Complet list of 1wi3 con file
Complete list of 1wi3.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 358
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 3.700 C A 0002 SER C
C A 0001 GLY C 2.963 C A 0002 SER CB
C A 0002 SER CA 3.785 C A 0003 SER CA
C A 0002 SER C 2.419 C A 0003 SER CA
C A 0002 SER C 3.701 C A 0003 SER C
C A 0002 SER C 2.960 C A 0003 SER CB
C A 0003 SER CA 3.784 C A 0004 GLY CA
C A 0003 SER C 2.418 C A 0004 GLY CA
C A 0003 SER C 3.690 C A 0004 GLY C
C A 0004 GLY CA 3.786 C A 0005 SER CA
C A 0004 GLY C 2.419 C A 0005 SER CA
C A 0004 GLY C 3.699 C A 0005 SER C
C A 0004 GLY C 3.005 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 3.126 C A 0006 SER C
C A 0005 SER C 3.684 C A 0006 SER CB
C A 0006 SER CA 3.785 C A 0007 GLY CA
C A 0006 SER C 2.418 C A 0007 GLY CA
C A 0006 SER C 3.695 C A 0007 GLY C
C A 0007 GLY CA 2.873 C A 0008 PRO CD
C A 0007 GLY C 2.449 C A 0008 PRO CA
C A 0007 GLY C 3.136 C A 0008 PRO C
C A 0007 GLY C 3.643 C A 0008 PRO CB
C A 0007 GLY C 3.683 C A 0008 PRO CG
C A 0007 GLY C 2.513 C A 0008 PRO CD
C A 0008 PRO CA 3.785 C A 0009 ARG CA
C A 0008 PRO C 2.419 C A 0009 ARG CA
C A 0008 PRO C 2.977 C A 0009 ARG C
C A 0008 PRO C 2.991 C A 0009 ARG CB
C A 0008 PRO C 3.767 C A 0009 ARG CG
C A 0009 ARG CA 3.785 C A 0010 SER CA
C A 0009 ARG C 2.419 C A 0010 SER CA
C A 0009 ARG C 3.671 C A 0010 SER C
C A 0009 ARG C 3.149 C A 0010 SER CB
C A 0010 SER CA 3.785 C A 0011 ARG CA
C A 0010 SER C 2.419 C A 0011 ARG CA
C A 0010 SER C 3.702 C A 0011 ARG C
C A 0010 SER C 3.006 C A 0011 ARG CB
C A 0011 ARG CA 3.785 C A 0012 THR CA
C A 0011 ARG C 2.419 C A 0012 THR CA
C A 0011 ARG C 3.620 C A 0012 THR C
C A 0011 ARG C 3.208 C A 0012 THR CB
C A 0012 THR CA 3.785 C A 0013 LYS CA
C A 0012 THR C 2.419 C A 0013 LYS CA
C A 0012 THR C 3.625 C A 0013 LYS C
C A 0012 THR C 3.202 C A 0013 LYS CB
C A 0013 LYS CA 3.785 C A 0014 ILE CA
C A 0013 LYS C 2.419 C A 0014 ILE CA
C A 0013 LYS C 3.340 C A 0014 ILE C
C A 0013 LYS C 3.545 C A 0014 ILE CB
C A 0013 LYS C 3.652 C A 0014 ILE CG1
C A 0014 ILE CA 3.785 C A 0015 SER CA
C A 0014 ILE C 2.419 C A 0015 SER CA
C A 0014 ILE C 2.818 C A 0015 SER C
C A 0014 ILE C 3.693 C A 0015 SER CB
C A 0014 ILE CB 3.774 H A 0019 LEU CB
C A 0014 ILE CG2 3.640 H A 0019 LEU CA
C A 0014 ILE CG2 3.167 H A 0019 LEU CB
C A 0015 SER CA 3.785 H A 0016 LEU CA
C A 0015 SER C 2.418 H A 0016 LEU CA
C A 0015 SER C 3.648 H A 0016 LEU C
C A 0015 SER C 2.760 H A 0016 LEU CB
H A 0016 LEU CA 3.785 H A 0017 GLU CA
H A 0016 LEU C 2.418 H A 0017 GLU CA
H A 0016 LEU C 2.797 H A 0017 GLU C
H A 0016 LEU C 3.684 H A 0017 GLU CB
