Complet list of 1wil con file
Complete list of 1wil.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 348
C A 0001 GLY CA 3.796 C A 0002 SER CA
C A 0001 GLY C 2.434 C A 0002 SER CA
C A 0001 GLY C 3.703 C A 0002 SER C
C A 0001 GLY C 3.102 C A 0002 SER CB
C A 0002 SER C 2.434 C A 0003 SER CA
C A 0002 SER C 3.607 C A 0003 SER C
C A 0002 SER C 3.330 C A 0003 SER CB
C A 0003 SER CA 3.792 C A 0004 GLY CA
C A 0003 SER C 2.418 C A 0004 GLY CA
C A 0003 SER C 3.705 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 3.702 C A 0005 SER C
C A 0004 GLY C 3.104 C A 0005 SER CB
C A 0005 SER C 2.434 C A 0006 SER CA
C A 0005 SER C 3.583 C A 0006 SER C
C A 0005 SER C 3.368 C A 0006 SER CB
C A 0006 SER CA 3.793 C A 0007 GLY CA
C A 0006 SER C 2.418 C A 0007 GLY CA
C A 0006 SER C 3.504 C A 0007 GLY C
C A 0007 GLY CA 2.865 C A 0008 PRO CD
C A 0007 GLY C 2.464 C A 0008 PRO CA
C A 0007 GLY C 3.135 C A 0008 PRO C
C A 0007 GLY C 3.645 C A 0008 PRO CB
C A 0007 GLY C 3.635 C A 0008 PRO CG
C A 0007 GLY C 2.497 C A 0008 PRO CD
C A 0008 PRO C 2.434 C A 0009 ARG CA
C A 0008 PRO C 3.393 C A 0009 ARG C
C A 0008 PRO C 3.564 C A 0009 ARG CB
C A 0009 ARG C 2.434 C A 0010 GLU CA
C A 0009 ARG C 3.185 C A 0010 GLU C
C A 0009 ARG C 3.678 C A 0010 GLU CB
C A 0010 GLU CA 2.866 C A 0011 PRO CD
C A 0010 GLU C 2.464 C A 0011 PRO CA
C A 0010 GLU C 3.136 C A 0011 PRO C
C A 0010 GLU C 3.645 C A 0011 PRO CB
C A 0010 GLU C 3.635 C A 0011 PRO CG
C A 0010 GLU C 2.499 C A 0011 PRO CD
C A 0010 GLU CB 3.582 C A 0011 PRO CD
C A 0011 PRO C 2.433 C A 0012 VAL CA
C A 0011 PRO C 2.935 C A 0012 VAL C
C A 0011 PRO C 3.733 C A 0012 VAL CB
C A 0012 VAL C 2.434 C A 0013 VAL CA
C A 0012 VAL C 3.377 C A 0013 VAL C
C A 0012 VAL C 3.602 C A 0013 VAL CB
C A 0013 VAL C 2.434 C A 0014 ASN CA
C A 0013 VAL C 3.443 C A 0014 ASN C
C A 0013 VAL C 3.524 C A 0014 ASN CB
C A 0014 ASN C 2.433 C A 0015 ASP CA
C A 0014 ASN C 3.057 C A 0015 ASP C
C A 0014 ASN C 3.708 C A 0015 ASP CB
C A 0014 ASN CG 3.770 C A 0017 MET CG
C A 0015 ASP C 2.432 C A 0016 GLU CA
C A 0015 ASP C 3.283 C A 0016 GLU C
C A 0015 ASP C 3.633 C A 0016 GLU CB
C A 0016 GLU C 2.434 C A 0017 MET CA
C A 0016 GLU C 3.450 C A 0017 MET C
C A 0016 GLU C 3.518 C A 0017 MET CB
C A 0016 GLU C 3.330 C A 0038 VAL CG2
C A 0017 MET C 2.433 C A 0018 CYS CA
C A 0017 MET C 2.817 C A 0018 CYS C
C A 0017 MET C 3.677 C A 0018 CYS CB
