Complet list of 1xv3 con file
Complete list of 1xv3.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 178
C A 0001 HIS C 2.453 C A 0002 SER CA
C A 0001 HIS C 2.957 C A 0002 SER C
C A 0001 HIS C 2.980 C A 0002 SER CB
C A 0002 SER C 2.433 C A 0003 SER CA
C A 0002 SER C 3.205 C A 0003 SER C
C A 0002 SER C 3.611 C A 0003 SER CB
C A 0003 SER C 2.435 C A 0004 GLY CA
C A 0003 SER C 3.190 C A 0004 GLY C
C A 0004 GLY C 2.440 C A 0005 TYR CA
C A 0004 GLY C 3.703 C A 0005 TYR C
C A 0004 GLY C 3.074 C A 0005 TYR CB
C A 0005 TYR C 2.442 C A 0006 THR CA
C A 0005 TYR C 3.654 C A 0006 THR C
C A 0005 TYR C 3.199 C A 0006 THR CB
C A 0005 TYR CE1 3.620 C A 0007 ARG CZ
C A 0006 THR C 2.435 C A 0007 ARG CA
C A 0006 THR C 3.677 C A 0007 ARG C
C A 0006 THR C 3.138 C A 0007 ARG CB
C A 0006 THR C 3.727 C A 0008 PRO CD
C A 0006 THR CG2 3.535 C A 0008 PRO CD
C A 0007 ARG CA 2.854 C A 0008 PRO CD
C A 0007 ARG C 2.438 C A 0008 PRO CA
C A 0007 ARG C 3.138 C A 0008 PRO C
C A 0007 ARG C 3.611 C A 0008 PRO CB
C A 0007 ARG C 3.635 C A 0008 PRO CG
C A 0007 ARG C 2.486 C A 0008 PRO CD
C A 0008 PRO C 2.443 C A 0009 LEU CA
C A 0008 PRO C 3.006 C A 0009 LEU C
C A 0008 PRO C 3.661 C A 0009 LEU CB
C A 0009 LEU C 2.433 C A 0010 ARG CA
C A 0009 LEU C 3.615 C A 0010 ARG C
C A 0009 LEU C 3.262 C A 0010 ARG CB
C A 0010 ARG C 2.438 C A 0011 LYS CA
C A 0010 ARG C 3.127 C A 0011 LYS C
C A 0010 ARG C 3.641 C A 0011 LYS CB
C A 0011 LYS CA 2.856 C A 0012 PRO CD
C A 0011 LYS C 2.436 C A 0012 PRO CA
C A 0011 LYS C 3.160 C A 0012 PRO C
C A 0011 LYS C 3.604 C A 0012 PRO CB
C A 0011 LYS C 3.638 C A 0012 PRO CG
C A 0011 LYS C 2.485 C A 0012 PRO CD
C A 0011 LYS CB 3.295 C A 0012 PRO CD
C A 0011 LYS CG 3.788 C A 0012 PRO CD
C A 0012 PRO C 2.440 C A 0013 SER CA
C A 0012 PRO C 2.992 C A 0013 SER C
C A 0012 PRO C 3.656 C A 0013 SER CB
C A 0013 SER C 2.429 C A 0014 ARG CA
C A 0013 SER C 3.165 C A 0014 ARG C
C A 0013 SER C 3.626 C A 0014 ARG CB
C A 0014 ARG CA 2.863 C A 0015 PRO CD
C A 0014 ARG C 2.436 C A 0015 PRO CA
C A 0014 ARG C 3.107 C A 0015 PRO C
C A 0014 ARG C 3.618 C A 0015 PRO CB
C A 0014 ARG C 3.632 C A 0015 PRO CG
C A 0014 ARG C 2.492 C A 0015 PRO CD
C A 0014 ARG CB 3.477 C A 0015 PRO CD
C A 0015 PRO C 2.436 C A 0016 ILE CA
C A 0015 PRO C 3.092 C A 0016 ILE C
C A 0015 PRO C 3.661 C A 0016 ILE CB
C A 0016 ILE C 2.437 C A 0017 PHE CA
C A 0016 ILE C 3.703 C A 0017 PHE C
C A 0016 ILE C 3.035 C A 0017 PHE CB
C A 0017 PHE C 2.437 C A 0018 ILE CA
C A 0017 PHE C 3.060 C A 0018 ILE C
C A 0017 PHE C 3.671 C A 0018 ILE CB
C A 0017 PHE CD2 3.693 C A 0018 ILE CG1
C A 0017 PHE CE2 3.461 C A 0018 ILE CG1
