Complet list of 1liq con file
Complete list of 1liq.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 112
H A 0001 GLU CA 3.793 H A 0002 VAL CA
H A 0001 GLU C 2.432 H A 0002 VAL CA
H A 0001 GLU C 2.994 H A 0002 VAL C
H A 0001 GLU C 3.727 H A 0002 VAL CB
H A 0001 GLU CA 3.647 H A 0016 VAL CG1
H A 0001 GLU CA 3.437 H A 0019 HIS CD2
H A 0001 GLU C 2.989 H A 0019 HIS CD2
H A 0002 VAL C 2.433 H A 0003 ARG CA
H A 0002 VAL C 3.054 H A 0003 ARG C
H A 0002 VAL C 3.709 H A 0003 ARG CB
H A 0002 VAL CG2 3.301 C A 0010 CYS C
H A 0002 VAL CG2 3.429 C A 0010 CYS CB
H A 0002 VAL CG1 3.420 C A 0014 LYS CA
H A 0002 VAL CG1 3.398 C A 0014 LYS C
H A 0002 VAL CG1 3.726 H A 0016 VAL CG2
H A 0002 VAL CA 3.781 H A 0019 HIS CB
H A 0002 VAL CA 3.462 H A 0019 HIS CG
H A 0002 VAL CA 3.500 H A 0019 HIS CD2
H A 0002 VAL CB 3.553 H A 0019 HIS CB
H A 0003 ARG C 2.434 H A 0004 ALA CA
H A 0003 ARG C 3.335 H A 0004 ALA C
H A 0003 ARG C 3.599 H A 0004 ALA CB
H A 0004 ALA C 2.431 H A 0005 CYS CA
H A 0004 ALA C 3.122 H A 0005 CYS C
H A 0004 ALA C 3.698 H A 0005 CYS CB
H A 0005 CYS CA 3.799 C A 0006 SER CA
H A 0005 CYS C 2.432 C A 0006 SER CA
H A 0005 CYS C 3.488 C A 0006 SER C
H A 0005 CYS C 3.478 C A 0006 SER CB
H A 0005 CYS CB 3.402 H A 0019 HIS CE1
C A 0006 SER C 2.436 C A 0007 LEU CA
C A 0006 SER C 3.391 C A 0007 LEU C
C A 0006 SER C 3.578 C A 0007 LEU CB
C A 0007 LEU CA 2.910 C A 0008 PRO CD
C A 0007 LEU C 2.465 C A 0008 PRO CA
C A 0007 LEU C 3.220 C A 0008 PRO C
C A 0007 LEU C 3.619 C A 0008 PRO CB
C A 0007 LEU C 3.662 C A 0008 PRO CG
C A 0007 LEU C 2.510 C A 0008 PRO CD
C A 0007 LEU CB 3.552 C A 0008 PRO CD
C A 0008 PRO C 2.439 C A 0009 HIS CA
C A 0008 PRO C 3.150 C A 0009 HIS C
C A 0008 PRO C 3.693 C A 0009 HIS CB
C A 0009 HIS CA 3.789 C A 0010 CYS CA
C A 0009 HIS C 2.432 C A 0010 CYS CA
C A 0009 HIS C 3.041 C A 0010 CYS C
C A 0009 HIS C 3.706 C A 0010 CYS CB
C A 0010 CYS C 2.432 C A 0011 ARG CA
C A 0010 CYS C 3.138 C A 0011 ARG C
C A 0010 CYS C 3.690 C A 0011 ARG CB
C A 0011 ARG C 2.434 C A 0012 THR CA
C A 0011 ARG C 3.587 C A 0012 THR C
C A 0011 ARG C 3.359 C A 0012 THR CB
C A 0012 THR C 2.435 C A 0013 MET CA
C A 0012 THR C 3.458 C A 0013 MET C
C A 0012 THR C 3.516 C A 0013 MET CB
C A 0012 THR C 3.750 C A 0013 MET CG
C A 0013 MET C 2.452 C A 0014 LYS CA
C A 0013 MET C 3.198 C A 0014 LYS C
C A 0013 MET C 2.900 C A 0014 LYS CB
C A 0013 MET C 3.433 C A 0014 LYS CG
C A 0014 LYS C 2.434 H A 0015 ASN CA
C A 0014 LYS C 3.037 H A 0015 ASN C
