Complet list of 1jrj con file
Complete list of 1jrj.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 159
C A 0001 HIS C 2.427 C A 0002 GLY CA
C A 0001 HIS C 3.677 C A 0002 GLY C
C A 0002 GLY C 2.444 C A 0003 GLU CA
C A 0002 GLY C 3.369 C A 0003 GLU C
C A 0002 GLY C 3.600 C A 0003 GLU CB
C A 0003 GLU C 2.427 C A 0004 GLY CA
C A 0003 GLU C 3.725 C A 0004 GLY C
C A 0004 GLY C 2.446 C A 0005 THR CA
C A 0004 GLY C 3.303 C A 0005 THR C
C A 0004 GLY C 3.643 C A 0005 THR CB
C A 0004 GLY C 3.749 H A 0006 PHE CD1
C A 0005 THR C 2.448 H A 0006 PHE CA
C A 0005 THR C 3.441 H A 0006 PHE C
C A 0005 THR C 3.560 H A 0006 PHE CB
H A 0006 PHE C 2.452 H A 0007 THR CA
H A 0006 PHE C 3.017 H A 0007 THR C
H A 0006 PHE C 3.734 H A 0007 THR CB
H A 0007 THR C 2.450 H A 0008 SER CA
H A 0007 THR C 3.005 H A 0008 SER C
H A 0007 THR C 3.731 H A 0008 SER CB
H A 0008 SER C 2.443 H A 0009 ASP CA
H A 0008 SER C 3.166 H A 0009 ASP C
H A 0008 SER C 3.699 H A 0009 ASP CB
H A 0009 ASP C 2.450 H A 0010 LEU CA
H A 0009 ASP C 3.032 H A 0010 LEU C
H A 0009 ASP C 3.729 H A 0010 LEU CB
H A 0010 LEU C 2.449 H A 0011 SER CA
H A 0010 LEU C 3.006 H A 0011 SER C
H A 0010 LEU C 3.731 H A 0011 SER CB
H A 0011 SER C 2.444 H A 0012 LYS CA
H A 0011 SER C 3.085 H A 0012 LYS C
H A 0011 SER C 3.717 H A 0012 LYS CB
H A 0012 LYS C 2.453 H A 0013 GLN CA
H A 0012 LYS C 2.988 H A 0013 GLN C
H A 0012 LYS C 3.732 H A 0013 GLN CB
H A 0012 LYS C 3.794 H A 0016 GLU CD
H A 0013 GLN C 2.448 H A 0014 MET CA
H A 0013 GLN C 2.994 H A 0014 MET C
H A 0013 GLN C 3.731 H A 0014 MET CB
H A 0014 MET C 2.449 H A 0015 GLU CA
H A 0014 MET C 3.066 H A 0015 GLU C
H A 0014 MET C 3.727 H A 0015 GLU CB
H A 0015 GLU C 2.448 H A 0016 GLU CA
H A 0015 GLU C 3.054 H A 0016 GLU C
H A 0015 GLU C 3.727 H A 0016 GLU CB
H A 0016 GLU C 2.447 H A 0017 GLU CA
H A 0016 GLU C 3.020 H A 0017 GLU C
H A 0016 GLU C 3.731 H A 0017 GLU CB
H A 0017 GLU C 2.446 H A 0018 ALA CA
H A 0017 GLU C 3.015 H A 0018 ALA C
H A 0017 GLU C 3.722 H A 0018 ALA CB
H A 0018 ALA C 2.449 H A 0019 VAL CA
H A 0018 ALA C 3.032 H A 0019 VAL C
H A 0018 ALA C 3.756 H A 0019 VAL CB
H A 0019 VAL C 2.452 H A 0020 ARG CA
H A 0019 VAL C 3.007 H A 0020 ARG C
H A 0019 VAL C 3.732 H A 0020 ARG CB
H A 0019 VAL C 3.737 H A 0023 ILE CD1
H A 0019 VAL CG1 3.491 H A 0023 ILE CD1
H A 0020 ARG C 2.447 H A 0021 LEU CA
H A 0020 ARG C 3.026 H A 0021 LEU C
H A 0020 ARG C 3.731 H A 0021 LEU CB
H A 0021 LEU C 2.446 H A 0022 PHE CA
H A 0021 LEU C 3.019 H A 0022 PHE C
H A 0021 LEU C 3.725 H A 0022 PHE CB