C A 0018 ILE C 2.423 C A 0019 ARG CA
C A 0018 ILE C 3.234 C A 0019 ARG C
C A 0018 ILE C 3.592 C A 0019 ARG CB
C A 0019 ARG CA 2.852 C A 0020 PRO CD
C A 0019 ARG C 2.437 C A 0020 PRO CA
C A 0019 ARG C 3.105 C A 0020 PRO C
C A 0019 ARG C 3.620 C A 0020 PRO CB
C A 0019 ARG C 3.624 C A 0020 PRO CG
C A 0019 ARG C 2.484 C A 0020 PRO CD
C A 0019 ARG CB 3.283 C A 0020 PRO CD
C A 0019 ARG CD 3.470 C A 0023 CYS CB
C A 0019 ARG CZ 3.583 C A 0023 CYS CB
C A 0019 ARG CG 3.700 C A 0024 ASP CG
C A 0019 ARG CD 3.578 C A 0024 ASP CG
C A 0020 PRO C 2.439 C A 0021 ILE CA
C A 0020 PRO C 3.110 C A 0021 ILE C
C A 0020 PRO C 3.637 C A 0021 ILE CB
C A 0021 ILE C 2.434 C A 0022 GLY CA
C A 0021 ILE C 3.383 C A 0022 GLY C
C A 0022 GLY C 2.435 C A 0023 CYS CA
C A 0022 GLY C 3.081 C A 0023 CYS C
C A 0022 GLY C 3.647 C A 0023 CYS CB
C A 0023 CYS C 2.440 C A 0024 ASP CA
C A 0023 CYS C 3.165 C A 0024 ASP C
C A 0023 CYS C 3.635 C A 0024 ASP CB
C A 0024 ASP C 2.440 C A 0025 VAL CA
C A 0024 ASP C 3.620 C A 0025 VAL C
C A 0024 ASP C 3.253 C A 0025 VAL CB
C A 0024 ASP C 2.995 C A 0025 VAL CG2
C A 0025 VAL C 2.447 C A 0026 CYS CA
C A 0025 VAL C 2.945 C A 0026 CYS C
C A 0025 VAL C 3.659 C A 0026 CYS CB
C A 0026 CYS C 2.432 C A 0027 TYR CA
C A 0026 CYS C 3.388 C A 0027 TYR C
C A 0026 CYS C 3.520 C A 0027 TYR CB
C A 0026 CYS C 3.501 C A 0027 TYR CG
C A 0026 CYS CB 3.786 C A 0044 CYS CB
C A 0027 TYR C 2.431 C A 0028 GLY CA
C A 0027 TYR C 3.446 C A 0028 GLY C
C A 0027 TYR CD1 3.392 C A 0047 LEU CD2
C A 0027 TYR CE1 3.451 C A 0047 LEU CD2
C A 0028 GLY C 2.433 C A 0029 ILE CA
C A 0028 GLY C 3.141 C A 0029 ILE C
C A 0028 GLY C 3.657 C A 0029 ILE CB
C A 0029 ILE CA 2.844 H A 0030 PRO CD
C A 0029 ILE C 2.430 H A 0030 PRO CA
C A 0029 ILE C 3.119 H A 0030 PRO C
C A 0029 ILE C 3.609 H A 0030 PRO CB
C A 0029 ILE C 3.634 H A 0030 PRO CG
C A 0029 ILE C 2.480 H A 0030 PRO CD
C A 0029 ILE CB 3.261 H A 0030 PRO CD
C A 0029 ILE CD1 3.583 H A 0034 ALA CA
C A 0029 ILE CD1 3.741 H A 0034 ALA CB
H A 0030 PRO C 2.447 H A 0031 SER CA
H A 0030 PRO C 2.997 H A 0031 SER C
H A 0030 PRO C 3.659 H A 0031 SER CB
H A 0030 PRO CG 3.579 H A 0033 THR CB
H A 0030 PRO CD 3.708 H A 0033 THR CB
H A 0031 SER C 2.436 H A 0032 SER CA
H A 0031 SER C 2.993 H A 0032 SER C
H A 0031 SER C 3.661 H A 0032 SER CB
H A 0031 SER C 3.573 H A 0035 ARG CD
H A 0032 SER C 2.428 H A 0033 THR CA
H A 0032 SER C 3.018 H A 0033 THR C
H A 0032 SER C 3.655 H A 0033 THR CB
H A 0033 THR C 2.433 H A 0034 ALA CA
H A 0033 THR C 2.978 H A 0034 ALA C
H A 0033 THR C 3.655 H A 0034 ALA CB
H A 0034 ALA C 2.438 H A 0035 ARG CA
