Complet list of 2d8v con file
Complete list of 2d8v.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 303
C A 0001 GLY CA 3.797 C A 0002 SER CA
C A 0001 GLY C 2.434 C A 0002 SER CA
C A 0001 GLY C 3.559 C A 0002 SER C
C A 0001 GLY C 3.400 C A 0002 SER CB
C A 0002 SER C 2.434 C A 0003 SER CA
C A 0002 SER C 2.966 C A 0003 SER C
C A 0002 SER C 3.715 C A 0003 SER CB
C A 0003 SER CA 3.792 C A 0004 GLY CA
C A 0003 SER C 2.419 C A 0004 GLY CA
C A 0003 SER C 3.716 C A 0004 GLY C
C A 0004 GLY CA 3.796 C A 0005 SER CA
C A 0004 GLY C 2.434 C A 0005 SER CA
C A 0004 GLY C 3.244 C A 0005 SER C
C A 0004 GLY C 3.654 C A 0005 SER CB
C A 0005 SER C 2.434 C A 0006 SER CA
C A 0005 SER C 3.363 C A 0006 SER C
C A 0005 SER C 3.586 C A 0006 SER CB
C A 0006 SER CA 3.791 C A 0007 GLY CA
C A 0006 SER C 2.418 C A 0007 GLY CA
C A 0006 SER C 3.690 C A 0007 GLY C
C A 0007 GLY CA 3.797 C A 0008 LEU CA
C A 0007 GLY C 2.434 C A 0008 LEU CA
C A 0007 GLY C 3.113 C A 0008 LEU C
C A 0007 GLY C 3.698 C A 0008 LEU CB
C A 0008 LEU CA 2.866 C A 0009 PRO CD
C A 0008 LEU C 2.464 C A 0009 PRO CA
C A 0008 LEU C 3.137 C A 0009 PRO C
C A 0008 LEU C 3.645 C A 0009 PRO CB
C A 0008 LEU C 3.635 C A 0009 PRO CG
C A 0008 LEU C 2.498 C A 0009 PRO CD
C A 0008 LEU CB 3.382 C A 0009 PRO CD
C A 0008 LEU CB 3.160 C A 0010 TRP CD1
C A 0008 LEU CD1 3.786 C A 0015 ASN CG
C A 0009 PRO C 2.433 C A 0010 TRP CA
C A 0009 PRO C 3.412 C A 0010 TRP C
C A 0009 PRO C 3.548 C A 0010 TRP CB
C A 0010 TRP C 2.434 C A 0011 CYS CA
C A 0010 TRP C 2.886 C A 0011 CYS C
C A 0010 TRP C 3.704 C A 0011 CYS CB
C A 0010 TRP CB 3.484 C A 0015 ASN CA
C A 0010 TRP CB 3.190 C A 0015 ASN C
C A 0010 TRP CG 3.390 C A 0015 ASN CA
C A 0010 TRP CG 3.246 C A 0015 ASN C
C A 0010 TRP CG 3.662 C A 0015 ASN CB
C A 0010 TRP CD1 3.412 C A 0015 ASN CA
C A 0010 TRP CD1 3.264 C A 0015 ASN CB
C A 0010 TRP CD2 3.660 C A 0015 ASN C
C A 0010 TRP CB 3.753 C A 0016 GLU C
C A 0010 TRP CA 3.739 C A 0018 ALA CB
C A 0010 TRP C 3.417 C A 0018 ALA CB
C A 0011 CYS C 2.433 C A 0012 CYS CA
C A 0011 CYS C 3.059 C A 0012 CYS C
C A 0011 CYS C 3.708 C A 0012 CYS CB
C A 0012 CYS C 2.433 C A 0013 ILE CA
C A 0012 CYS C 3.361 C A 0013 ILE C
C A 0012 CYS C 3.612 C A 0013 ILE CB
C A 0012 CYS C 3.772 C A 0013 ILE CG1
C A 0013 ILE C 2.435 C A 0014 CYS CA
C A 0013 ILE C 3.282 C A 0014 CYS C
C A 0013 ILE C 3.634 C A 0014 CYS CB
C A 0013 ILE CG1 3.519 E A 0030 TYR CD1
C A 0013 ILE CG1 3.221 E A 0030 TYR CE1
C A 0013 ILE CD1 3.592 E A 0030 TYR CE1
C A 0013 ILE CB 3.667 H A 0034 CYS CB
C A 0013 ILE CG1 3.580 H A 0034 CYS CB