C A 0017 MET CB 3.692 C A 0022 GLU C
C A 0017 MET CA 3.774 C A 0038 VAL CG2
C A 0017 MET C 3.293 C A 0038 VAL CG2
C A 0018 CYS C 2.433 C A 0019 ASP CA
C A 0018 CYS C 3.187 C A 0019 ASP C
C A 0018 CYS C 3.677 C A 0019 ASP CB
C A 0018 CYS CB 3.763 C A 0021 CYS CB
C A 0018 CYS CA 3.681 C A 0038 VAL CG2
C A 0018 CYS CB 3.653 C A 0040 HIS CD2
C A 0018 CYS CB 3.793 C A 0040 HIS CE1
C A 0019 ASP C 2.435 C A 0020 VAL CA
C A 0019 ASP C 3.490 C A 0020 VAL C
C A 0019 ASP C 3.510 C A 0020 VAL CB
C A 0019 ASP C 3.617 C A 0020 VAL CG2
C A 0019 ASP CG 3.781 C A 0039 PHE CB
C A 0020 VAL C 2.433 C A 0021 CYS CA
C A 0020 VAL C 3.536 C A 0021 CYS C
C A 0020 VAL C 3.428 C A 0021 CYS CB
C A 0020 VAL CB 3.664 H A 0043 CYS CB
C A 0020 VAL CG1 3.724 H A 0043 CYS CB
C A 0021 CYS C 2.433 C A 0022 GLU CA
C A 0021 CYS C 2.978 C A 0022 GLU C
C A 0021 CYS C 3.024 C A 0022 GLU CB
C A 0021 CYS C 3.529 C A 0022 GLU CG
C A 0021 CYS CB 3.520 C A 0023 VAL CG2
C A 0022 GLU C 2.434 C A 0023 VAL CA
C A 0022 GLU C 3.622 C A 0023 VAL C
C A 0022 GLU C 3.337 C A 0023 VAL CB
C A 0022 GLU C 3.275 C A 0023 VAL CG1
C A 0023 VAL C 2.433 C A 0024 TRP CA
C A 0023 VAL C 3.485 C A 0024 TRP C
C A 0023 VAL C 3.482 C A 0024 TRP CB
C A 0024 TRP C 2.434 C A 0025 THR CA
C A 0024 TRP C 3.689 C A 0025 THR C
C A 0024 TRP C 3.191 C A 0025 THR CB
C A 0024 TRP CD2 3.676 C A 0025 THR CA
C A 0024 TRP CD2 3.711 C A 0025 THR C
C A 0024 TRP CE3 3.351 C A 0025 THR CA
C A 0024 TRP CE3 2.878 C A 0025 THR C
C A 0024 TRP CZ3 2.963 C A 0025 THR C
C A 0024 TRP CZ3 3.224 C A 0026 ALA CA
C A 0024 TRP CH2 3.630 C A 0026 ALA CA
C A 0025 THR C 2.432 C A 0026 ALA CA
C A 0025 THR C 2.851 C A 0026 ALA C
C A 0025 THR C 3.686 C A 0026 ALA CB
C A 0026 ALA C 2.433 C A 0027 GLU CA
C A 0026 ALA C 2.948 C A 0027 GLU C
C A 0026 ALA C 3.714 C A 0027 GLU CB
C A 0027 GLU C 2.435 C A 0028 SER CA
C A 0027 GLU C 3.063 C A 0028 SER C
C A 0027 GLU C 3.709 C A 0028 SER CB
C A 0028 SER C 2.434 C A 0029 LEU CA
C A 0028 SER C 3.293 C A 0029 LEU C
C A 0028 SER C 3.628 C A 0029 LEU CB
C A 0029 LEU C 2.433 C A 0030 PHE CA
C A 0029 LEU C 3.264 C A 0030 PHE C
C A 0029 LEU C 3.643 C A 0030 PHE CB
C A 0029 LEU C 3.626 C A 0030 PHE CD1
C A 0029 LEU CG 3.780 C A 0038 VAL CB
C A 0029 LEU CD2 3.344 C A 0038 VAL CB
C A 0029 LEU CD2 3.682 C A 0038 VAL CG1
C A 0029 LEU CD2 3.240 C A 0038 VAL CG2