H A 0017 GLU CA 3.784 H A 0018 ALA CA
H A 0017 GLU C 2.418 H A 0018 ALA CA
H A 0017 GLU C 2.734 H A 0018 ALA C
H A 0017 GLU C 3.643 H A 0018 ALA CB
H A 0017 GLU C 3.734 H A 0021 ILE CD1
H A 0018 ALA CA 3.785 H A 0019 LEU CA
H A 0018 ALA C 2.419 H A 0019 LEU CA
H A 0018 ALA C 2.862 H A 0019 LEU C
H A 0018 ALA C 3.704 H A 0019 LEU CB
H A 0018 ALA CA 3.604 H A 0021 ILE CD1
H A 0018 ALA CA 3.502 H A 0045 LEU CD2
H A 0018 ALA C 3.625 H A 0045 LEU CD1
H A 0018 ALA CB 3.746 H A 0045 LEU CB
H A 0018 ALA CB 3.784 H A 0045 LEU CD2
H A 0019 LEU CA 3.785 H A 0020 GLY CA
H A 0019 LEU C 2.418 H A 0020 GLY CA
H A 0019 LEU C 2.881 H A 0020 GLY C
H A 0019 LEU CD1 2.994 H A 0055 PHE CE2
H A 0019 LEU CD1 3.039 H A 0055 PHE CZ
H A 0020 GLY CA 3.785 H A 0021 ILE CA
H A 0020 GLY C 2.418 H A 0021 ILE CA
H A 0020 GLY C 2.839 H A 0021 ILE C
H A 0020 GLY C 3.701 H A 0021 ILE CB
H A 0020 GLY CA 3.603 H A 0023 GLN CB
H A 0020 GLY C 3.470 H A 0023 GLN CB
H A 0021 ILE CA 3.784 H A 0022 LEU CA
H A 0021 ILE C 2.419 H A 0022 LEU CA
H A 0021 ILE C 2.841 H A 0022 LEU C
H A 0021 ILE C 3.702 H A 0022 LEU CB
H A 0021 ILE CG2 3.730 H A 0045 LEU CD2
H A 0022 LEU CA 3.785 H A 0023 GLN CA
H A 0022 LEU C 2.418 H A 0023 GLN CA
H A 0022 LEU C 2.934 H A 0023 GLN C
H A 0022 LEU C 3.711 H A 0023 GLN CB
H A 0022 LEU CD1 3.521 H A 0026 ILE CG1
H A 0022 LEU CD1 2.942 H A 0026 ILE CD1
H A 0022 LEU CA 3.659 H A 0041 LEU CD2
H A 0022 LEU CB 3.271 H A 0041 LEU CD2
H A 0022 LEU CB 3.544 H A 0045 LEU CD1
H A 0022 LEU CD2 3.417 H A 0045 LEU CD1
H A 0022 LEU CG 3.795 H A 0055 PHE CE2
H A 0022 LEU CD1 3.546 H A 0055 PHE CE2
H A 0022 LEU CD2 3.655 H A 0055 PHE CD2
H A 0022 LEU CD2 3.442 H A 0055 PHE CE2
H A 0023 GLN CA 3.785 H A 0024 SER CA
H A 0023 GLN C 2.419 H A 0024 SER CA
H A 0023 GLN C 2.976 H A 0024 SER C
H A 0023 GLN C 3.712 H A 0024 SER CB
H A 0024 SER CA 3.785 H A 0025 PHE CA
H A 0024 SER C 2.418 H A 0025 PHE CA
H A 0024 SER C 3.033 H A 0025 PHE C
H A 0024 SER C 3.663 H A 0025 PHE CB
H A 0025 PHE CA 3.784 H A 0026 ILE CA
H A 0025 PHE C 2.418 H A 0026 ILE CA
H A 0025 PHE C 3.025 H A 0026 ILE C
H A 0025 PHE C 3.692 H A 0026 ILE CB
H A 0025 PHE CD1 3.615 H A 0026 ILE CA
H A 0025 PHE CD1 3.710 H A 0029 VAL CG2
H A 0025 PHE CD2 3.468 H A 0029 VAL CG1
H A 0025 PHE CE1 3.181 H A 0029 VAL CG2
H A 0025 PHE CE2 3.297 H A 0029 VAL CG1
H A 0025 PHE CZ 3.542 H A 0029 VAL CG1
H A 0025 PHE CZ 3.433 H A 0029 VAL CG2
H A 0025 PHE CE2 3.537 H A 0037 ALA CB
H A 0025 PHE CZ 3.369 H A 0037 ALA CB
H A 0026 ILE CA 3.786 H A 0027 HIS CA
H A 0026 ILE C 2.420 H A 0027 HIS CA
