Complet list of 1hit con file
Complete list of 1hit.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 88
C A 0001 GLY C 2.456 C A 0002 ILE CA
C A 0001 GLY C 3.430 C A 0002 ILE C
C A 0001 GLY C 3.617 C A 0002 ILE CB
C A 0001 GLY C 3.659 C A 0002 ILE CG2
C A 0002 ILE C 2.452 C A 0003 VAL CA
C A 0002 ILE C 3.249 C A 0003 VAL C
C A 0002 ILE C 3.606 C A 0003 VAL CB
C A 0002 ILE C 3.736 H A 0005 GLN CB
C A 0002 ILE CB 3.386 H A 0019 TYR CE2
C A 0002 ILE CB 3.504 H A 0019 TYR CZ
C A 0002 ILE CG1 3.382 H A 0019 TYR CD2
C A 0002 ILE CG1 3.101 H A 0019 TYR CE2
C A 0002 ILE CG1 3.397 H A 0019 TYR CZ
C A 0003 VAL C 2.449 H A 0004 GLU CA
C A 0003 VAL C 3.027 H A 0004 GLU C
C A 0003 VAL C 3.707 H A 0004 GLU CB
H A 0004 GLU C 2.453 H A 0005 GLN CA
H A 0004 GLU C 2.913 H A 0005 GLN C
H A 0004 GLU C 3.707 H A 0005 GLN CB
H A 0005 GLN C 2.470 H A 0006 CYS CA
H A 0005 GLN C 3.129 H A 0006 CYS C
H A 0005 GLN C 3.706 H A 0006 CYS CB
H A 0006 CYS C 2.453 H A 0007 CYS CA
H A 0006 CYS C 3.420 H A 0007 CYS C
H A 0006 CYS C 3.575 H A 0007 CYS CB
H A 0007 CYS C 2.445 H A 0008 THR CA
H A 0007 CYS C 3.172 H A 0008 THR C
H A 0007 CYS C 3.660 H A 0008 THR CB
H A 0008 THR C 2.480 H A 0009 SER CA
H A 0008 THR C 3.542 H A 0009 SER C
H A 0008 THR C 3.446 H A 0009 SER CB
H A 0009 SER C 2.457 C A 0010 ILE CA
H A 0009 SER C 3.296 C A 0010 ILE C
H A 0009 SER C 3.640 C A 0010 ILE CB
H A 0009 SER C 3.756 C A 0010 ILE CG1
C A 0010 ILE C 2.445 C A 0011 CYS CA
C A 0010 ILE C 3.597 C A 0011 CYS C
C A 0010 ILE C 3.402 C A 0011 CYS CB
C A 0011 CYS C 2.460 C A 0012 SER CA
C A 0011 CYS C 3.395 C A 0012 SER C
C A 0011 CYS C 3.600 C A 0012 SER CB
C A 0012 SER C 2.449 C A 0013 LEU CA
C A 0012 SER C 3.402 C A 0013 LEU C
C A 0012 SER C 3.567 C A 0013 LEU CB
C A 0012 SER C 3.626 C A 0013 LEU CG
C A 0012 SER C 3.757 C A 0013 LEU CD2
C A 0013 LEU C 2.447 C A 0014 TYR CA
C A 0013 LEU C 3.409 C A 0014 TYR C
C A 0013 LEU C 3.541 C A 0014 TYR CB
C A 0014 TYR C 2.457 H A 0015 GLN CA
C A 0014 TYR C 2.904 H A 0015 GLN C
C A 0014 TYR C 3.695 H A 0015 GLN CB
C A 0014 TYR CA 3.781 H A 0017 GLU CB
C A 0014 TYR C 3.686 H A 0017 GLU CB
H A 0015 GLN C 2.436 H A 0016 LEU CA
H A 0015 GLN C 3.067 H A 0016 LEU C
