Complet list of 2cqw con file
Complete list of 2cqw.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 380
C A 0001 GLY CA 3.785 C A 0002 SER CA
C A 0001 GLY C 2.419 C A 0002 SER CA
C A 0001 GLY C 3.690 C A 0002 SER C
C A 0001 GLY C 3.068 C A 0002 SER CB
C A 0002 SER CA 3.785 C A 0003 SER CA
C A 0002 SER C 2.418 C A 0003 SER CA
C A 0002 SER C 3.568 C A 0003 SER C
C A 0002 SER C 3.355 C A 0003 SER CB
C A 0003 SER CA 3.785 C A 0004 GLY CA
C A 0003 SER C 2.418 C A 0004 GLY CA
C A 0003 SER C 2.950 C A 0004 GLY C
C A 0004 GLY CA 3.785 C A 0005 SER CA
C A 0004 GLY C 2.419 C A 0005 SER CA
C A 0004 GLY C 3.570 C A 0005 SER C
C A 0004 GLY C 3.352 C A 0005 SER CB
C A 0005 SER CA 3.785 C A 0006 SER CA
C A 0005 SER C 2.418 C A 0006 SER CA
C A 0005 SER C 3.023 C A 0006 SER C
C A 0005 SER C 2.952 C A 0006 SER CB
C A 0006 SER CA 3.785 C A 0007 GLY CA
C A 0006 SER C 2.419 C A 0007 GLY CA
C A 0006 SER C 3.711 C A 0007 GLY C
C A 0007 GLY CA 3.784 C A 0008 ILE CA
C A 0007 GLY C 2.418 C A 0008 ILE CA
C A 0007 GLY C 3.592 C A 0008 ILE C
C A 0007 GLY C 3.263 C A 0008 ILE CB
C A 0007 GLY C 3.252 C A 0008 ILE CG2
C A 0007 GLY C 3.770 C A 0009 PRO CD
C A 0008 ILE CA 2.872 C A 0009 PRO CD
C A 0008 ILE C 2.449 C A 0009 PRO CA
C A 0008 ILE C 3.136 C A 0009 PRO C
C A 0008 ILE C 3.642 C A 0009 PRO CB
C A 0008 ILE C 3.683 C A 0009 PRO CG
C A 0008 ILE C 2.513 C A 0009 PRO CD
C A 0009 PRO CA 3.785 C A 0010 GLY CA
C A 0009 PRO C 2.419 C A 0010 GLY CA
C A 0009 PRO C 3.273 C A 0010 GLY C
C A 0010 GLY CA 2.872 C A 0011 PRO CD
C A 0010 GLY C 2.449 C A 0011 PRO CA
C A 0010 GLY C 3.136 C A 0011 PRO C
C A 0010 GLY C 3.642 C A 0011 PRO CB
C A 0010 GLY C 3.684 C A 0011 PRO CG
C A 0010 GLY C 2.513 C A 0011 PRO CD
C A 0011 PRO CA 3.785 C A 0012 GLY CA
C A 0011 PRO C 2.419 C A 0012 GLY CA
C A 0011 PRO C 3.360 C A 0012 GLY C
C A 0012 GLY CA 3.785 C A 0013 PHE CA
C A 0012 GLY C 2.418 C A 0013 PHE CA
C A 0012 GLY C 3.169 C A 0013 PHE C
C A 0012 GLY C 3.635 C A 0013 PHE CB
C A 0013 PHE CA 3.785 C A 0014 THR CA
C A 0013 PHE C 2.419 C A 0014 THR CA
C A 0013 PHE C 2.975 C A 0014 THR C
C A 0013 PHE C 2.962 C A 0014 THR CB
C A 0014 THR CA 3.785 C A 0015 ALA CA
C A 0014 THR C 2.419 C A 0015 ALA CA
C A 0014 THR C 3.233 C A 0015 ALA C
C A 0014 THR C 3.612 C A 0015 ALA CB
C A 0015 ALA CA 3.785 C A 0016 GLY CA
C A 0015 ALA C 2.418 C A 0016 GLY CA
C A 0015 ALA C 3.474 C A 0016 GLY C
C A 0016 GLY CA 3.785 C A 0017 ALA CA
