Complet list of 1xrz con file
Complete list of 1xrz.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 LYS C 2.456 C A 0002 THR CA
C A 0001 LYS C 3.470 C A 0002 THR C
C A 0001 LYS C 3.543 C A 0002 THR CB
C A 0001 LYS C 3.621 C A 0002 THR CG2
C A 0002 THR C 2.447 E A 0003 TYR CA
C A 0002 THR C 3.338 E A 0003 TYR C
C A 0002 THR C 3.592 E A 0003 TYR CB
C A 0002 THR C 3.646 E A 0003 TYR CG
C A 0002 THR C 3.474 E A 0003 TYR CD1
E A 0003 TYR C 2.410 E A 0004 GLN CA
E A 0003 TYR C 3.395 E A 0004 GLN C
E A 0003 TYR C 3.452 E A 0004 GLN CB
E A 0003 TYR CD2 3.787 C A 0013 ALA C
E A 0003 TYR CE2 3.393 C A 0013 ALA C
E A 0003 TYR CE2 3.798 H A 0014 ASP CA
E A 0003 TYR CE2 3.767 H A 0014 ASP C
E A 0004 GLN C 2.464 C A 0005 CYS CA
E A 0004 GLN C 2.955 C A 0005 CYS C
E A 0004 GLN C 3.671 C A 0005 CYS CB
C A 0005 CYS C 2.425 C A 0006 GLN CA
C A 0005 CYS C 3.341 C A 0006 GLN C
C A 0005 CYS C 3.581 C A 0006 GLN CB
C A 0006 GLN C 2.468 C A 0007 TYR CA
C A 0006 GLN C 3.618 C A 0007 TYR C
C A 0006 GLN C 3.341 C A 0007 TYR CB
C A 0006 GLN C 3.158 C A 0007 TYR CG
C A 0006 GLN C 3.410 C A 0007 TYR CD1
C A 0006 GLN C 3.611 C A 0007 TYR CD2
C A 0006 GLN CG 3.726 C A 0007 TYR CD2
C A 0006 GLN CG 3.368 C A 0007 TYR CE2
C A 0006 GLN CG 3.659 C A 0007 TYR CZ
C A 0007 TYR C 2.455 C A 0008 CYS CA
C A 0007 TYR C 3.441 C A 0008 CYS C
C A 0007 TYR C 3.537 C A 0008 CYS CB
C A 0007 TYR CB 3.751 C A 0028 LYS CE
C A 0007 TYR CG 3.502 C A 0028 LYS CE
C A 0007 TYR CD1 3.385 C A 0028 LYS CE
C A 0007 TYR CE2 3.671 C A 0029 GLU CB
C A 0007 TYR CZ 3.475 C A 0029 GLU CB
C A 0007 TYR CZ 3.412 C A 0029 GLU CG
C A 0008 CYS C 2.430 C A 0009 GLU CA
C A 0008 CYS C 3.479 C A 0009 GLU C
C A 0008 CYS C 3.473 C A 0009 GLU CB
C A 0008 CYS CB 3.658 H A 0026 HIS CE1
E A 0011 ARG C 2.472 E A 0012 SER CA
E A 0011 ARG C 3.583 E A 0012 SER C
E A 0011 ARG C 3.442 E A 0012 SER CB
E A 0012 SER C 2.456 C A 0013 ALA CA
E A 0012 SER C 3.465 C A 0013 ALA C
E A 0012 SER C 3.524 C A 0013 ALA CB
C A 0013 ALA C 2.463 H A 0014 ASP CA
C A 0013 ALA C 3.546 H A 0014 ASP C
C A 0013 ALA C 3.399 H A 0014 ASP CB
H A 0014 ASP C 2.449 H A 0015 SER CA
H A 0014 ASP C 3.301 H A 0015 SER C
H A 0014 ASP C 3.624 H A 0015 SER CB
H A 0014 ASP CB 3.582 H A 0017 ASN CG
H A 0014 ASP CG 3.775 H A 0017 ASN CG
H A 0015 SER C 2.463 H A 0016 SER CA
H A 0015 SER C 2.844 H A 0016 SER C
H A 0015 SER C 3.705 H A 0016 SER CB
H A 0016 SER C 2.465 H A 0017 ASN CA
H A 0016 SER C 3.018 H A 0017 ASN C
H A 0016 SER C 3.696 H A 0017 ASN CB
H A 0017 ASN C 2.441 H A 0018 LEU CA
H A 0017 ASN C 3.010 H A 0018 LEU C
H A 0017 ASN C 3.702 H A 0018 LEU CB
H A 0018 LEU C 2.424 H A 0019 LYS CA
H A 0018 LEU C 2.915 H A 0019 LYS C
H A 0018 LEU C 3.700 H A 0019 LYS CB
H A 0019 LYS C 2.462 H A 0020 THR CA
H A 0019 LYS C 2.860 H A 0020 THR C