C A 0013 ILE CG2 3.764 H A 0034 CYS CB
C A 0014 CYS C 2.434 C A 0015 ASN CA
C A 0014 CYS C 3.074 C A 0015 ASN C
C A 0014 CYS C 2.930 C A 0015 ASN CB
C A 0014 CYS C 3.111 C A 0015 ASN CG
C A 0015 ASN C 2.434 C A 0016 GLU CA
C A 0015 ASN C 3.344 C A 0016 GLU C
C A 0015 ASN C 3.599 C A 0016 GLU CB
C A 0016 GLU C 2.433 C A 0017 ASP CA
C A 0016 GLU C 3.703 C A 0017 ASP C
C A 0016 GLU C 3.096 C A 0017 ASP CB
C A 0017 ASP C 2.434 C A 0018 ALA CA
C A 0017 ASP C 3.206 C A 0018 ALA C
C A 0017 ASP C 3.660 C A 0018 ALA CB
C A 0017 ASP CG 3.780 C A 0058 CYS C
C A 0018 ALA C 2.434 C A 0019 THR CA
C A 0018 ALA C 3.499 C A 0019 THR C
C A 0018 ALA C 3.498 C A 0019 THR CB
C A 0018 ALA CB 3.441 E A 0029 LEU CB
C A 0019 THR C 2.435 E A 0020 LEU CA
C A 0019 THR C 3.653 E A 0020 LEU C
C A 0019 THR C 3.245 E A 0020 LEU CB
C A 0019 THR C 3.134 E A 0020 LEU CG
C A 0019 THR C 3.680 E A 0020 LEU CD2
C A 0019 THR CG2 3.617 E A 0020 LEU CG
E A 0020 LEU C 2.434 E A 0021 ARG CA
E A 0020 LEU C 3.574 E A 0021 ARG C
E A 0020 LEU C 3.380 E A 0021 ARG CB
E A 0020 LEU CD1 3.731 C A 0031 CYS C
E A 0020 LEU CD1 3.614 H A 0035 PHE CD2
E A 0021 ARG C 2.434 E A 0022 CYS CA
E A 0021 ARG C 3.149 E A 0022 CYS C
E A 0021 ARG C 3.689 E A 0022 CYS CB
E A 0021 ARG CG 3.696 C A 0027 GLY CA
E A 0021 ARG CG 3.664 C A 0027 GLY C
E A 0021 ARG CB 3.591 E A 0029 LEU CD2
E A 0021 ARG CG 3.598 E A 0029 LEU CD2
E A 0021 ARG CD 3.639 E A 0029 LEU CD2
E A 0021 ARG C 3.771 E A 0049 THR CG2
E A 0022 CYS C 2.434 C A 0023 ALA CA
E A 0022 CYS C 3.163 C A 0023 ALA C
E A 0022 CYS C 3.676 C A 0023 ALA CB
E A 0022 CYS C 3.769 C A 0027 GLY CA
E A 0022 CYS CA 3.478 E A 0049 THR CG2
C A 0023 ALA CA 3.791 C A 0024 GLY CA
C A 0023 ALA C 2.418 C A 0024 GLY CA
C A 0023 ALA C 3.100 C A 0024 GLY C
C A 0024 GLY CA 3.797 C A 0025 CYS CA
C A 0024 GLY C 2.434 C A 0025 CYS CA
C A 0024 GLY C 3.349 C A 0025 CYS C
C A 0024 GLY C 3.595 C A 0025 CYS CB
C A 0025 CYS C 2.433 C A 0026 ASP CA
C A 0025 CYS C 3.080 C A 0026 ASP C
C A 0025 CYS C 2.926 C A 0026 ASP CB
C A 0025 CYS CB 3.619 E A 0028 ASP CB
C A 0026 ASP CA 3.792 C A 0027 GLY CA
C A 0026 ASP C 2.418 C A 0027 GLY CA
C A 0026 ASP C 3.019 C A 0027 GLY C
C A 0027 GLY CA 3.796 E A 0028 ASP CA
C A 0027 GLY C 2.433 E A 0028 ASP CA
C A 0027 GLY C 3.082 E A 0028 ASP C
C A 0027 GLY C 3.705 E A 0028 ASP CB
E A 0028 ASP C 2.434 E A 0029 LEU CA
E A 0028 ASP C 3.116 E A 0029 LEU C
E A 0028 ASP C 3.697 E A 0029 LEU CB
E A 0028 ASP CB 3.455 E A 0030 TYR CE2
E A 0029 LEU C 2.433 E A 0030 TYR CA
E A 0029 LEU C 3.513 E A 0030 TYR C
E A 0029 LEU C 3.454 E A 0030 TYR CB
