Complet list of 2ctj con file
Complete list of 2ctj.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 376
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 3.621 C A 0002 SER C
C A 0001 GLY C 3.308 C A 0002 SER CB
C A 0002 SER C 2.434 C A 0003 SER CA
C A 0002 SER C 2.995 C A 0003 SER C
C A 0002 SER C 3.714 C A 0003 SER CB
C A 0003 SER CA 3.791 C A 0004 GLY CA
C A 0003 SER C 2.418 C A 0004 GLY CA
C A 0003 SER C 3.075 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 3.329 C A 0005 SER C
C A 0004 GLY C 3.609 C A 0005 SER CB
C A 0005 SER C 2.434 C A 0006 SER CA
C A 0005 SER C 3.600 C A 0006 SER C
C A 0005 SER C 3.340 C A 0006 SER CB
C A 0006 SER CA 3.792 C A 0007 GLY CA
C A 0006 SER C 2.418 C A 0007 GLY CA
C A 0006 SER C 3.525 C A 0007 GLY C
C A 0007 GLY CA 3.797 C A 0008 SER CA
C A 0007 GLY C 2.434 C A 0008 SER CA
C A 0007 GLY C 3.514 C A 0008 SER C
C A 0007 GLY C 3.454 C A 0008 SER CB
C A 0008 SER C 2.433 C A 0009 ILE CA
C A 0008 SER C 3.457 C A 0009 ILE C
C A 0008 SER C 3.536 C A 0009 ILE CB
C A 0008 SER C 3.571 C A 0009 ILE CG2
C A 0009 ILE C 2.434 C A 0010 GLN CA
C A 0009 ILE C 3.483 C A 0010 GLN C
C A 0009 ILE C 3.486 C A 0010 GLN CB
C A 0009 ILE C 3.731 C A 0010 GLN CG
C A 0010 GLN C 2.433 C A 0011 LYS CA
C A 0010 GLN C 3.218 C A 0011 LYS C
C A 0010 GLN C 3.665 C A 0011 LYS CB
C A 0010 GLN CB 3.658 C A 0012 ASP CG
C A 0011 LYS C 2.434 C A 0012 ASP CA
C A 0011 LYS C 3.107 C A 0012 ASP C
C A 0011 LYS C 3.700 C A 0012 ASP CB
C A 0012 ASP C 2.433 C A 0013 LEU CA
C A 0012 ASP C 3.630 C A 0013 LEU C
C A 0012 ASP C 3.290 C A 0013 LEU CB
C A 0012 ASP C 3.549 C A 0013 LEU CG
C A 0013 LEU C 2.433 C A 0014 ALA CA
C A 0013 LEU C 3.499 C A 0014 ALA C
C A 0013 LEU C 3.459 C A 0014 ALA CB
C A 0014 ALA C 2.434 C A 0015 ASN CA
C A 0014 ALA C 3.040 C A 0015 ASN C
C A 0014 ALA C 3.711 C A 0015 ASN CB
C A 0015 ASN C 2.433 C A 0016 ILE CA
C A 0015 ASN C 3.258 C A 0016 ILE C
C A 0015 ASN C 3.671 C A 0016 ILE CB
C A 0016 ILE C 2.432 C A 0017 ALA CA
C A 0016 ILE C 3.514 C A 0017 ALA C
C A 0016 ILE C 3.442 C A 0017 ALA CB
C A 0017 ALA C 2.434 C A 0018 GLU CA
C A 0017 ALA C 3.240 C A 0018 GLU C
C A 0017 ALA C 3.656 C A 0018 GLU CB
C A 0018 GLU C 2.433 E A 0019 VAL CA
C A 0018 GLU C 3.496 E A 0019 VAL C
C A 0018 GLU C 3.499 E A 0019 VAL CB
C A 0018 GLU C 3.602 E A 0019 VAL CG2
C A 0018 GLU CG 3.337 E A 0064 VAL CG1
C A 0018 GLU CD 3.223 E A 0064 VAL CG1
E A 0019 VAL C 2.433 E A 0020 GLU CA
E A 0019 VAL C 3.433 E A 0020 GLU C
E A 0019 VAL C 3.533 E A 0020 GLU CB
E A 0019 VAL C 3.696 E A 0020 GLU CG
E A 0019 VAL C 3.599 E A 0020 GLU CD
E A 0019 VAL CB 3.588 H A 0072 VAL CG1
E A 0019 VAL CG2 3.787 H A 0072 VAL CG1
E A 0020 GLU C 2.434 E A 0021 VAL CA
E A 0020 GLU C 3.621 E A 0021 VAL C
E A 0020 GLU C 3.338 E A 0021 VAL CB
E A 0020 GLU CG 3.576 E A 0064 VAL CG2
E A 0021 VAL C 2.434 E A 0022 SER CA
E A 0021 VAL C 3.349 E A 0022 SER C
E A 0021 VAL C 3.595 E A 0022 SER CB
E A 0021 VAL CG1 3.647 C A 0023 ILE CD1
E A 0022 SER C 2.431 C A 0023 ILE CA
E A 0022 SER C 3.630 C A 0023 ILE C
E A 0022 SER C 3.317 C A 0023 ILE CB
E A 0022 SER C 3.213 C A 0023 ILE CG1
C A 0023 ILE CA 2.867 C A 0024 PRO CD
