Complet list of 1wqe con file
Complete list of 1wqe.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 106
C A 0001 ASN C 2.435 H A 0002 ASP CA
C A 0001 ASN C 3.292 H A 0002 ASP C
C A 0001 ASN C 3.630 H A 0002 ASP CB
H A 0002 ASP CA 2.911 H A 0003 PRO CD
H A 0002 ASP C 2.465 H A 0003 PRO CA
H A 0002 ASP C 3.035 H A 0003 PRO C
H A 0002 ASP C 3.663 H A 0003 PRO CB
H A 0002 ASP C 3.611 H A 0003 PRO CG
H A 0002 ASP C 2.506 H A 0003 PRO CD
H A 0002 ASP CB 3.589 H A 0003 PRO CD
H A 0003 PRO CA 3.781 H A 0004 CYS CA
H A 0003 PRO C 2.427 H A 0004 CYS CA
H A 0003 PRO C 2.966 H A 0004 CYS C
H A 0003 PRO C 3.705 H A 0004 CYS CB
H A 0003 PRO CA 3.791 H A 0006 GLU CB
H A 0003 PRO C 3.747 H A 0006 GLU CB
H A 0003 PRO C 3.723 H A 0007 VAL CG2
H A 0004 CYS CA 3.795 H A 0005 GLU CA
H A 0004 CYS C 2.428 H A 0005 GLU CA
H A 0004 CYS C 2.913 H A 0005 GLU C
H A 0004 CYS C 3.702 H A 0005 GLU CB
H A 0005 GLU CA 3.796 H A 0006 GLU CA
H A 0005 GLU C 2.432 H A 0006 GLU CA
H A 0005 GLU C 3.071 H A 0006 GLU C
H A 0005 GLU C 3.700 H A 0006 GLU CB
H A 0005 GLU C 3.595 H A 0009 ILE CD1
H A 0005 GLU CG 3.744 H A 0018 CYS CB
H A 0005 GLU CD 3.588 H A 0019 GLU CA
H A 0005 GLU CD 3.536 H A 0019 GLU CG
H A 0006 GLU CA 3.797 H A 0007 VAL CA
H A 0006 GLU C 2.429 H A 0007 VAL CA
H A 0006 GLU C 3.030 H A 0007 VAL C
H A 0006 GLU C 3.729 H A 0007 VAL CB
H A 0007 VAL CA 3.794 H A 0008 CYS CA
H A 0007 VAL C 2.429 H A 0008 CYS CA
H A 0007 VAL C 3.026 H A 0008 CYS C
H A 0007 VAL C 3.717 H A 0008 CYS CB
H A 0008 CYS CA 3.783 H A 0009 ILE CA
H A 0008 CYS C 2.424 H A 0009 ILE CA
H A 0008 CYS C 2.919 H A 0009 ILE C
H A 0008 CYS C 3.720 H A 0009 ILE CB
H A 0008 CYS CB 3.143 H A 0018 CYS CB
H A 0009 ILE C 2.426 H A 0010 GLN CA
H A 0009 ILE C 3.081 H A 0010 GLN C
H A 0009 ILE C 3.701 H A 0010 GLN CB
H A 0009 ILE CA 3.389 C A 0013 GLY CA
H A 0009 ILE C 3.433 C A 0013 GLY CA
H A 0009 ILE CG1 3.562 H A 0015 VAL CA
H A 0009 ILE CG1 3.390 H A 0015 VAL CG2
H A 0010 GLN C 2.436 H A 0011 HIS CA
H A 0010 GLN C 3.348 H A 0011 HIS C
H A 0010 GLN C 3.604 H A 0011 HIS CB
H A 0011 HIS C 2.434 H A 0012 THR CA
H A 0011 HIS C 3.434 H A 0012 THR C
H A 0011 HIS C 3.540 H A 0012 THR CB
H A 0012 THR CA 3.797 C A 0013 GLY CA
H A 0012 THR C 2.411 C A 0013 GLY CA
H A 0012 THR C 2.999 C A 0013 GLY C
H A 0012 THR CB 3.408 H A 0014 ASP CG
H A 0012 THR CG2 3.657 H A 0014 ASP CB
H A 0012 THR CG2 3.303 H A 0014 ASP CG
C A 0013 GLY CA 3.785 H A 0014 ASP CA
C A 0013 GLY C 2.429 H A 0014 ASP CA
C A 0013 GLY C 3.250 H A 0014 ASP C
C A 0013 GLY C 3.613 H A 0014 ASP CB
H A 0014 ASP CA 3.783 H A 0015 VAL CA
H A 0014 ASP C 2.431 H A 0015 VAL CA
H A 0014 ASP C 2.984 H A 0015 VAL C
H A 0014 ASP C 3.720 H A 0015 VAL CB
H A 0014 ASP CB 3.243 H A 0017 ALA CB