E A 0029 LEU C 3.724 E A 0030 TYR CG
E A 0029 LEU CD1 3.431 C A 0052 TYR CE2
E A 0029 LEU CD1 3.671 C A 0052 TYR CZ
E A 0029 LEU CD2 3.331 C A 0052 TYR CG
E A 0029 LEU CD2 3.431 C A 0052 TYR CD1
E A 0029 LEU CD2 3.525 C A 0052 TYR CD2
E A 0029 LEU CD2 3.727 C A 0052 TYR CE1
E A 0030 TYR C 2.434 C A 0031 CYS CA
E A 0030 TYR C 3.365 C A 0031 CYS C
E A 0030 TYR C 3.584 C A 0031 CYS CB
E A 0030 TYR CE2 3.645 H A 0039 HIS CE1
E A 0030 TYR CZ 3.661 H A 0039 HIS CE1
C A 0031 CYS C 2.434 C A 0032 ALA CA
C A 0031 CYS C 3.217 C A 0032 ALA C
C A 0031 CYS C 3.656 C A 0032 ALA CB
C A 0032 ALA C 2.434 H A 0033 ARG CA
C A 0032 ALA C 3.358 H A 0033 ARG C
C A 0032 ALA C 3.588 H A 0033 ARG CB
H A 0033 ARG C 2.434 H A 0034 CYS CA
H A 0033 ARG C 2.855 H A 0034 CYS C
H A 0033 ARG C 3.695 H A 0034 CYS CB
H A 0033 ARG CD 3.533 H A 0034 CYS CA
H A 0033 ARG CD 3.428 H A 0037 GLU CD
H A 0034 CYS C 2.433 H A 0035 PHE CA
H A 0034 CYS C 3.044 H A 0035 PHE C
H A 0034 CYS C 3.711 H A 0035 PHE CB
H A 0034 CYS C 3.708 H A 0037 GLU CB
H A 0035 PHE C 2.433 H A 0036 ARG CA
H A 0035 PHE C 2.979 H A 0036 ARG C
H A 0035 PHE C 3.714 H A 0036 ARG CB
H A 0035 PHE C 3.766 H A 0039 HIS CB
H A 0035 PHE CG 3.613 H A 0039 HIS CB
H A 0035 PHE CD1 3.036 H A 0039 HIS CB
H A 0035 PHE CD1 3.133 H A 0039 HIS CG
H A 0035 PHE CE1 2.985 H A 0039 HIS CB
H A 0035 PHE CE1 3.076 H A 0039 HIS CG
H A 0035 PHE CE1 3.534 H A 0039 HIS CD2
H A 0035 PHE CZ 3.522 H A 0039 HIS CB
H A 0035 PHE CE1 3.500 E A 0049 THR CG2
H A 0035 PHE CZ 3.432 E A 0049 THR CG2
H A 0036 ARG C 2.434 H A 0037 GLU CA
H A 0036 ARG C 3.149 H A 0037 GLU C
H A 0036 ARG C 3.690 H A 0037 GLU CB
H A 0037 GLU CA 3.792 H A 0038 GLY CA
H A 0037 GLU C 2.418 H A 0038 GLY CA
H A 0037 GLU C 3.417 H A 0038 GLY C
H A 0038 GLY CA 3.797 H A 0039 HIS CA
H A 0038 GLY C 2.435 H A 0039 HIS CA
H A 0038 GLY C 3.155 H A 0039 HIS C
H A 0038 GLY C 3.687 H A 0039 HIS CB
H A 0039 HIS C 2.434 C A 0040 ASP CA
H A 0039 HIS C 3.588 C A 0040 ASP C
H A 0039 HIS C 3.359 C A 0040 ASP CB
H A 0039 HIS CA 3.497 C A 0044 LEU CG
H A 0039 HIS CA 3.660 C A 0044 LEU CD1
H A 0039 HIS CA 3.541 C A 0044 LEU CD2
H A 0039 HIS C 3.246 C A 0044 LEU CG
H A 0039 HIS C 3.018 C A 0044 LEU CD2
H A 0039 HIS CD2 3.281 C A 0044 LEU CD1
C A 0040 ASP C 2.434 C A 0041 ASN CA
C A 0040 ASP C 3.583 C A 0041 ASN C
C A 0040 ASP C 3.368 C A 0041 ASN CB
C A 0040 ASP CA 3.615 C A 0044 LEU CD2
C A 0040 ASP C 3.643 C A 0044 LEU CD2
C A 0041 ASN C 2.434 C A 0042 PHE CA
C A 0041 ASN C 2.940 C A 0042 PHE C
C A 0041 ASN C 3.713 C A 0042 PHE CB