C A 0023 ILE C 2.464 C A 0024 PRO CA
C A 0023 ILE C 3.135 C A 0024 PRO C
C A 0023 ILE C 3.645 C A 0024 PRO CB
C A 0023 ILE C 3.635 C A 0024 PRO CG
C A 0023 ILE C 2.499 C A 0024 PRO CD
C A 0023 ILE CB 3.612 C A 0024 PRO CD
C A 0023 ILE CG2 3.178 C A 0024 PRO CD
C A 0023 ILE CG2 3.352 H A 0028 HIS CD2
C A 0023 ILE CD1 3.069 H A 0079 LEU CD2
C A 0024 PRO C 2.433 C A 0025 ALA CA
C A 0024 PRO C 3.052 C A 0025 ALA C
C A 0024 PRO C 3.702 C A 0025 ALA CB
C A 0024 PRO CG 3.651 C A 0027 LEU CG
C A 0024 PRO CG 3.531 C A 0027 LEU CD1
C A 0024 PRO C 3.597 H A 0028 HIS CD2
C A 0025 ALA C 2.435 C A 0026 LYS CA
C A 0025 ALA C 2.987 C A 0026 LYS C
C A 0025 ALA C 3.715 C A 0026 LYS CB
C A 0025 ALA CA 3.649 H A 0028 HIS CG
C A 0026 LYS C 2.435 C A 0027 LEU CA
C A 0026 LYS C 3.278 C A 0027 LEU C
C A 0026 LYS C 3.637 C A 0027 LEU CB
C A 0027 LEU C 2.434 H A 0028 HIS CA
C A 0027 LEU C 2.877 H A 0028 HIS C
C A 0027 LEU C 3.702 H A 0028 HIS CB
C A 0027 LEU CD1 3.445 H A 0083 ALA C
C A 0027 LEU CD1 3.683 H A 0083 ALA CB
C A 0027 LEU CD2 3.640 H A 0087 GLN CG
H A 0028 HIS C 2.435 H A 0029 ASN CA
H A 0028 HIS C 2.844 H A 0029 ASN C
H A 0028 HIS C 3.692 H A 0029 ASN CB
H A 0028 HIS C 3.761 H A 0032 ILE CD1
H A 0028 HIS CB 3.531 C A 0053 PHE CD1
H A 0028 HIS CB 3.725 C A 0053 PHE CE1
H A 0028 HIS CG 3.179 C A 0053 PHE CD1
H A 0028 HIS CG 3.331 C A 0053 PHE CE1
H A 0028 HIS CD2 3.633 C A 0053 PHE CD1
H A 0028 HIS CD2 3.338 C A 0053 PHE CE1
H A 0028 HIS CE1 3.701 C A 0053 PHE CD1
H A 0028 HIS CE1 3.607 C A 0054 PRO CG
H A 0028 HIS CE1 3.660 C A 0054 PRO CD
H A 0028 HIS CE1 3.629 E A 0063 VAL CG2
H A 0029 ASN C 2.434 H A 0030 SER CA
H A 0029 ASN C 3.013 H A 0030 SER C
H A 0029 ASN C 3.714 H A 0030 SER CB
H A 0030 SER C 2.434 H A 0031 LEU CA
H A 0030 SER C 2.963 H A 0031 LEU C
H A 0030 SER C 3.713 H A 0031 LEU CB
H A 0031 LEU C 2.433 H A 0032 ILE CA
H A 0031 LEU C 2.975 H A 0032 ILE C
H A 0031 LEU C 3.736 H A 0032 ILE CB
H A 0031 LEU C 3.714 H A 0039 ILE CG1
H A 0031 LEU CD2 3.475 H A 0082 LEU CB
H A 0031 LEU CD2 3.672 H A 0082 LEU CD1
H A 0031 LEU CD1 3.567 H A 0083 ALA CB
H A 0032 ILE CA 3.791 H A 0033 GLY CA
H A 0032 ILE C 2.418 H A 0033 GLY CA
H A 0032 ILE C 3.322 H A 0033 GLY C
H A 0032 ILE CA 3.405 H A 0039 ILE CG1
H A 0032 ILE CG1 3.716 C A 0053 PHE CD2
H A 0033 GLY CA 3.797 C A 0034 THR CA
H A 0033 GLY C 2.434 C A 0034 THR CA
H A 0033 GLY C 3.151 C A 0034 THR C
H A 0033 GLY C 3.712 C A 0034 THR CB
C A 0034 THR C 2.435 C A 0035 LYS CA
C A 0034 THR C 3.507 C A 0035 LYS C
C A 0034 THR C 3.462 C A 0035 LYS CB
C A 0035 LYS CA 3.792 H A 0036 GLY CA
C A 0035 LYS C 2.418 H A 0036 GLY CA
C A 0035 LYS C 2.911 H A 0036 GLY C
C A 0035 LYS C 3.781 H A 0037 ARG CG
C A 0035 LYS CB 3.378 H A 0037 ARG CZ
H A 0036 GLY CA 3.797 H A 0037 ARG CA
H A 0036 GLY C 2.434 H A 0037 ARG CA
H A 0036 GLY C 3.316 H A 0037 ARG C
H A 0036 GLY C 3.614 H A 0037 ARG CB
H A 0037 ARG C 2.434 H A 0038 LEU CA
H A 0037 ARG C 2.928 H A 0038 LEU C
H A 0037 ARG C 3.710 H A 0038 LEU CB
H A 0038 LEU C 2.433 H A 0039 ILE CA
H A 0038 LEU C 3.325 H A 0039 ILE C
H A 0038 LEU C 3.636 H A 0039 ILE CB
H A 0039 ILE C 2.433 H A 0040 ARG CA
