 0034 ARG CG
C A 0003 THR CA 3.769 C A 0004 GLN CA
C A 0003 THR C 2.443 C A 0004 GLN CA
C A 0003 THR C 3.361 C A 0004 GLN C
C A 0003 THR C 3.549 C A 0004 GLN CB
C A 0003 THR CG2 3.451 C A 0020 LEU CD2
C A 0004 GLN C 2.460 C A 0005 GLU CA
C A 0004 GLN C 3.305 C A 0005 GLU C
C A 0004 GLN C 3.578 C A 0005 GLU CB
C A 0005 GLU C 2.447 C A 0006 SER CA
C A 0005 GLU C 3.512 C A 0006 SER C
C A 0005 GLU C 3.499 C A 0006 SER CB
C A 0005 GLU CD 3.755 C A 0006 SER CA
C A 0005 GLU CD 3.624 C A 0006 SER C
C A 0005 GLU CD 3.394 H A 0016 ILE CG1
C A 0005 GLU CD 3.646 H A 0016 ILE CG2
C A 0006 SER CA 3.798 C A 0007 CYS CA
C A 0006 SER C 2.456 C A 0007 CYS CA
C A 0006 SER C 3.575 C A 0007 CYS C
C A 0006 SER C 3.388 C A 0007 CYS CB
C A 0007 CYS CA 3.761 C A 0008 THR CA
C A 0007 CYS C 2.456 C A 0008 THR CA
C A 0007 CYS C 3.387 C A 0008 THR C
C A 0007 CYS C 3.508 C A 0008 THR CB
C A 0008 THR C 2.454 C A 0009 ALA CA
C A 0008 THR C 3.637 C A 0009 ALA C
C A 0008 THR C 3.324 C A 0009 ALA CB
C A 0008 THR CB 3.657 H A 0012 GLN CD
C A 0009 ALA C 2.457 H A 0010 SER CA
C A 0009 ALA C 3.017 H A 0010 SER C
C A 0009 ALA C 3.708 H A 0010 SER CB
C A 0009 ALA C 3.260 E A 0028 CYS CB
H A 0010 SER CA 3.786 H A 0011 ASN CA
H A 0010 SER C 2.452 H A 0011 ASN CA
H A 0010 SER C 2.941 H A 0011 ASN C
H A 0010 SER C 3.686 H A 0011 ASN CB
H A 0010 SER CA 3.626 E A 0028 CYS CB
H A 0011 ASN CA 3.783 H A 0012 GLN CA
H A 0011 ASN C 2.437 H A 0012 GLN CA
H A 0011 ASN C 3.175 H A 0012 GLN C
H A 0011 ASN C 3.644 H A 0012 GLN CB
H A 0011 ASN CA 3.408 H A 0014 TRP CD2
H A 0011 ASN CA 3.524 H A 0014 TRP CE2
H A 0011 ASN CA 3.448 H A 0014 TRP CE3
H A 0011 ASN CA 3.671 H A 0014 TRP CZ2
H A 0011 ASN CA 3.601 H A 0014 TRP CZ3
H A 0011 ASN CA 3.709 H A 0014 TRP CH2
H A 0011 ASN C 3.668 H A 0014 TRP CD2
H A 0011 ASN C 3.622 H A 0014 TRP CE3
H A 0011 ASN CG 3.312 H A 0014 TRP CZ3
H A 0011 ASN CG 3.739 H A 0014 TRP CH2
H A 0012 GLN C 2.446 H A 0013 CYS CA
H A 0012 GLN C 2.942 H A 0013 CYS C
H A 0012 GLN C 3.730 H A 0013 CYS CB
H A 0013 CYS C 2.439 H A 0014 TRP CA
H A 0013 CYS C 2.982 H A 0014 TRP C
H A 0013 CYS C 3.711 H A 0014 TRP CB
H A 0014 TRP C 2.454 H A 0015 SER CA
H A 0014 TRP C 2.943 H A 0015 SER C
H A 0014 TRP C 3.717 H A 0015 SER CB
H A 0014 TRP CB 3.702 C A 0024 ASN CG
H A 0014 TRP CD1 3.782 C A 0024 ASN C
H A 0014 TRP CD1 3.751 E A 0026 GLY C
H A 0015 SER CA 3.790 H A 0016 ILE CA
H A 0015 SER C 2.435 H A 0016 ILE CA
H A 0015 SER C 2.994 H A 0016 ILE C