C A 0041 ASN C 3.668 C A 0044 LEU CD2
C A 0042 PHE C 2.434 C A 0043 ASP CA
C A 0042 PHE C 3.149 C A 0043 ASP C
C A 0042 PHE C 3.688 C A 0043 ASP CB
C A 0042 PHE CA 3.691 C A 0044 LEU CD2
C A 0042 PHE C 3.524 C A 0044 LEU CD2
C A 0043 ASP C 2.434 C A 0044 LEU CA
C A 0043 ASP C 2.917 C A 0044 LEU C
C A 0043 ASP C 3.710 C A 0044 LEU CB
C A 0043 ASP C 3.647 C A 0045 LYS CG
C A 0044 LEU C 2.434 C A 0045 LYS CA
C A 0044 LEU C 2.865 C A 0045 LYS C
C A 0044 LEU C 3.698 C A 0045 LYS CB
C A 0045 LYS C 2.433 C A 0046 GLU CA
C A 0045 LYS C 3.401 C A 0046 GLU C
C A 0045 LYS C 3.558 C A 0046 GLU CB
C A 0045 LYS C 3.790 C A 0046 GLU CG
C A 0046 GLU C 2.435 C A 0047 HIS CA
C A 0046 GLU C 2.985 C A 0047 HIS C
C A 0046 GLU C 3.715 C A 0047 HIS CB
C A 0047 HIS C 2.433 C A 0048 GLN CA
C A 0047 HIS C 3.119 C A 0048 GLN C
C A 0047 HIS C 3.696 C A 0048 GLN CB
C A 0048 GLN C 2.434 E A 0049 THR CA
C A 0048 GLN C 3.281 E A 0049 THR C
C A 0048 GLN C 3.660 E A 0049 THR CB
E A 0049 THR C 2.435 E A 0050 SER CA
E A 0049 THR C 3.619 E A 0050 SER C
E A 0049 THR C 3.310 E A 0050 SER CB
E A 0050 SER CA 2.865 C A 0051 PRO CD
E A 0050 SER C 2.464 C A 0051 PRO CA
E A 0050 SER C 3.137 C A 0051 PRO C
E A 0050 SER C 3.646 C A 0051 PRO CB
E A 0050 SER C 3.636 C A 0051 PRO CG
E A 0050 SER C 2.498 C A 0051 PRO CD
E A 0050 SER CB 3.366 C A 0051 PRO CD
C A 0051 PRO C 2.433 C A 0052 TYR CA
C A 0051 PRO C 3.124 C A 0052 TYR C
C A 0051 PRO C 3.695 C A 0052 TYR CB
C A 0052 TYR C 2.434 C A 0053 HIS CA
C A 0052 TYR C 3.568 C A 0053 HIS C
C A 0052 TYR C 3.386 C A 0053 HIS CB
C A 0052 TYR C 3.796 C A 0053 HIS CG
C A 0052 TYR CD2 3.663 C A 0054 PRO CD
C A 0052 TYR CE2 3.701 C A 0054 PRO CA
C A 0052 TYR CE2 3.780 C A 0054 PRO CB
C A 0053 HIS CA 2.867 C A 0054 PRO CD
C A 0053 HIS C 2.465 C A 0054 PRO CA
C A 0053 HIS C 3.136 C A 0054 PRO C
C A 0053 HIS C 3.646 C A 0054 PRO CB
C A 0053 HIS C 3.636 C A 0054 PRO CG
C A 0053 HIS C 2.498 C A 0054 PRO CD
C A 0054 PRO C 2.433 C A 0055 ARG CA
C A 0054 PRO C 3.147 C A 0055 ARG C
C A 0054 PRO C 3.689 C A 0055 ARG CB
C A 0054 PRO CB 3.577 C A 0057 PRO CD
C A 0054 PRO CG 3.601 C A 0057 PRO CD
C A 0055 ARG C 2.434 C A 0056 ARG CA
C A 0055 ARG C 2.821 C A 0056 ARG C
C A 0055 ARG C 3.219 C A 0056 ARG CB
C A 0055 ARG C 3.056 C A 0057 PRO CD
C A 0056 ARG CA 2.866 C A 0057 PRO CD
C A 0056 ARG C 2.463 C A 0057 PRO CA
C A 0056 ARG C 3.136 C A 0057 PRO C
C A 0056 ARG C 3.644 C A 0057 PRO CB
C A 0056 ARG C 3.635 C A 0057 PRO CG
C A 0056 ARG C 2.497 C A 0057 PRO CD
C A 0056 ARG CB 3.549 C A 0059 GLN CG
C A 0057 PRO C 2.433 C A 0058 CYS CA