H A 0021 LEU C 3.366 C A 0038 PRO CG
H A 0021 LEU CB 3.761 C A 0038 PRO CB
H A 0022 PHE C 2.448 H A 0023 ILE CA
H A 0022 PHE C 3.020 H A 0023 ILE C
H A 0022 PHE C 3.752 H A 0023 ILE CB
H A 0022 PHE CD1 3.797 H A 0025 TRP CE3
H A 0022 PHE CE1 3.796 H A 0025 TRP CE3
H A 0022 PHE CE1 3.754 H A 0025 TRP CZ3
H A 0022 PHE CE2 3.413 H A 0026 LEU CD1
H A 0022 PHE CZ 3.265 H A 0026 LEU CD1
H A 0022 PHE CA 3.386 C A 0038 PRO CG
H A 0023 ILE C 2.448 H A 0024 GLU CA
H A 0023 ILE C 3.032 H A 0024 GLU C
H A 0023 ILE C 3.727 H A 0024 GLU CB
H A 0024 GLU C 2.448 H A 0025 TRP CA
H A 0024 GLU C 3.045 H A 0025 TRP C
H A 0024 GLU C 3.723 H A 0025 TRP CB
H A 0025 TRP C 2.438 H A 0026 LEU CA
H A 0025 TRP C 3.088 H A 0026 LEU C
H A 0025 TRP C 3.712 H A 0026 LEU CB
H A 0025 TRP CE3 3.507 H A 0026 LEU CD2
H A 0025 TRP CZ3 3.477 H A 0026 LEU CD2
H A 0025 TRP C 3.722 H A 0028 ASN CG
H A 0025 TRP CE2 3.647 H A 0030 GLY CA
H A 0025 TRP CE2 3.396 H A 0030 GLY C
H A 0025 TRP CZ2 3.730 H A 0030 GLY CA
H A 0025 TRP CZ2 3.117 H A 0030 GLY C
H A 0025 TRP CH2 3.592 H A 0030 GLY C
H A 0025 TRP CZ2 3.621 H A 0031 PRO CA
H A 0025 TRP CH2 3.735 H A 0031 PRO CG
H A 0025 TRP CH2 3.584 H A 0031 PRO CD
H A 0025 TRP CD2 3.628 C A 0037 PRO CA
H A 0025 TRP CE2 3.407 C A 0037 PRO CA
H A 0025 TRP CZ2 3.644 C A 0037 PRO CA
H A 0025 TRP CZ2 3.612 C A 0037 PRO CB
H A 0025 TRP CZ3 3.667 C A 0037 PRO CB
H A 0025 TRP CH2 3.500 C A 0037 PRO CB
H A 0025 TRP CB 3.587 C A 0038 PRO CG
H A 0025 TRP CB 3.267 C A 0038 PRO CD
H A 0025 TRP CG 3.277 C A 0038 PRO CD
H A 0025 TRP CD2 3.573 C A 0038 PRO CD
H A 0026 LEU C 2.448 H A 0027 LYS CA
H A 0026 LEU C 3.086 H A 0027 LYS C
H A 0026 LEU C 3.720 H A 0027 LYS CB
H A 0027 LYS C 2.446 H A 0028 ASN CA
H A 0027 LYS C 3.156 H A 0028 ASN C
H A 0027 LYS C 3.718 H A 0028 ASN CB
H A 0028 ASN C 2.429 H A 0029 GLY CA
H A 0028 ASN C 3.642 H A 0029 GLY C
H A 0029 GLY C 2.427 H A 0030 GLY CA
H A 0029 GLY C 3.088 H A 0030 GLY C
H A 0029 GLY CA 3.752 H A 0033 SER CB
H A 0029 GLY C 3.792 H A 0033 SER CB
H A 0030 GLY CA 2.910 H A 0031 PRO CD
H A 0030 GLY C 2.476 H A 0031 PRO CA
H A 0030 GLY C 3.087 H A 0031 PRO C
H A 0030 GLY C 3.671 H A 0031 PRO CB
H A 0030 GLY C 3.616 H A 0031 PRO CG
H A 0030 GLY C 2.503 H A 0031 PRO CD
H A 0031 PRO C 2.444 H A 0032 SER CA
H A 0031 PRO C 3.326 H A 0032 SER C
H A 0031 PRO C 3.625 H A 0032 SER CB
H A 0032 SER C 2.443 H A 0033 SER CA
H A 0032 SER C 3.488 H A 0033 SER C
H A 0032 SER C 3.508 H A 0033 SER CB
H A 0033 SER C 2.430 C A 0034 GLY CA
H A 0033 SER C 3.569 C A 0034 GLY C