H A 0014 ASP CG 3.316 H A 0017 ALA CB
H A 0015 VAL CA 3.793 H A 0016 LYS CA
H A 0015 VAL C 2.427 H A 0016 LYS CA
H A 0015 VAL C 2.909 H A 0016 LYS C
H A 0015 VAL C 3.705 H A 0016 LYS CB
H A 0015 VAL C 3.359 H A 0019 GLU CG
H A 0015 VAL CG1 3.513 H A 0019 GLU CG
H A 0016 LYS CA 3.796 H A 0017 ALA CA
H A 0016 LYS C 2.424 H A 0017 ALA CA
H A 0016 LYS C 3.032 H A 0017 ALA C
H A 0016 LYS C 3.699 H A 0017 ALA CB
H A 0016 LYS CA 3.570 H A 0019 GLU CB
H A 0016 LYS CA 3.624 H A 0019 GLU CG
H A 0016 LYS C 3.646 H A 0019 GLU CB
H A 0017 ALA CA 3.793 H A 0018 CYS CA
H A 0017 ALA C 2.415 H A 0018 CYS CA
H A 0017 ALA C 3.042 H A 0018 CYS C
H A 0017 ALA C 3.691 H A 0018 CYS CB
H A 0018 CYS CA 3.785 H A 0019 GLU CA
H A 0018 CYS C 2.433 H A 0019 GLU CA
H A 0018 CYS C 2.917 H A 0019 GLU C
H A 0018 CYS C 3.702 H A 0019 GLU CB
H A 0019 GLU CA 3.793 H A 0020 GLU CA
H A 0019 GLU C 2.433 H A 0020 GLU CA
H A 0019 GLU C 3.244 H A 0020 GLU C
H A 0019 GLU C 3.648 H A 0020 GLU CB
H A 0020 GLU C 2.436 H A 0021 ALA CA
H A 0020 GLU C 3.082 H A 0021 ALA C
H A 0020 GLU C 3.700 H A 0021 ALA CB
H A 0021 ALA C 2.436 H A 0022 CYS CA
H A 0021 ALA C 3.480 H A 0022 CYS C
H A 0021 ALA C 3.501 H A 0022 CYS CB
H A 0022 CYS C 2.435 H A 0023 GLN CA
H A 0022 CYS C 3.025 H A 0023 GLN C
H A 0022 CYS C 2.979 H A 0023 GLN CB
H A 0022 CYS C 3.472 H A 0023 GLN CG
CHARGE_ATTR 2.00 12.00 16
H A 0005 GLU OE1 10.15 H A 0016 LYS NZ
H A 0005 GLU OE2 11.18 H A 0016 LYS NZ
H A 0006 GLU OE1 11.96 H A 0011 HIS ND1
H A 0006 GLU OE1 11.02 H A 0011 HIS NE2
H A 0006 GLU OE2 11.84 H A 0011 HIS ND1
H A 0006 GLU OE2 10.88 H A 0011 HIS NE2
H A 0014 ASP OD1 8.256 H A 0011 HIS ND1
H A 0014 ASP OD1 9.731 H A 0011 HIS NE2
H A 0014 ASP OD2 8.826 H A 0011 HIS ND1
H A 0014 ASP OD2 10.60 H A 0011 HIS NE2
H A 0014 ASP OD1 9.701 H A 0016 LYS NZ
H A 0014 ASP OD2 9.959 H A 0016 LYS NZ
H A 0019 GLU OE1 9.861 H A 0016 LYS NZ
H A 0019 GLU OE2 8.259 H A 0016 LYS NZ
H A 0020 GLU OE1 9.438 H A 0016 LYS NZ
H A 0020 GLU OE2 11.39 H A 0016 LYS NZ
CHARGE_REPU 2.00 12.00 40
H A 0002 ASP OD1 7.521 H A 0005 GLU OE1
H A 0002 ASP OD1 5.981 H A 0005 GLU OE2
H A 0002 ASP OD2 9.220 H A 0005 GLU OE1
H A 0002 ASP OD2 7.853 H A 0005 GLU OE2
H A 0002 ASP OD1 8.714 H A 0006 GLU OE1
H A 0002 ASP OD1 9.793 H A 0006 GLU OE2
H A 0002 ASP OD2 9.070 H A 0006 GLU OE1
H A 0002 ASP OD2 10.55 H A 0006 GLU OE2
H A 0002 ASP OD1 8.412 H A 0019 GLU OE1
H A 0002 ASP OD1 9.400 H A 0019 GLU OE2
H A 0002 ASP OD2 10.30 H A 0019 GLU OE1
H A 0002 ASP OD2 11.45 H A 0019 GLU OE2
H A 0005 GLU OE1 10.31 H A 0006 GLU OE1
H A 0005 GLU OE1 10.12 H A 0006 GLU OE2
H A 0005 GLU OE2 10.56 H A 0006 GLU OE1
H A 0005 GLU OE2 10.59 H A 0006 GLU OE2
H A 0005 GLU OE1 6.674 H A 0014 ASP OD1
H A 0005 GLU OE1 8.260 H A 0014 ASP OD2