C A 0057 PRO C 3.544 C A 0058 CYS C
C A 0057 PRO C 3.417 C A 0058 CYS CB
C A 0058 CYS C 2.434 C A 0059 GLN CA
C A 0058 CYS C 3.119 C A 0059 GLN C
C A 0058 CYS C 3.697 C A 0059 GLN CB
C A 0059 GLN C 2.434 C A 0060 GLU CA
C A 0059 GLN C 3.581 C A 0060 GLU C
C A 0059 GLN C 3.371 C A 0060 GLU CB
C A 0060 GLU C 2.435 C A 0061 HIS CA
C A 0060 GLU C 3.532 C A 0061 HIS C
C A 0060 GLU C 3.435 C A 0061 HIS CB
C A 0060 GLU C 3.715 C A 0061 HIS CG
C A 0061 HIS C 2.434 C A 0062 SER CA
C A 0061 HIS C 3.681 C A 0062 SER C
C A 0061 HIS C 3.175 C A 0062 SER CB
C A 0062 SER CA 3.791 C A 0063 GLY CA
C A 0062 SER C 2.418 C A 0063 GLY CA
C A 0062 SER C 3.178 C A 0063 GLY C
C A 0063 GLY CA 2.866 C A 0064 PRO CD
C A 0063 GLY C 2.464 C A 0064 PRO CA
C A 0063 GLY C 3.136 C A 0064 PRO C
C A 0063 GLY C 3.645 C A 0064 PRO CB
C A 0063 GLY C 3.636 C A 0064 PRO CG
C A 0063 GLY C 2.498 C A 0064 PRO CD
C A 0064 PRO C 2.434 C A 0065 SER CA
C A 0064 PRO C 3.581 C A 0065 SER C
C A 0064 PRO C 3.371 C A 0065 SER CB
C A 0065 SER C 2.434 C A 0066 SER CA
C A 0065 SER C 3.600 C A 0066 SER C
C A 0065 SER C 3.341 C A 0066 SER CB
C A 0066 SER CA 3.792 C A 0067 GLY CA
C A 0066 SER C 2.418 C A 0067 GLY CA
C A 0066 SER C 3.511 C A 0067 GLY C
CHARGE_ATTR 2.00 12.00 75
C A 0016 GLU OE1 5.705 H A 0033 ARG NH1
C A 0016 GLU OE1 7.633 H A 0033 ARG NH2
C A 0016 GLU OE2 6.535 H A 0033 ARG NH1
C A 0016 GLU OE2 8.718 H A 0033 ARG NH2
C A 0017 ASP OD1 10.94 C A 0053 HIS ND1
C A 0017 ASP OD1 11.83 C A 0053 HIS NE2
C A 0017 ASP OD2 11.41 C A 0053 HIS ND1
C A 0017 ASP OD1 11.11 C A 0056 ARG NH1
C A 0017 ASP OD1 10.49 C A 0056 ARG NH2
C A 0017 ASP OD2 10.96 C A 0056 ARG NH1
C A 0017 ASP OD2 10.13 C A 0056 ARG NH2
C A 0017 ASP OD1 11.59 C A 0061 HIS ND1
C A 0017 ASP OD1 11.79 C A 0061 HIS NE2
C A 0017 ASP OD2 10.68 C A 0061 HIS ND1
C A 0017 ASP OD2 10.96 C A 0061 HIS NE2
C A 0026 ASP OD1 9.754 E A 0021 ARG NH1
C A 0026 ASP OD1 7.550 E A 0021 ARG NH2
C A 0026 ASP OD2 9.659 E A 0021 ARG NH1
C A 0026 ASP OD2 7.566 E A 0021 ARG NH2
C A 0026 ASP OD1 11.11 C A 0047 HIS ND1
C A 0026 ASP OD1 11.91 C A 0047 HIS NE2
C A 0026 ASP OD2 11.56 C A 0047 HIS ND1
E A 0028 ASP OD1 9.733 E A 0021 ARG NH1
E A 0028 ASP OD1 8.365 E A 0021 ARG NH2
E A 0028 ASP OD2 11.57 E A 0021 ARG NH1
E A 0028 ASP OD2 10.39 E A 0021 ARG NH2
E A 0028 ASP OD1 9.676 H A 0039 HIS ND1
E A 0028 ASP OD1 8.587 H A 0039 HIS NE2
E A 0028 ASP OD2 8.329 H A 0039 HIS ND1
E A 0028 ASP OD2 7.434 H A 0039 HIS NE2
E A 0028 ASP OD1 9.184 C A 0047 HIS ND1
E A 0028 ASP OD1 10.64 C A 0047 HIS NE2
E A 0028 ASP OD2 8.750 C A 0047 HIS ND1