H A 0039 ILE C 2.963 H A 0040 ARG C
H A 0039 ILE C 3.714 H A 0040 ARG CB
H A 0039 ILE CG2 3.677 E A 0051 ILE CD1
H A 0039 ILE CD1 3.493 H A 0079 LEU CD1
H A 0040 ARG C 2.434 H A 0041 SER CA
H A 0040 ARG C 2.970 H A 0041 SER C
H A 0040 ARG C 3.715 H A 0041 SER CB
H A 0041 SER C 2.433 H A 0042 ILE CA
H A 0041 SER C 2.986 H A 0042 ILE C
H A 0041 SER C 3.736 H A 0042 ILE CB
H A 0042 ILE C 2.435 H A 0043 MET CA
H A 0042 ILE C 2.964 H A 0043 MET C
H A 0042 ILE C 3.715 H A 0043 MET CB
H A 0042 ILE CD1 3.488 H A 0082 LEU CD1
H A 0043 MET C 2.435 H A 0044 GLU CA
H A 0043 MET C 3.173 H A 0044 GLU C
H A 0043 MET C 3.682 H A 0044 GLU CB
H A 0043 MET C 3.798 C A 0048 GLY CA
H A 0043 MET CG 3.705 E A 0051 ILE CD1
H A 0044 GLU C 2.434 H A 0045 GLU CA
H A 0044 GLU C 2.850 H A 0045 GLU C
H A 0044 GLU C 3.695 H A 0045 GLU CB
H A 0045 GLU C 2.433 H A 0046 CYS CA
H A 0045 GLU C 3.046 H A 0046 CYS C
H A 0045 GLU C 3.710 H A 0046 CYS CB
H A 0046 CYS CA 3.791 H A 0047 GLY CA
H A 0046 CYS C 2.419 H A 0047 GLY CA
H A 0046 CYS C 3.688 H A 0047 GLY C
H A 0046 CYS C 3.646 H A 0071 ASP CG
H A 0046 CYS CB 3.262 H A 0071 ASP CG
H A 0047 GLY CA 3.785 C A 0048 GLY CA
H A 0047 GLY C 2.418 C A 0048 GLY CA
H A 0047 GLY C 3.640 C A 0048 GLY C
C A 0048 GLY CA 3.796 C A 0049 VAL CA
C A 0048 GLY C 2.435 C A 0049 VAL CA
C A 0048 GLY C 3.206 C A 0049 VAL C
C A 0048 GLY C 3.695 C A 0049 VAL CB
C A 0049 VAL C 2.434 E A 0050 HIS CA
C A 0049 VAL C 3.448 E A 0050 HIS C
C A 0049 VAL C 3.519 E A 0050 HIS CB
C A 0049 VAL C 3.644 E A 0050 HIS CG
C A 0049 VAL C 3.186 E A 0050 HIS CD2
C A 0049 VAL CG1 3.722 C A 0067 GLY CA
C A 0049 VAL CG1 3.395 H A 0071 ASP CG
E A 0050 HIS C 2.433 E A 0051 ILE CA
E A 0050 HIS C 3.501 E A 0051 ILE C
E A 0050 HIS C 3.495 E A 0051 ILE CB
E A 0050 HIS C 3.454 E A 0051 ILE CG1
E A 0051 ILE C 2.434 E A 0052 HIS CA
E A 0051 ILE C 3.417 E A 0052 HIS C
E A 0051 ILE C 3.545 E A 0052 HIS CB
E A 0051 ILE C 3.705 E A 0052 HIS CD2
E A 0051 ILE CG2 3.651 C A 0053 PHE CE2
E A 0051 ILE CG2 3.621 E A 0063 VAL CG1
E A 0052 HIS C 2.433 C A 0053 PHE CA
E A 0052 HIS C 3.464 C A 0053 PHE C
E A 0052 HIS C 3.505 C A 0053 PHE CB
C A 0053 PHE CA 2.865 C A 0054 PRO CD
C A 0053 PHE C 2.464 C A 0054 PRO CA
C A 0053 PHE C 3.137 C A 0054 PRO C
C A 0053 PHE C 3.646 C A 0054 PRO CB
C A 0053 PHE C 3.637 C A 0054 PRO CG
C A 0053 PHE C 2.498 C A 0054 PRO CD
C A 0053 PHE CB 3.708 C A 0054 PRO CD
C A 0053 PHE CD1 3.410 E A 0063 VAL CG2
C A 0053 PHE CE1 3.294 E A 0063 VAL CG2
C A 0054 PRO C 2.433 C A 0055 VAL CA
C A 0054 PRO C 3.254 C A 0055 VAL C
C A 0054 PRO C 3.672 C A 0055 VAL CB
C A 0054 PRO CB 3.601 C A 0060 SER CB
C A 0054 PRO CG 3.679 C A 0060 SER C
C A 0055 VAL C 2.433 C A 0056 GLU CA
C A 0055 VAL C 2.900 C A 0056 GLU C
C A 0055 VAL C 3.708 C A 0056 GLU CB
C A 0056 GLU CA 3.792 C A 0057 GLY CA
C A 0056 GLU C 2.418 C A 0057 GLY CA
C A 0056 GLU C 2.942 C A 0057 GLY C
C A 0057 GLY CA 3.797 C A 0058 SER CA
C A 0057 GLY C 2.434 C A 0058 SER CA
C A 0057 GLY C 2.915 C A 0058 SER C
C A 0057 GLY C 3.710 C A 0058 SER CB
C A 0058 SER CA 3.790 C A 0059 GLY CA
C A 0058 SER C 2.417 C A 0059 GLY CA
C A 0058 SER C 3.328 C A 0059 GLY C