H A 0019 LYS C 3.715 H A 0020 THR CB
H A 0020 THR C 2.453 H A 0021 HIS CA
H A 0020 THR C 2.867 H A 0021 HIS C
H A 0020 THR C 3.706 H A 0021 HIS CB
H A 0021 HIS C 2.444 H A 0022 ILE CA
H A 0021 HIS C 2.948 H A 0022 ILE C
H A 0021 HIS C 3.731 H A 0022 ILE CB
H A 0021 HIS CE1 3.627 H A 0025 LYS CB
H A 0021 HIS CE1 3.697 H A 0025 LYS CG
H A 0022 ILE C 2.479 H A 0023 LYS CA
H A 0022 ILE C 2.990 H A 0023 LYS C
H A 0022 ILE C 3.719 H A 0023 LYS CB
H A 0022 ILE CG2 3.785 C A 0029 GLU C
H A 0023 LYS C 2.463 H A 0024 THR CA
H A 0023 LYS C 3.500 H A 0024 THR C
H A 0023 LYS C 3.563 H A 0024 THR CB
H A 0024 THR C 2.446 H A 0025 LYS CA
H A 0024 THR C 3.326 H A 0025 LYS C
H A 0024 THR C 3.666 H A 0025 LYS CB
H A 0025 LYS C 2.460 H A 0026 HIS CA
H A 0025 LYS C 3.536 H A 0026 HIS C
H A 0025 LYS C 3.447 H A 0026 HIS CB
H A 0025 LYS C 3.433 H A 0026 HIS CG
H A 0026 HIS C 2.475 C A 0027 SER CA
H A 0026 HIS C 2.998 C A 0027 SER C
H A 0026 HIS C 3.169 C A 0027 SER CB
C A 0027 SER C 2.460 C A 0028 LYS CA
C A 0027 SER C 3.555 C A 0028 LYS C
C A 0027 SER C 3.452 C A 0028 LYS CB
C A 0028 LYS C 2.457 C A 0029 GLU CA
C A 0028 LYS C 3.516 C A 0029 GLU C
C A 0028 LYS C 3.438 C A 0029 GLU CB
C A 0028 LYS C 3.493 C A 0029 GLU CG
C A 0029 GLU CA 2.950 C A 0030 LYS CA
C A 0029 GLU C 2.497 C A 0030 LYS CA
C A 0029 GLU C 3.458 C A 0030 LYS C
C A 0029 GLU C 3.573 C A 0030 LYS CB
C A 0029 GLU CB 3.333 C A 0030 LYS CA
CHARGE_ATTR 2.00 12.00 22
C A 0009 GLU OE1 5.949 E A 0011 ARG NH1
C A 0009 GLU OE1 6.531 E A 0011 ARG NH2
C A 0009 GLU OE2 6.703 E A 0011 ARG NH1
C A 0009 GLU OE2 7.545 E A 0011 ARG NH2
C A 0009 GLU OE1 10.47 H A 0021 HIS ND1
C A 0009 GLU OE1 9.186 H A 0021 HIS NE2
C A 0009 GLU OE2 10.81 H A 0021 HIS NE2
C A 0009 GLU OE1 11.66 H A 0026 HIS ND1
C A 0009 GLU OE1 9.903 H A 0026 HIS NE2
C A 0009 GLU OE2 11.01 H A 0026 HIS NE2
H A 0014 ASP OD1 9.071 H A 0019 LYS NZ
H A 0014 ASP OD2 10.88 H A 0019 LYS NZ
C A 0029 GLU OE1 11.85 H A 0019 LYS NZ
C A 0029 GLU OE1 11.28 H A 0023 LYS NZ
C A 0029 GLU OE1 10.60 H A 0026 HIS ND1
C A 0029 GLU OE1 11.12 H A 0026 HIS NE2
C A 0029 GLU OE2 10.38 H A 0026 HIS ND1
C A 0029 GLU OE2 10.66 H A 0026 HIS NE2
C A 0029 GLU OE1 7.953 C A 0028 LYS NZ
C A 0029 GLU OE2 7.261 C A 0028 LYS NZ
C A 0029 GLU OE1 4.465 C A 0030 LYS NZ
C A 0029 GLU OE2 2.886 C A 0030 LYS NZ
CHARGE_REPU 2.00 12.00 20
C A 0001 LYS NZ 9.398 E A 0011 ARG NH1
C A 0001 LYS NZ 8.437 E A 0011 ARG NH2
H A 0019 LYS NZ 11.69 H A 0021 HIS ND1
H A 0019 LYS NZ 5.584 H A 0023 LYS NZ
H A 0019 LYS NZ 11.88 C A 0030 LYS NZ
H A 0021 HIS ND1 4.800 H A 0025 LYS NZ
H A 0021 HIS NE2 6.575 H A 0025 LYS NZ
H A 0021 HIS ND1 6.428 H A 0026 HIS ND1
H A 0021 HIS ND1 4.921 H A 0026 HIS NE2
H A 0021 HIS NE2 5.071 H A 0026 HIS ND1
H A 0021 HIS NE2 3.172 H A 0026 HIS NE2