E A 0028 ASP OD2 10.17 C A 0047 HIS NE2
H A 0037 GLU OE1 4.977 H A 0033 ARG NH1
H A 0037 GLU OE1 4.352 H A 0033 ARG NH2
H A 0037 GLU OE2 5.514 H A 0033 ARG NH1
H A 0037 GLU OE2 4.261 H A 0033 ARG NH2
H A 0037 GLU OE1 7.276 H A 0036 ARG NH1
H A 0037 GLU OE1 9.335 H A 0036 ARG NH2
H A 0037 GLU OE2 6.482 H A 0036 ARG NH1
H A 0037 GLU OE2 8.466 H A 0036 ARG NH2
H A 0037 GLU OE1 9.207 H A 0039 HIS ND1
H A 0037 GLU OE1 11.21 H A 0039 HIS NE2
H A 0037 GLU OE2 10.73 H A 0039 HIS ND1
C A 0040 ASP OD1 8.448 H A 0036 ARG NH1
C A 0040 ASP OD1 7.328 H A 0036 ARG NH2
C A 0040 ASP OD2 6.756 H A 0036 ARG NH1
C A 0040 ASP OD2 5.768 H A 0036 ARG NH2
C A 0040 ASP OD1 9.903 H A 0039 HIS ND1
C A 0040 ASP OD1 10.98 H A 0039 HIS NE2
C A 0040 ASP OD2 9.282 H A 0039 HIS ND1
C A 0040 ASP OD2 10.65 H A 0039 HIS NE2
C A 0043 ASP OD1 11.76 H A 0039 HIS NE2
C A 0043 ASP OD2 10.99 H A 0039 HIS NE2
C A 0043 ASP OD1 4.825 C A 0045 LYS NZ
C A 0043 ASP OD2 6.947 C A 0045 LYS NZ
C A 0043 ASP OD1 9.547 C A 0047 HIS ND1
C A 0043 ASP OD1 7.839 C A 0047 HIS NE2
C A 0043 ASP OD2 8.870 C A 0047 HIS ND1
C A 0043 ASP OD2 6.984 C A 0047 HIS NE2
C A 0046 GLU OE1 8.596 C A 0045 LYS NZ
C A 0046 GLU OE2 6.691 C A 0045 LYS NZ
C A 0046 GLU OE1 8.969 C A 0047 HIS ND1
C A 0046 GLU OE1 8.061 C A 0047 HIS NE2
C A 0046 GLU OE2 10.11 C A 0047 HIS ND1
C A 0046 GLU OE2 9.004 C A 0047 HIS NE2
C A 0060 GLU OE1 9.780 C A 0056 ARG NH1
C A 0060 GLU OE1 8.499 C A 0056 ARG NH2
C A 0060 GLU OE2 9.010 C A 0056 ARG NH1
C A 0060 GLU OE2 7.869 C A 0056 ARG NH2
C A 0060 GLU OE1 7.936 C A 0061 HIS ND1
C A 0060 GLU OE1 8.313 C A 0061 HIS NE2
C A 0060 GLU OE2 7.473 C A 0061 HIS ND1
C A 0060 GLU OE2 7.463 C A 0061 HIS NE2
CHARGE_REPU 2.00 12.00 54
C A 0016 GLU OE1 8.651 C A 0017 ASP OD1
C A 0016 GLU OE1 8.313 C A 0017 ASP OD2
C A 0016 GLU OE2 7.435 C A 0017 ASP OD1
C A 0016 GLU OE2 6.646 C A 0017 ASP OD2
C A 0016 GLU OE1 9.224 H A 0037 GLU OE1
C A 0016 GLU OE1 10.63 H A 0037 GLU OE2
C A 0016 GLU OE2 10.29 H A 0037 GLU OE1
C A 0016 GLU OE2 11.56 H A 0037 GLU OE2
C A 0016 GLU OE1 10.66 C A 0060 GLU OE1
C A 0016 GLU OE2 8.559 C A 0060 GLU OE1
C A 0016 GLU OE2 10.58 C A 0060 GLU OE2
C A 0017 ASP OD1 6.223 C A 0060 GLU OE1
C A 0017 ASP OD1 7.921 C A 0060 GLU OE2
C A 0017 ASP OD2 4.237 C A 0060 GLU OE1
C A 0017 ASP OD2 6.052 C A 0060 GLU OE2
E A 0021 ARG NH1 10.11 C A 0053 HIS ND1
E A 0021 ARG NH1 8.374 C A 0053 HIS NE2
E A 0021 ARG NH2 10.66 C A 0053 HIS NE2
E A 0021 ARG NH1 11.70 C A 0055 ARG NH1
E A 0021 ARG NH1 10.53 C A 0055 ARG NH2
E A 0021 ARG NH2 11.68 C A 0055 ARG NH2
