Complet list of 1xrd con file
Complete list of 1xrd.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 230
H A 0001 MET CA 3.618 H A 0002 TRP CE3
H A 0001 MET C 2.445 H A 0002 TRP CA
H A 0001 MET C 2.913 H A 0002 TRP C
H A 0001 MET C 3.147 H A 0002 TRP CB
H A 0001 MET C 3.573 H A 0002 TRP CG
H A 0001 MET C 3.561 H A 0002 TRP CD2
H A 0001 MET C 3.250 H A 0002 TRP CE3
H A 0001 MET CB 3.786 H A 0002 TRP CE3
H A 0002 TRP C 2.444 H A 0003 ARG CA
H A 0002 TRP C 2.912 H A 0003 ARG C
H A 0002 TRP C 3.141 H A 0003 ARG CB
H A 0003 ARG C 2.438 H A 0004 ILE CA
H A 0003 ARG C 2.936 H A 0004 ILE C
H A 0003 ARG C 3.113 H A 0004 ILE CB
H A 0003 ARG C 3.523 H A 0004 ILE CG1
H A 0004 ILE C 2.456 H A 0005 TRP CA
H A 0004 ILE C 2.862 H A 0005 TRP C
H A 0004 ILE C 3.254 H A 0005 TRP CB
H A 0004 ILE C 3.794 H A 0005 TRP CG
H A 0004 ILE C 3.564 H A 0005 TRP CD1
H A 0004 ILE CB 3.751 H A 0009 ASP CB
H A 0004 ILE CG1 3.495 H A 0009 ASP CG
H A 0005 TRP C 2.458 H A 0006 GLN CA
H A 0005 TRP C 2.868 H A 0006 GLN C
H A 0005 TRP C 3.256 H A 0006 GLN CB
H A 0006 GLN C 2.433 H A 0007 LEU CA
H A 0006 GLN C 3.207 H A 0007 LEU C
H A 0006 GLN C 3.666 H A 0007 LEU CB
H A 0006 GLN CA 3.687 H A 0010 PRO CG
H A 0007 LEU C 2.433 C A 0008 PHE CA
H A 0007 LEU C 3.614 C A 0008 PHE C
H A 0007 LEU C 3.313 C A 0008 PHE CB
H A 0007 LEU C 3.521 C A 0008 PHE CG
H A 0007 LEU C 3.365 C A 0008 PHE CD1
C A 0008 PHE C 2.432 H A 0009 ASP CA
C A 0008 PHE C 3.715 H A 0009 ASP C
C A 0008 PHE C 3.075 H A 0009 ASP CB
C A 0008 PHE C 3.556 H A 0009 ASP CG
H A 0009 ASP CA 2.932 H A 0010 PRO CD
H A 0009 ASP C 2.466 H A 0010 PRO CA
H A 0009 ASP C 3.021 H A 0010 PRO C
H A 0009 ASP C 3.658 H A 0010 PRO CB
H A 0009 ASP C 3.636 H A 0010 PRO CG
H A 0009 ASP C 2.513 H A 0010 PRO CD
H A 0009 ASP CB 3.109 H A 0010 PRO CD
H A 0010 PRO C 2.436 H A 0011 ARG CA
H A 0010 PRO C 2.978 H A 0011 ARG C
H A 0010 PRO C 3.718 H A 0011 ARG CB
H A 0011 ARG C 2.434 H A 0012 GLN CA
H A 0011 ARG C 2.991 H A 0012 GLN C
H A 0011 ARG C 3.715 H A 0012 GLN CB
H A 0011 ARG C 3.679 H A 0015 VAL CG2
H A 0012 GLN C 2.434 H A 0013 ALA CA
H A 0012 GLN C 3.033 H A 0013 ALA C
H A 0012 GLN C 3.704 H A 0013 ALA CB
H A 0013 ALA CA 3.798 H A 0014 LEU CA
H A 0013 ALA C 2.430 H A 0014 LEU CA