C A 0059 GLY CA 3.797 C A 0060 SER CA
C A 0059 GLY C 2.434 C A 0060 SER CA
C A 0059 GLY C 3.458 C A 0060 SER C
C A 0059 GLY C 3.511 C A 0060 SER CB
C A 0060 SER C 2.433 C A 0061 ASP CA
C A 0060 SER C 3.309 C A 0061 ASP C
C A 0060 SER C 3.619 C A 0061 ASP CB
C A 0060 SER C 3.749 C A 0061 ASP CG
C A 0061 ASP C 2.435 E A 0062 THR CA
C A 0061 ASP C 3.495 E A 0062 THR C
C A 0061 ASP C 3.502 E A 0062 THR CB
E A 0062 THR C 2.434 E A 0063 VAL CA
E A 0062 THR C 3.516 E A 0063 VAL C
E A 0062 THR C 3.479 E A 0063 VAL CB
E A 0062 THR C 3.498 E A 0063 VAL CG2
E A 0063 VAL C 2.434 E A 0064 VAL CA
E A 0063 VAL C 3.471 E A 0064 VAL C
E A 0063 VAL C 3.526 E A 0064 VAL CB
E A 0063 VAL C 3.566 E A 0064 VAL CG2
E A 0064 VAL C 2.432 E A 0065 ILE CA
E A 0064 VAL C 3.464 E A 0065 ILE C
E A 0064 VAL C 3.530 E A 0065 ILE CB
E A 0064 VAL C 3.537 E A 0065 ILE CG1
E A 0065 ILE C 2.433 E A 0066 ARG CA
E A 0065 ILE C 3.533 E A 0066 ARG C
E A 0065 ILE C 3.430 E A 0066 ARG CB
E A 0065 ILE C 3.763 E A 0066 ARG CG
E A 0066 ARG CA 3.792 C A 0067 GLY CA
E A 0066 ARG C 2.418 C A 0067 GLY CA
E A 0066 ARG C 3.598 C A 0067 GLY C
C A 0067 GLY CA 2.866 H A 0068 PRO CD
C A 0067 GLY C 2.463 H A 0068 PRO CA
C A 0067 GLY C 3.135 H A 0068 PRO C
C A 0067 GLY C 3.645 H A 0068 PRO CB
C A 0067 GLY C 3.634 H A 0068 PRO CG
C A 0067 GLY C 2.497 H A 0068 PRO CD
C A 0067 GLY C 3.497 H A 0072 VAL CG2
H A 0068 PRO C 2.434 H A 0069 SER CA
H A 0068 PRO C 2.846 H A 0069 SER C
H A 0068 PRO C 3.693 H A 0069 SER CB
H A 0068 PRO C 3.496 H A 0072 VAL CG2
H A 0069 SER C 2.434 H A 0070 SER CA
H A 0069 SER C 2.823 H A 0070 SER C
H A 0069 SER C 3.681 H A 0070 SER CB
H A 0070 SER C 2.435 H A 0071 ASP CA
H A 0070 SER C 3.236 H A 0071 ASP C
H A 0070 SER C 3.655 H A 0071 ASP CB
H A 0071 ASP C 2.433 H A 0072 VAL CA
H A 0071 ASP C 2.898 H A 0072 VAL C
H A 0071 ASP C 3.728 H A 0072 VAL CB
H A 0072 VAL C 2.434 H A 0073 GLU CA
H A 0072 VAL C 3.022 H A 0073 GLU C
H A 0072 VAL C 3.714 H A 0073 GLU CB
H A 0073 GLU C 2.435 H A 0074 LYS CA
H A 0073 GLU C 3.155 H A 0074 LYS C
H A 0073 GLU C 3.688 H A 0074 LYS CB
H A 0074 LYS C 2.434 H A 0075 ALA CA
H A 0074 LYS C 3.055 H A 0075 ALA C
H A 0074 LYS C 3.701 H A 0075 ALA CB
H A 0075 ALA C 2.434 H A 0076 LYS CA
H A 0075 ALA C 3.107 H A 0076 LYS C
H A 0075 ALA C 3.700 H A 0076 LYS CB
H A 0076 LYS C 2.436 H A 0077 LYS CA
H A 0076 LYS C 2.987 H A 0077 LYS C
H A 0076 LYS C 3.715 H A 0077 LYS CB
H A 0076 LYS C 3.627 H A 0080 LEU CD1
H A 0076 LYS CG 3.490 H A 0080 LEU CD1
H A 0076 LYS CE 3.668 H A 0080 LEU CD1
H A 0077 LYS C 2.434 H A 0078 GLN CA
H A 0077 LYS C 3.149 H A 0078 GLN C
H A 0077 LYS C 3.689 H A 0078 GLN CB
H A 0078 GLN C 2.434 H A 0079 LEU CA
H A 0078 GLN C 3.030 H A 0079 LEU C
H A 0078 GLN C 3.711 H A 0079 LEU CB
H A 0079 LEU C 2.435 H A 0080 LEU CA
H A 0079 LEU C 2.989 H A 0080 LEU C
H A 0079 LEU C 3.714 H A 0080 LEU CB
H A 0080 LEU C 2.435 H A 0081 HIS CA
H A 0080 LEU C 2.952 H A 0081 HIS C
H A 0080 LEU C 3.714 H A 0081 HIS CB
H A 0081 HIS C 2.436 H A 0082 LEU CA
H A 0081 HIS C 3.013 H A 0082 LEU C
H A 0081 HIS C 3.714 H A 0082 LEU CB
H A 0082 LEU C 2.433 H A 0083 ALA CA