H A 0015 SER C 3.703 H A 0016 ILE CB
H A 0016 ILE C 2.449 H A 0017 CYS CA
H A 0016 ILE C 3.103 H A 0017 CYS C
H A 0016 ILE C 3.698 H A 0017 CYS CB
H A 0016 ILE CA 3.647 C A 0019 ARG CG
H A 0016 ILE C 3.624 C A 0019 ARG CG
H A 0017 CYS C 2.435 H A 0018 LYS CA
H A 0017 CYS C 3.032 H A 0018 LYS C
H A 0017 CYS C 3.668 H A 0018 LYS CB
H A 0017 CYS CA 3.690 C A 0020 LEU CB
H A 0017 CYS CB 3.681 E A 0035 CYS CB
H A 0018 LYS C 2.435 C A 0019 ARG CA
H A 0018 LYS C 3.354 C A 0019 ARG C
H A 0018 LYS C 3.549 C A 0019 ARG CB
C A 0019 ARG C 2.471 C A 0020 LEU CA
C A 0019 ARG C 3.441 C A 0020 LEU C
C A 0019 ARG C 3.578 C A 0020 LEU CB
C A 0020 LEU CA 3.798 C A 0021 HIS CA
C A 0020 LEU C 2.459 C A 0021 HIS CA
C A 0020 LEU C 3.575 C A 0021 HIS C
C A 0020 LEU C 3.352 C A 0021 HIS CB
C A 0020 LEU C 3.216 C A 0021 HIS CG
C A 0020 LEU C 3.381 C A 0021 HIS CD2
C A 0020 LEU CB 3.581 C A 0021 HIS CD2
C A 0021 HIS C 2.497 C A 0022 ASN CA
C A 0021 HIS C 2.986 C A 0022 ASN C
C A 0021 HIS C 3.336 C A 0022 ASN CB
C A 0022 ASN C 2.455 C A 0023 THR CA
C A 0022 ASN C 3.594 C A 0023 THR C
C A 0022 ASN C 3.429 C A 0023 THR CB
C A 0022 ASN C 3.631 C A 0023 THR CG2
C A 0023 THR C 2.467 C A 0024 ASN CA
C A 0023 THR C 3.518 C A 0024 ASN C
C A 0023 THR C 3.434 C A 0024 ASN CB
C A 0024 ASN C 2.457 C A 0025 ARG CA
C A 0024 ASN C 3.448 C A 0025 ARG C
C A 0024 ASN C 3.556 C A 0025 ARG CB
C A 0024 ASN C 3.694 C A 0025 ARG CG
C A 0024 ASN C 3.511 C A 0025 ARG CD
C A 0025 ARG CA 3.790 E A 0026 GLY CA
C A 0025 ARG C 2.449 E A 0026 GLY CA
C A 0025 ARG C 3.513 E A 0026 GLY C
E A 0026 GLY CA 3.790 E A 0027 LYS CA
E A 0026 GLY CA 3.766 E A 0027 LYS CD
E A 0026 GLY C 2.451 E A 0027 LYS CA
E A 0026 GLY C 3.539 E A 0027 LYS C
E A 0026 GLY C 3.483 E A 0027 LYS CB
E A 0026 GLY C 3.611 E A 0027 LYS CG
E A 0026 GLY C 3.174 E A 0027 LYS CD
E A 0026 GLY C 3.665 E A 0027 LYS CE
E A 0027 LYS C 2.441 E A 0028 CYS CA
E A 0027 LYS C 3.358 E A 0028 CYS C
E A 0027 LYS C 3.524 E A 0028 CYS CB
E A 0027 LYS CE 3.601 E A 0034 ARG CD
E A 0027 LYS CD 3.735 C A 0036 TYR CE2
E A 0027 LYS CE 3.747 C A 0036 TYR CE1
E A 0027 LYS CE 3.517 C A 0036 TYR CZ
E A 0028 CYS C 2.456 E A 0029 MET CA
E A 0028 CYS C 3.539 E A 0029 MET C
E A 0028 CYS C 3.395 E A 0029 MET CB
E A 0029 MET C 2.481 C A 0030 ASN CA
E A 0029 MET C 2.832 C A 0030 ASN C
E A 0029 MET C 3.236 C A 0030 ASN CB
C A 0030 ASN C 2.484 C A 0031 LYS CA
C A 0030 ASN C 2.970 C A 0031 LYS C
C A 0030 ASN C 3.315 C A 0031 LYS CB