H A 0034 ALA C 2.999 H A 0035 ARG C
H A 0034 ALA C 3.676 H A 0035 ARG CB
H A 0035 ARG C 2.441 H A 0036 LEU CA
H A 0035 ARG C 3.028 H A 0036 LEU C
H A 0035 ARG C 3.653 H A 0036 LEU CB
H A 0036 LEU C 2.440 H A 0037 CYS CA
H A 0036 LEU C 3.036 H A 0037 CYS C
H A 0036 LEU C 3.655 H A 0037 CYS CB
H A 0037 CYS C 2.436 H A 0038 CYS CA
H A 0037 CYS C 3.208 H A 0038 CYS C
H A 0037 CYS C 3.607 H A 0038 CYS CB
H A 0038 CYS C 2.442 H A 0039 PHE CA
H A 0038 CYS C 3.100 H A 0039 PHE C
H A 0038 CYS C 3.650 H A 0039 PHE CB
H A 0039 PHE C 2.430 H A 0040 ARG CA
H A 0039 PHE C 3.330 H A 0040 ARG C
H A 0039 PHE C 3.557 H A 0040 ARG CB
H A 0040 ARG C 2.428 C A 0041 TYR CA
H A 0040 ARG C 3.170 C A 0041 TYR C
H A 0040 ARG C 3.628 C A 0041 TYR CB
C A 0041 TYR C 2.427 C A 0042 GLY CA
C A 0041 TYR C 3.332 C A 0042 GLY C
C A 0041 TYR CB 3.712 C A 0043 ASP CG
C A 0042 GLY C 2.439 C A 0043 ASP CA
C A 0042 GLY C 3.385 C A 0043 ASP C
C A 0042 GLY C 3.549 C A 0043 ASP CB
C A 0042 GLY C 3.538 C A 0043 ASP CG
C A 0043 ASP C 2.451 C A 0044 CYS CA
C A 0043 ASP C 3.008 C A 0044 CYS C
C A 0043 ASP C 2.919 C A 0044 CYS CB
C A 0044 CYS C 2.433 C A 0045 CYS CA
C A 0044 CYS C 3.249 C A 0045 CYS C
C A 0044 CYS C 3.588 C A 0045 CYS CB
C A 0044 CYS CA 3.517 C A 0047 LEU CD1
C A 0044 CYS C 3.563 C A 0047 LEU CD1
C A 0044 CYS CB 3.710 C A 0047 LEU CD1
C A 0045 CYS C 2.432 C A 0046 HIS CA
C A 0045 CYS C 3.343 C A 0046 HIS C
C A 0045 CYS C 3.538 C A 0046 HIS CB
C A 0046 HIS C 2.438 C A 0047 LEU CA
C A 0046 HIS C 3.260 C A 0047 LEU C
C A 0046 HIS C 3.599 C A 0047 LEU CB
CHARGE_ATTR 2.00 12.00 8
C A 0024 ASP OD1 4.898 C A 0019 ARG NH1
C A 0024 ASP OD1 4.011 C A 0019 ARG NH2
C A 0024 ASP OD2 5.619 C A 0019 ARG NH1
C A 0024 ASP OD2 5.161 C A 0019 ARG NH2
C A 0043 ASP OD1 4.071 C A 0019 ARG NH1
C A 0043 ASP OD1 3.598 C A 0019 ARG NH2
C A 0043 ASP OD2 3.282 C A 0019 ARG NH1
C A 0043 ASP OD2 2.875 C A 0019 ARG NH2
CHARGE_REPU 2.00 12.00 12
C A 0007 ARG NH1 10.79 C A 0010 ARG NH1
C A 0007 ARG NH1 11.78 C A 0010 ARG NH2
C A 0007 ARG NH2 11.63 C A 0010 ARG NH1
C A 0010 ARG NH1 11.91 C A 0011 LYS NZ
C A 0010 ARG NH1 11.46 C A 0014 ARG NH2
C A 0010 ARG NH2 10.72 C A 0014 ARG NH2
C A 0011 LYS NZ 4.589 C A 0014 ARG NH1
C A 0011 LYS NZ 5.982 C A 0014 ARG NH2
C A 0024 ASP OD1 7.579 C A 0043 ASP OD1
C A 0024 ASP OD1 6.707 C A 0043 ASP OD2
C A 0024 ASP OD2 8.707 C A 0043 ASP OD1
C A 0024 ASP OD2 7.369 C A 0043 ASP OD2
HB_MM 2.00 3.20 63
C A 0002 SER N 2.212 C A 0001 HIS O
C A 0003 SER N 2.203 C A 0002 SER O
C A 0004 GLY N 2.206 C A 0003 SER O
C A 0005 TYR N 2.208 C A 0004 GLY O
