Complet list of 1d0r con file
Complete list of 1d0r.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 109
C A 0001 HIS C 2.524 C A 0002 ALA CA
C A 0001 HIS C 3.375 C A 0002 ALA C
C A 0001 HIS C 2.916 C A 0002 ALA CB
C A 0001 HIS CE1 3.614 C A 0003 GLU CD
C A 0001 HIS C 3.442 C A 0005 THR CB
C A 0002 ALA C 2.513 C A 0003 GLU CA
C A 0002 ALA C 3.035 C A 0003 GLU C
C A 0002 ALA C 3.466 C A 0003 GLU CB
C A 0002 ALA C 3.742 C A 0005 THR CB
C A 0002 ALA CB 3.756 C A 0005 THR CB
C A 0003 GLU CA 3.733 C A 0004 GLY CA
C A 0003 GLU C 2.525 C A 0004 GLY CA
C A 0003 GLU C 3.462 C A 0004 GLY C
C A 0003 GLU CD 3.753 H A 0007 THR CG2
C A 0004 GLY C 2.522 C A 0005 THR CA
C A 0004 GLY C 3.027 C A 0005 THR C
C A 0004 GLY C 3.606 C A 0005 THR CB
C A 0005 THR C 2.513 C A 0006 PHE CA
C A 0005 THR C 3.211 C A 0006 PHE C
C A 0005 THR C 3.023 C A 0006 PHE CB
C A 0006 PHE C 2.522 H A 0007 THR CA
C A 0006 PHE C 2.960 H A 0007 THR C
C A 0006 PHE C 3.691 H A 0007 THR CB
C A 0006 PHE CZ 3.556 H A 0010 VAL CG2
H A 0007 THR C 2.482 H A 0008 SER CA
H A 0007 THR C 2.953 H A 0008 SER C
H A 0007 THR C 3.689 H A 0008 SER CB
H A 0008 SER C 2.472 H A 0009 ASP CA
H A 0008 SER C 2.977 H A 0009 ASP C
H A 0008 SER C 3.666 H A 0009 ASP CB
H A 0009 ASP C 2.479 H A 0010 VAL CA
H A 0009 ASP C 2.873 H A 0010 VAL C
H A 0009 ASP C 3.670 H A 0010 VAL CB
H A 0010 VAL C 2.451 H A 0011 SER CA
H A 0010 VAL C 3.033 H A 0011 SER C
H A 0010 VAL C 3.723 H A 0011 SER CB
H A 0011 SER C 2.459 H A 0012 SER CA
H A 0011 SER C 2.896 H A 0012 SER C
H A 0011 SER C 3.706 H A 0012 SER CB
H A 0012 SER C 2.436 H A 0013 TYR CA
H A 0012 SER C 2.926 H A 0013 TYR C
H A 0012 SER C 3.724 H A 0013 TYR CB
H A 0012 SER CA 3.550 H A 0015 GLU CD
H A 0013 TYR C 2.458 H A 0014 LEU CA
H A 0013 TYR C 2.858 H A 0014 LEU C
H A 0013 TYR C 3.717 H A 0014 LEU CB
H A 0013 TYR CE1 3.761 H A 0017 GLN CG
H A 0013 TYR CZ 3.437 H A 0017 GLN CG
H A 0014 LEU C 2.475 H A 0015 GLU CA
H A 0014 LEU C 3.027 H A 0015 GLU C
H A 0014 LEU C 3.704 H A 0015 GLU CB
H A 0015 GLU C 2.517 H A 0016 GLY CA
H A 0015 GLU C 3.016 H A 0016 GLY C
H A 0016 GLY CA 3.768 H A 0017 GLN CA
H A 0016 GLY C 2.412 H A 0017 GLN CA
H A 0016 GLY C 3.095 H A 0017 GLN C
H A 0016 GLY C 3.678 H A 0017 GLN CB
H A 0017 GLN C 2.479 H A 0018 ALA CA
H A 0017 GLN C 2.931 H A 0018 ALA C
H A 0017 GLN C 3.634 H A 0018 ALA CB
H A 0018 ALA C 2.485 H A 0019 ALA CA
H A 0018 ALA C 3.003 H A 0019 ALA C
H A 0018 ALA C 3.621 H A 0019 ALA CB
H A 0019 ALA C 2.474 H A 0020 LYS CA
H A 0019 ALA C 2.970 H A 0020 LYS C
H A 0019 ALA C 3.731 H A 0020 LYS CB
H A 0020 LYS C 2.448 H A 0021 GLU CA
H A 0020 LYS C 2.939 H A 0021 GLU C
H A 0020 LYS C 3.662 H A 0021 GLU CB
H A 0020 LYS CA 3.792 H A 0023 ILE CB