C A 0026 ASP OD1 5.951 E A 0028 ASP OD1
C A 0026 ASP OD1 7.782 E A 0028 ASP OD2
C A 0026 ASP OD2 4.543 E A 0028 ASP OD1
C A 0026 ASP OD2 6.409 E A 0028 ASP OD2
H A 0033 ARG NH1 8.221 H A 0036 ARG NH1
H A 0033 ARG NH1 10.50 H A 0036 ARG NH2
H A 0033 ARG NH2 8.448 H A 0036 ARG NH1
H A 0033 ARG NH2 10.71 H A 0036 ARG NH2
H A 0036 ARG NH1 11.82 H A 0039 HIS ND1
H A 0037 GLU OE1 11.87 C A 0040 ASP OD1
H A 0037 GLU OE1 10.65 C A 0040 ASP OD2
H A 0037 GLU OE2 11.62 C A 0040 ASP OD1
H A 0037 GLU OE2 10.52 C A 0040 ASP OD2
H A 0039 HIS ND1 6.015 C A 0047 HIS ND1
H A 0039 HIS ND1 7.536 C A 0047 HIS NE2
H A 0039 HIS NE2 4.004 C A 0047 HIS ND1
H A 0039 HIS NE2 5.597 C A 0047 HIS NE2
C A 0043 ASP OD1 9.125 C A 0046 GLU OE1
C A 0043 ASP OD1 8.098 C A 0046 GLU OE2
C A 0043 ASP OD2 9.763 C A 0046 GLU OE1
C A 0043 ASP OD2 9.142 C A 0046 GLU OE2
C A 0045 LYS NZ 11.00 C A 0047 HIS NE2
C A 0053 HIS ND1 11.97 C A 0055 ARG NH1
C A 0053 HIS ND1 10.95 C A 0055 ARG NH2
C A 0053 HIS NE2 11.00 C A 0055 ARG NH1
C A 0053 HIS NE2 9.706 C A 0055 ARG NH2
C A 0053 HIS ND1 10.40 C A 0056 ARG NH1
C A 0053 HIS ND1 11.92 C A 0056 ARG NH2
C A 0053 HIS NE2 11.89 C A 0056 ARG NH1
C A 0056 ARG NH1 6.814 C A 0061 HIS ND1
C A 0056 ARG NH1 5.015 C A 0061 HIS NE2
C A 0056 ARG NH2 4.573 C A 0061 HIS ND1
C A 0056 ARG NH2 3.003 C A 0061 HIS NE2
HB_MM 2.00 3.20 95
C A 0002 SER N 2.250 C A 0001 GLY O
C A 0003 SER N 2.250 C A 0002 SER O
C A 0004 GLY N 3.042 C A 0002 SER O
C A 0004 GLY N 2.250 C A 0003 SER O
C A 0005 SER N 2.251 C A 0004 GLY O
C A 0006 SER N 2.250 C A 0005 SER O
C A 0007 GLY N 2.250 C A 0006 SER O
C A 0008 LEU N 2.250 C A 0007 GLY O
C A 0009 PRO N 2.253 C A 0008 LEU O
C A 0010 TRP N 2.249 C A 0009 PRO O
C A 0011 CYS N 2.250 C A 0010 TRP O
C A 0012 CYS N 3.152 C A 0010 TRP O
C A 0012 CYS N 2.250 C A 0011 CYS O
C A 0012 CYS N 2.772 E A 0029 LEU O
C A 0013 ILE N 2.909 C A 0011 CYS O
C A 0013 ILE N 2.250 C A 0012 CYS O
C A 0014 CYS N 2.249 C A 0013 ILE O
C A 0015 ASN N 2.621 C A 0011 CYS O
C A 0015 ASN N 2.249 C A 0014 CYS O
C A 0016 GLU N 2.250 C A 0015 ASN O
C A 0017 ASP N 2.250 C A 0016 GLU O
C A 0018 ALA N 2.249 C A 0017 ASP O
C A 0019 THR N 2.250 C A 0018 ALA O
C A 0019 THR N 2.894 E A 0030 TYR O
E A 0020 LEU N 2.250 C A 0019 THR O
E A 0020 LEU N 2.908 E A 0030 TYR O
E A 0021 ARG N 2.251 E A 0020 LEU O
E A 0021 ARG N 2.933 E A 0050 SER O
E A 0022 CYS N 2.249 E A 0021 ARG O
E A 0022 CYS N 2.896 E A 0028 ASP O
C A 0023 ALA N 2.250 E A 0022 CYS O
C A 0024 GLY N 2.250 C A 0023 ALA O
C A 0025 CYS N 2.251 C A 0024 GLY O