C A 0016 GLY C 2.419 C A 0017 ALA CA
C A 0016 GLY C 2.903 C A 0017 ALA C
C A 0016 GLY C 3.694 C A 0017 ALA CB
C A 0017 ALA CA 3.784 C A 0018 GLN CA
C A 0017 ALA C 2.418 C A 0018 GLN CA
C A 0017 ALA C 3.669 C A 0018 GLN C
C A 0017 ALA C 3.152 C A 0018 GLN CB
C A 0017 ALA C 3.611 C A 0018 GLN CG
C A 0018 GLN CA 3.786 C A 0019 GLY CA
C A 0018 GLN C 2.418 C A 0019 GLY CA
C A 0018 GLN C 3.381 C A 0019 GLY C
C A 0019 GLY CA 3.784 C A 0020 SER CA
C A 0019 GLY C 2.418 C A 0020 SER CA
C A 0019 GLY C 3.509 C A 0020 SER C
C A 0019 GLY C 3.431 C A 0020 SER CB
C A 0020 SER CA 3.785 C A 0021 CYS CA
C A 0020 SER C 2.419 C A 0021 CYS CA
C A 0020 SER C 3.488 C A 0021 CYS C
C A 0020 SER C 3.428 C A 0021 CYS CB
C A 0021 CYS CA 3.785 C A 0022 SER CA
C A 0021 CYS C 2.418 C A 0022 SER CA
C A 0021 CYS C 3.172 C A 0022 SER C
C A 0021 CYS C 3.667 C A 0022 SER CB
C A 0021 CYS CB 3.782 C A 0034 CYS CB
C A 0021 CYS C 3.751 H A 0051 TYR CD2
C A 0022 SER CA 3.785 C A 0023 LEU CA
C A 0022 SER C 2.419 C A 0023 LEU CA
C A 0022 SER C 3.470 C A 0023 LEU C
C A 0022 SER C 3.430 C A 0023 LEU CB
C A 0022 SER CA 3.766 H A 0051 TYR CD2
C A 0023 LEU CA 3.785 C A 0024 ARG CA
C A 0023 LEU C 2.419 C A 0024 ARG CA
C A 0023 LEU C 3.439 C A 0024 ARG C
C A 0023 LEU C 3.516 C A 0024 ARG CB
C A 0023 LEU C 3.714 C A 0024 ARG CG
C A 0024 ARG CA 3.785 C A 0025 CYS CA
C A 0024 ARG C 2.419 C A 0025 CYS CA
C A 0024 ARG C 2.927 C A 0025 CYS C
C A 0024 ARG C 3.033 C A 0025 CYS CB
C A 0024 ARG CD 3.268 C A 0027 ALA CB
C A 0024 ARG CB 3.645 C A 0034 CYS CB
C A 0025 CYS CA 3.785 C A 0026 GLY CA
C A 0025 CYS C 2.419 C A 0026 GLY CA
C A 0025 CYS C 3.700 C A 0026 GLY C
C A 0025 CYS CA 3.749 C A 0034 CYS CB
C A 0026 GLY CA 3.784 C A 0027 ALA CA
C A 0026 GLY C 2.418 C A 0027 ALA CA
C A 0026 GLY C 3.648 C A 0027 ALA C
C A 0026 GLY C 3.149 C A 0027 ALA CB
C A 0026 GLY C 3.782 C A 0035 HIS CD2
C A 0027 ALA CA 3.785 C A 0028 GLN CA
C A 0027 ALA C 2.418 C A 0028 GLN CA
C A 0027 ALA C 3.520 C A 0028 GLN C
C A 0027 ALA C 3.414 C A 0028 GLN CB
C A 0027 ALA C 3.453 C A 0028 GLN CG
C A 0028 GLN CA 3.785 C A 0029 ASP CA
C A 0028 GLN C 2.418 C A 0029 ASP CA
C A 0028 GLN C 3.518 C A 0029 ASP C
C A 0028 GLN C 3.435 C A 0029 ASP CB
C A 0028 GLN CG 3.478 C A 0035 HIS CB
C A 0028 GLN CG 3.738 C A 0035 HIS CG
C A 0029 ASP CA 3.785 C A 0030 GLY CA
C A 0029 ASP C 2.418 C A 0030 GLY CA
C A 0029 ASP C 3.182 C A 0030 GLY C
C A 0030 GLY CA 3.786 C A 0031 LEU CA