H A 0021 HIS ND1 10.77 C A 0028 LYS NZ
H A 0021 HIS NE2 8.982 C A 0028 LYS NZ
H A 0025 LYS NZ 8.817 H A 0026 HIS ND1
H A 0025 LYS NZ 8.221 H A 0026 HIS NE2
H A 0026 HIS ND1 4.912 C A 0028 LYS NZ
H A 0026 HIS NE2 5.980 C A 0028 LYS NZ
H A 0026 HIS ND1 11.48 C A 0030 LYS NZ
H A 0026 HIS NE2 11.22 C A 0030 LYS NZ
C A 0028 LYS NZ 8.933 C A 0030 LYS NZ
HB_MM 2.00 3.20 48
C A 0002 THR N 2.234 C A 0001 LYS O
E A 0003 TYR N 2.232 C A 0002 THR O
E A 0003 TYR N 2.979 E A 0012 SER O
E A 0004 GLN N 2.219 E A 0003 TYR O
C A 0005 CYS N 2.241 E A 0004 GLN O
C A 0006 GLN N 2.224 C A 0005 CYS O
C A 0007 TYR N 2.239 C A 0006 GLN O
C A 0008 CYS N 2.233 C A 0007 TYR O
C A 0009 GLU N 2.228 C A 0008 CYS O
E A 0012 SER N 2.879 E A 0003 TYR O
E A 0012 SER N 2.233 E A 0011 ARG O
C A 0013 ALA N 2.227 E A 0012 SER O
H A 0014 ASP N 2.235 C A 0013 ALA O
H A 0015 SER N 2.226 H A 0014 ASP O
H A 0016 SER N 2.234 H A 0015 SER O
H A 0017 ASN N 2.909 H A 0015 SER O
H A 0017 ASN N 2.226 H A 0016 SER O
H A 0018 LEU N 2.845 H A 0015 SER O
H A 0018 LEU N 2.220 H A 0017 ASN O
H A 0019 LYS N 2.969 H A 0015 SER O
H A 0019 LYS N 3.165 H A 0016 SER O
H A 0019 LYS N 2.214 H A 0018 LEU O
H A 0020 THR N 2.905 H A 0016 SER O
H A 0020 THR N 3.180 H A 0017 ASN O
H A 0020 THR N 2.231 H A 0019 LYS O
H A 0021 HIS N 3.025 H A 0017 ASN O
H A 0021 HIS N 3.180 H A 0018 LEU O
H A 0021 HIS N 2.237 H A 0020 THR O
H A 0022 ILE N 3.013 H A 0018 LEU O
H A 0022 ILE N 2.979 H A 0019 LYS O
H A 0022 ILE N 3.163 H A 0020 THR O
H A 0022 ILE N 2.226 H A 0021 HIS O
H A 0023 LYS N 2.968 H A 0019 LYS O
H A 0023 LYS N 3.029 H A 0020 THR O
H A 0023 LYS N 2.229 H A 0022 ILE O
H A 0024 THR N 2.832 H A 0022 ILE O
H A 0024 THR N 2.235 H A 0023 LYS O
H A 0025 LYS N 2.869 H A 0021 HIS O
H A 0025 LYS N 3.199 H A 0022 ILE O
H A 0025 LYS N 2.213 H A 0024 THR O
H A 0026 HIS N 2.857 H A 0022 ILE O
H A 0026 HIS N 2.223 H A 0025 LYS O
C A 0027 SER N 2.937 H A 0022 ILE O
C A 0027 SER N 2.241 H A 0026 HIS O
C A 0028 LYS N 3.060 H A 0026 HIS O
C A 0028 LYS N 2.228 C A 0027 SER O
C A 0029 GLU N 2.234 C A 0028 LYS O
C A 0030 LYS N 2.195 C A 0029 GLU O
HB_MS 2.00 3.20 7
C A 0005 CYS O 2.683 E A 0004 GLN NE2
C A 0008 CYS O 2.997 E A 0004 GLN NE2
H A 0015 SER N 2.744 H A 0014 ASP OD1
H A 0016 SER N 2.849 H A 0014 ASP OD1
H A 0016 SER O 2.888 H A 0020 THR OG1
H A 0017 ASN N 3.047 H A 0014 ASP OD1
H A 0023 LYS O 2.589 C A 0027 SER OG
HB_SS 2.00 3.20 5
C A 0006 GLN NE2 3.030 C A 0007 TYR OH
C A 0009 GLU OE1 2.978 E A 0004 GLN NE2
E A 0011 ARG NH2 2.986 C A 0002 THR OG1
C A 0029 GLU OE2 2.936 C A 0007 TYR OH
C A 0030 LYS NZ 2.925 C A 0007 TYR OH
AROMATIC 0.00 8.00 4
H A 0025 LYS 5.953 H A 0021 HIS
H A 0021 HIS 4.960 H A 0026 HIS
C A 0028 LYS 4.294 C A 0007 TYR
C A 0030 LYS 5.616 C A 0007 TYR