H A 0015 GLN C 3.729 H A 0016 LEU CB
H A 0015 GLN CA 3.717 H A 0019 TYR CE2
H A 0015 GLN CA 3.536 H A 0019 TYR CZ
H A 0015 GLN C 3.484 H A 0019 TYR CD2
H A 0015 GLN C 3.685 H A 0019 TYR CE1
H A 0015 GLN C 3.160 H A 0019 TYR CE2
H A 0015 GLN C 3.274 H A 0019 TYR CZ
H A 0015 GLN CB 3.551 H A 0019 TYR CE2
H A 0015 GLN CB 3.652 H A 0019 TYR CZ
H A 0016 LEU C 2.439 H A 0017 GLU CA
H A 0016 LEU C 3.027 H A 0017 GLU C
H A 0016 LEU C 3.697 H A 0017 GLU CB
H A 0016 LEU CA 3.586 H A 0019 TYR CG
H A 0016 LEU CA 3.221 H A 0019 TYR CD2
H A 0016 LEU CA 3.753 H A 0019 TYR CE2
H A 0016 LEU CG 3.520 H A 0019 TYR CD2
H A 0016 LEU CD1 3.319 H A 0019 TYR CD2
H A 0016 LEU CD1 3.627 H A 0019 TYR CE2
H A 0017 GLU C 2.471 H A 0018 ASN CA
H A 0017 GLU C 3.470 H A 0018 ASN C
H A 0017 GLU C 3.534 H A 0018 ASN CB
H A 0018 ASN C 2.457 H A 0019 TYR CA
H A 0018 ASN C 3.459 H A 0019 TYR C
H A 0018 ASN C 3.623 H A 0019 TYR CB
H A 0018 ASN C 3.705 H A 0019 TYR CG
H A 0018 ASN C 3.242 H A 0019 TYR CD1
H A 0019 TYR C 2.449 C A 0020 CYS CA
H A 0019 TYR C 3.557 C A 0020 CYS C
H A 0019 TYR C 3.441 C A 0020 CYS CB
C A 0020 CYS C 2.465 C A 0021 ASN CA
C A 0020 CYS C 3.586 C A 0021 ASN C
C A 0020 CYS C 3.397 C A 0021 ASN CB
HB_MM 2.00 3.20 29
C A 0002 ILE N 2.231 C A 0001 GLY O
C A 0003 VAL N 2.231 C A 0002 ILE O
H A 0004 GLU N 2.237 C A 0003 VAL O
H A 0005 GLN N 2.224 H A 0004 GLU O
H A 0006 CYS N 2.232 H A 0005 GLN O
H A 0007 CYS N 3.054 H A 0004 GLU O
H A 0007 CYS N 2.916 H A 0005 GLN O
H A 0007 CYS N 2.216 H A 0006 CYS O
H A 0008 THR N 2.819 H A 0004 GLU O
H A 0008 THR N 2.222 H A 0007 CYS O
H A 0009 SER N 2.883 H A 0005 GLN O
H A 0009 SER N 2.229 H A 0008 THR O
C A 0010 ILE N 2.227 H A 0009 SER O
C A 0011 CYS N 2.221 C A 0010 ILE O
C A 0012 SER N 2.237 C A 0011 CYS O
C A 0013 LEU N 2.234 C A 0012 SER O
C A 0014 TYR N 2.232 C A 0013 LEU O
H A 0015 GLN N 2.232 C A 0014 TYR O
H A 0016 LEU N 2.219 H A 0015 GLN O
H A 0017 GLU N 2.942 C A 0014 TYR O
H A 0017 GLU N 2.930 H A 0015 GLN O
H A 0017 GLU N 2.226 H A 0016 LEU O
H A 0018 ASN N 2.884 H A 0015 GLN O
H A 0018 ASN N 3.027 H A 0016 LEU O
H A 0018 ASN N 2.233 H A 0017 GLU O
H A 0019 TYR N 2.915 H A 0016 LEU O
H A 0019 TYR N 2.232 H A 0018 ASN O