C A 0026 ASP N 2.250 C A 0025 CYS O
C A 0027 GLY N 2.638 E A 0022 CYS O
C A 0027 GLY N 2.249 C A 0026 ASP O
E A 0028 ASP N 2.952 E A 0022 CYS O
E A 0028 ASP N 2.250 C A 0027 GLY O
E A 0029 LEU N 2.250 E A 0028 ASP O
E A 0030 TYR N 2.684 E A 0020 LEU O
E A 0030 TYR N 2.250 E A 0029 LEU O
C A 0031 CYS N 2.249 E A 0030 TYR O
C A 0032 ALA N 2.250 C A 0031 CYS O
H A 0033 ARG N 2.250 C A 0032 ALA O
H A 0034 CYS N 2.250 H A 0033 ARG O
H A 0035 PHE N 2.720 H A 0033 ARG O
H A 0035 PHE N 2.250 H A 0034 CYS O
H A 0036 ARG N 2.894 H A 0033 ARG O
H A 0036 ARG N 2.250 H A 0035 PHE O
H A 0037 GLU N 2.785 H A 0033 ARG O
H A 0037 GLU N 2.771 H A 0035 PHE O
H A 0037 GLU N 2.251 H A 0036 ARG O
H A 0038 GLY N 3.058 H A 0035 PHE O
H A 0038 GLY N 2.250 H A 0037 GLU O
H A 0039 HIS N 2.497 H A 0035 PHE O
H A 0039 HIS N 2.251 H A 0038 GLY O
C A 0040 ASP N 2.791 H A 0038 GLY O
C A 0040 ASP N 2.250 H A 0039 HIS O
C A 0041 ASN N 2.249 C A 0040 ASP O
C A 0042 PHE N 2.250 C A 0041 ASN O
C A 0043 ASP N 2.249 C A 0042 PHE O
C A 0044 LEU N 2.778 C A 0042 PHE O
C A 0044 LEU N 2.250 C A 0043 ASP O
C A 0045 LYS N 2.662 C A 0043 ASP O
C A 0045 LYS N 2.250 C A 0044 LEU O
C A 0046 GLU N 3.050 C A 0043 ASP O
C A 0046 GLU N 2.507 C A 0044 LEU O
C A 0046 GLU N 2.250 C A 0045 LYS O
C A 0047 HIS N 2.711 C A 0044 LEU O
C A 0047 HIS N 2.250 C A 0046 GLU O
C A 0048 GLN N 2.448 C A 0046 GLU O
C A 0048 GLN N 2.251 C A 0047 HIS O
E A 0049 THR N 2.250 C A 0048 GLN O
E A 0050 SER N 3.092 E A 0021 ARG O
E A 0050 SER N 2.250 E A 0049 THR O
C A 0051 PRO N 2.253 E A 0050 SER O
C A 0052 TYR N 2.777 E A 0050 SER O
C A 0052 TYR N 2.250 C A 0051 PRO O
C A 0053 HIS N 2.251 C A 0052 TYR O
C A 0054 PRO N 2.253 C A 0053 HIS O
C A 0055 ARG N 2.251 C A 0054 PRO O
C A 0056 ARG N 2.739 C A 0054 PRO O
C A 0056 ARG N 2.250 C A 0055 ARG O
C A 0057 PRO N 2.851 C A 0055 ARG O
C A 0057 PRO N 2.254 C A 0056 ARG O
C A 0058 CYS N 2.251 C A 0057 PRO O
C A 0059 GLN N 2.251 C A 0058 CYS O
C A 0060 GLU N 2.251 C A 0059 GLN O
C A 0061 HIS N 2.251 C A 0060 GLU O
C A 0062 SER N 2.250 C A 0061 HIS O
C A 0063 GLY N 2.250 C A 0062 SER O
C A 0064 PRO N 2.252 C A 0063 GLY O
C A 0065 SER N 2.250 C A 0064 PRO O
C A 0066 SER N 2.251 C A 0065 SER O
C A 0067 GLY N 2.250 C A 0066 SER O
HB_MS 2.00 3.20 5
C A 0011 CYS O 2.606 C A 0015 ASN ND2
H A 0038 GLY O 2.547 C A 0041 ASN ND2
E A 0049 THR O 3.184 E A 0050 SER OG
C A 0060 GLU N 2.845 C A 0059 GLN OE1
C A 0061 HIS O 2.722 C A 0062 SER OG
AROMATIC 0.00 8.00 3
C A 0056 ARG 4.069 C A 0061 HIS
E A 0021 ARG 5.540 C A 0052 TYR
H A 0035 PHE 4.456 H A 0039 HIS