H A 0026 ILE C 3.081 H A 0027 HIS C
H A 0026 ILE C 3.685 H A 0027 HIS CB
H A 0026 ILE CG2 3.538 C A 0031 LEU CD2
H A 0026 ILE CG1 3.245 H A 0056 PHE CE1
H A 0026 ILE CG1 3.144 H A 0056 PHE CZ
H A 0026 ILE CD1 3.368 H A 0056 PHE CE1
H A 0026 ILE CD1 3.412 H A 0056 PHE CZ
H A 0027 HIS CA 3.785 H A 0028 ASP CA
H A 0027 HIS C 2.419 H A 0028 ASP CA
H A 0027 HIS C 3.249 H A 0028 ASP C
H A 0027 HIS C 3.643 H A 0028 ASP CB
H A 0028 ASP CA 3.785 H A 0029 VAL CA
H A 0028 ASP C 2.418 H A 0029 VAL CA
H A 0028 ASP C 3.117 H A 0029 VAL C
H A 0028 ASP C 3.663 H A 0029 VAL CB
H A 0029 VAL CA 3.786 H A 0030 GLY CA
H A 0029 VAL C 2.420 H A 0030 GLY CA
H A 0029 VAL C 3.570 H A 0030 GLY C
H A 0030 GLY CA 3.785 C A 0031 LEU CA
H A 0030 GLY C 2.419 C A 0031 LEU CA
H A 0030 GLY C 3.610 C A 0031 LEU C
H A 0030 GLY C 3.232 C A 0031 LEU CB
H A 0030 GLY C 3.263 C A 0031 LEU CG
C A 0031 LEU CA 3.786 C A 0032 TYR CA
C A 0031 LEU C 2.419 C A 0032 TYR CA
C A 0031 LEU C 3.646 C A 0032 TYR C
C A 0031 LEU C 3.194 C A 0032 TYR CB
C A 0031 LEU C 3.069 C A 0032 TYR CG
C A 0031 LEU C 3.766 C A 0032 TYR CD1
C A 0031 LEU C 3.143 C A 0032 TYR CD2
C A 0031 LEU C 3.625 C A 0033 PRO CD
C A 0031 LEU CD1 3.547 H A 0063 VAL CG2
C A 0032 TYR CA 2.872 C A 0033 PRO CD
C A 0032 TYR C 2.449 C A 0033 PRO CA
C A 0032 TYR C 3.136 C A 0033 PRO C
C A 0032 TYR C 3.643 C A 0033 PRO CB
C A 0032 TYR C 3.684 C A 0033 PRO CG
C A 0032 TYR C 2.514 C A 0033 PRO CD
C A 0033 PRO CA 3.786 H A 0034 ASP CA
C A 0033 PRO C 2.419 H A 0034 ASP CA
C A 0033 PRO C 3.285 H A 0034 ASP C
C A 0033 PRO C 3.625 H A 0034 ASP CB
C A 0033 PRO CG 3.744 H A 0056 PHE CD1
C A 0033 PRO CG 3.462 H A 0056 PHE CE1
C A 0033 PRO CG 3.591 H A 0056 PHE CE2
C A 0033 PRO CG 3.392 H A 0056 PHE CZ
H A 0034 ASP CA 3.785 H A 0035 GLN CA
H A 0034 ASP C 2.418 H A 0035 GLN CA
H A 0034 ASP C 2.845 H A 0035 GLN C
H A 0034 ASP C 3.700 H A 0035 GLN CB
H A 0035 GLN CA 3.785 H A 0036 GLU CA
H A 0035 GLN C 2.419 H A 0036 GLU CA
H A 0035 GLN C 3.133 H A 0036 GLU C
H A 0035 GLN C 3.679 H A 0036 GLU CB
H A 0036 GLU CA 3.785 H A 0037 ALA CA
H A 0036 GLU C 2.419 H A 0037 ALA CA
H A 0036 GLU C 2.952 H A 0037 ALA C
H A 0036 GLU C 3.694 H A 0037 ALA CB
H A 0037 ALA CA 3.785 H A 0038 ILE CA
H A 0037 ALA C 2.418 H A 0038 ILE CA
H A 0037 ALA C 2.957 H A 0038 ILE C
H A 0037 ALA C 3.703 H A 0038 ILE CB
H A 0038 ILE CA 3.785 H A 0039 HIS CA
H A 0038 ILE C 2.419 H A 0039 HIS CA
H A 0038 ILE C 2.938 H A 0039 HIS C
H A 0038 ILE C 3.709 H A 0039 HIS CB
H A 0038 ILE CG2 3.623 H A 0049 LYS CG
H A 0038 ILE CG2 3.622 H A 0049 LYS CE
H A 0038 ILE CD1 3.356 H A 0053 ILE CG1