C A 0020 CYS N 2.228 H A 0019 TYR O
C A 0021 ASN N 2.236 C A 0020 CYS O
HB_MS 2.00 3.20 3
C A 0013 LEU N 3.081 C A 0012 SER OG
H A 0018 ASN N 3.006 H A 0017 GLU OE1
H A 0018 ASN O 3.172 C A 0021 ASN ND2
HB_SS 2.00 3.20 1
H A 0015 GLN NE2 3.003 C A 0012 SER OG
SS_BOND 1.50 2.80 1
H A 0006 CYS SG 2.018 C A 0011 CYS SG
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 16
H A 0006 CYS CB 3.438 H B 0011 LEU CD2
H A 0008 THR C 3.777 C B 0005 HIS CE1
H A 0009 SER CA 3.574 C B 0005 HIS CE1
H A 0009 SER C 3.635 C B 0005 HIS CE1
C A 0010 ILE CD1 3.708 C B 0003 ASN C
C A 0010 ILE CD1 3.425 C B 0004 GLN C
C A 0010 ILE CD1 3.629 C B 0005 HIS CE1
C A 0013 LEU CD2 3.686 C B 0001 PHE CE1
H A 0016 LEU CD2 3.708 H B 0015 LEU CB
H A 0016 LEU CD2 3.633 H B 0015 LEU CD2
H A 0017 GLU CB 3.708 H B 0018 VAL CG1
H A 0017 GLU CG 3.653 H B 0018 VAL CG1
C A 0020 CYS CA 3.768 H B 0015 LEU CD1
C A 0020 CYS CB 3.487 H B 0015 LEU C
C A 0020 CYS CB 3.684 H B 0015 LEU CD1
C A 0020 CYS CB 3.570 H B 0019 CYS CB
CHARGE_ATTR 2.00 12.00 4
H A 0004 GLU OE1 10.00 C B 0005 HIS ND1
H A 0004 GLU OE1 11.37 C B 0005 HIS NE2
H A 0004 GLU OE2 7.933 C B 0005 HIS ND1
H A 0004 GLU OE2 9.259 C B 0005 HIS NE2
HB_MM 2.00 3.20 1
H A 0006 CYS O 2.933 C B 0006 LEU N
HB_MS 2.00 3.20 1
H A 0009 SER O 3.007 C B 0005 HIS ND1
SS_BOND 1.50 2.80 2
H A 0007 CYS SG 2.021 C B 0007 CYS SG
C A 0020 CYS SG 2.022 H B 0019 CYS SG
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 127
C B 0001 PHE C 2.451 C B 0002 VAL CA
C B 0001 PHE C 3.487 C B 0002 VAL C
C B 0001 PHE C 3.492 C B 0002 VAL CB
C B 0001 PHE C 3.507 C B 0002 VAL CG1
C B 0002 VAL C 2.460 C B 0003 ASN CA
C B 0002 VAL C 3.520 C B 0003 ASN C
C B 0002 VAL C 3.458 C B 0003 ASN CB
C B 0002 VAL C 3.520 C B 0003 ASN CG
C B 0003 ASN C 2.451 C B 0004 GLN CA
C B 0003 ASN C 3.483 C B 0004 GLN C
C B 0003 ASN C 3.442 C B 0004 GLN CB
C B 0004 GLN C 2.452 C B 0005 HIS CA
C B 0004 GLN C 3.263 C B 0005 HIS C
C B 0004 GLN C 3.621 C B 0005 HIS CB
C B 0005 HIS C 2.453 C B 0006 LEU CA
C B 0005 HIS C 3.407 C B 0006 LEU C
C B 0005 HIS C 3.549 C B 0006 LEU CB
C B 0005 HIS C 3.579 C B 0006 LEU CG
C B 0005 HIS C 3.504 C B 0006 LEU CD2
C B 0006 LEU C 2.435 C B 0007 CYS CA