C A 0030 ASN C 3.235 C A 0031 LYS CG
C A 0030 ASN C 3.130 C A 0031 LYS CD
C A 0031 LYS C 2.464 E A 0032 LYS CA
C A 0031 LYS C 3.563 E A 0032 LYS C
C A 0031 LYS C 3.404 E A 0032 LYS CB
C A 0031 LYS C 3.468 E A 0032 LYS CG
E A 0032 LYS C 2.419 E A 0033 CYS CA
E A 0032 LYS C 3.452 E A 0033 CYS C
E A 0032 LYS C 3.497 E A 0033 CYS CB
E A 0033 CYS C 2.468 E A 0034 ARG CA
E A 0033 CYS C 3.445 E A 0034 ARG C
E A 0033 CYS C 3.477 E A 0034 ARG CB
E A 0034 ARG C 2.431 E A 0035 CYS CA
E A 0034 ARG C 3.563 E A 0035 CYS C
E A 0034 ARG C 3.361 E A 0035 CYS CB
E A 0035 CYS CA 3.797 C A 0036 TYR CA
E A 0035 CYS C 2.452 C A 0036 TYR CA
E A 0035 CYS C 3.399 C A 0036 TYR C
E A 0035 CYS C 3.464 C A 0036 TYR CB
E A 0035 CYS C 3.735 C A 0036 TYR CG
E A 0035 CYS C 3.594 C A 0036 TYR CD1
C A 0036 TYR C 2.485 C A 0037 SER CA
C A 0036 TYR C 2.931 C A 0037 SER C
C A 0036 TYR C 3.335 C A 0037 SER CB
CHARGE_ATTR 2.00 12.00 10
C A 0005 GLU OE1 9.434 C A 0019 ARG NH1
C A 0005 GLU OE1 10.51 C A 0019 ARG NH2
C A 0005 GLU OE2 7.978 C A 0019 ARG NH1
C A 0005 GLU OE2 9.404 C A 0019 ARG NH2
C A 0005 GLU OE1 10.73 C A 0021 HIS NE2
C A 0005 GLU OE2 11.79 C A 0021 HIS NE2
C A 0005 GLU OE1 11.45 E A 0027 LYS NZ
C A 0005 GLU OE1 11.57 C A 0031 LYS NZ
C A 0005 GLU OE1 9.256 E A 0032 LYS NZ
C A 0005 GLU OE2 10.79 E A 0032 LYS NZ
CHARGE_REPU 2.00 12.00 16
H A 0018 LYS NZ 8.991 C A 0019 ARG NH1
H A 0018 LYS NZ 6.729 C A 0019 ARG NH2
H A 0018 LYS NZ 11.46 C A 0021 HIS ND1
H A 0018 LYS NZ 10.35 C A 0025 ARG NH1
C A 0021 HIS ND1 10.90 E A 0027 LYS NZ
C A 0021 HIS NE2 10.40 E A 0027 LYS NZ
C A 0021 HIS ND1 8.640 E A 0034 ARG NH1
C A 0021 HIS ND1 9.715 E A 0034 ARG NH2
C A 0021 HIS NE2 7.720 E A 0034 ARG NH1
C A 0021 HIS NE2 9.224 E A 0034 ARG NH2
C A 0025 ARG NH1 10.98 E A 0027 LYS NZ
C A 0025 ARG NH2 10.39 E A 0027 LYS NZ
E A 0027 LYS NZ 5.647 E A 0034 ARG NH1
E A 0027 LYS NZ 5.057 E A 0034 ARG NH2
C A 0031 LYS NZ 11.44 E A 0032 LYS NZ
E A 0032 LYS NZ 11.16 E A 0034 ARG NH1
HB_MM 2.00 3.20 60
C A 0003 THR N 2.234 C A 0002 PHE O
C A 0004 GLN N 2.243 C A 0003 THR O
C A 0005 GLU N 2.239 C A 0004 GLN O
C A 0006 SER N 2.236 C A 0005 GLU O
C A 0007 CYS N 2.237 C A 0006 SER O
C A 0007 CYS N 3.169 C A 0031 LYS O
C A 0008 THR N 2.241 C A 0007 CYS O
C A 0009 ALA N 2.243 C A 0008 THR O
H A 0010 SER N 2.233 C A 0009 ALA O
H A 0011 ASN N 2.243 H A 0010 SER O
H A 0012 GLN N 2.934 H A 0010 SER O
H A 0012 GLN N 2.237 H A 0011 ASN O
H A 0013 CYS N 2.854 C A 0009 ALA O