C A 0014 LYS C 3.705 H A 0015 ASN CB
H A 0015 ASN C 2.439 H A 0016 VAL CA
H A 0015 ASN C 2.934 H A 0016 VAL C
H A 0015 ASN C 3.733 H A 0016 VAL CB
H A 0015 ASN CB 3.588 H A 0018 ASN CB
H A 0016 VAL C 2.432 H A 0017 LEU CA
H A 0016 VAL C 2.993 H A 0017 LEU C
H A 0016 VAL C 3.715 H A 0017 LEU CB
H A 0017 LEU CA 3.793 H A 0018 ASN CA
H A 0017 LEU C 2.431 H A 0018 ASN CA
H A 0017 LEU C 3.126 H A 0018 ASN C
H A 0017 LEU C 3.690 H A 0018 ASN CB
H A 0018 ASN C 2.433 H A 0019 HIS CA
H A 0018 ASN C 3.156 H A 0019 HIS C
H A 0018 ASN C 3.686 H A 0019 HIS CB
H A 0018 ASN C 3.582 H A 0021 THR CG2
H A 0019 HIS C 2.429 H A 0020 MET CA
H A 0019 HIS C 2.978 H A 0020 MET C
H A 0019 HIS C 3.712 H A 0020 MET CB
H A 0019 HIS CA 3.795 C A 0022 HIS CD2
H A 0019 HIS C 3.572 C A 0022 HIS CD2
H A 0019 HIS CE1 2.856 C A 0023 CYS CB
H A 0020 MET C 2.432 H A 0021 THR CA
H A 0020 MET C 3.019 H A 0021 THR C
H A 0020 MET C 3.710 H A 0021 THR CB
H A 0020 MET CE 3.741 C A 0025 ALA C
H A 0021 THR C 2.435 C A 0022 HIS CA
H A 0021 THR C 3.549 C A 0022 HIS C
H A 0021 THR C 3.434 C A 0022 HIS CB
C A 0022 HIS CA 3.787 C A 0023 CYS CA
C A 0022 HIS C 2.418 C A 0023 CYS CA
C A 0022 HIS C 3.347 C A 0023 CYS C
C A 0022 HIS C 3.540 C A 0023 CYS CB
C A 0022 HIS CD2 3.773 C A 0023 CYS CA
C A 0022 HIS CD2 3.559 C A 0023 CYS CB
C A 0023 CYS C 2.433 C A 0024 GLN CA
C A 0023 CYS C 3.377 C A 0024 GLN C
C A 0023 CYS C 3.575 C A 0024 GLN CB
C A 0023 CYS C 3.702 C A 0024 GLN CG
C A 0024 GLN C 2.434 C A 0025 ALA CA
C A 0024 GLN C 3.717 C A 0025 ALA C
C A 0024 GLN C 3.002 C A 0025 ALA CB
C A 0025 ALA CA 3.790 C A 0026 GLY CA
C A 0025 ALA C 2.416 C A 0026 GLY CA
C A 0025 ALA C 3.050 C A 0026 GLY C
C A 0026 GLY CA 3.797 C A 0027 LYS CA
C A 0026 GLY C 2.433 C A 0027 LYS CA
C A 0026 GLY C 3.571 C A 0027 LYS C
C A 0026 GLY C 3.383 C A 0027 LYS CB
CHARGE_ATTR 2.00 12.00 12
H A 0001 GLU OE1 8.653 H A 0003 ARG NH1
H A 0001 GLU OE1 10.49 H A 0003 ARG NH2
H A 0001 GLU OE2 7.423 H A 0003 ARG NH1
H A 0001 GLU OE2 9.499 H A 0003 ARG NH2
H A 0001 GLU OE1 11.37 C A 0014 LYS NZ
H A 0001 GLU OE2 9.611 C A 0014 LYS NZ
H A 0001 GLU OE1 9.604 H A 0019 HIS ND1
H A 0001 GLU OE1 7.778 H A 0019 HIS NE2
H A 0001 GLU OE2 10.06 H A 0019 HIS ND1
H A 0001 GLU OE2 8.470 H A 0019 HIS NE2
H A 0001 GLU OE1 9.412 C A 0027 LYS NZ
H A 0001 GLU OE2 10.57 C A 0027 LYS NZ
CHARGE_REPU 2.00 12.00 22
H A 0003 ARG NH1 7.938 C A 0011 ARG NH1
H A 0003 ARG NH1 7.871 C A 0011 ARG NH2
H A 0003 ARG NH2 6.480 C A 0011 ARG NH1