H A 0013 ALA C 3.035 H A 0014 LEU C
H A 0013 ALA C 3.708 H A 0014 LEU CB
H A 0013 ALA C 3.715 H A 0017 LEU CD1
H A 0014 LEU CA 3.793 H A 0015 VAL CA
H A 0014 LEU C 2.428 H A 0015 VAL CA
H A 0014 LEU C 3.074 H A 0015 VAL C
H A 0014 LEU C 3.724 H A 0015 VAL CB
H A 0014 LEU CA 3.646 H A 0017 LEU CD1
H A 0015 VAL CA 3.793 H A 0016 GLY CA
H A 0015 VAL C 2.420 H A 0016 GLY CA
H A 0015 VAL C 3.118 H A 0016 GLY C
H A 0016 GLY CA 3.791 H A 0017 LEU CA
H A 0016 GLY C 2.435 H A 0017 LEU CA
H A 0016 GLY C 3.001 H A 0017 LEU C
H A 0016 GLY C 3.726 H A 0017 LEU CB
H A 0017 LEU CA 3.779 H A 0018 ALA CA
H A 0017 LEU C 2.434 H A 0018 ALA CA
H A 0017 LEU C 2.969 H A 0018 ALA C
H A 0017 LEU C 3.702 H A 0018 ALA CB
H A 0017 LEU C 3.779 H A 0021 LEU CD2
H A 0018 ALA C 2.431 H A 0019 THR CA
H A 0018 ALA C 3.067 H A 0019 THR C
H A 0018 ALA C 3.708 H A 0019 THR CB
H A 0018 ALA CA 3.747 H A 0021 LEU CD2
H A 0018 ALA C 3.742 H A 0021 LEU CG
H A 0019 THR C 2.438 H A 0020 PHE CA
H A 0019 THR C 3.013 H A 0020 PHE C
H A 0019 THR C 3.718 H A 0020 PHE CB
H A 0019 THR C 3.742 H A 0023 VAL CG1
H A 0019 THR CG2 3.549 H A 0023 VAL CG1
H A 0020 PHE C 2.429 H A 0021 LEU CA
H A 0020 PHE C 3.044 H A 0021 LEU C
H A 0020 PHE C 3.709 H A 0021 LEU CB
H A 0020 PHE CA 3.697 H A 0023 VAL CG2
H A 0020 PHE C 3.576 H A 0023 VAL CG2
H A 0021 LEU C 2.440 H A 0022 PHE CA
H A 0021 LEU C 2.978 H A 0022 PHE C
H A 0021 LEU C 3.716 H A 0022 PHE CB
H A 0021 LEU CD1 3.608 H A 0022 PHE CA
H A 0022 PHE C 2.433 H A 0023 VAL CA
H A 0022 PHE C 3.057 H A 0023 VAL C
H A 0022 PHE C 3.730 H A 0023 VAL CB
H A 0022 PHE C 3.793 H A 0026 LEU CG
H A 0022 PHE C 3.580 H A 0026 LEU CD1
H A 0022 PHE CG 3.721 H A 0026 LEU CD1
H A 0022 PHE CD2 3.170 H A 0026 LEU CD1
H A 0022 PHE CE2 3.313 H A 0026 LEU CD1
H A 0023 VAL C 2.437 H A 0024 LEU CA
H A 0023 VAL C 2.953 H A 0024 LEU C
H A 0023 VAL C 3.710 H A 0024 LEU CB
H A 0023 VAL C 3.698 H A 0027 LEU CG
H A 0023 VAL C 3.773 H A 0027 LEU CD1
H A 0024 LEU C 2.434 H A 0025 ALA CA
H A 0024 LEU C 2.984 H A 0025 ALA C
H A 0024 LEU C 3.707 H A 0025 ALA CB
H A 0024 LEU C 3.514 H A 0028 ILE CD1
H A 0024 LEU CD1 3.772 H A 0028 ILE CG1
H A 0024 LEU CD1 2.998 H A 0028 ILE CD1
H A 0025 ALA C 2.431 H A 0026 LEU CA