C A 0029 LEU CD1 3.592 C A 0040 HIS CD2
C A 0030 PHE CA 2.809 C A 0031 PRO CA
C A 0030 PHE CA 3.076 C A 0031 PRO C
C A 0030 PHE C 2.465 C A 0031 PRO CA
C A 0030 PHE C 3.136 C A 0031 PRO C
C A 0030 PHE C 3.645 C A 0031 PRO CB
C A 0030 PHE C 3.636 C A 0031 PRO CG
C A 0030 PHE C 2.498 C A 0031 PRO CD
C A 0030 PHE CB 3.300 C A 0031 PRO CA
C A 0030 PHE CE2 3.660 C A 0060 GLU CG
C A 0030 PHE CE2 3.622 C A 0060 GLU CD
C A 0030 PHE CZ 3.729 C A 0060 GLU CD
C A 0030 PHE CD2 3.689 C A 0062 ALA CB
C A 0030 PHE CE2 3.396 C A 0062 ALA CB
C A 0030 PHE CZ 3.631 C A 0062 ALA CB
C A 0031 PRO C 2.434 C A 0032 CYS CA
C A 0031 PRO C 3.489 C A 0032 CYS C
C A 0031 PRO C 3.481 C A 0032 CYS CB
C A 0031 PRO CG 3.340 C A 0039 PHE CE1
C A 0031 PRO CG 3.683 C A 0039 PHE CZ
C A 0031 PRO CD 3.444 C A 0039 PHE CD1
C A 0031 PRO CD 3.494 C A 0039 PHE CE1
C A 0031 PRO CB 3.699 C A 0070 CYS CB
C A 0031 PRO CG 3.385 C A 0070 CYS CB
C A 0032 CYS C 2.433 C A 0033 ARG CA
C A 0032 CYS C 3.296 C A 0033 ARG C
C A 0032 CYS C 3.627 C A 0033 ARG CB
C A 0033 ARG C 2.434 C A 0034 VAL CA
C A 0033 ARG C 3.011 C A 0034 VAL C
C A 0033 ARG C 3.736 C A 0034 VAL CB
C A 0034 VAL C 2.435 C A 0035 CYS CA
C A 0034 VAL C 2.893 C A 0035 CYS C
C A 0034 VAL C 3.707 C A 0035 CYS CB
C A 0035 CYS C 2.434 C A 0036 THR CA
C A 0035 CYS C 2.815 C A 0036 THR C
C A 0035 CYS C 3.696 C A 0036 THR CB
C A 0036 THR C 2.434 C A 0037 ARG CA
C A 0036 THR C 3.023 C A 0037 ARG C
C A 0036 THR C 3.712 C A 0037 ARG CB
C A 0037 ARG C 2.433 C A 0038 VAL CA
C A 0037 ARG C 3.410 C A 0038 VAL C
C A 0037 ARG C 3.578 C A 0038 VAL CB
C A 0037 ARG C 3.707 C A 0038 VAL CG1
C A 0037 ARG C 3.757 C A 0039 PHE CE2
C A 0037 ARG CG 3.653 C A 0039 PHE CD2
C A 0037 ARG CG 3.366 C A 0039 PHE CE2
C A 0037 ARG CG 3.510 C A 0072 TYR CE2
C A 0038 VAL C 2.434 C A 0039 PHE CA
C A 0038 VAL C 3.663 C A 0039 PHE C
C A 0038 VAL C 3.222 C A 0039 PHE CB
C A 0038 VAL C 3.464 C A 0039 PHE CG
C A 0038 VAL C 3.351 C A 0039 PHE CD2
C A 0039 PHE C 2.435 C A 0040 HIS CA
C A 0039 PHE C 3.008 C A 0040 HIS C
C A 0039 PHE C 3.714 C A 0040 HIS CB
C A 0039 PHE CD1 3.711 H A 0044 LEU CD1
C A 0040 HIS C 2.434 H A 0041 ASP CA
C A 0040 HIS C 2.912 H A 0041 ASP C
C A 0040 HIS C 3.710 H A 0041 ASP CB
H A 0041 ASP CA 3.793 H A 0042 GLY CA
H A 0041 ASP C 2.418 H A 0042 GLY CA
H A 0041 ASP C 3.077 H A 0042 GLY C
H A 0042 GLY CA 3.797 H A 0043 CYS CA