C B 0006 LEU C 3.601 C B 0007 CYS C
C B 0006 LEU C 3.368 C B 0007 CYS CB
C B 0006 LEU C 3.695 H B 0011 LEU CG
C B 0007 CYS C 2.502 C B 0008 GLY CA
C B 0007 CYS C 2.982 C B 0008 GLY C
C B 0007 CYS CA 3.787 H B 0011 LEU CG
C B 0007 CYS CA 3.635 H B 0011 LEU CD1
C B 0008 GLY C 2.514 C B 0009 SER CA
C B 0008 GLY C 3.660 C B 0009 SER C
C B 0008 GLY C 2.969 C B 0009 SER CB
C B 0009 SER CA 3.793 C B 0010 HIS CA
C B 0009 SER C 2.430 C B 0010 HIS CA
C B 0009 SER C 2.915 C B 0010 HIS C
C B 0009 SER C 3.693 C B 0010 HIS CB
C B 0010 HIS CA 3.797 H B 0011 LEU CA
C B 0010 HIS C 2.441 H B 0011 LEU CA
C B 0010 HIS C 2.918 H B 0011 LEU C
C B 0010 HIS C 3.719 H B 0011 LEU CB
C B 0010 HIS CA 3.610 H B 0013 GLU CG
C B 0010 HIS C 3.752 H B 0013 GLU CG
H B 0011 LEU C 2.425 H B 0012 VAL CA
H B 0011 LEU C 2.924 H B 0012 VAL C
H B 0011 LEU C 3.756 H B 0012 VAL CB
H B 0012 VAL C 2.413 H B 0013 GLU CA
H B 0012 VAL C 3.239 H B 0013 GLU C
H B 0012 VAL C 3.636 H B 0013 GLU CB
H B 0012 VAL C 3.716 H B 0016 TYR CD2
H B 0013 GLU C 2.449 H B 0014 ALA CA
H B 0013 GLU C 3.292 H B 0014 ALA C
H B 0013 GLU C 3.581 H B 0014 ALA CB
H B 0013 GLU CA 3.514 H B 0016 TYR CG
H B 0013 GLU CA 3.401 H B 0016 TYR CD1
H B 0013 GLU CA 3.671 H B 0016 TYR CD2
H B 0013 GLU CA 3.500 H B 0016 TYR CE1
H B 0013 GLU CA 3.759 H B 0016 TYR CE2
H B 0013 GLU CA 3.687 H B 0016 TYR CZ
H B 0013 GLU CB 3.334 H B 0016 TYR CE1
H B 0013 GLU CB 3.691 H B 0016 TYR CE2
H B 0013 GLU CB 3.259 H B 0016 TYR CZ
H B 0014 ALA CA 3.779 H B 0015 LEU CA
H B 0014 ALA C 2.425 H B 0015 LEU CA
H B 0014 ALA C 2.990 H B 0015 LEU C
H B 0014 ALA C 3.714 H B 0015 LEU CB
H B 0014 ALA C 3.746 H B 0017 LEU CB
H B 0015 LEU C 2.415 H B 0016 TYR CA
H B 0015 LEU C 3.057 H B 0016 TYR C
H B 0015 LEU C 3.709 H B 0016 TYR CB
H B 0016 TYR C 2.440 H B 0017 LEU CA
H B 0016 TYR C 3.029 H B 0017 LEU C
H B 0016 TYR C 3.698 H B 0017 LEU CB
H B 0016 TYR C 3.483 H B 0019 CYS C
H B 0016 TYR CE1 3.706 C B 0025 PHE CA
H B 0016 TYR CE1 3.513 C B 0025 PHE CB
H B 0016 TYR CZ 3.505 C B 0025 PHE CB
H B 0017 LEU C 2.444 H B 0018 VAL CA
H B 0017 LEU C 2.859 H B 0018 VAL C
H B 0017 LEU C 3.731 H B 0018 VAL CB
H B 0018 VAL C 2.466 H B 0019 CYS CA