H A 0025 ALA C 3.023 H A 0026 LEU C
H A 0025 ALA C 3.712 H A 0026 LEU CB
H A 0025 ALA CA 3.460 H A 0028 ILE CD1
H A 0026 LEU C 2.435 H A 0027 LEU CA
H A 0026 LEU C 3.022 H A 0027 LEU C
H A 0026 LEU C 3.715 H A 0027 LEU CB
H A 0027 LEU C 2.432 H A 0028 ILE CA
H A 0027 LEU C 3.023 H A 0028 ILE C
H A 0027 LEU C 3.737 H A 0028 ILE CB
H A 0028 ILE C 2.436 H A 0029 HIS CA
H A 0028 ILE C 3.001 H A 0029 HIS C
H A 0028 ILE C 3.715 H A 0029 HIS CB
H A 0028 ILE C 3.769 H A 0032 LEU CG
H A 0028 ILE C 3.440 H A 0032 LEU CD2
H A 0028 ILE CG2 3.748 H A 0032 LEU CD2
H A 0029 HIS C 2.433 H A 0030 PHE CA
H A 0029 HIS C 3.055 H A 0030 PHE C
H A 0029 HIS C 3.707 H A 0030 PHE CB
H A 0029 HIS CA 3.416 H A 0032 LEU CG
H A 0029 HIS CA 3.424 H A 0032 LEU CD2
H A 0029 HIS C 3.585 H A 0032 LEU CG
H A 0029 HIS C 3.533 H A 0033 LEU CD2
H A 0030 PHE C 2.429 H A 0031 ILE CA
H A 0030 PHE C 3.075 H A 0031 ILE C
H A 0030 PHE C 3.737 H A 0031 ILE CB
H A 0030 PHE CA 3.634 H A 0033 LEU CG
H A 0030 PHE CA 3.419 H A 0033 LEU CD2
H A 0030 PHE C 3.781 H A 0033 LEU CG
H A 0031 ILE C 2.429 H A 0032 LEU CA
H A 0031 ILE C 3.028 H A 0032 LEU C
H A 0031 ILE C 3.716 H A 0032 LEU CB
H A 0032 LEU CA 3.797 H A 0033 LEU CA
H A 0032 LEU C 2.432 H A 0033 LEU CA
H A 0032 LEU C 3.002 H A 0033 LEU C
H A 0032 LEU C 3.720 H A 0033 LEU CB
H A 0032 LEU CD1 3.577 H A 0033 LEU CA
H A 0033 LEU C 2.441 H A 0034 SER CA
H A 0033 LEU C 3.033 H A 0034 SER C
H A 0033 LEU C 3.718 H A 0034 SER CB
H A 0033 LEU CD1 3.597 H A 0034 SER CA
H A 0034 SER C 2.435 H A 0035 THR CA
H A 0034 SER C 3.027 H A 0035 THR C
H A 0034 SER C 3.713 H A 0035 THR CB
H A 0035 THR C 2.435 H A 0036 GLU CA
H A 0035 THR C 3.044 H A 0036 GLU C
H A 0035 THR C 3.711 H A 0036 GLU CB
H A 0036 GLU C 2.435 H A 0037 ARG CA
H A 0036 GLU C 3.038 H A 0037 ARG C
H A 0036 GLU C 3.711 H A 0037 ARG CB
H A 0037 ARG C 2.433 H A 0038 PHE CA
H A 0037 ARG C 3.010 H A 0038 PHE C
H A 0037 ARG C 3.713 H A 0038 PHE CB
H A 0037 ARG C 3.710 H A 0040 TRP CB
H A 0037 ARG CD 3.224 H A 0040 TRP CE3
H A 0037 ARG CD 3.459 H A 0040 TRP CZ3
H A 0038 PHE C 2.438 H A 0039 ASN CA
H A 0038 PHE C 2.994 H A 0039 ASN C
H A 0038 PHE C 3.716 H A 0039 ASN CB
H A 0038 PHE C 3.591 H A 0042 GLU CB
H A 0039 ASN C 2.440 H A 0040 TRP CA