H A 0042 GLY C 2.435 H A 0043 CYS CA
H A 0042 GLY C 2.988 H A 0043 CYS C
H A 0042 GLY C 3.715 H A 0043 CYS CB
H A 0043 CYS C 2.434 H A 0044 LEU CA
H A 0043 CYS C 3.163 H A 0044 LEU C
H A 0043 CYS C 3.684 H A 0044 LEU CB
H A 0044 LEU C 2.434 H A 0045 ARG CA
H A 0044 LEU C 2.960 H A 0045 ARG C
H A 0044 LEU C 3.714 H A 0045 ARG CB
H A 0044 LEU C 3.778 C A 0050 ILE CG1
H A 0044 LEU CB 3.379 C A 0050 ILE CG1
H A 0044 LEU CB 3.446 C A 0050 ILE CD1
H A 0045 ARG C 2.434 H A 0046 ARG CA
H A 0045 ARG C 3.027 H A 0046 ARG C
H A 0045 ARG C 3.713 H A 0046 ARG CB
H A 0046 ARG C 2.434 H A 0047 MET CA
H A 0046 ARG C 2.856 H A 0047 MET C
H A 0046 ARG C 3.696 H A 0047 MET CB
H A 0047 MET CA 3.793 C A 0048 GLY CA
H A 0047 MET C 2.418 C A 0048 GLY CA
H A 0047 MET C 3.594 C A 0048 GLY C
C A 0048 GLY CA 3.795 C A 0049 TYR CA
C A 0048 GLY C 2.433 C A 0049 TYR CA
C A 0048 GLY C 3.389 C A 0049 TYR C
C A 0048 GLY C 3.566 C A 0049 TYR CB
C A 0049 TYR C 2.432 C A 0050 ILE CA
C A 0049 TYR C 3.346 C A 0050 ILE C
C A 0049 TYR C 3.623 C A 0050 ILE CB
C A 0049 TYR C 3.669 C A 0050 ILE CG1
C A 0050 ILE C 2.433 C A 0051 GLN CA
C A 0050 ILE C 2.843 C A 0051 GLN C
C A 0050 ILE C 3.186 C A 0051 GLN CB
C A 0051 GLN CA 3.792 C A 0052 GLY CA
C A 0051 GLN C 2.417 C A 0052 GLY CA
C A 0051 GLN C 3.501 C A 0052 GLY C
C A 0052 GLY CA 3.796 C A 0053 ASP CA
C A 0052 GLY C 2.432 C A 0053 ASP CA
C A 0052 GLY C 3.078 C A 0053 ASP C
C A 0052 GLY C 3.704 C A 0053 ASP CB
C A 0053 ASP C 2.434 C A 0054 SER CA
C A 0053 ASP C 3.464 C A 0054 SER C
C A 0053 ASP C 3.504 C A 0054 SER CB
C A 0054 SER C 2.433 C A 0055 ALA CA
C A 0054 SER C 2.872 C A 0055 ALA C
C A 0054 SER C 3.694 C A 0055 ALA CB
C A 0055 ALA C 2.433 C A 0056 ALA CA
C A 0055 ALA C 3.607 C A 0056 ALA C
C A 0055 ALA C 3.319 C A 0056 ALA CB
C A 0056 ALA C 2.434 C A 0057 GLU CA
C A 0056 ALA C 3.293 C A 0057 GLU C
C A 0056 ALA C 3.630 C A 0057 GLU CB
C A 0057 GLU C 2.434 C A 0058 VAL CA
C A 0057 GLU C 3.636 C A 0058 VAL C
C A 0057 GLU C 3.310 C A 0058 VAL CB
C A 0058 VAL C 2.434 C A 0059 THR CA
C A 0058 VAL C 3.236 C A 0059 THR C
C A 0058 VAL C 3.681 C A 0059 THR CB
C A 0058 VAL CG2 3.510 C A 0061 MET CG
C A 0059 THR C 2.433 C A 0060 GLU CA
C A 0059 THR C 3.639 C A 0060 GLU C
C A 0059 THR C 3.275 C A 0060 GLU CB
C A 0059 THR C 3.450 C A 0060 GLU CG
C A 0060 GLU C 2.434 C A 0061 MET CA