C A 0034 GLY C 2.443 C A 0035 ALA CA
C A 0034 GLY C 3.309 C A 0035 ALA C
C A 0034 GLY C 3.626 C A 0035 ALA CB
C A 0035 ALA CA 2.912 C A 0036 PRO CD
C A 0035 ALA C 2.473 C A 0036 PRO CA
C A 0035 ALA C 3.163 C A 0036 PRO C
C A 0035 ALA C 3.652 C A 0036 PRO CB
C A 0035 ALA C 3.649 C A 0036 PRO CG
C A 0035 ALA C 2.510 C A 0036 PRO CD
C A 0035 ALA CB 3.428 C A 0036 PRO CD
C A 0036 PRO CA 2.909 C A 0037 PRO CD
C A 0036 PRO C 2.475 C A 0037 PRO CA
C A 0036 PRO C 3.158 C A 0037 PRO C
C A 0036 PRO C 3.657 C A 0037 PRO CB
C A 0036 PRO C 3.650 C A 0037 PRO CG
C A 0036 PRO C 2.511 C A 0037 PRO CD
C A 0036 PRO CB 3.380 C A 0037 PRO CD
C A 0037 PRO CA 2.904 C A 0038 PRO CD
C A 0037 PRO C 2.473 C A 0038 PRO CA
C A 0037 PRO C 3.189 C A 0038 PRO C
C A 0037 PRO C 3.641 C A 0038 PRO CB
C A 0037 PRO C 3.659 C A 0038 PRO CG
C A 0037 PRO C 2.508 C A 0038 PRO CD
C A 0037 PRO CB 3.782 C A 0038 PRO CD
C A 0038 PRO C 2.444 C A 0039 SER CA
C A 0038 PRO C 3.536 C A 0039 SER C
C A 0038 PRO C 3.451 C A 0039 SER CB
CHARGE_ATTR 2.00 12.00 18
H A 0009 ASP OD1 8.372 H A 0012 LYS NZ
H A 0009 ASP OD2 7.820 H A 0012 LYS NZ
H A 0015 GLU OE1 10.79 H A 0012 LYS NZ
H A 0015 GLU OE2 9.339 H A 0012 LYS NZ
H A 0016 GLU OE1 6.367 H A 0012 LYS NZ
H A 0016 GLU OE2 5.885 H A 0012 LYS NZ
H A 0016 GLU OE1 11.43 H A 0020 ARG NH1
H A 0016 GLU OE2 11.16 H A 0020 ARG NH1
H A 0017 GLU OE1 6.248 H A 0020 ARG NH1
H A 0017 GLU OE1 5.380 H A 0020 ARG NH2
H A 0017 GLU OE2 5.815 H A 0020 ARG NH1
H A 0017 GLU OE2 4.991 H A 0020 ARG NH2
H A 0024 GLU OE1 9.722 H A 0020 ARG NH1
H A 0024 GLU OE1 8.464 H A 0020 ARG NH2
H A 0024 GLU OE2 8.079 H A 0020 ARG NH1
H A 0024 GLU OE2 6.844 H A 0020 ARG NH2
H A 0024 GLU OE1 9.866 H A 0027 LYS NZ
H A 0024 GLU OE2 8.615 H A 0027 LYS NZ
CHARGE_REPU 2.00 12.00 21
H A 0009 ASP OD1 8.507 H A 0016 GLU OE1
H A 0009 ASP OD1 6.435 H A 0016 GLU OE2
H A 0009 ASP OD2 9.559 H A 0016 GLU OE1
H A 0009 ASP OD2 7.531 H A 0016 GLU OE2
H A 0009 ASP OD1 11.76 H A 0017 GLU OE1
H A 0015 GLU OE1 5.982 H A 0016 GLU OE1
H A 0015 GLU OE1 7.978 H A 0016 GLU OE2
H A 0015 GLU OE2 5.741 H A 0016 GLU OE1
H A 0015 GLU OE2 7.760 H A 0016 GLU OE2
H A 0015 GLU OE1 11.25 H A 0017 GLU OE1
H A 0015 GLU OE1 10.57 H A 0017 GLU OE2
H A 0016 GLU OE1 10.01 H A 0017 GLU OE1
H A 0016 GLU OE1 10.09 H A 0017 GLU OE2
H A 0016 GLU OE2 9.799 H A 0017 GLU OE1
H A 0016 GLU OE2 10.31 H A 0017 GLU OE2
H A 0017 GLU OE1 10.40 H A 0024 GLU OE1
H A 0017 GLU OE1 9.793 H A 0024 GLU OE2
H A 0017 GLU OE2 8.577 H A 0024 GLU OE1