H A 0039 ASN C 3.041 H A 0040 TRP C
H A 0039 ASN C 3.717 H A 0040 TRP CB
H A 0039 ASN CA 3.248 H A 0042 GLU CB
H A 0039 ASN C 3.382 H A 0042 GLU CB
H A 0040 TRP CA 3.772 H A 0041 LEU CA
H A 0040 TRP C 2.418 H A 0041 LEU CA
H A 0040 TRP C 2.969 H A 0041 LEU C
H A 0040 TRP C 3.704 H A 0041 LEU CB
H A 0041 LEU CA 3.795 H A 0042 GLU CA
H A 0041 LEU C 2.433 H A 0042 GLU CA
H A 0041 LEU C 3.014 H A 0042 GLU C
H A 0041 LEU C 3.719 H A 0042 GLU CB
H A 0042 GLU CA 3.785 H A 0043 GLY CA
H A 0042 GLU C 2.418 H A 0043 GLY CA
H A 0042 GLU C 3.265 H A 0043 GLY C
H A 0043 GLY CA 3.791 C A 0044 ALA CA
H A 0043 GLY C 2.432 C A 0044 ALA CA
H A 0043 GLY C 3.708 C A 0044 ALA C
H A 0043 GLY C 3.027 C A 0044 ALA CB
H A 0043 GLY CA 3.740 C A 0047 LYS CB
H A 0043 GLY CA 3.290 C A 0048 PRO CD
H A 0043 GLY C 3.759 C A 0048 PRO CG
H A 0043 GLY C 3.613 C A 0048 PRO CD
C A 0044 ALA C 2.450 C A 0045 SER CA
C A 0044 ALA C 3.214 C A 0045 SER C
C A 0044 ALA C 2.875 C A 0045 SER CB
C A 0045 SER C 2.434 C A 0046 THR CA
C A 0045 SER C 3.659 C A 0046 THR C
C A 0045 SER C 3.236 C A 0046 THR CB
C A 0045 SER C 3.006 C A 0046 THR CG2
C A 0046 THR C 2.434 C A 0047 LYS CA
C A 0046 THR C 3.156 C A 0047 LYS C
C A 0046 THR C 3.687 C A 0047 LYS CB
C A 0047 LYS CA 2.911 C A 0048 PRO CD
C A 0047 LYS C 2.465 C A 0048 PRO CA
C A 0047 LYS C 3.193 C A 0048 PRO C
C A 0047 LYS C 3.629 C A 0048 PRO CB
C A 0047 LYS C 3.657 C A 0048 PRO CG
C A 0047 LYS C 2.509 C A 0048 PRO CD
C A 0047 LYS CB 3.002 C A 0048 PRO CD
C A 0048 PRO C 2.431 C A 0049 VAL CA
C A 0048 PRO C 3.295 C A 0049 VAL C
C A 0048 PRO C 3.649 C A 0049 VAL CB
C A 0049 VAL C 2.454 C A 0050 GLN CA
C A 0049 VAL C 2.907 C A 0050 GLN C
C A 0049 VAL C 3.210 C A 0050 GLN CB
C A 0049 VAL C 2.956 C A 0050 GLN CG
C A 0050 GLN C 2.436 C A 0051 THR CA
C A 0050 GLN C 3.693 C A 0051 THR C
C A 0050 GLN C 3.145 C A 0051 THR CB
C A 0050 GLN C 3.404 C A 0051 THR CG2
C A 0051 THR C 2.434 C A 0052 SER CA
C A 0051 THR C 3.658 C A 0052 SER C
C A 0051 THR C 3.235 C A 0052 SER CB
CHARGE_ATTR 2.00 12.00 14
H A 0009 ASP OD1 9.081 H A 0011 ARG NH1
H A 0009 ASP OD1 11.34 H A 0011 ARG NH2
H A 0009 ASP OD2 9.762 H A 0011 ARG NH1
H A 0009 ASP OD2 11.93 H A 0011 ARG NH2
H A 0036 GLU OE1 10.64 H A 0029 HIS ND1