H A 0020 LYS CA 3.597 H A 0023 ILE CG2
H A 0021 GLU C 2.444 H A 0022 PHE CA
H A 0021 GLU C 3.179 H A 0022 PHE C
H A 0021 GLU C 3.643 H A 0022 PHE CB
H A 0022 PHE C 2.455 H A 0023 ILE CA
H A 0022 PHE C 2.894 H A 0023 ILE C
H A 0022 PHE C 3.733 H A 0023 ILE CB
H A 0022 PHE CA 3.503 H A 0025 TRP CB
H A 0022 PHE C 3.722 H A 0025 TRP CB
H A 0022 PHE CD2 3.710 H A 0025 TRP CE3
H A 0022 PHE CE2 3.324 H A 0025 TRP CE3
H A 0022 PHE CE2 3.388 H A 0025 TRP CZ3
H A 0022 PHE CZ 3.494 H A 0025 TRP CE3
H A 0022 PHE CZ 3.473 H A 0025 TRP CZ3
H A 0023 ILE C 2.452 H A 0024 ALA CA
H A 0023 ILE C 3.293 H A 0024 ALA C
H A 0023 ILE C 3.602 H A 0024 ALA CB
H A 0024 ALA C 2.476 H A 0025 TRP CA
H A 0024 ALA C 2.937 H A 0025 TRP C
H A 0024 ALA C 3.700 H A 0025 TRP CB
H A 0025 TRP C 2.464 H A 0026 LEU CA
H A 0025 TRP C 3.075 H A 0026 LEU C
H A 0025 TRP C 3.651 H A 0026 LEU CB
H A 0025 TRP CE3 3.215 H A 0026 LEU CD2
H A 0025 TRP CZ3 3.478 H A 0026 LEU CD2
H A 0025 TRP C 3.641 C A 0028 LYS C
H A 0026 LEU C 2.509 C A 0027 VAL CA
H A 0026 LEU C 3.398 C A 0027 VAL C
H A 0026 LEU C 3.557 C A 0027 VAL CB
H A 0026 LEU C 3.647 C A 0027 VAL CG2
C A 0027 VAL C 2.489 C A 0028 LYS CA
C A 0027 VAL C 3.210 C A 0028 LYS C
C A 0027 VAL C 3.656 C A 0028 LYS CB
C A 0028 LYS C 2.500 C A 0029 GLY CA
C A 0028 LYS C 3.609 C A 0029 GLY C
C A 0029 GLY C 2.456 C A 0030 ARG CA
C A 0029 GLY C 3.468 C A 0030 ARG C
C A 0029 GLY C 3.567 C A 0030 ARG CB
C A 0029 GLY C 3.631 C A 0030 ARG CG
CHARGE_ATTR 2.00 12.00 9
C A 0003 GLU OE1 2.889 C A 0001 HIS ND1
C A 0003 GLU OE1 3.970 C A 0001 HIS NE2
C A 0003 GLU OE2 4.587 C A 0001 HIS ND1
C A 0003 GLU OE2 5.389 C A 0001 HIS NE2
H A 0015 GLU OE1 11.42 H A 0020 LYS NZ
H A 0021 GLU OE1 10.79 H A 0020 LYS NZ
H A 0021 GLU OE2 11.74 H A 0020 LYS NZ
H A 0021 GLU OE1 2.619 C A 0028 LYS NZ
H A 0021 GLU OE2 2.473 C A 0028 LYS NZ
CHARGE_REPU 2.00 12.00 9
C A 0003 GLU OE1 11.06 H A 0015 GLU OE2
C A 0003 GLU OE2 11.13 H A 0015 GLU OE1
C A 0003 GLU OE2 9.450 H A 0015 GLU OE2
H A 0009 ASP OD1 10.25 H A 0015 GLU OE1
H A 0009 ASP OD1 9.209 H A 0015 GLU OE2
H A 0009 ASP OD2 10.95 H A 0015 GLU OE2
H A 0020 LYS NZ 11.31 C A 0028 LYS NZ
C A 0028 LYS NZ 11.68 C A 0030 ARG NH1
C A 0028 LYS NZ 11.56 C A 0030 ARG NH2
HB_MM 2.00 3.20 73
C A 0001 HIS N 2.610 C A 0005 THR O
C A 0002 ALA N 2.250 C A 0001 HIS O
C A 0003 GLU N 2.243 C A 0002 ALA O
C A 0004 GLY N 3.068 C A 0002 ALA O
C A 0004 GLY N 2.248 C A 0003 GLU O
C A 0005 THR N 3.110 C A 0002 ALA O
C A 0005 THR N 2.232 C A 0004 GLY O
C A 0006 PHE N 2.525 C A 0004 GLY O
C A 0006 PHE N 2.233 C A 0005 THR O
H A 0007 THR N 2.914 C A 0005 THR O
H A 0007 THR N 2.238 C A 0006 PHE O
H A 0008 SER N 2.462 C A 0006 PHE O
H A 0008 SER N 2.231 H A 0007 THR O