C A 0006 THR N 2.207 C A 0005 TYR O
C A 0007 ARG N 2.207 C A 0006 THR O
C A 0008 PRO N 2.233 C A 0007 ARG O
C A 0009 LEU N 2.208 C A 0008 PRO O
C A 0010 ARG N 2.205 C A 0009 LEU O
C A 0011 LYS N 2.206 C A 0010 ARG O
C A 0012 PRO N 2.233 C A 0011 LYS O
C A 0013 SER N 2.208 C A 0012 PRO O
C A 0014 ARG N 2.204 C A 0013 SER O
C A 0015 PRO N 2.234 C A 0014 ARG O
C A 0016 ILE N 2.206 C A 0015 PRO O
C A 0017 PHE N 2.206 C A 0016 ILE O
C A 0018 ILE N 2.206 C A 0017 PHE O
C A 0019 ARG N 2.201 C A 0018 ILE O
C A 0020 PRO N 2.233 C A 0019 ARG O
C A 0021 ILE N 2.204 C A 0020 PRO O
C A 0022 GLY N 2.204 C A 0021 ILE O
C A 0023 CYS N 2.205 C A 0022 GLY O
C A 0024 ASP N 2.206 C A 0023 CYS O
C A 0025 VAL N 3.122 C A 0023 CYS O
C A 0025 VAL N 2.207 C A 0024 ASP O
C A 0026 CYS N 2.208 C A 0025 VAL O
C A 0027 TYR N 2.794 C A 0025 VAL O
C A 0027 TYR N 2.205 C A 0026 CYS O
C A 0028 GLY N 2.203 C A 0027 TYR O
C A 0029 ILE N 2.204 C A 0028 GLY O
H A 0030 PRO N 2.230 C A 0029 ILE O
H A 0031 SER N 2.212 H A 0030 PRO O
H A 0032 SER N 2.205 H A 0031 SER O
H A 0033 THR N 3.178 H A 0030 PRO O
H A 0033 THR N 2.204 H A 0032 SER O
H A 0034 ALA N 2.841 H A 0030 PRO O
H A 0034 ALA N 3.191 H A 0031 SER O
H A 0034 ALA N 2.208 H A 0033 THR O
H A 0035 ARG N 2.829 H A 0031 SER O
H A 0035 ARG N 2.208 H A 0034 ALA O
H A 0036 LEU N 3.164 H A 0032 SER O
H A 0036 LEU N 3.130 H A 0033 THR O
H A 0036 LEU N 2.209 H A 0035 ARG O
H A 0037 CYS N 2.769 H A 0033 THR O
H A 0037 CYS N 2.208 H A 0036 LEU O
H A 0038 CYS N 3.020 H A 0034 ALA O
H A 0038 CYS N 3.189 H A 0035 ARG O
H A 0038 CYS N 2.202 H A 0037 CYS O
H A 0038 CYS N 3.159 C A 0043 ASP O
H A 0039 PHE N 2.787 H A 0035 ARG O
H A 0039 PHE N 2.206 H A 0038 CYS O
H A 0040 ARG N 2.870 H A 0036 LEU O
H A 0040 ARG N 2.201 H A 0039 PHE O
C A 0041 TYR N 3.127 H A 0037 CYS O
C A 0041 TYR N 2.200 H A 0040 ARG O
C A 0042 GLY N 2.693 H A 0037 CYS O
C A 0042 GLY N 2.201 C A 0041 TYR O
C A 0043 ASP N 3.038 H A 0037 CYS O
C A 0043 ASP N 2.205 C A 0042 GLY O
C A 0044 CYS N 2.210 C A 0043 ASP O
C A 0045 CYS N 2.206 C A 0044 CYS O
C A 0046 HIS N 2.204 C A 0045 CYS O
C A 0047 LEU N 2.206 C A 0046 HIS O
HB_MS 2.00 3.20 3
C A 0005 TYR O 2.912 C A 0006 THR OG1
C A 0012 PRO O 3.058 C A 0014 ARG NH2
C A 0013 SER O 3.059 C A 0014 ARG NH2
HB_SS 2.00 3.20 2
C A 0007 ARG NH1 2.915 C A 0005 TYR OH
C A 0007 ARG NH2 2.943 C A 0005 TYR OH
AROMATIC 0.00 8.00 2
C A 0019 ARG 4.839 C A 0041 TYR
H A 0040 ARG 5.785 H A 0039 PHE
SS_BOND 1.50 2.80 3
C A 0023 CYS SG 2.019 H A 0037 CYS SG
C A 0026 CYS SG 2.022 C A 0044 CYS SG
H A 0038 CYS SG 2.020 C A 0045 CYS SG