H A 0039 HIS CA 3.785 H A 0040 THR CA
H A 0039 HIS C 2.418 H A 0040 THR CA
H A 0039 HIS C 3.037 H A 0040 THR C
H A 0039 HIS C 3.666 H A 0040 THR CB
H A 0040 THR CA 3.785 H A 0041 LEU CA
H A 0040 THR C 2.418 H A 0041 LEU CA
H A 0040 THR C 3.041 H A 0041 LEU C
H A 0040 THR C 3.688 H A 0041 LEU CB
H A 0041 LEU CA 3.785 H A 0042 SER CA
H A 0041 LEU C 2.419 H A 0042 SER CA
H A 0041 LEU C 3.084 H A 0042 SER C
H A 0041 LEU C 3.696 H A 0042 SER CB
H A 0041 LEU C 3.673 H A 0052 ILE CD1
H A 0041 LEU CB 3.684 H A 0052 ILE CG2
H A 0041 LEU CD1 3.514 H A 0052 ILE CG2
H A 0041 LEU CD1 3.429 H A 0056 PHE CE2
H A 0042 SER CA 3.785 H A 0043 ALA CA
H A 0042 SER C 2.418 H A 0043 ALA CA
H A 0042 SER C 3.294 H A 0043 ALA C
H A 0042 SER C 3.578 H A 0043 ALA CB
H A 0042 SER C 3.695 C A 0046 ASP CA
H A 0042 SER CA 3.718 C A 0047 LEU C
H A 0042 SER CA 3.127 H A 0052 ILE CD1
H A 0042 SER CB 3.183 H A 0052 ILE CD1
H A 0043 ALA CA 3.785 H A 0044 GLN CA
H A 0043 ALA C 2.419 H A 0044 GLN CA
H A 0043 ALA C 2.832 H A 0044 GLN C
H A 0043 ALA C 3.697 H A 0044 GLN CB
H A 0044 GLN CA 3.784 H A 0045 LEU CA
H A 0044 GLN C 2.418 H A 0045 LEU CA
H A 0044 GLN C 3.227 H A 0045 LEU C
H A 0044 GLN C 3.617 H A 0045 LEU CB
H A 0044 GLN C 3.644 H A 0045 LEU CD2
H A 0045 LEU CA 3.785 C A 0046 ASP CA
H A 0045 LEU C 2.419 C A 0046 ASP CA
H A 0045 LEU C 3.137 C A 0046 ASP C
H A 0045 LEU C 2.825 C A 0046 ASP CB
C A 0046 ASP CA 3.785 C A 0047 LEU CA
C A 0046 ASP C 2.419 C A 0047 LEU CA
C A 0046 ASP C 3.268 C A 0047 LEU C
C A 0046 ASP C 3.594 C A 0047 LEU CB
C A 0047 LEU CA 2.872 H A 0048 PRO CD
C A 0047 LEU C 2.448 H A 0048 PRO CA
C A 0047 LEU C 3.136 H A 0048 PRO C
C A 0047 LEU C 3.642 H A 0048 PRO CB
C A 0047 LEU C 3.683 H A 0048 PRO CG
C A 0047 LEU C 2.512 H A 0048 PRO CD
C A 0047 LEU CB 3.197 H A 0048 PRO CD
C A 0047 LEU CD2 3.373 H A 0048 PRO CD
C A 0047 LEU CD1 3.731 H A 0051 THR CG2
H A 0048 PRO CA 3.785 H A 0049 LYS CA
H A 0048 PRO C 2.418 H A 0049 LYS CA
H A 0048 PRO C 2.982 H A 0049 LYS C
H A 0048 PRO C 3.700 H A 0049 LYS CB
H A 0048 PRO CB 3.577 H A 0050 HIS CD2
H A 0048 PRO CB 3.146 H A 0050 HIS CE1
H A 0048 PRO CG 3.323 H A 0051 THR CB
H A 0048 PRO CD 3.388 H A 0051 THR CB
H A 0048 PRO C 3.412 H A 0052 ILE CD1
H A 0049 LYS CA 3.785 H A 0050 HIS CA
H A 0049 LYS C 2.418 H A 0050 HIS CA
H A 0049 LYS C 2.869 H A 0050 HIS C
H A 0049 LYS C 3.707 H A 0050 HIS CB
H A 0049 LYS C 3.723 H A 0053 ILE CG1
H A 0049 LYS C 3.722 H A 0053 ILE CD1
H A 0050 HIS CA 3.785 H A 0051 THR CA
H A 0050 HIS C 2.419 H A 0051 THR CA
H A 0050 HIS C 2.931 H A 0051 THR C