H A 0009 ASP N 2.910 C A 0006 PHE O
H A 0009 ASP N 3.060 H A 0007 THR O
H A 0009 ASP N 2.233 H A 0008 SER O
H A 0010 VAL N 2.224 H A 0009 ASP O
H A 0011 SER N 2.743 H A 0009 ASP O
H A 0011 SER N 2.220 H A 0010 VAL O
H A 0012 SER N 2.851 H A 0008 SER O
H A 0012 SER N 2.764 H A 0009 ASP O
H A 0012 SER N 2.217 H A 0011 SER O
H A 0013 TYR N 2.804 H A 0009 ASP O
H A 0013 TYR N 2.873 H A 0011 SER O
H A 0013 TYR N 2.211 H A 0012 SER O
H A 0014 LEU N 3.083 H A 0010 VAL O
H A 0014 LEU N 2.765 H A 0011 SER O
H A 0014 LEU N 2.225 H A 0013 TYR O
H A 0015 GLU N 3.060 H A 0011 SER O
H A 0015 GLU N 2.976 H A 0013 TYR O
H A 0015 GLU N 2.232 H A 0014 LEU O
H A 0016 GLY N 2.790 H A 0012 SER O
H A 0016 GLY N 2.988 H A 0013 TYR O
H A 0016 GLY N 2.233 H A 0015 GLU O
H A 0017 GLN N 2.788 H A 0013 TYR O
H A 0017 GLN N 2.944 H A 0015 GLU O
H A 0017 GLN N 2.215 H A 0016 GLY O
H A 0018 ALA N 2.800 H A 0014 LEU O
H A 0018 ALA N 3.184 H A 0015 GLU O
H A 0018 ALA N 2.231 H A 0017 GLN O
H A 0019 ALA N 3.103 H A 0015 GLU O
H A 0019 ALA N 2.868 H A 0017 GLN O
H A 0019 ALA N 2.229 H A 0018 ALA O
H A 0020 LYS N 3.130 H A 0017 GLN O
H A 0020 LYS N 2.593 H A 0018 ALA O
H A 0020 LYS N 2.228 H A 0019 ALA O
H A 0021 GLU N 3.193 H A 0018 ALA O
H A 0021 GLU N 2.998 H A 0019 ALA O
H A 0021 GLU N 2.222 H A 0020 LYS O
H A 0022 PHE N 3.124 H A 0019 ALA O
H A 0022 PHE N 2.983 H A 0020 LYS O
H A 0022 PHE N 2.227 H A 0021 GLU O
H A 0023 ILE N 3.060 H A 0019 ALA O
H A 0023 ILE N 2.987 H A 0020 LYS O
H A 0023 ILE N 2.229 H A 0022 PHE O
H A 0024 ALA N 2.828 H A 0020 LYS O
H A 0024 ALA N 2.819 H A 0022 PHE O
H A 0024 ALA N 2.222 H A 0023 ILE O
H A 0025 TRP N 2.930 H A 0021 GLU O
H A 0025 TRP N 2.784 H A 0022 PHE O
H A 0025 TRP N 2.202 H A 0024 ALA O
H A 0026 LEU N 2.930 H A 0024 ALA O
H A 0026 LEU N 2.191 H A 0025 TRP O
C A 0027 VAL N 2.830 H A 0024 ALA O
C A 0027 VAL N 2.598 H A 0025 TRP O
C A 0027 VAL N 2.208 H A 0026 LEU O
C A 0028 LYS N 2.793 H A 0024 ALA O
C A 0028 LYS N 2.772 H A 0025 TRP O
C A 0028 LYS N 2.223 C A 0027 VAL O
C A 0029 GLY N 2.614 H A 0025 TRP O
C A 0029 GLY N 2.812 C A 0027 VAL O
C A 0029 GLY N 2.221 C A 0028 LYS O
C A 0030 ARG N 2.250 C A 0029 GLY O
HB_MS 2.00 3.20 8
C A 0002 ALA O 2.787 C A 0005 THR OG1
H A 0010 VAL N 3.084 H A 0009 ASP OD1
H A 0012 SER N 3.117 H A 0015 GLU OE2
H A 0016 GLY O 2.654 H A 0020 LYS NZ
H A 0017 GLN O 2.730 H A 0020 LYS NZ
H A 0021 GLU O 2.821 C A 0028 LYS NZ
H A 0026 LEU O 2.684 C A 0030 ARG NH1
H A 0026 LEU O 2.703 C A 0030 ARG NH2
HB_SS 2.00 3.20 3
C A 0001 HIS ND1 3.009 H A 0007 THR OG1
H A 0015 GLU OE2 2.854 H A 0011 SER OG
H A 0020 LYS NZ 2.771 H A 0017 GLN OE1
AROMATIC 0.00 8.00 2
H A 0020 LYS 7.909 H A 0013 TYR
C A 0030 ARG 7.702 H A 0025 TRP