C A 0060 GLU C 3.552 C A 0061 MET C
C A 0060 GLU C 3.408 C A 0061 MET CB
C A 0060 GLU C 3.604 C A 0061 MET CG
C A 0061 MET C 2.433 C A 0062 ALA CA
C A 0061 MET C 3.346 C A 0062 ALA C
C A 0061 MET C 3.587 C A 0062 ALA CB
C A 0061 MET C 3.615 C A 0068 TRP CD1
C A 0061 MET CB 3.568 C A 0068 TRP CD1
C A 0062 ALA C 2.435 C A 0063 HIS CA
C A 0062 ALA C 2.833 C A 0063 HIS C
C A 0062 ALA C 3.686 C A 0063 HIS CB
C A 0063 HIS C 2.433 C A 0064 THR CA
C A 0063 HIS C 2.875 C A 0064 THR C
C A 0063 HIS C 3.722 C A 0064 THR CB
C A 0063 HIS CD2 3.636 C A 0064 THR CA
C A 0064 THR C 2.432 C A 0065 GLU CA
C A 0064 THR C 2.970 C A 0065 GLU C
C A 0064 THR C 3.716 C A 0065 GLU CB
C A 0065 GLU C 2.434 C A 0066 THR CA
C A 0065 GLU C 3.397 C A 0066 THR C
C A 0065 GLU C 3.589 C A 0066 THR CB
C A 0065 GLU C 3.775 C A 0066 THR CG2
C A 0066 THR CA 3.791 C A 0067 GLY CA
C A 0066 THR C 2.419 C A 0067 GLY CA
C A 0066 THR C 3.557 C A 0067 GLY C
C A 0067 GLY CA 3.796 C A 0068 TRP CA
C A 0067 GLY C 2.433 C A 0068 TRP CA
C A 0067 GLY C 3.317 C A 0068 TRP C
C A 0067 GLY C 3.613 C A 0068 TRP CB
C A 0068 TRP C 2.434 C A 0069 SER CA
C A 0068 TRP C 3.407 C A 0069 SER C
C A 0068 TRP C 3.554 C A 0069 SER CB
C A 0069 SER C 2.434 C A 0070 CYS CA
C A 0069 SER C 2.926 C A 0070 CYS C
C A 0069 SER C 3.712 C A 0070 CYS CB
C A 0070 CYS C 2.435 C A 0071 HIS CA
C A 0070 CYS C 3.049 C A 0071 HIS C
C A 0070 CYS C 3.710 C A 0071 HIS CB
C A 0071 HIS C 2.434 C A 0072 TYR CA
C A 0071 HIS C 2.868 C A 0072 TYR C
C A 0071 HIS C 3.699 C A 0072 TYR CB
C A 0071 HIS CA 3.695 C A 0074 ASP CG
C A 0071 HIS C 3.471 C A 0074 ASP CG
C A 0072 TYR C 2.434 C A 0073 CYS CA
C A 0072 TYR C 3.042 C A 0073 CYS C
C A 0072 TYR C 3.711 C A 0073 CYS CB
C A 0073 CYS C 2.434 C A 0074 ASP CA
C A 0073 CYS C 2.884 C A 0074 ASP C
C A 0073 CYS C 3.135 C A 0074 ASP CB
C A 0074 ASP C 2.433 C A 0075 ASN CA
C A 0074 ASP C 3.160 C A 0075 ASN C
C A 0074 ASP C 3.685 C A 0075 ASN CB
C A 0075 ASN C 2.433 C A 0076 ILE CA
C A 0075 ASN C 3.282 C A 0076 ILE C
C A 0075 ASN C 3.659 C A 0076 ILE CB
C A 0076 ILE C 2.434 C A 0077 ASN CA
C A 0076 ILE C 3.027 C A 0077 ASN C
C A 0076 ILE C 3.713 C A 0077 ASN CB
C A 0077 ASN C 2.433 C A 0078 LEU CA
C A 0077 ASN C 2.836 C A 0078 LEU C
C A 0077 ASN C 3.686 C A 0078 LEU CB
C A 0078 LEU C 2.436 C A 0079 LEU CA
C A 0078 LEU C 3.235 C A 0079 LEU C