H A 0050 HIS C 3.676 H A 0051 THR CB
H A 0050 HIS C 3.766 H A 0054 LYS CE
H A 0050 HIS CB 3.482 H A 0054 LYS CE
H A 0051 THR CA 3.786 H A 0052 ILE CA
H A 0051 THR C 2.419 H A 0052 ILE CA
H A 0051 THR C 2.902 H A 0052 ILE C
H A 0051 THR C 3.706 H A 0052 ILE CB
H A 0052 ILE CA 3.785 H A 0053 ILE CA
H A 0052 ILE C 2.418 H A 0053 ILE CA
H A 0052 ILE C 2.922 H A 0053 ILE C
H A 0052 ILE C 3.705 H A 0053 ILE CB
H A 0052 ILE CG2 3.742 H A 0056 PHE CD2
H A 0052 ILE CG2 3.779 H A 0056 PHE CE2
H A 0053 ILE CA 3.785 H A 0054 LYS CA
H A 0053 ILE C 2.419 H A 0054 LYS CA
H A 0053 ILE C 2.826 H A 0054 LYS C
H A 0053 ILE C 3.699 H A 0054 LYS CB
H A 0054 LYS CA 3.785 H A 0055 PHE CA
H A 0054 LYS C 2.418 H A 0055 PHE CA
H A 0054 LYS C 2.820 H A 0055 PHE C
H A 0054 LYS C 3.624 H A 0055 PHE CB
H A 0055 PHE CA 3.786 H A 0056 PHE CA
H A 0055 PHE C 2.419 H A 0056 PHE CA
H A 0055 PHE C 2.907 H A 0056 PHE C
H A 0055 PHE C 3.655 H A 0056 PHE CB
H A 0056 PHE CA 3.785 H A 0057 GLN CA
H A 0056 PHE C 2.419 H A 0057 GLN CA
H A 0056 PHE C 2.827 H A 0057 GLN C
H A 0056 PHE C 3.695 H A 0057 GLN CB
H A 0057 GLN CA 3.785 H A 0058 ASN CA
H A 0057 GLN C 2.418 H A 0058 ASN CA
H A 0057 GLN C 2.939 H A 0058 ASN C
H A 0057 GLN C 3.712 H A 0058 ASN CB
H A 0058 ASN CA 3.785 H A 0059 GLN CA
H A 0058 ASN C 2.419 H A 0059 GLN CA
H A 0058 ASN C 2.932 H A 0059 GLN C
H A 0058 ASN C 3.712 H A 0059 GLN CB
H A 0059 GLN CA 3.784 H A 0060 ARG CA
H A 0059 GLN C 2.418 H A 0060 ARG CA
H A 0059 GLN C 2.987 H A 0060 ARG C
H A 0059 GLN C 3.712 H A 0060 ARG CB
H A 0060 ARG CA 3.785 H A 0061 TYR CA
H A 0060 ARG C 2.419 H A 0061 TYR CA
H A 0060 ARG C 2.874 H A 0061 TYR C
H A 0060 ARG C 3.633 H A 0061 TYR CB
H A 0061 TYR CA 3.785 H A 0062 HIS CA
H A 0061 TYR C 2.419 H A 0062 HIS CA
H A 0061 TYR C 2.987 H A 0062 HIS C
H A 0061 TYR C 3.705 H A 0062 HIS CB
H A 0062 HIS CA 3.784 H A 0063 VAL CA
H A 0062 HIS C 2.418 H A 0063 VAL CA
H A 0062 HIS C 2.866 H A 0063 VAL C
H A 0062 HIS C 3.697 H A 0063 VAL CB
H A 0063 VAL CA 3.785 C A 0064 LYS CA
H A 0063 VAL C 2.419 C A 0064 LYS CA
H A 0063 VAL C 3.653 C A 0064 LYS C
H A 0063 VAL C 3.133 C A 0064 LYS CB
C A 0064 LYS CA 3.785 C A 0065 HIS CA
C A 0064 LYS C 2.419 C A 0065 HIS CA
C A 0064 LYS C 2.935 C A 0065 HIS C
C A 0064 LYS C 3.708 C A 0065 HIS CB
C A 0065 HIS CA 3.786 C A 0066 SER CA
C A 0065 HIS C 2.419 C A 0066 SER CA
C A 0065 HIS C 3.145 C A 0066 SER C
C A 0065 HIS C 3.678 C A 0066 SER CB
C A 0066 SER CA 3.785 C A 0067 GLY CA
C A 0066 SER C 2.419 C A 0067 GLY CA
C A 0066 SER C 3.487 C A 0067 GLY C
C A 0067 GLY CA 2.872 C A 0068 PRO CD
C A 0067 GLY C 2.449 C A 0068 PRO CA