H A 0036 GLU OE1 9.427 H A 0029 HIS NE2
H A 0036 GLU OE2 11.17 H A 0029 HIS ND1
H A 0036 GLU OE2 9.699 H A 0029 HIS NE2
H A 0036 GLU OE1 3.023 H A 0037 ARG NH1
H A 0036 GLU OE1 4.408 H A 0037 ARG NH2
H A 0036 GLU OE2 5.157 H A 0037 ARG NH1
H A 0036 GLU OE2 6.573 H A 0037 ARG NH2
H A 0042 GLU OE1 11.43 C A 0047 LYS NZ
H A 0042 GLU OE2 11.68 C A 0047 LYS NZ
CHARGE_REPU 2.00 12.00 4
H A 0029 HIS ND1 11.40 H A 0037 ARG NH1
H A 0029 HIS ND1 10.59 H A 0037 ARG NH2
H A 0029 HIS NE2 10.63 H A 0037 ARG NH1
H A 0029 HIS NE2 9.955 H A 0037 ARG NH2
HB_MM 2.00 3.20 102
H A 0002 TRP N 2.252 H A 0001 MET O
H A 0003 ARG N 2.728 H A 0001 MET O
H A 0003 ARG N 2.252 H A 0002 TRP O
H A 0004 ILE N 2.850 H A 0001 MET O
H A 0004 ILE N 2.742 H A 0002 TRP O
H A 0004 ILE N 2.250 H A 0003 ARG O
H A 0005 TRP N 2.827 H A 0002 TRP O
H A 0005 TRP N 2.259 H A 0004 ILE O
H A 0006 GLN N 3.010 H A 0003 ARG O
H A 0006 GLN N 2.577 H A 0004 ILE O
H A 0006 GLN N 2.259 H A 0005 TRP O
H A 0007 LEU N 2.836 H A 0004 ILE O
H A 0007 LEU N 2.575 H A 0005 TRP O
H A 0007 LEU N 2.250 H A 0006 GLN O
C A 0008 PHE N 2.249 H A 0007 LEU O
H A 0009 ASP N 2.250 C A 0008 PHE O
H A 0010 PRO N 2.250 H A 0009 ASP O
H A 0011 ARG N 2.251 H A 0010 PRO O
H A 0012 GLN N 2.250 H A 0011 ARG O
H A 0013 ALA N 2.725 H A 0009 ASP O
H A 0013 ALA N 3.073 H A 0010 PRO O
H A 0013 ALA N 2.249 H A 0012 GLN O
H A 0014 LEU N 3.012 H A 0010 PRO O
H A 0014 LEU N 3.175 H A 0011 ARG O
H A 0014 LEU N 2.250 H A 0013 ALA O
H A 0015 VAL N 2.906 H A 0011 ARG O
H A 0015 VAL N 2.250 H A 0014 LEU O
H A 0016 GLY N 2.848 H A 0012 GLN O
H A 0016 GLY N 3.138 H A 0013 ALA O
H A 0016 GLY N 2.251 H A 0015 VAL O
H A 0017 LEU N 3.078 H A 0013 ALA O
H A 0017 LEU N 2.250 H A 0016 GLY O
H A 0018 ALA N 3.005 H A 0014 LEU O
H A 0018 ALA N 2.253 H A 0017 LEU O
H A 0019 THR N 3.009 H A 0015 VAL O
H A 0019 THR N 2.246 H A 0018 ALA O
H A 0020 PHE N 2.742 H A 0016 GLY O
H A 0020 PHE N 3.084 H A 0017 LEU O
H A 0020 PHE N 2.246 H A 0019 THR O
H A 0021 LEU N 2.940 H A 0017 LEU O
H A 0021 LEU N 2.244 H A 0020 PHE O
H A 0022 PHE N 2.983 H A 0018 ALA O
H A 0022 PHE N 2.253 H A 0021 LEU O
H A 0023 VAL N 2.822 H A 0019 THR O
H A 0023 VAL N 2.250 H A 0022 PHE O
H A 0024 LEU N 3.004 H A 0020 PHE O