C A 0030 GLY C 2.419 C A 0031 LEU CA
C A 0030 GLY C 2.972 C A 0031 LEU C
C A 0030 GLY C 3.701 C A 0031 LEU CB
C A 0031 LEU CA 3.785 C A 0032 CYS CA
C A 0031 LEU C 2.418 C A 0032 CYS CA
C A 0031 LEU C 3.602 C A 0032 CYS C
C A 0031 LEU C 3.259 C A 0032 CYS CB
C A 0032 CYS CA 3.784 C A 0033 SER CA
C A 0032 CYS C 2.419 C A 0033 SER CA
C A 0032 CYS C 3.673 C A 0033 SER C
C A 0032 CYS C 3.140 C A 0033 SER CB
C A 0032 CYS CB 3.538 C A 0045 CYS CA
C A 0032 CYS CB 3.479 C A 0045 CYS CB
C A 0033 SER CA 3.785 C A 0034 CYS CA
C A 0033 SER C 2.419 C A 0034 CYS CA
C A 0033 SER C 3.308 C A 0034 CYS C
C A 0033 SER C 3.585 C A 0034 CYS CB
C A 0033 SER CB 3.791 H A 0038 CYS CB
C A 0034 CYS CA 3.786 C A 0035 HIS CA
C A 0034 CYS C 2.419 C A 0035 HIS CA
C A 0034 CYS C 3.320 C A 0035 HIS C
C A 0034 CYS C 3.571 C A 0035 HIS CB
C A 0034 CYS CA 3.470 H A 0048 PHE CD1
C A 0034 CYS CA 3.482 H A 0048 PHE CE1
C A 0034 CYS C 3.324 H A 0048 PHE CE1
C A 0035 HIS CA 2.872 C A 0036 PRO CD
C A 0035 HIS C 2.448 C A 0036 PRO CA
C A 0035 HIS C 3.136 C A 0036 PRO C
C A 0035 HIS C 3.643 C A 0036 PRO CB
C A 0035 HIS C 3.683 C A 0036 PRO CG
C A 0035 HIS C 2.513 C A 0036 PRO CD
C A 0035 HIS CB 3.366 C A 0036 PRO CD
C A 0035 HIS CG 3.165 C A 0036 PRO CD
C A 0035 HIS CD2 3.579 C A 0036 PRO CD
C A 0036 PRO CA 3.784 H A 0037 THR CA
C A 0036 PRO C 2.418 H A 0037 THR CA
C A 0036 PRO C 3.214 H A 0037 THR C
C A 0036 PRO C 3.606 H A 0037 THR CB
H A 0037 THR CA 3.785 H A 0038 CYS CA
H A 0037 THR C 2.419 H A 0038 CYS CA
H A 0037 THR C 2.911 H A 0038 CYS C
H A 0037 THR C 3.720 H A 0038 CYS CB
H A 0038 CYS CA 3.785 H A 0039 SER CA
H A 0038 CYS C 2.419 H A 0039 SER CA
H A 0038 CYS C 3.048 H A 0039 SER C
H A 0038 CYS C 3.703 H A 0039 SER CB
H A 0038 CYS CB 3.706 C A 0044 CYS CA
H A 0039 SER CA 3.784 H A 0040 GLY CA
H A 0039 SER C 2.419 H A 0040 GLY CA
H A 0039 SER C 3.122 H A 0040 GLY C
H A 0040 GLY CA 3.785 H A 0041 LEU CA
H A 0040 GLY C 2.419 H A 0041 LEU CA
H A 0040 GLY C 3.172 H A 0041 LEU C
H A 0040 GLY C 3.644 H A 0041 LEU CB
H A 0041 LEU CA 3.785 H A 0042 GLY CA
H A 0041 LEU C 2.419 H A 0042 GLY CA
H A 0041 LEU C 3.464 H A 0042 GLY C
H A 0042 GLY CA 3.784 C A 0043 THR CA
H A 0042 GLY C 2.418 C A 0043 THR CA
H A 0042 GLY C 3.497 C A 0043 THR C
H A 0042 GLY C 3.390 C A 0043 THR CB
H A 0042 GLY C 3.353 C A 0043 THR CG2
C A 0043 THR CA 3.785 C A 0044 CYS CA
C A 0043 THR C 2.419 C A 0044 CYS CA
C A 0043 THR C 2.974 C A 0044 CYS C