H A 0082 LEU C 2.822 H A 0083 ALA C
H A 0082 LEU C 3.674 H A 0083 ALA CB
H A 0083 ALA C 2.433 H A 0084 GLU CA
H A 0083 ALA C 3.051 H A 0084 GLU C
H A 0083 ALA C 3.711 H A 0084 GLU CB
H A 0084 GLU C 2.434 H A 0085 GLU CA
H A 0084 GLU C 2.954 H A 0085 GLU C
H A 0084 GLU C 3.715 H A 0085 GLU CB
H A 0085 GLU C 2.434 H A 0086 LYS CA
H A 0085 GLU C 2.818 H A 0086 LYS C
H A 0085 GLU C 3.678 H A 0086 LYS CB
H A 0086 LYS C 2.433 H A 0087 GLN CA
H A 0086 LYS C 2.925 H A 0087 GLN C
H A 0086 LYS C 3.711 H A 0087 GLN CB
H A 0087 GLN C 2.435 C A 0088 THR CA
H A 0087 GLN C 3.212 C A 0088 THR C
H A 0087 GLN C 3.692 C A 0088 THR CB
C A 0088 THR C 2.435 C A 0089 LYS CA
C A 0088 THR C 3.708 C A 0089 LYS C
C A 0088 THR C 3.078 C A 0089 LYS CB
C A 0089 LYS C 2.434 C A 0090 SER CA
C A 0089 LYS C 3.106 C A 0090 SER C
C A 0089 LYS C 3.700 C A 0090 SER CB
C A 0090 SER CA 3.791 C A 0091 GLY CA
C A 0090 SER C 2.418 C A 0091 GLY CA
C A 0090 SER C 3.135 C A 0091 GLY C
C A 0091 GLY CA 2.866 C A 0092 PRO CD
C A 0091 GLY C 2.463 C A 0092 PRO CA
C A 0091 GLY C 3.135 C A 0092 PRO C
C A 0091 GLY C 3.644 C A 0092 PRO CB
C A 0091 GLY C 3.634 C A 0092 PRO CG
C A 0091 GLY C 2.498 C A 0092 PRO CD
C A 0092 PRO C 2.435 C A 0093 SER CA
C A 0092 PRO C 3.497 C A 0093 SER C
C A 0092 PRO C 3.474 C A 0093 SER CB
C A 0093 SER C 2.435 C A 0094 SER CA
C A 0093 SER C 3.192 C A 0094 SER C
C A 0093 SER C 3.674 C A 0094 SER CB
C A 0094 SER CA 3.791 C A 0095 GLY CA
C A 0094 SER C 2.418 C A 0095 GLY CA
C A 0094 SER C 3.667 C A 0095 GLY C
CHARGE_ATTR 2.00 12.00 73
C A 0012 ASP OD1 9.675 C A 0011 LYS NZ
C A 0012 ASP OD2 10.29 C A 0011 LYS NZ
C A 0018 GLU OE2 11.20 E A 0050 HIS ND1
C A 0018 GLU OE1 9.332 E A 0052 HIS ND1
C A 0018 GLU OE1 9.282 E A 0052 HIS NE2
C A 0018 GLU OE2 8.375 E A 0052 HIS ND1
C A 0018 GLU OE2 8.076 E A 0052 HIS NE2
C A 0018 GLU OE1 8.257 E A 0066 ARG NH1
C A 0018 GLU OE1 9.665 E A 0066 ARG NH2
C A 0018 GLU OE2 6.300 E A 0066 ARG NH1
C A 0018 GLU OE2 7.665 E A 0066 ARG NH2
E A 0020 GLU OE1 11.70 E A 0052 HIS ND1
E A 0020 GLU OE1 12.00 E A 0052 HIS NE2
E A 0020 GLU OE2 10.51 E A 0052 HIS ND1
E A 0020 GLU OE2 10.50 E A 0052 HIS NE2
E A 0020 GLU OE1 11.73 E A 0066 ARG NH1
E A 0020 GLU OE2 10.22 E A 0066 ARG NH1
E A 0020 GLU OE2 11.55 E A 0066 ARG NH2
E A 0020 GLU OE1 11.95 H A 0076 LYS NZ
E A 0020 GLU OE2 11.46 H A 0076 LYS NZ
H A 0044 GLU OE1 7.182 H A 0040 ARG NH1
H A 0044 GLU OE1 6.857 H A 0040 ARG NH2
H A 0044 GLU OE2 7.460 H A 0040 ARG NH1
H A 0044 GLU OE2 7.199 H A 0040 ARG NH2
H A 0044 GLU OE2 11.80 E A 0050 HIS NE2
H A 0045 GLU OE1 11.38 H A 0040 ARG NH1
H A 0045 GLU OE1 11.41 H A 0040 ARG NH2
H A 0045 GLU OE1 11.19 H A 0074 LYS NZ
H A 0045 GLU OE2 10.68 H A 0074 LYS NZ
H A 0045 GLU OE2 11.77 H A 0077 LYS NZ
C A 0056 GLU OE1 10.09 H A 0028 HIS ND1
C A 0056 GLU OE1 11.84 H A 0028 HIS NE2
C A 0056 GLU OE2 9.150 H A 0028 HIS ND1
C A 0056 GLU OE2 11.09 H A 0028 HIS NE2
C A 0061 ASP OD1 10.50 C A 0026 LYS NZ
C A 0061 ASP OD2 8.840 C A 0026 LYS NZ
C A 0061 ASP OD1 8.022 H A 0028 HIS ND1
C A 0061 ASP OD1 7.606 H A 0028 HIS NE2
C A 0061 ASP OD2 6.614 H A 0028 HIS ND1
C A 0061 ASP OD2 6.297 H A 0028 HIS NE2