C A 0067 GLY C 3.136 C A 0068 PRO C
C A 0067 GLY C 3.643 C A 0068 PRO CB
C A 0067 GLY C 3.683 C A 0068 PRO CG
C A 0067 GLY C 2.513 C A 0068 PRO CD
C A 0068 PRO CA 3.784 C A 0069 SER CA
C A 0068 PRO C 2.419 C A 0069 SER CA
C A 0068 PRO C 2.936 C A 0069 SER C
C A 0068 PRO C 3.037 C A 0069 SER CB
C A 0069 SER CA 3.785 C A 0070 SER CA
C A 0069 SER C 2.419 C A 0070 SER CA
C A 0069 SER C 2.877 C A 0070 SER C
C A 0069 SER C 3.708 C A 0070 SER CB
C A 0070 SER CA 3.785 C A 0071 GLY CA
C A 0070 SER C 2.419 C A 0071 GLY CA
C A 0070 SER C 3.308 C A 0071 GLY C
CHARGE_ATTR 2.00 12.00 19
H A 0028 ASP OD1 7.463 H A 0027 HIS ND1
H A 0028 ASP OD1 9.095 H A 0027 HIS NE2
H A 0028 ASP OD2 7.753 H A 0027 HIS ND1
H A 0028 ASP OD2 9.438 H A 0027 HIS NE2
H A 0034 ASP OD1 11.12 H A 0039 HIS ND1
H A 0034 ASP OD2 11.65 H A 0039 HIS ND1
H A 0034 ASP OD1 10.44 H A 0049 LYS NZ
H A 0034 ASP OD2 10.89 H A 0049 LYS NZ
H A 0034 ASP OD1 11.66 H A 0060 ARG NH1
H A 0034 ASP OD2 11.97 H A 0060 ARG NH1
H A 0036 GLU OE1 8.185 H A 0039 HIS ND1
H A 0036 GLU OE1 10.23 H A 0039 HIS NE2
H A 0036 GLU OE2 9.483 H A 0039 HIS ND1
H A 0036 GLU OE2 11.52 H A 0039 HIS NE2
H A 0036 GLU OE1 10.66 H A 0049 LYS NZ
H A 0036 GLU OE2 11.16 H A 0049 LYS NZ
C A 0046 ASP OD1 11.41 H A 0039 HIS NE2
C A 0046 ASP OD2 11.64 H A 0039 HIS NE2
C A 0046 ASP OD2 11.32 H A 0050 HIS NE2
CHARGE_REPU 2.00 12.00 30
C A 0009 ARG NH1 11.14 C A 0011 ARG NH1
C A 0009 ARG NH2 9.370 C A 0011 ARG NH1
C A 0009 ARG NH2 11.08 C A 0011 ARG NH2
C A 0009 ARG NH1 11.94 H A 0050 HIS NE2
C A 0009 ARG NH1 7.404 H A 0054 LYS NZ
C A 0009 ARG NH2 8.447 H A 0054 LYS NZ
C A 0011 ARG NH1 8.670 C A 0013 LYS NZ
C A 0011 ARG NH2 7.492 C A 0013 LYS NZ
C A 0011 ARG NH1 11.62 H A 0054 LYS NZ
H A 0034 ASP OD1 7.326 H A 0036 GLU OE1
H A 0034 ASP OD1 5.500 H A 0036 GLU OE2
H A 0034 ASP OD2 7.470 H A 0036 GLU OE1
H A 0034 ASP OD2 5.767 H A 0036 GLU OE2
H A 0039 HIS ND1 4.696 H A 0049 LYS NZ
H A 0039 HIS NE2 5.085 H A 0049 LYS NZ
H A 0039 HIS ND1 11.68 H A 0050 HIS ND1
H A 0039 HIS NE2 10.32 H A 0050 HIS ND1
H A 0039 HIS NE2 11.57 H A 0050 HIS NE2
H A 0049 LYS NZ 8.879 H A 0050 HIS ND1
H A 0049 LYS NZ 10.77 H A 0050 HIS NE2
H A 0050 HIS ND1 6.707 H A 0054 LYS NZ
H A 0050 HIS NE2 7.160 H A 0054 LYS NZ
H A 0060 ARG NH2 11.37 C A 0064 LYS NZ
H A 0062 HIS ND1 9.034 C A 0064 LYS NZ
H A 0062 HIS NE2 11.05 C A 0064 LYS NZ
H A 0062 HIS ND1 11.30 C A 0065 HIS ND1
H A 0062 HIS ND1 9.670 C A 0065 HIS NE2
H A 0062 HIS NE2 11.70 C A 0065 HIS NE2
C A 0064 LYS NZ 9.090 C A 0065 HIS ND1
C A 0064 LYS NZ 7.644 C A 0065 HIS NE2