C A 0043 THR C 3.715 C A 0044 CYS CB
C A 0044 CYS CA 3.785 C A 0045 CYS CA
C A 0044 CYS C 2.419 C A 0045 CYS CA
C A 0044 CYS C 3.108 C A 0045 CYS C
C A 0044 CYS C 3.684 C A 0045 CYS CB
C A 0044 CYS CB 3.665 H A 0048 PHE CD2
C A 0045 CYS CA 3.786 C A 0046 GLU CA
C A 0045 CYS C 2.419 C A 0046 GLU CA
C A 0045 CYS C 3.065 C A 0046 GLU C
C A 0045 CYS C 3.698 C A 0046 GLU CB
C A 0045 CYS CA 3.587 H A 0048 PHE CB
C A 0045 CYS C 3.618 H A 0048 PHE CB
C A 0045 CYS CB 3.419 H A 0048 PHE CB
C A 0046 GLU CA 3.785 H A 0047 ASP CA
C A 0046 GLU C 2.419 H A 0047 ASP CA
C A 0046 GLU C 3.411 H A 0047 ASP C
C A 0046 GLU C 3.540 H A 0047 ASP CB
C A 0046 GLU C 3.641 H A 0047 ASP CG
H A 0047 ASP CA 3.784 H A 0048 PHE CA
H A 0047 ASP C 2.417 H A 0048 PHE CA
H A 0047 ASP C 3.061 H A 0048 PHE C
H A 0047 ASP C 3.659 H A 0048 PHE CB
H A 0048 PHE CA 3.784 H A 0049 LEU CA
H A 0048 PHE C 2.418 H A 0049 LEU CA
H A 0048 PHE C 3.069 H A 0049 LEU C
H A 0048 PHE C 3.680 H A 0049 LEU CB
H A 0049 LEU CA 3.784 H A 0050 ASP CA
H A 0049 LEU C 2.419 H A 0050 ASP CA
H A 0049 LEU C 2.941 H A 0050 ASP C
H A 0049 LEU C 3.713 H A 0050 ASP CB
H A 0049 LEU CA 3.718 H A 0052 CYS C
H A 0049 LEU C 3.614 H A 0052 CYS C
H A 0049 LEU C 3.726 C A 0053 LEU CB
H A 0049 LEU C 3.404 C A 0053 LEU CG
H A 0049 LEU C 3.469 C A 0053 LEU CD1
H A 0050 ASP CA 3.786 H A 0051 TYR CA
H A 0050 ASP C 2.419 H A 0051 TYR CA
H A 0050 ASP C 3.289 H A 0051 TYR C
H A 0050 ASP C 3.574 H A 0051 TYR CB
H A 0050 ASP CA 3.743 C A 0053 LEU CD1
H A 0051 TYR CA 3.785 H A 0052 CYS CA
H A 0051 TYR C 2.419 H A 0052 CYS CA
H A 0051 TYR C 3.521 H A 0052 CYS C
H A 0051 TYR C 3.388 H A 0052 CYS CB
H A 0052 CYS CA 3.785 C A 0053 LEU CA
H A 0052 CYS C 2.418 C A 0053 LEU CA
H A 0052 CYS C 3.302 C A 0053 LEU C
H A 0052 CYS C 3.571 C A 0053 LEU CB
H A 0052 CYS CA 3.590 C A 0055 ILE CG2
H A 0052 CYS CB 3.424 C A 0055 ILE CG1
H A 0052 CYS CB 3.448 C A 0055 ILE CG2
H A 0052 CYS CB 3.385 C A 0055 ILE CD1
C A 0053 LEU CA 3.785 C A 0054 GLU CA
C A 0053 LEU C 2.419 C A 0054 GLU CA
C A 0053 LEU C 3.682 C A 0054 GLU C
C A 0053 LEU C 3.109 C A 0054 GLU CB
C A 0054 GLU CA 3.785 C A 0055 ILE CA
C A 0054 GLU C 2.419 C A 0055 ILE CA
C A 0054 GLU C 3.390 C A 0055 ILE C
C A 0054 GLU C 3.507 C A 0055 ILE CB
C A 0054 GLU C 3.566 C A 0055 ILE CG2
C A 0055 ILE CA 3.785 C A 0056 LEU CA
C A 0055 ILE C 2.418 C A 0056 LEU CA
C A 0055 ILE C 2.936 C A 0056 LEU C