C A 0078 LEU C 3.658 C A 0079 LEU CB
C A 0079 LEU C 2.434 C A 0080 LEU CA
C A 0079 LEU C 3.711 C A 0080 LEU C
C A 0079 LEU C 3.052 C A 0080 LEU CB
C A 0080 LEU C 2.434 C A 0081 THR CA
C A 0080 LEU C 2.990 C A 0081 THR C
C A 0080 LEU C 3.738 C A 0081 THR CB
C A 0081 THR C 2.433 C A 0082 GLU CA
C A 0081 THR C 3.500 C A 0082 GLU C
C A 0081 THR C 3.470 C A 0082 GLU CB
C A 0082 GLU C 2.433 C A 0083 GLU CA
C A 0082 GLU C 2.828 C A 0083 GLU C
C A 0082 GLU C 3.685 C A 0083 GLU CB
C A 0083 GLU C 2.434 C A 0084 SER CA
C A 0083 GLU C 3.355 C A 0084 SER C
C A 0083 GLU C 3.591 C A 0084 SER CB
C A 0084 SER CA 3.791 C A 0085 GLY CA
C A 0084 SER C 2.417 C A 0085 GLY CA
C A 0084 SER C 3.594 C A 0085 GLY C
C A 0084 SER C 3.485 C A 0086 PRO CD
C A 0085 GLY CA 2.865 C A 0086 PRO CD
C A 0085 GLY C 2.464 C A 0086 PRO CA
C A 0085 GLY C 3.136 C A 0086 PRO C
C A 0085 GLY C 3.646 C A 0086 PRO CB
C A 0085 GLY C 3.636 C A 0086 PRO CG
C A 0085 GLY C 2.498 C A 0086 PRO CD
C A 0086 PRO C 2.434 C A 0087 SER CA
C A 0086 PRO C 2.962 C A 0087 SER C
C A 0086 PRO C 3.715 C A 0087 SER CB
C A 0087 SER C 2.433 C A 0088 SER CA
C A 0087 SER C 2.855 C A 0088 SER C
C A 0087 SER C 3.695 C A 0088 SER CB
C A 0088 SER CA 3.792 C A 0089 GLY CA
C A 0088 SER C 2.418 C A 0089 GLY CA
C A 0088 SER C 3.707 C A 0089 GLY C
CHARGE_ATTR 2.00 12.00 72
C A 0010 GLU OE1 11.67 C A 0009 ARG NH1
C A 0010 GLU OE2 11.70 C A 0009 ARG NH1
C A 0015 ASP OD1 11.13 C A 0033 ARG NH1
C A 0015 ASP OD1 11.15 C A 0037 ARG NH1
C A 0015 ASP OD2 9.438 C A 0037 ARG NH1
C A 0015 ASP OD2 11.73 C A 0037 ARG NH2
C A 0016 GLU OE1 6.004 C A 0033 ARG NH1
C A 0016 GLU OE1 8.279 C A 0033 ARG NH2
C A 0016 GLU OE2 7.053 C A 0033 ARG NH1
C A 0016 GLU OE2 9.196 C A 0033 ARG NH2
C A 0016 GLU OE1 11.85 C A 0037 ARG NH1
C A 0016 GLU OE2 11.03 C A 0037 ARG NH1
C A 0019 ASP OD1 6.220 C A 0037 ARG NH1
C A 0019 ASP OD1 5.580 C A 0037 ARG NH2
C A 0019 ASP OD2 4.553 C A 0037 ARG NH1
C A 0019 ASP OD2 3.810 C A 0037 ARG NH2
C A 0019 ASP OD1 7.518 C A 0040 HIS ND1
C A 0019 ASP OD1 7.217 C A 0040 HIS NE2
C A 0019 ASP OD2 9.463 C A 0040 HIS ND1
C A 0019 ASP OD2 8.930 C A 0040 HIS NE2
C A 0019 ASP OD1 11.12 H A 0046 ARG NH1
C A 0022 GLU OE1 8.322 C A 0037 ARG NH1
C A 0022 GLU OE1 9.310 C A 0037 ARG NH2
C A 0022 GLU OE2 6.747 C A 0037 ARG NH1
C A 0022 GLU OE2 7.405 C A 0037 ARG NH2
C A 0022 GLU OE1 11.46 C A 0040 HIS ND1