HB_MM 2.00 3.20 133
C A 0002 SER N 2.262 C A 0001 GLY O
C A 0003 SER N 2.262 C A 0002 SER O
C A 0004 GLY N 2.262 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 PRO N 2.293 C A 0007 GLY O
C A 0009 ARG N 2.262 C A 0008 PRO O
C A 0010 SER N 2.262 C A 0009 ARG O
C A 0011 ARG N 2.261 C A 0010 SER O
C A 0012 THR N 2.261 C A 0011 ARG O
C A 0013 LYS N 2.261 C A 0012 THR O
C A 0014 ILE N 2.261 C A 0013 LYS O
C A 0015 SER N 2.262 C A 0014 ILE O
H A 0016 LEU N 2.871 C A 0014 ILE O
H A 0016 LEU N 2.262 C A 0015 SER O
H A 0017 GLU N 2.261 H A 0016 LEU O
H A 0018 ALA N 2.262 H A 0017 GLU O
H A 0019 LEU N 2.877 H A 0016 LEU O
H A 0019 LEU N 2.757 H A 0017 GLU O
H A 0019 LEU N 2.262 H A 0018 ALA O
H A 0020 GLY N 2.585 H A 0016 LEU O
H A 0020 GLY N 2.496 H A 0017 GLU O
H A 0020 GLY N 2.262 H A 0019 LEU O
H A 0021 ILE N 2.705 H A 0017 GLU O
H A 0021 ILE N 3.007 H A 0018 ALA O
H A 0021 ILE N 3.140 H A 0019 LEU O
H A 0021 ILE N 2.262 H A 0020 GLY O
H A 0022 LEU N 3.038 H A 0018 ALA O
H A 0022 LEU N 2.262 H A 0021 ILE O
H A 0023 GLN N 2.694 H A 0019 LEU O
H A 0023 GLN N 2.825 H A 0020 GLY O
H A 0023 GLN N 2.819 H A 0021 ILE O
H A 0023 GLN N 2.261 H A 0022 LEU O
H A 0024 SER N 2.738 H A 0020 GLY O
H A 0024 SER N 2.561 H A 0021 ILE O
H A 0024 SER N 2.262 H A 0023 GLN O
H A 0025 PHE N 2.945 H A 0022 LEU O
H A 0025 PHE N 2.262 H A 0024 SER O
H A 0026 ILE N 2.871 H A 0022 LEU O
H A 0026 ILE N 3.033 H A 0023 GLN O
H A 0026 ILE N 2.262 H A 0025 PHE O
H A 0027 HIS N 3.054 H A 0023 GLN O
H A 0027 HIS N 2.261 H A 0026 ILE O
H A 0028 ASP N 2.972 H A 0024 SER O
H A 0028 ASP N 3.148 H A 0025 PHE O
H A 0028 ASP N 2.261 H A 0027 HIS O
H A 0029 VAL N 2.619 H A 0025 PHE O
H A 0029 VAL N 2.261 H A 0028 ASP O
H A 0030 GLY N 2.524 H A 0026 ILE O
H A 0030 GLY N 2.262 H A 0029 VAL O
C A 0031 LEU N 2.261 H A 0030 GLY O
C A 0032 TYR N 2.261 C A 0031 LEU O
C A 0033 PRO N 2.293 C A 0032 TYR O
H A 0034 ASP N 2.262 C A 0033 PRO O
H A 0035 GLN N 2.262 H A 0034 ASP O
H A 0036 GLU N 2.584 H A 0034 ASP O
H A 0036 GLU N 2.261 H A 0035 GLN O
H A 0037 ALA N 2.548 H A 0034 ASP O
H A 0037 ALA N 2.262 H A 0036 GLU O
H A 0038 ILE N 2.790 H A 0034 ASP O
H A 0038 ILE N 2.262 H A 0037 ALA O
H A 0039 HIS N 3.182 H A 0035 GLN O
H A 0039 HIS N 3.080 H A 0036 GLU O
H A 0039 HIS N 2.262 H A 0038 ILE O
H A 0040 THR N 2.968 H A 0036 GLU O
H A 0040 THR N 3.054 H A 0037 ALA O
H A 0040 THR N 2.261 H A 0039 HIS O
H A 0041 LEU N 2.867 H A 0037 ALA O
H A 0041 LEU N 2.962 H A 0038 ILE O
H A 0041 LEU N 2.262 H A 0040 THR O
H A 0042 SER N 2.653 H A 0038 ILE O
H A 0042 SER N 2.262 H A 0041 LEU O