H A 0005 GLU OE2 8.844 H A 0014 ASP OD1
H A 0005 GLU OE2 10.33 H A 0014 ASP OD2
H A 0005 GLU OE1 4.997 H A 0019 GLU OE1
H A 0005 GLU OE1 4.818 H A 0019 GLU OE2
H A 0005 GLU OE2 3.696 H A 0019 GLU OE1
H A 0005 GLU OE2 4.158 H A 0019 GLU OE2
H A 0005 GLU OE1 9.713 H A 0020 GLU OE1
H A 0005 GLU OE1 10.48 H A 0020 GLU OE2
H A 0005 GLU OE2 10.26 H A 0020 GLU OE1
H A 0005 GLU OE2 11.07 H A 0020 GLU OE2
H A 0014 ASP OD1 10.70 H A 0019 GLU OE1
H A 0014 ASP OD1 10.01 H A 0019 GLU OE2
H A 0014 ASP OD2 11.78 H A 0019 GLU OE1
H A 0014 ASP OD2 11.24 H A 0019 GLU OE2
H A 0014 ASP OD1 10.03 H A 0020 GLU OE1
H A 0014 ASP OD1 10.37 H A 0020 GLU OE2
H A 0014 ASP OD2 9.279 H A 0020 GLU OE1
H A 0014 ASP OD2 9.390 H A 0020 GLU OE2
H A 0019 GLU OE1 8.823 H A 0020 GLU OE1
H A 0019 GLU OE1 10.11 H A 0020 GLU OE2
H A 0019 GLU OE2 9.388 H A 0020 GLU OE1
H A 0019 GLU OE2 10.92 H A 0020 GLU OE2
HB_MM 2.00 3.20 47
H A 0002 ASP N 2.250 C A 0001 ASN O
H A 0003 PRO N 2.252 H A 0002 ASP O
H A 0004 CYS N 2.245 H A 0003 PRO O
H A 0005 GLU N 2.252 H A 0004 CYS O
H A 0006 GLU N 2.833 H A 0002 ASP O
H A 0006 GLU N 2.915 H A 0004 CYS O
H A 0006 GLU N 2.256 H A 0005 GLU O
H A 0007 VAL N 2.585 H A 0003 PRO O
H A 0007 VAL N 2.688 H A 0004 CYS O
H A 0007 VAL N 2.250 H A 0006 GLU O
H A 0008 CYS N 2.970 H A 0004 CYS O
H A 0008 CYS N 2.252 H A 0007 VAL O
H A 0009 ILE N 3.012 H A 0005 GLU O
H A 0009 ILE N 2.248 H A 0008 CYS O
H A 0010 GLN N 2.869 H A 0006 GLU O
H A 0010 GLN N 3.084 H A 0008 CYS O
H A 0010 GLN N 2.244 H A 0009 ILE O
H A 0011 HIS N 2.912 H A 0007 VAL O
H A 0011 HIS N 2.624 H A 0008 CYS O
H A 0011 HIS N 2.250 H A 0010 GLN O
H A 0012 THR N 2.566 H A 0008 CYS O
H A 0012 THR N 2.247 H A 0011 HIS O
C A 0013 GLY N 3.169 H A 0008 CYS O
C A 0013 GLY N 2.663 H A 0009 ILE O
C A 0013 GLY N 2.246 H A 0012 THR O
H A 0014 ASP N 2.951 H A 0012 THR O
H A 0014 ASP N 2.253 C A 0013 GLY O
H A 0015 VAL N 3.200 C A 0013 GLY O
H A 0015 VAL N 2.255 H A 0014 ASP O
H A 0016 LYS N 2.241 H A 0015 VAL O
H A 0017 ALA N 3.190 H A 0014 ASP O
H A 0017 ALA N 2.780 H A 0015 VAL O
H A 0017 ALA N 2.251 H A 0016 LYS O
H A 0018 CYS N 3.027 H A 0014 ASP O
H A 0018 CYS N 2.947 H A 0015 VAL O
H A 0018 CYS N 2.249 H A 0017 ALA O
H A 0019 GLU N 2.659 H A 0015 VAL O
H A 0019 GLU N 2.245 H A 0018 CYS O
H A 0020 GLU N 3.156 H A 0018 CYS O
H A 0020 GLU N 2.251 H A 0019 GLU O
H A 0021 ALA N 2.955 H A 0017 ALA O
H A 0021 ALA N 3.173 H A 0018 CYS O
H A 0021 ALA N 2.250 H A 0020 GLU O
H A 0022 CYS N 2.539 H A 0018 CYS O
H A 0022 CYS N 2.250 H A 0021 ALA O
H A 0023 GLN N 2.807 H A 0019 GLU O
H A 0023 GLN N 2.250 H A 0022 CYS O
HB_SS 2.00 3.20 1
H A 0006 GLU OE1 2.901 C A 0001 ASN ND2
SS_BOND 1.50 2.80 2
H A 0004 CYS SG 2.030 H A 0022 CYS SG
H A 0008 CYS SG 2.030 H A 0018 CYS SG