H A 0071 ASP OD1 10.96 E A 0050 HIS ND1
H A 0071 ASP OD1 9.998 E A 0050 HIS NE2
H A 0071 ASP OD2 10.90 E A 0050 HIS ND1
H A 0071 ASP OD2 9.569 E A 0050 HIS NE2
H A 0071 ASP OD1 7.795 H A 0074 LYS NZ
H A 0071 ASP OD2 7.742 H A 0074 LYS NZ
H A 0071 ASP OD1 10.23 H A 0077 LYS NZ
H A 0071 ASP OD2 11.21 H A 0077 LYS NZ
H A 0073 GLU OE1 7.479 H A 0074 LYS NZ
H A 0073 GLU OE2 6.064 H A 0074 LYS NZ
H A 0073 GLU OE1 10.25 H A 0076 LYS NZ
H A 0073 GLU OE2 9.893 H A 0076 LYS NZ
H A 0073 GLU OE1 9.849 H A 0077 LYS NZ
H A 0073 GLU OE2 7.834 H A 0077 LYS NZ
H A 0084 GLU OE1 9.607 C A 0026 LYS NZ
H A 0084 GLU OE2 8.328 C A 0026 LYS NZ
H A 0084 GLU OE2 10.76 H A 0028 HIS NE2
H A 0084 GLU OE1 11.11 H A 0076 LYS NZ
H A 0084 GLU OE2 10.43 H A 0076 LYS NZ
H A 0084 GLU OE1 8.008 H A 0081 HIS ND1
H A 0084 GLU OE1 9.670 H A 0081 HIS NE2
H A 0084 GLU OE2 9.055 H A 0081 HIS ND1
H A 0084 GLU OE2 10.77 H A 0081 HIS NE2
H A 0084 GLU OE1 7.351 C A 0089 LYS NZ
H A 0084 GLU OE2 7.757 C A 0089 LYS NZ
H A 0085 GLU OE1 6.475 H A 0081 HIS ND1
H A 0085 GLU OE1 5.815 H A 0081 HIS NE2
H A 0085 GLU OE2 4.692 H A 0081 HIS ND1
H A 0085 GLU OE2 4.466 H A 0081 HIS NE2
H A 0085 GLU OE1 9.941 H A 0086 LYS NZ
H A 0085 GLU OE2 11.21 H A 0086 LYS NZ
H A 0085 GLU OE1 10.43 C A 0089 LYS NZ
H A 0085 GLU OE2 10.48 C A 0089 LYS NZ
CHARGE_REPU 2.00 12.00 56
C A 0018 GLU OE1 3.623 E A 0020 GLU OE1
C A 0018 GLU OE1 2.679 E A 0020 GLU OE2
C A 0018 GLU OE2 5.809 E A 0020 GLU OE1
C A 0018 GLU OE2 4.719 E A 0020 GLU OE2
C A 0026 LYS NZ 11.30 H A 0028 HIS ND1
C A 0026 LYS NZ 10.42 H A 0028 HIS NE2
C A 0026 LYS NZ 6.635 C A 0089 LYS NZ
H A 0028 HIS ND1 11.32 E A 0052 HIS ND1
C A 0035 LYS NZ 7.846 H A 0037 ARG NH1
C A 0035 LYS NZ 6.402 H A 0037 ARG NH2
C A 0035 LYS NZ 10.94 H A 0040 ARG NH1
C A 0035 LYS NZ 9.599 H A 0040 ARG NH2
H A 0037 ARG NH1 11.76 H A 0040 ARG NH2
H A 0037 ARG NH2 11.90 H A 0040 ARG NH2
H A 0037 ARG NH1 9.924 H A 0086 LYS NZ
H A 0040 ARG NH1 8.692 E A 0050 HIS ND1
H A 0040 ARG NH1 8.273 E A 0050 HIS NE2
H A 0040 ARG NH2 10.94 E A 0050 HIS ND1
H A 0040 ARG NH2 10.47 E A 0050 HIS NE2
H A 0044 GLU OE1 4.799 H A 0045 GLU OE1
H A 0044 GLU OE1 6.805 H A 0045 GLU OE2
H A 0044 GLU OE2 5.893 H A 0045 GLU OE1
H A 0044 GLU OE2 8.023 H A 0045 GLU OE2
H A 0044 GLU OE1 10.75 H A 0071 ASP OD2
H A 0044 GLU OE2 10.82 H A 0071 ASP OD2
H A 0045 GLU OE1 10.78 H A 0071 ASP OD1
H A 0045 GLU OE1 9.548 H A 0071 ASP OD2
H A 0045 GLU OE2 11.55 H A 0071 ASP OD1
H A 0045 GLU OE2 10.54 H A 0071 ASP OD2
E A 0050 HIS ND1 7.624 E A 0052 HIS ND1
E A 0050 HIS ND1 5.582 E A 0052 HIS NE2
E A 0050 HIS NE2 9.696 E A 0052 HIS ND1
E A 0050 HIS NE2 7.641 E A 0052 HIS NE2
E A 0050 HIS ND1 6.405 E A 0066 ARG NH1
E A 0050 HIS ND1 5.956 E A 0066 ARG NH2
E A 0050 HIS NE2 7.959 E A 0066 ARG NH1
E A 0050 HIS NE2 7.031 E A 0066 ARG NH2
E A 0052 HIS ND1 5.825 E A 0066 ARG NH1
E A 0052 HIS ND1 7.806 E A 0066 ARG NH2
E A 0052 HIS NE2 4.422 E A 0066 ARG NH1
E A 0052 HIS NE2 6.082 E A 0066 ARG NH2
C A 0056 GLU OE1 10.94 C A 0061 ASP OD2
C A 0056 GLU OE2 11.30 C A 0061 ASP OD2
H A 0071 ASP OD1 9.028 H A 0073 GLU OE1
H A 0071 ASP OD1 9.041 H A 0073 GLU OE2
H A 0071 ASP OD2 10.12 H A 0073 GLU OE1