H A 0017 GLU OE2 8.137 H A 0024 GLU OE2
H A 0020 ARG NH1 9.977 H A 0027 LYS NZ
H A 0020 ARG NH2 10.72 H A 0027 LYS NZ
HB_MM 2.00 3.20 59
C A 0002 GLY N 2.257 C A 0001 HIS O
C A 0003 GLU N 2.256 C A 0002 GLY O
C A 0004 GLY N 2.259 C A 0003 GLU O
C A 0005 THR N 2.257 C A 0004 GLY O
H A 0006 PHE N 2.256 C A 0005 THR O
H A 0007 THR N 2.260 H A 0006 PHE O
H A 0008 SER N 2.257 H A 0007 THR O
H A 0009 ASP N 3.190 H A 0006 PHE O
H A 0009 ASP N 2.255 H A 0008 SER O
H A 0010 LEU N 2.835 H A 0006 PHE O
H A 0010 LEU N 2.257 H A 0009 ASP O
H A 0011 SER N 2.909 H A 0007 THR O
H A 0011 SER N 2.260 H A 0010 LEU O
H A 0012 LYS N 2.256 H A 0011 SER O
H A 0013 GLN N 2.917 H A 0009 ASP O
H A 0013 GLN N 2.260 H A 0012 LYS O
H A 0014 MET N 2.988 H A 0010 LEU O
H A 0014 MET N 2.259 H A 0013 GLN O
H A 0015 GLU N 3.017 H A 0012 LYS O
H A 0015 GLU N 2.259 H A 0014 MET O
H A 0016 GLU N 3.086 H A 0012 LYS O
H A 0016 GLU N 3.118 H A 0013 GLN O
H A 0016 GLU N 2.259 H A 0015 GLU O
H A 0017 GLU N 2.950 H A 0013 GLN O
H A 0017 GLU N 2.259 H A 0016 GLU O
H A 0018 ALA N 2.258 H A 0017 GLU O
H A 0019 VAL N 3.131 H A 0016 GLU O
H A 0019 VAL N 2.261 H A 0018 ALA O
H A 0020 ARG N 3.151 H A 0017 GLU O
H A 0020 ARG N 2.258 H A 0019 VAL O
H A 0021 LEU N 2.258 H A 0020 ARG O
H A 0022 PHE N 3.003 H A 0018 ALA O
H A 0022 PHE N 2.259 H A 0021 LEU O
H A 0023 ILE N 2.786 H A 0019 VAL O
H A 0023 ILE N 2.262 H A 0022 PHE O
H A 0024 GLU N 2.942 H A 0020 ARG O
H A 0024 GLU N 2.259 H A 0023 ILE O
H A 0025 TRP N 2.939 H A 0021 LEU O
H A 0025 TRP N 2.261 H A 0024 GLU O
H A 0026 LEU N 3.012 H A 0022 PHE O
H A 0026 LEU N 2.250 H A 0025 TRP O
H A 0027 LYS N 3.056 H A 0023 ILE O
H A 0027 LYS N 3.192 H A 0024 GLU O
H A 0027 LYS N 2.259 H A 0026 LEU O
H A 0028 ASN N 3.169 H A 0024 GLU O
H A 0028 ASN N 2.259 H A 0027 LYS O
H A 0029 GLY N 2.258 H A 0028 ASN O
H A 0030 GLY N 2.819 H A 0025 TRP O
H A 0030 GLY N 2.258 H A 0029 GLY O
H A 0031 PRO N 2.255 H A 0030 GLY O
H A 0032 SER N 2.257 H A 0031 PRO O
H A 0033 SER N 2.254 H A 0032 SER O
C A 0034 GLY N 2.260 H A 0033 SER O
C A 0035 ALA N 2.256 C A 0034 GLY O
C A 0036 PRO N 2.257 C A 0035 ALA O
C A 0037 PRO N 2.258 C A 0036 PRO O
C A 0038 PRO N 2.257 C A 0037 PRO O
C A 0039 SER N 2.998 C A 0037 PRO O
C A 0039 SER N 2.257 C A 0038 PRO O
HB_MS 2.00 3.20 5
H A 0025 TRP O 3.146 H A 0028 ASN ND2
H A 0028 ASN O 3.053 H A 0033 SER OG
H A 0029 GLY N 2.903 H A 0028 ASN OD1
C A 0035 ALA O 2.961 H A 0025 TRP NE1
C A 0036 PRO O 3.183 H A 0025 TRP NE1
HB_SS 2.00 3.20 1
H A 0033 SER OG 2.713 H A 0028 ASN OD1