H B 0018 VAL C 3.368 H B 0019 CYS C
H B 0018 VAL C 3.631 H B 0019 CYS CB
H B 0019 CYS C 2.473 C B 0020 GLY CA
H B 0019 CYS C 3.480 C B 0020 GLY C
C B 0020 GLY CA 3.792 C B 0021 GLU CA
C B 0020 GLY CA 3.673 C B 0021 GLU CD
C B 0020 GLY C 2.475 C B 0021 GLU CA
C B 0020 GLY C 2.950 C B 0021 GLU C
C B 0020 GLY C 3.234 C B 0021 GLU CB
C B 0020 GLY C 3.313 C B 0021 GLU CD
C B 0020 GLY C 3.615 C B 0024 GLY C
C B 0021 GLU C 2.451 C B 0022 ARG CA
C B 0021 GLU C 3.383 C B 0022 ARG C
C B 0021 GLU C 3.555 C B 0022 ARG CB
C B 0022 ARG C 2.457 C B 0023 GLY CA
C B 0022 ARG C 3.509 C B 0023 GLY C
C B 0023 GLY C 2.465 C B 0024 GLY CA
C B 0023 GLY C 3.549 C B 0024 GLY C
C B 0024 GLY C 2.436 C B 0025 PHE CA
C B 0024 GLY C 3.551 C B 0025 PHE C
C B 0024 GLY C 3.415 C B 0025 PHE CB
C B 0025 PHE C 2.454 C B 0026 TYR CA
C B 0025 PHE C 3.535 C B 0026 TYR C
C B 0025 PHE C 3.369 C B 0026 TYR CB
C B 0025 PHE CD2 3.523 C B 0026 TYR CB
C B 0025 PHE CE2 3.558 C B 0026 TYR CB
C B 0026 TYR C 2.440 C B 0027 THR CA
C B 0026 TYR C 3.646 C B 0027 THR C
C B 0026 TYR C 3.326 C B 0027 THR CB
C B 0026 TYR CE2 3.557 C B 0028 PRO CG
C B 0026 TYR CE2 3.772 C B 0028 PRO CD
C B 0027 THR CA 3.012 C B 0028 PRO CD
C B 0027 THR C 2.472 C B 0028 PRO CA
C B 0027 THR C 3.071 C B 0028 PRO C
C B 0027 THR C 3.665 C B 0028 PRO CB
C B 0027 THR C 3.600 C B 0028 PRO CG
C B 0027 THR C 2.512 C B 0028 PRO CD
C B 0027 THR CB 3.077 C B 0028 PRO CD
C B 0027 THR CG2 3.780 C B 0028 PRO CD
C B 0028 PRO C 2.451 C B 0029 LYS CA
C B 0028 PRO C 3.453 C B 0029 LYS C
C B 0028 PRO C 3.585 C B 0029 LYS CB
C B 0028 PRO C 3.725 C B 0029 LYS CG
C B 0028 PRO C 3.776 C B 0029 LYS CD
C B 0028 PRO CB 3.677 C B 0029 LYS CD
C B 0028 PRO CG 3.778 C B 0029 LYS CD
C B 0029 LYS C 2.461 C B 0030 THR CA
C B 0029 LYS C 3.511 C B 0030 THR C
C B 0029 LYS C 3.487 C B 0030 THR CB
CHARGE_ATTR 2.00 12.00 7
H B 0013 GLU OE1 5.706 C B 0010 HIS ND1
H B 0013 GLU OE1 5.870 C B 0010 HIS NE2
H B 0013 GLU OE2 4.204 C B 0010 HIS ND1
H B 0013 GLU OE2 5.089 C B 0010 HIS NE2
C B 0021 GLU OE1 10.94 C B 0022 ARG NH1
C B 0021 GLU OE2 11.92 C B 0022 ARG NH1
C B 0021 GLU OE2 11.35 C B 0029 LYS NZ
CHARGE_REPU 2.00 12.00 1
C B 0005 HIS ND1 11.86 C B 0010 HIS ND1