C A 0055 ILE C 3.705 C A 0056 LEU CB
C A 0056 LEU CA 2.872 C A 0057 PRO CD
C A 0056 LEU C 2.449 C A 0057 PRO CA
C A 0056 LEU C 3.136 C A 0057 PRO C
C A 0056 LEU C 3.642 C A 0057 PRO CB
C A 0056 LEU C 3.683 C A 0057 PRO CG
C A 0056 LEU C 2.512 C A 0057 PRO CD
C A 0056 LEU CB 3.332 C A 0057 PRO CD
C A 0057 PRO CA 3.785 C A 0058 SER CA
C A 0057 PRO C 2.419 C A 0058 SER CA
C A 0057 PRO C 2.859 C A 0058 SER C
C A 0057 PRO C 3.705 C A 0058 SER CB
C A 0058 SER CA 3.785 C A 0059 SER CA
C A 0058 SER C 2.418 C A 0059 SER CA
C A 0058 SER C 3.432 C A 0059 SER C
C A 0058 SER C 3.508 C A 0059 SER CB
C A 0059 SER CA 3.785 C A 0060 GLY CA
C A 0059 SER C 2.419 C A 0060 GLY CA
C A 0059 SER C 2.903 C A 0060 GLY C
C A 0060 GLY CA 3.785 C A 0061 SER CA
C A 0060 GLY C 2.419 C A 0061 SER CA
C A 0060 GLY C 3.616 C A 0061 SER C
C A 0060 GLY C 3.276 C A 0061 SER CB
C A 0061 SER CA 3.785 C A 0062 MET CA
C A 0061 SER C 2.419 C A 0062 MET CA
C A 0061 SER C 2.979 C A 0062 MET C
C A 0061 SER C 2.971 C A 0062 MET CB
C A 0062 MET CA 3.786 C A 0063 MET CA
C A 0062 MET C 2.419 C A 0063 MET CA
C A 0062 MET C 3.615 C A 0063 MET C
C A 0062 MET C 3.286 C A 0063 MET CB
C A 0062 MET C 3.780 C A 0063 MET CG
C A 0063 MET CA 3.785 C A 0064 GLY CA
C A 0063 MET C 2.419 C A 0064 GLY CA
C A 0063 MET C 3.520 C A 0064 GLY C
C A 0064 GLY CA 3.785 C A 0065 GLY CA
C A 0064 GLY C 2.418 C A 0065 GLY CA
C A 0064 GLY C 3.513 C A 0065 GLY C
C A 0065 GLY CA 3.786 C A 0066 LYS CA
C A 0065 GLY C 2.419 C A 0066 LYS CA
C A 0065 GLY C 3.650 C A 0066 LYS C
C A 0065 GLY C 3.142 C A 0066 LYS CB
C A 0065 GLY C 3.693 C A 0066 LYS CG
C A 0066 LYS CA 3.784 C A 0067 ASP CA
C A 0066 LYS C 2.418 C A 0067 ASP CA
C A 0066 LYS C 3.582 C A 0067 ASP C
C A 0066 LYS C 3.346 C A 0067 ASP CB
C A 0067 ASP CA 3.785 C A 0068 PHE CA
C A 0067 ASP C 2.419 C A 0068 PHE CA
C A 0067 ASP C 3.642 C A 0068 PHE C
C A 0067 ASP C 3.214 C A 0068 PHE CB
C A 0068 PHE CA 3.785 C A 0069 VAL CA
C A 0068 PHE C 2.419 C A 0069 VAL CA
C A 0068 PHE C 3.682 C A 0069 VAL C
C A 0068 PHE C 3.034 C A 0069 VAL CB
C A 0068 PHE C 3.746 C A 0069 VAL CG1
C A 0068 PHE CE2 3.644 C A 0070 VAL CG1
C A 0068 PHE CZ 3.656 C A 0070 VAL CB
C A 0068 PHE CZ 3.203 C A 0070 VAL CG1
C A 0069 VAL CA 3.785 C A 0070 VAL CA
C A 0069 VAL C 2.419 C A 0070 VAL CA
C A 0069 VAL C 3.685 C A 0070 VAL C
C A 0069 VAL C 3.008 C A 0070 VAL CB
C A 0069 VAL C 3.792 C A 0070 VAL CG1
C A 0070 VAL CA 3.784 C A 0071 GLN CA