H A 0024 LEU N 2.246 H A 0023 VAL O
H A 0025 ALA N 3.006 H A 0021 LEU O
H A 0025 ALA N 2.251 H A 0024 LEU O
H A 0026 LEU N 2.966 H A 0022 PHE O
H A 0026 LEU N 3.107 H A 0023 VAL O
H A 0026 LEU N 3.121 H A 0024 LEU O
H A 0026 LEU N 2.250 H A 0025 ALA O
H A 0027 LEU N 2.817 H A 0023 VAL O
H A 0027 LEU N 3.099 H A 0024 LEU O
H A 0027 LEU N 2.250 H A 0026 LEU O
H A 0028 ILE N 3.045 H A 0024 LEU O
H A 0028 ILE N 2.248 H A 0027 LEU O
H A 0029 HIS N 3.001 H A 0025 ALA O
H A 0029 HIS N 2.250 H A 0028 ILE O
H A 0030 PHE N 2.772 H A 0026 LEU O
H A 0030 PHE N 2.239 H A 0029 HIS O
H A 0031 ILE N 2.801 H A 0027 LEU O
H A 0031 ILE N 2.246 H A 0030 PHE O
H A 0032 LEU N 2.951 H A 0028 ILE O
H A 0032 LEU N 2.248 H A 0031 ILE O
H A 0033 LEU N 2.727 H A 0029 HIS O
H A 0033 LEU N 2.250 H A 0032 LEU O
H A 0034 SER N 2.754 H A 0030 PHE O
H A 0034 SER N 2.252 H A 0033 LEU O
H A 0035 THR N 2.812 H A 0031 ILE O
H A 0035 THR N 2.248 H A 0034 SER O
H A 0036 GLU N 2.751 H A 0032 LEU O
H A 0036 GLU N 2.248 H A 0035 THR O
H A 0037 ARG N 2.847 H A 0033 LEU O
H A 0037 ARG N 2.249 H A 0036 GLU O
H A 0038 PHE N 2.730 H A 0034 SER O
H A 0038 PHE N 2.251 H A 0037 ARG O
H A 0039 ASN N 2.971 H A 0035 THR O
H A 0039 ASN N 2.251 H A 0038 PHE O
H A 0040 TRP N 2.974 H A 0036 GLU O
H A 0040 TRP N 2.930 H A 0038 PHE O
H A 0040 TRP N 2.253 H A 0039 ASN O
H A 0041 LEU N 3.025 H A 0037 ARG O
H A 0041 LEU N 2.252 H A 0040 TRP O
H A 0042 GLU N 2.613 H A 0038 PHE O
H A 0042 GLU N 2.981 H A 0040 TRP O
H A 0042 GLU N 2.259 H A 0041 LEU O
H A 0043 GLY N 3.060 H A 0039 ASN O
H A 0043 GLY N 3.180 H A 0040 TRP O
H A 0043 GLY N 2.254 H A 0042 GLU O
C A 0044 ALA N 2.249 H A 0043 GLY O
C A 0045 SER N 2.257 C A 0044 ALA O
C A 0046 THR N 2.251 C A 0045 SER O
C A 0047 LYS N 2.250 C A 0046 THR O
C A 0048 PRO N 2.253 C A 0047 LYS O
C A 0049 VAL N 2.875 C A 0047 LYS O
C A 0049 VAL N 2.250 C A 0048 PRO O
C A 0050 GLN N 2.257 C A 0049 VAL O
C A 0051 THR N 2.518 C A 0049 VAL O
C A 0051 THR N 2.249 C A 0050 GLN O
C A 0052 SER N 2.251 C A 0051 THR O
HB_MS 2.00 3.20 3
H A 0015 VAL O 2.449 H A 0019 THR OG1
H A 0031 ILE O 2.637 H A 0035 THR OG1
C A 0047 LYS N 2.567 C A 0046 THR OG1
AROMATIC 0.00 8.00 1
H A 0011 ARG 4.776 C A 0008 PHE