H A 0071 ASP OD2 10.11 H A 0073 GLU OE2
H A 0074 LYS NZ 6.522 H A 0077 LYS NZ
H A 0076 LYS NZ 10.36 H A 0077 LYS NZ
H A 0076 LYS NZ 10.87 H A 0081 HIS ND1
H A 0077 LYS NZ 8.103 H A 0081 HIS ND1
H A 0077 LYS NZ 8.277 H A 0081 HIS NE2
H A 0084 GLU OE1 8.762 H A 0085 GLU OE1
H A 0084 GLU OE1 7.439 H A 0085 GLU OE2
H A 0084 GLU OE2 9.914 H A 0085 GLU OE1
H A 0084 GLU OE2 8.829 H A 0085 GLU OE2
HB_MM 2.00 3.20 155
C A 0002 SER N 2.251 C A 0001 GLY O
C A 0003 SER N 2.250 C A 0002 SER O
C A 0004 GLY N 2.249 C A 0003 SER O
C A 0005 SER N 2.250 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 SER N 2.250 C A 0007 GLY O
C A 0009 ILE N 2.249 C A 0008 SER O
C A 0010 GLN N 2.250 C A 0009 ILE O
C A 0011 LYS N 2.248 C A 0010 GLN O
C A 0012 ASP N 2.973 C A 0010 GLN O
C A 0012 ASP N 2.250 C A 0011 LYS O
C A 0013 LEU N 3.061 C A 0011 LYS O
C A 0013 LEU N 2.250 C A 0012 ASP O
C A 0014 ALA N 2.250 C A 0013 LEU O
C A 0015 ASN N 2.249 C A 0014 ALA O
C A 0016 ILE N 2.251 C A 0015 ASN O
C A 0017 ALA N 2.249 C A 0016 ILE O
C A 0017 ALA N 2.901 C A 0067 GLY O
C A 0018 GLU N 2.251 C A 0017 ALA O
E A 0019 VAL N 2.250 C A 0018 GLU O
E A 0019 VAL N 3.188 E A 0065 ILE O
E A 0020 GLU N 2.251 E A 0019 VAL O
E A 0021 VAL N 2.251 E A 0020 GLU O
E A 0021 VAL N 3.186 E A 0063 VAL O
E A 0022 SER N 2.250 E A 0021 VAL O
C A 0023 ILE N 2.251 E A 0022 SER O
C A 0024 PRO N 2.254 C A 0023 ILE O
C A 0025 ALA N 2.249 C A 0024 PRO O
C A 0026 LYS N 2.250 C A 0025 ALA O
C A 0027 LEU N 3.160 C A 0024 PRO O
C A 0027 LEU N 3.033 C A 0025 ALA O
C A 0027 LEU N 2.250 C A 0026 LYS O
H A 0028 HIS N 3.097 C A 0025 ALA O
H A 0028 HIS N 2.250 C A 0027 LEU O
H A 0029 ASN N 2.250 H A 0028 HIS O
H A 0030 SER N 2.884 C A 0027 LEU O
H A 0030 SER N 2.831 H A 0028 HIS O
H A 0030 SER N 2.251 H A 0029 ASN O
H A 0031 LEU N 2.812 C A 0027 LEU O
H A 0031 LEU N 2.704 H A 0028 HIS O
H A 0031 LEU N 2.249 H A 0030 SER O
H A 0032 ILE N 2.788 H A 0028 HIS O
H A 0032 ILE N 2.251 H A 0031 LEU O
H A 0033 GLY N 2.952 H A 0029 ASN O
H A 0033 GLY N 3.177 H A 0030 SER O
H A 0033 GLY N 2.249 H A 0032 ILE O
C A 0034 THR N 2.250 H A 0033 GLY O
C A 0035 LYS N 2.250 C A 0034 THR O
H A 0036 GLY N 2.250 C A 0035 LYS O
H A 0037 ARG N 3.113 C A 0035 LYS O
H A 0037 ARG N 2.250 H A 0036 GLY O
H A 0038 LEU N 2.249 H A 0037 ARG O
H A 0039 ILE N 2.820 H A 0037 ARG O
H A 0039 ILE N 2.250 H A 0038 LEU O
H A 0040 ARG N 3.004 H A 0037 ARG O
H A 0040 ARG N 2.250 H A 0039 ILE O
H A 0041 SER N 2.860 H A 0037 ARG O
H A 0041 SER N 2.249 H A 0040 ARG O
H A 0042 ILE N 3.195 H A 0039 ILE O
H A 0042 ILE N 2.250 H A 0041 SER O
H A 0043 MET N 2.930 H A 0039 ILE O
H A 0043 MET N 3.179 H A 0040 ARG O
H A 0043 MET N 2.249 H A 0042 ILE O
H A 0044 GLU N 3.125 H A 0040 ARG O
H A 0044 GLU N 3.058 H A 0041 SER O
H A 0044 GLU N 3.164 H A 0042 ILE O
H A 0044 GLU N 2.251 H A 0043 MET O
H A 0045 GLU N 2.742 H A 0041 SER O
H A 0045 GLU N 2.250 H A 0044 GLU O
H A 0046 CYS N 2.977 H A 0042 ILE O
H A 0046 CYS N 2.901 H A 0044 GLU O
H A 0046 CYS N 2.250 H A 0045 GLU O
H A 0047 GLY N 2.526 H A 0044 GLU O
H A 0047 GLY N 2.250 H A 0046 CYS O
C A 0048 GLY N 2.485 H A 0043 MET O