C A 0070 VAL C 2.419 C A 0071 GLN CA
C A 0070 VAL C 3.702 C A 0071 GLN C
C A 0070 VAL C 3.005 C A 0071 GLN CB
C A 0071 GLN CA 3.785 C A 0072 HIS CA
C A 0071 GLN C 2.418 C A 0072 HIS CA
C A 0071 GLN C 3.676 C A 0072 HIS C
C A 0071 GLN C 3.079 C A 0072 HIS CB
C A 0072 HIS CA 3.785 C A 0073 LEU CA
C A 0072 HIS C 2.419 C A 0073 LEU CA
C A 0072 HIS C 3.686 C A 0073 LEU C
C A 0072 HIS C 3.012 C A 0073 LEU CB
C A 0073 LEU CA 3.785 C A 0074 LYS CA
C A 0073 LEU C 2.418 C A 0074 LYS CA
C A 0073 LEU C 3.685 C A 0074 LYS C
C A 0073 LEU C 3.008 C A 0074 LYS CB
C A 0074 LYS CA 3.785 C A 0075 TRP CA
C A 0074 LYS C 2.419 C A 0075 TRP CA
C A 0074 LYS C 3.675 C A 0075 TRP C
C A 0074 LYS C 2.990 C A 0075 TRP CB
C A 0074 LYS C 3.688 C A 0075 TRP CG
C A 0074 LYS C 3.616 C A 0075 TRP CD1
C A 0075 TRP CA 3.785 C A 0076 THR CA
C A 0075 TRP C 2.418 C A 0076 THR CA
C A 0075 TRP C 3.634 C A 0076 THR C
C A 0075 TRP C 3.178 C A 0076 THR CB
C A 0076 THR CA 3.785 C A 0077 ASP CA
C A 0076 THR C 2.419 C A 0077 ASP CA
C A 0076 THR C 3.692 C A 0077 ASP C
C A 0076 THR C 2.969 C A 0077 ASP CB
C A 0077 ASP CA 2.871 C A 0078 PRO CD
C A 0077 ASP C 2.448 C A 0078 PRO CA
C A 0077 ASP C 3.136 C A 0078 PRO C
C A 0077 ASP C 3.642 C A 0078 PRO CB
C A 0077 ASP C 3.684 C A 0078 PRO CG
C A 0077 ASP C 2.512 C A 0078 PRO CD
C A 0078 PRO CA 3.785 C A 0079 SER CA
C A 0078 PRO C 2.419 C A 0079 SER CA
C A 0078 PRO C 3.641 C A 0079 SER C
C A 0078 PRO C 3.225 C A 0079 SER CB
C A 0079 SER CA 3.785 C A 0080 GLY CA
C A 0079 SER C 2.419 C A 0080 GLY CA
C A 0079 SER C 3.676 C A 0080 GLY C
C A 0080 GLY CA 2.872 C A 0081 PRO CD
C A 0080 GLY C 2.449 C A 0081 PRO CA
C A 0080 GLY C 3.136 C A 0081 PRO C
C A 0080 GLY C 3.642 C A 0081 PRO CB
C A 0080 GLY C 3.683 C A 0081 PRO CG
C A 0080 GLY C 2.513 C A 0081 PRO CD
C A 0081 PRO CA 3.785 C A 0082 SER CA
C A 0081 PRO C 2.418 C A 0082 SER CA
C A 0081 PRO C 3.683 C A 0082 SER C
C A 0081 PRO C 3.098 C A 0082 SER CB
C A 0082 SER CA 3.785 C A 0083 SER CA
C A 0082 SER C 2.419 C A 0083 SER CA
C A 0082 SER C 3.646 C A 0083 SER C
C A 0082 SER C 3.214 C A 0083 SER CB
C A 0083 SER CA 3.785 C A 0084 GLY CA
C A 0083 SER C 2.419 C A 0084 GLY CA
C A 0083 SER C 3.628 C A 0084 GLY C
CHARGE_ATTR 2.00 12.00 7
C A 0029 ASP OD1 5.527 C A 0024 ARG NH1
C A 0029 ASP OD1 4.667 C A 0024 ARG NH2
C A 0029 ASP OD2 5.703 C A 0024 ARG NH1
C A 0029 ASP OD2 4.120 C A 0024 ARG NH2
H A 0047 ASP OD2 11.28 C A 0024 ARG NH2