H A 0013 CYS N 2.721 H A 0010 SER O
H A 0013 CYS N 2.236 H A 0012 GLN O
H A 0014 TRP N 2.941 H A 0010 SER O
H A 0014 TRP N 2.928 H A 0012 GLN O
H A 0014 TRP N 2.232 H A 0013 CYS O
H A 0015 SER N 2.882 H A 0012 GLN O
H A 0015 SER N 2.237 H A 0014 TRP O
H A 0016 ILE N 3.191 H A 0013 CYS O
H A 0016 ILE N 2.235 H A 0015 SER O
H A 0017 CYS N 2.831 H A 0013 CYS O
H A 0017 CYS N 2.863 H A 0014 TRP O
H A 0017 CYS N 2.229 H A 0016 ILE O
H A 0018 LYS N 2.809 H A 0014 TRP O
H A 0018 LYS N 3.163 H A 0015 SER O
H A 0018 LYS N 2.228 H A 0017 CYS O
H A 0018 LYS N 2.839 C A 0023 THR O
C A 0019 ARG N 2.228 H A 0018 LYS O
C A 0020 LEU N 3.026 H A 0016 ILE O
C A 0020 LEU N 2.235 C A 0019 ARG O
C A 0021 HIS N 2.852 H A 0017 CYS O
C A 0021 HIS N 2.239 C A 0020 LEU O
C A 0022 ASN N 3.057 H A 0017 CYS O
C A 0022 ASN N 2.239 C A 0021 HIS O
C A 0023 THR N 3.021 H A 0017 CYS O
C A 0023 THR N 2.807 C A 0021 HIS O
C A 0023 THR N 2.231 C A 0022 ASN O
C A 0024 ASN N 2.238 C A 0023 THR O
C A 0025 ARG N 2.235 C A 0024 ASN O
E A 0026 GLY N 2.240 C A 0025 ARG O
E A 0027 LYS N 2.236 E A 0026 GLY O
E A 0027 LYS N 2.889 E A 0034 ARG O
E A 0028 CYS N 2.236 E A 0027 LYS O
E A 0029 MET N 2.234 E A 0028 CYS O
E A 0029 MET N 2.939 E A 0032 LYS O
C A 0030 ASN N 2.242 E A 0029 MET O
C A 0031 LYS N 3.060 E A 0029 MET O
C A 0031 LYS N 2.245 C A 0030 ASN O
E A 0032 LYS N 2.753 E A 0029 MET O
E A 0032 LYS N 2.866 C A 0030 ASN O
E A 0032 LYS N 2.244 C A 0031 LYS O
E A 0033 CYS N 2.973 C A 0005 GLU O
E A 0033 CYS N 2.223 E A 0032 LYS O
E A 0034 ARG N 3.013 E A 0027 LYS O
E A 0034 ARG N 2.245 E A 0033 CYS O
E A 0035 CYS N 2.221 E A 0034 ARG O
C A 0036 TYR N 2.235 E A 0035 CYS O
C A 0037 SER N 2.242 C A 0036 TYR O
HB_MS 2.00 3.20 10
C A 0006 SER N 2.861 C A 0005 GLU OE1
C A 0008 THR N 2.803 H A 0012 GLN OE1
H A 0010 SER O 3.177 H A 0014 TRP NE1
C A 0021 HIS O 2.904 C A 0023 THR OG1
C A 0025 ARG O 3.054 E A 0027 LYS NZ
E A 0026 GLY O 2.808 H A 0010 SER OG
E A 0026 GLY O 3.013 H A 0014 TRP NE1
E A 0034 ARG O 3.102 E A 0027 LYS NZ
E A 0035 CYS O 2.957 E A 0034 ARG NH1
C A 0036 TYR O 3.196 C A 0023 THR OG1
HB_SS 2.00 3.20 2
C A 0008 THR OG1 3.002 H A 0012 GLN OE1
H A 0018 LYS NZ 2.905 C A 0022 ASN OD1
AROMATIC 0.00 8.00 3
E A 0032 LYS 4.734 C A 0002 PHE
E A 0027 LYS 2.955 C A 0036 TYR
E A 0034 ARG 4.479 C A 0036 TYR
SS_BOND 1.50 2.80 3
C A 0007 CYS SG 2.019 E A 0028 CYS SG
H A 0013 CYS SG 2.021 E A 0033 CYS SG
H A 0017 CYS SG 2.019 E A 0035 CYS SG