C A 0048 GLY N 2.249 H A 0047 GLY O
C A 0049 VAL N 2.251 C A 0048 GLY O
E A 0050 HIS N 2.251 C A 0049 VAL O
E A 0050 HIS N 3.026 E A 0066 ARG O
E A 0051 ILE N 2.251 E A 0050 HIS O
E A 0052 HIS N 2.251 E A 0051 ILE O
E A 0052 HIS N 2.771 E A 0064 VAL O
C A 0053 PHE N 2.250 E A 0052 HIS O
C A 0054 PRO N 2.253 C A 0053 PHE O
C A 0055 VAL N 2.250 C A 0054 PRO O
C A 0056 GLU N 2.249 C A 0055 VAL O
C A 0057 GLY N 3.005 C A 0055 VAL O
C A 0057 GLY N 2.250 C A 0056 GLU O
C A 0058 SER N 3.036 C A 0055 VAL O
C A 0058 SER N 2.251 C A 0057 GLY O
C A 0059 GLY N 2.250 C A 0058 SER O
C A 0060 SER N 2.251 C A 0059 GLY O
C A 0061 ASP N 2.249 C A 0060 SER O
E A 0062 THR N 2.250 C A 0061 ASP O
E A 0063 VAL N 2.250 E A 0062 THR O
E A 0064 VAL N 2.250 E A 0063 VAL O
E A 0065 ILE N 3.017 E A 0019 VAL O
E A 0065 ILE N 2.250 E A 0064 VAL O
E A 0066 ARG N 2.785 E A 0050 HIS O
E A 0066 ARG N 2.251 E A 0065 ILE O
C A 0067 GLY N 2.251 E A 0066 ARG O
H A 0068 PRO N 2.253 C A 0067 GLY O
H A 0069 SER N 2.250 H A 0068 PRO O
H A 0070 SER N 3.063 H A 0068 PRO O
H A 0070 SER N 2.250 H A 0069 SER O
H A 0071 ASP N 2.645 H A 0068 PRO O
H A 0071 ASP N 2.631 H A 0069 SER O
H A 0071 ASP N 2.251 H A 0070 SER O
H A 0072 VAL N 2.771 H A 0068 PRO O
H A 0072 VAL N 2.707 H A 0069 SER O
H A 0072 VAL N 2.250 H A 0071 ASP O
H A 0073 GLU N 2.774 H A 0069 SER O
H A 0073 GLU N 2.999 H A 0071 ASP O
H A 0073 GLU N 2.252 H A 0072 VAL O
H A 0074 LYS N 2.612 H A 0071 ASP O
H A 0074 LYS N 2.249 H A 0073 GLU O
H A 0075 ALA N 2.785 H A 0071 ASP O
H A 0075 ALA N 2.249 H A 0074 LYS O
H A 0076 LYS N 2.885 H A 0072 VAL O
H A 0076 LYS N 2.250 H A 0075 ALA O
H A 0077 LYS N 2.249 H A 0076 LYS O
H A 0078 GLN N 3.132 H A 0074 LYS O
H A 0078 GLN N 3.064 H A 0076 LYS O
H A 0078 GLN N 2.251 H A 0077 LYS O
H A 0079 LEU N 3.112 H A 0075 ALA O
H A 0079 LEU N 3.060 H A 0076 LYS O
H A 0079 LEU N 2.251 H A 0078 GLN O
H A 0080 LEU N 2.989 H A 0076 LYS O
H A 0080 LEU N 2.250 H A 0079 LEU O
H A 0081 HIS N 2.251 H A 0080 LEU O
H A 0082 LEU N 3.148 H A 0078 GLN O
H A 0082 LEU N 2.250 H A 0081 HIS O
H A 0083 ALA N 2.754 H A 0079 LEU O
H A 0083 ALA N 2.250 H A 0082 LEU O
H A 0084 GLU N 3.091 H A 0080 LEU O
H A 0084 GLU N 2.802 H A 0082 LEU O
H A 0084 GLU N 2.251 H A 0083 ALA O
H A 0085 GLU N 2.932 H A 0081 HIS O
H A 0085 GLU N 2.567 H A 0082 LEU O
H A 0085 GLU N 2.251 H A 0084 GLU O
H A 0086 LYS N 2.783 H A 0082 LEU O
H A 0086 LYS N 2.249 H A 0085 GLU O
H A 0087 GLN N 3.181 H A 0084 GLU O
H A 0087 GLN N 2.764 H A 0085 GLU O
H A 0087 GLN N 2.250 H A 0086 LYS O
C A 0088 THR N 2.675 H A 0086 LYS O
C A 0088 THR N 2.251 H A 0087 GLN O
C A 0089 LYS N 2.249 C A 0088 THR O
C A 0090 SER N 2.249 C A 0089 LYS O
C A 0091 GLY N 2.250 C A 0090 SER O
C A 0092 PRO N 2.253 C A 0091 GLY O
C A 0093 SER N 2.252 C A 0092 PRO O
C A 0094 SER N 2.250 C A 0093 SER O
C A 0095 GLY N 2.249 C A 0094 SER O
HB_MS 2.00 3.20 7
C A 0004 GLY N 2.942 C A 0003 SER OG
C A 0016 ILE N 2.782 C A 0015 ASN OD1
C A 0023 ILE O 2.749 H A 0028 HIS NE2
C A 0024 PRO O 3.108 H A 0028 HIS NE2
H A 0047 GLY N 2.922 H A 0071 ASP OD2
H A 0070 SER N 2.834 H A 0069 SER OG
C A 0095 GLY N 3.052 C A 0094 SER OG