C A 0067 ASP OD1 10.72 C A 0066 LYS NZ
C A 0067 ASP OD2 11.73 C A 0066 LYS NZ
CHARGE_REPU 2.00 12.00 18
C A 0024 ARG NH1 10.36 C A 0035 HIS ND1
C A 0024 ARG NH1 9.721 C A 0035 HIS NE2
C A 0024 ARG NH2 11.68 C A 0035 HIS NE2
C A 0029 ASP OD2 11.20 H A 0047 ASP OD2
C A 0046 GLU OE1 5.356 H A 0047 ASP OD1
C A 0046 GLU OE1 7.165 H A 0047 ASP OD2
C A 0046 GLU OE2 5.863 H A 0047 ASP OD1
C A 0046 GLU OE2 7.437 H A 0047 ASP OD2
C A 0046 GLU OE1 6.846 H A 0050 ASP OD1
C A 0046 GLU OE1 7.746 H A 0050 ASP OD2
C A 0046 GLU OE2 8.739 H A 0050 ASP OD1
C A 0046 GLU OE2 9.281 H A 0050 ASP OD2
H A 0047 ASP OD1 6.355 H A 0050 ASP OD1
H A 0047 ASP OD1 5.787 H A 0050 ASP OD2
H A 0047 ASP OD2 8.024 H A 0050 ASP OD1
H A 0047 ASP OD2 7.292 H A 0050 ASP OD2
C A 0072 HIS ND1 7.487 C A 0074 LYS NZ
C A 0072 HIS NE2 7.564 C A 0074 LYS NZ
HB_MM 2.00 3.20 98
C A 0002 SER N 2.261 C A 0001 GLY O
C A 0003 SER N 2.262 C A 0002 SER O
C A 0004 GLY N 2.261 C A 0003 SER O
C A 0005 SER N 2.261 C A 0004 GLY O
C A 0006 SER N 2.262 C A 0005 SER O
C A 0007 GLY N 2.262 C A 0006 SER O
C A 0008 ILE N 2.262 C A 0007 GLY O
C A 0009 PRO N 2.293 C A 0008 ILE O
C A 0010 GLY N 2.261 C A 0009 PRO O
C A 0011 PRO N 2.293 C A 0010 GLY O
C A 0012 GLY N 2.261 C A 0011 PRO O
C A 0013 PHE N 2.262 C A 0012 GLY O
C A 0014 THR N 2.261 C A 0013 PHE O
C A 0015 ALA N 2.262 C A 0014 THR O
C A 0016 GLY N 2.262 C A 0015 ALA O
C A 0017 ALA N 2.262 C A 0016 GLY O
C A 0018 GLN N 2.896 C A 0016 GLY O
C A 0018 GLN N 2.261 C A 0017 ALA O
C A 0019 GLY N 2.261 C A 0018 GLN O
C A 0020 SER N 2.262 C A 0019 GLY O
C A 0021 CYS N 2.261 C A 0020 SER O
C A 0022 SER N 2.261 C A 0021 CYS O
C A 0023 LEU N 2.261 C A 0022 SER O
C A 0024 ARG N 2.261 C A 0023 LEU O
C A 0025 CYS N 2.261 C A 0024 ARG O
C A 0026 GLY N 2.262 C A 0025 CYS O
C A 0026 GLY N 2.595 C A 0034 CYS O
C A 0027 ALA N 2.261 C A 0026 GLY O
C A 0028 GLN N 2.261 C A 0027 ALA O
C A 0029 ASP N 2.263 C A 0028 GLN O
C A 0029 ASP N 2.942 C A 0032 CYS O
C A 0030 GLY N 2.262 C A 0029 ASP O
C A 0031 LEU N 2.262 C A 0030 GLY O
C A 0032 CYS N 2.261 C A 0031 LEU O
C A 0033 SER N 2.262 C A 0032 CYS O
C A 0033 SER N 2.497 C A 0043 THR O
C A 0034 CYS N 2.498 C A 0027 ALA O
C A 0034 CYS N 2.262 C A 0033 SER O
C A 0035 HIS N 2.830 C A 0027 ALA O
C A 0035 HIS N 2.262 C A 0034 CYS O
C A 0036 PRO N 2.293 C A 0035 HIS O
H A 0037 THR N 2.261 C A 0036 PRO O
H A 0038 CYS N 3.185 C A 0035 HIS O
H A 0038 CYS N 2.261 H A 0037 THR O