H A 0003 ARG NH2 6.422 C A 0011 ARG NH2
H A 0003 ARG NH1 4.094 C A 0014 LYS NZ
H A 0003 ARG NH2 4.779 C A 0014 LYS NZ
C A 0009 HIS ND1 10.11 H A 0019 HIS ND1
C A 0009 HIS NE2 9.645 H A 0019 HIS ND1
C A 0009 HIS NE2 11.81 H A 0019 HIS NE2
C A 0009 HIS ND1 6.820 C A 0022 HIS ND1
C A 0009 HIS ND1 7.088 C A 0022 HIS NE2
C A 0009 HIS NE2 5.766 C A 0022 HIS ND1
C A 0009 HIS NE2 6.320 C A 0022 HIS NE2
C A 0011 ARG NH1 9.579 C A 0014 LYS NZ
C A 0011 ARG NH2 8.480 C A 0014 LYS NZ
C A 0011 ARG NH1 11.14 H A 0019 HIS ND1
C A 0011 ARG NH1 11.90 H A 0019 HIS NE2
C A 0011 ARG NH2 11.66 H A 0019 HIS ND1
H A 0019 HIS ND1 6.147 C A 0022 HIS ND1
H A 0019 HIS ND1 4.100 C A 0022 HIS NE2
H A 0019 HIS NE2 7.907 C A 0022 HIS ND1
H A 0019 HIS NE2 6.028 C A 0022 HIS NE2
HB_MM 2.00 3.20 41
H A 0002 VAL N 2.249 H A 0001 GLU O
H A 0003 ARG N 3.134 H A 0001 GLU O
H A 0003 ARG N 2.250 H A 0002 VAL O
H A 0004 ALA N 2.904 H A 0001 GLU O
H A 0004 ALA N 2.250 H A 0003 ARG O
H A 0005 CYS N 3.130 H A 0001 GLU O
H A 0005 CYS N 3.144 H A 0002 VAL O
H A 0005 CYS N 2.248 H A 0004 ALA O
C A 0006 SER N 2.249 H A 0005 CYS O
C A 0007 LEU N 2.251 C A 0006 SER O
C A 0008 PRO N 2.253 C A 0007 LEU O
C A 0009 HIS N 2.251 C A 0008 PRO O
C A 0010 CYS N 2.250 C A 0009 HIS O
C A 0011 ARG N 2.251 C A 0010 CYS O
C A 0012 THR N 2.908 C A 0010 CYS O
C A 0012 THR N 2.250 C A 0011 ARG O
C A 0013 MET N 2.251 C A 0012 THR O
C A 0014 LYS N 2.256 C A 0013 MET O
H A 0015 ASN N 2.250 C A 0014 LYS O
H A 0016 VAL N 2.548 C A 0014 LYS O
H A 0016 VAL N 2.251 H A 0015 ASN O
H A 0017 LEU N 3.056 H A 0015 ASN O
H A 0017 LEU N 2.249 H A 0016 VAL O
H A 0018 ASN N 2.725 H A 0015 ASN O
H A 0018 ASN N 2.248 H A 0017 LEU O
H A 0019 HIS N 2.991 H A 0015 ASN O
H A 0019 HIS N 2.992 H A 0016 VAL O
H A 0019 HIS N 2.250 H A 0018 ASN O
H A 0020 MET N 2.814 H A 0016 VAL O
H A 0020 MET N 2.242 H A 0019 HIS O
H A 0021 THR N 2.917 H A 0019 HIS O
H A 0021 THR N 2.247 H A 0020 MET O
C A 0022 HIS N 2.881 H A 0019 HIS O
C A 0022 HIS N 3.163 H A 0020 MET O
C A 0022 HIS N 2.249 H A 0021 THR O
C A 0023 CYS N 2.635 H A 0019 HIS O
C A 0023 CYS N 2.243 C A 0022 HIS O
C A 0024 GLN N 2.250 C A 0023 CYS O
C A 0025 ALA N 2.251 C A 0024 GLN O
C A 0026 GLY N 2.250 C A 0025 ALA O
C A 0027 LYS N 2.251 C A 0026 GLY O
HB_MS 2.00 3.20 3
H A 0001 GLU O 3.085 H A 0019 HIS NE2
C A 0009 HIS O 3.001 C A 0012 THR OG1
H A 0019 HIS O 3.164 C A 0022 HIS NE2
AROMATIC 0.00 8.00 1
H A 0019 HIS 5.840 C A 0022 HIS