H A 0043 ALA N 2.920 H A 0039 HIS O
H A 0043 ALA N 3.169 H A 0040 THR O
H A 0043 ALA N 2.261 H A 0042 SER O
H A 0044 GLN N 2.570 H A 0040 THR O
H A 0044 GLN N 2.261 H A 0043 ALA O
H A 0045 LEU N 3.157 H A 0041 LEU O
H A 0045 LEU N 2.859 H A 0043 ALA O
H A 0045 LEU N 2.262 H A 0044 GLN O
C A 0046 ASP N 3.076 H A 0042 SER O
C A 0046 ASP N 2.625 H A 0043 ALA O
C A 0046 ASP N 2.261 H A 0045 LEU O
C A 0047 LEU N 2.953 H A 0042 SER O
C A 0047 LEU N 2.262 C A 0046 ASP O
H A 0048 PRO N 2.293 C A 0047 LEU O
H A 0049 LYS N 2.262 H A 0048 PRO O
H A 0050 HIS N 2.262 H A 0049 LYS O
H A 0051 THR N 3.109 H A 0049 LYS O
H A 0051 THR N 2.262 H A 0050 HIS O
H A 0052 ILE N 3.050 H A 0048 PRO O
H A 0052 ILE N 3.037 H A 0049 LYS O
H A 0052 ILE N 2.262 H A 0051 THR O
H A 0053 ILE N 2.602 H A 0049 LYS O
H A 0053 ILE N 2.261 H A 0052 ILE O
H A 0054 LYS N 2.502 H A 0050 HIS O
H A 0054 LYS N 3.198 H A 0051 THR O
H A 0054 LYS N 2.261 H A 0053 ILE O
H A 0055 PHE N 2.841 H A 0051 THR O
H A 0055 PHE N 2.262 H A 0054 LYS O
H A 0056 PHE N 2.950 H A 0052 ILE O
H A 0056 PHE N 2.950 H A 0053 ILE O
H A 0056 PHE N 2.958 H A 0054 LYS O
H A 0056 PHE N 2.261 H A 0055 PHE O
H A 0057 GLN N 2.854 H A 0053 ILE O
H A 0057 GLN N 2.678 H A 0054 LYS O
H A 0057 GLN N 2.262 H A 0056 PHE O
H A 0058 ASN N 2.850 H A 0055 PHE O
H A 0058 ASN N 2.778 H A 0056 PHE O
H A 0058 ASN N 2.261 H A 0057 GLN O
H A 0059 GLN N 2.510 H A 0056 PHE O
H A 0059 GLN N 2.262 H A 0058 ASN O
H A 0060 ARG N 2.984 H A 0056 PHE O
H A 0060 ARG N 3.132 H A 0057 GLN O
H A 0060 ARG N 2.261 H A 0059 GLN O
H A 0061 TYR N 2.758 H A 0057 GLN O
H A 0061 TYR N 2.261 H A 0060 ARG O
H A 0062 HIS N 2.939 H A 0058 ASN O
H A 0062 HIS N 2.988 H A 0060 ARG O
H A 0062 HIS N 2.261 H A 0061 TYR O
H A 0063 VAL N 2.935 H A 0059 GLN O
H A 0063 VAL N 3.019 H A 0060 ARG O
H A 0063 VAL N 2.262 H A 0062 HIS O
C A 0064 LYS N 3.020 H A 0062 HIS O
C A 0064 LYS N 2.262 H A 0063 VAL O
C A 0065 HIS N 2.261 C A 0064 LYS O
C A 0066 SER N 2.261 C A 0065 HIS O
C A 0067 GLY N 2.261 C A 0066 SER O
C A 0068 PRO N 2.293 C A 0067 GLY O
C A 0069 SER N 2.262 C A 0068 PRO O
C A 0070 SER N 2.261 C A 0069 SER O
C A 0071 GLY N 2.261 C A 0070 SER O
HB_MS 2.00 3.20 5
C A 0002 SER O 3.105 C A 0003 SER OG
C A 0005 SER O 3.168 H A 0057 GLN NE2
C A 0013 LYS N 2.856 C A 0012 THR OG1
C A 0047 LEU O 2.400 H A 0042 SER OG
C A 0071 GLY N 3.103 C A 0070 SER OG
HB_SS 2.00 3.20 1
H A 0062 HIS NE2 3.068 H A 0058 ASN OD1
AROMATIC 0.00 8.00 4
H A 0054 LYS 6.308 H A 0050 HIS
C A 0064 LYS 6.478 H A 0061 TYR
H A 0060 ARG 5.913 C A 0032 TYR
H A 0049 LYS 4.815 H A 0039 HIS