H A 0039 SER N 2.834 H A 0037 THR O
H A 0039 SER N 2.262 H A 0038 CYS O
H A 0040 GLY N 2.755 H A 0037 THR O
H A 0040 GLY N 2.262 H A 0039 SER O
H A 0041 LEU N 3.056 H A 0037 THR O
H A 0041 LEU N 2.261 H A 0040 GLY O
H A 0042 GLY N 2.497 H A 0038 CYS O
H A 0042 GLY N 2.262 H A 0041 LEU O
C A 0043 THR N 2.261 H A 0042 GLY O
C A 0044 CYS N 2.262 C A 0043 THR O
C A 0045 CYS N 2.262 C A 0044 CYS O
C A 0046 GLU N 2.262 C A 0045 CYS O
H A 0047 ASP N 2.261 C A 0046 GLU O
H A 0048 PHE N 2.261 H A 0047 ASP O
H A 0049 LEU N 2.262 H A 0048 PHE O
H A 0050 ASP N 2.262 H A 0049 LEU O
H A 0051 TYR N 2.997 H A 0047 ASP O
H A 0051 TYR N 2.262 H A 0050 ASP O
H A 0052 CYS N 2.489 H A 0048 PHE O
H A 0052 CYS N 3.133 H A 0049 LEU O
H A 0052 CYS N 2.262 H A 0051 TYR O
C A 0053 LEU N 2.606 H A 0049 LEU O
C A 0053 LEU N 2.262 H A 0052 CYS O
C A 0054 GLU N 2.261 C A 0053 LEU O
C A 0055 ILE N 2.262 C A 0054 GLU O
C A 0056 LEU N 2.261 C A 0055 ILE O
C A 0057 PRO N 2.293 C A 0056 LEU O
C A 0058 SER N 2.262 C A 0057 PRO O
C A 0059 SER N 2.262 C A 0058 SER O
C A 0060 GLY N 2.261 C A 0059 SER O
C A 0061 SER N 2.261 C A 0060 GLY O
C A 0062 MET N 2.262 C A 0061 SER O
C A 0063 MET N 2.262 C A 0062 MET O
C A 0064 GLY N 2.262 C A 0063 MET O
C A 0065 GLY N 2.261 C A 0064 GLY O
C A 0066 LYS N 2.262 C A 0065 GLY O
C A 0067 ASP N 2.261 C A 0066 LYS O
C A 0068 PHE N 2.261 C A 0067 ASP O
C A 0069 VAL N 2.262 C A 0068 PHE O
C A 0070 VAL N 2.262 C A 0069 VAL O
C A 0071 GLN N 2.262 C A 0070 VAL O
C A 0072 HIS N 2.261 C A 0071 GLN O
C A 0073 LEU N 2.262 C A 0072 HIS O
C A 0074 LYS N 2.262 C A 0073 LEU O
C A 0075 TRP N 2.262 C A 0074 LYS O
C A 0076 THR N 2.262 C A 0075 TRP O
C A 0077 ASP N 2.262 C A 0076 THR O
C A 0078 PRO N 2.293 C A 0077 ASP O
C A 0079 SER N 2.261 C A 0078 PRO O
C A 0080 GLY N 2.262 C A 0079 SER O
C A 0081 PRO N 2.293 C A 0080 GLY O
C A 0082 SER N 2.262 C A 0081 PRO O
C A 0083 SER N 2.261 C A 0082 SER O
C A 0084 GLY N 2.262 C A 0083 SER O
HB_MS 2.00 3.20 6
C A 0001 GLY O 2.794 C A 0002 SER OG
C A 0023 LEU N 3.017 C A 0022 SER OG
C A 0027 ALA O 2.987 C A 0033 SER OG
C A 0030 GLY N 3.072 C A 0029 ASP OD1
C A 0075 TRP O 2.983 C A 0076 THR OG1
C A 0084 GLY N 3.132 C A 0083 SER OG
SS_BOND 1.50 2.80 5
C A 0021 CYS SG 2.097 C A 0034 CYS SG
C A 0021 CYS SG 2.784 C A 0045 CYS SG
C A 0025 CYS SG 2.012 H A 0052 CYS SG
C A 0032 CYS SG 2.099 C A 0045 CYS SG
H A 0038 CYS SG 2.094 C A 0044 CYS SG