HB_MM 2.00 3.20 47
C B 0002 VAL N 2.230 C B 0001 PHE O
C B 0003 ASN N 2.232 C B 0002 VAL O
C B 0004 GLN N 2.232 C B 0003 ASN O
C B 0005 HIS N 2.224 C B 0004 GLN O
C B 0006 LEU N 2.241 C B 0005 HIS O
C B 0007 CYS N 2.229 C B 0006 LEU O
C B 0008 GLY N 2.246 C B 0007 CYS O
C B 0009 SER N 2.778 C B 0007 CYS O
C B 0009 SER N 2.248 C B 0008 GLY O
C B 0010 HIS N 3.053 C B 0007 CYS O
C B 0010 HIS N 2.223 C B 0009 SER O
H B 0011 LEU N 2.244 C B 0010 HIS O
H B 0012 VAL N 3.110 C B 0009 SER O
H B 0012 VAL N 2.230 H B 0011 LEU O
H B 0013 GLU N 3.047 C B 0009 SER O
H B 0013 GLU N 3.081 C B 0010 HIS O
H B 0013 GLU N 2.216 H B 0012 VAL O
H B 0014 ALA N 2.965 C B 0010 HIS O
H B 0014 ALA N 3.017 H B 0011 LEU O
H B 0014 ALA N 2.995 H B 0012 VAL O
H B 0014 ALA N 2.237 H B 0013 GLU O
H B 0015 LEU N 3.095 H B 0011 LEU O
H B 0015 LEU N 2.230 H B 0014 ALA O
H B 0016 TYR N 2.825 H B 0012 VAL O
H B 0016 TYR N 2.218 H B 0015 LEU O
H B 0017 LEU N 3.035 H B 0014 ALA O
H B 0017 LEU N 3.099 H B 0015 LEU O
H B 0017 LEU N 2.230 H B 0016 TYR O
H B 0018 VAL N 3.164 H B 0014 ALA O
H B 0018 VAL N 2.243 H B 0017 LEU O
H B 0019 CYS N 3.066 H B 0015 LEU O
H B 0019 CYS N 3.107 H B 0017 LEU O
H B 0019 CYS N 2.241 H B 0018 VAL O
C B 0020 GLY N 2.594 H B 0016 TYR O
C B 0020 GLY N 2.761 H B 0017 LEU O
C B 0020 GLY N 2.225 H B 0019 CYS O
C B 0021 GLU N 2.240 C B 0020 GLY O
C B 0022 ARG N 2.222 C B 0021 GLU O
C B 0023 GLY N 2.233 C B 0022 ARG O
C B 0024 GLY N 3.010 C B 0020 GLY O
C B 0024 GLY N 2.237 C B 0023 GLY O
C B 0025 PHE N 2.225 C B 0024 GLY O
C B 0026 TYR N 2.235 C B 0025 PHE O
C B 0027 THR N 2.230 C B 0026 TYR O
C B 0028 PRO N 2.222 C B 0027 THR O
C B 0029 LYS N 2.230 C B 0028 PRO O
C B 0030 THR N 2.230 C B 0029 LYS O
HB_MS 2.00 3.20 6
C B 0002 VAL O 2.889 C B 0003 ASN ND2
C B 0007 CYS O 3.034 C B 0009 SER OG
C B 0008 GLY O 2.780 C B 0009 SER OG
C B 0010 HIS N 2.666 C B 0009 SER OG
C B 0025 PHE N 3.026 C B 0021 GLU OE1
C B 0026 TYR O 3.125 C B 0027 THR OG1
HB_SS 2.00 3.20 3
C B 0010 HIS ND1 3.021 C B 0009 SER OG
C B 0021 GLU OE2 2.898 C B 0027 THR OG1
C B 0029 LYS NZ 3.042 C B 0026 TYR OH
AROMATIC 0.00 8.00 2
H B 0016 TYR 5.966 C B 0025 PHE
C B 0029 LYS 5.159 C B 0026 TYR