C A 0022 GLU OE1 10.47 C A 0040 HIS NE2
C A 0022 GLU OE2 10.48 C A 0040 HIS ND1
C A 0022 GLU OE2 9.659 C A 0040 HIS NE2
C A 0027 GLU OE1 10.27 C A 0033 ARG NH1
C A 0027 GLU OE1 8.561 C A 0033 ARG NH2
C A 0027 GLU OE2 10.33 C A 0033 ARG NH1
C A 0027 GLU OE2 8.537 C A 0033 ARG NH2
C A 0027 GLU OE1 10.38 C A 0040 HIS ND1
C A 0027 GLU OE1 9.843 C A 0040 HIS NE2
C A 0027 GLU OE2 9.950 C A 0040 HIS ND1
C A 0027 GLU OE2 9.510 C A 0040 HIS NE2
C A 0027 GLU OE1 7.474 C A 0063 HIS ND1
C A 0027 GLU OE1 9.284 C A 0063 HIS NE2
C A 0027 GLU OE2 6.100 C A 0063 HIS ND1
C A 0027 GLU OE2 8.068 C A 0063 HIS NE2
H A 0041 ASP OD1 6.732 C A 0040 HIS ND1
H A 0041 ASP OD1 7.842 C A 0040 HIS NE2
H A 0041 ASP OD2 8.911 C A 0040 HIS ND1
H A 0041 ASP OD2 10.02 C A 0040 HIS NE2
H A 0041 ASP OD1 6.750 H A 0045 ARG NH1
H A 0041 ASP OD1 6.502 H A 0045 ARG NH2
H A 0041 ASP OD2 5.577 H A 0045 ARG NH1
H A 0041 ASP OD2 6.034 H A 0045 ARG NH2
H A 0041 ASP OD1 10.84 H A 0046 ARG NH1
H A 0041 ASP OD2 12.00 H A 0046 ARG NH1
C A 0053 ASP OD1 10.91 H A 0045 ARG NH1
C A 0060 GLU OE1 9.374 C A 0040 HIS ND1
C A 0060 GLU OE1 9.728 C A 0040 HIS NE2
C A 0060 GLU OE2 9.161 C A 0040 HIS ND1
C A 0060 GLU OE2 9.988 C A 0040 HIS NE2
C A 0060 GLU OE1 10.05 H A 0045 ARG NH1
C A 0060 GLU OE1 9.775 H A 0045 ARG NH2
C A 0060 GLU OE2 8.069 H A 0045 ARG NH1
C A 0060 GLU OE2 7.683 H A 0045 ARG NH2
C A 0060 GLU OE1 8.287 C A 0063 HIS ND1
C A 0060 GLU OE1 10.05 C A 0063 HIS NE2
C A 0060 GLU OE2 10.40 C A 0063 HIS ND1
C A 0065 GLU OE1 11.63 C A 0063 HIS ND1
C A 0065 GLU OE1 10.07 C A 0063 HIS NE2
C A 0065 GLU OE2 10.95 C A 0063 HIS NE2
C A 0074 ASP OD1 3.845 C A 0071 HIS ND1
C A 0074 ASP OD1 5.638 C A 0071 HIS NE2
C A 0074 ASP OD2 2.926 C A 0071 HIS ND1
C A 0074 ASP OD2 4.114 C A 0071 HIS NE2
C A 0082 GLU OE1 11.35 C A 0071 HIS ND1
C A 0082 GLU OE2 10.84 C A 0071 HIS ND1
CHARGE_REPU 2.00 12.00 52
C A 0010 GLU OE1 10.37 C A 0022 GLU OE1
C A 0015 ASP OD1 5.258 C A 0016 GLU OE1
C A 0015 ASP OD1 5.623 C A 0016 GLU OE2
C A 0015 ASP OD2 6.582 C A 0016 GLU OE1
C A 0015 ASP OD2 6.458 C A 0016 GLU OE2
C A 0015 ASP OD1 10.84 C A 0022 GLU OE1
C A 0015 ASP OD1 11.60 C A 0022 GLU OE2
C A 0015 ASP OD2 9.970 C A 0022 GLU OE1
C A 0015 ASP OD2 10.52 C A 0022 GLU OE2
C A 0016 GLU OE1 11.90 C A 0022 GLU OE1
C A 0019 ASP OD1 8.601 C A 0022 GLU OE1
C A 0019 ASP OD1 6.593 C A 0022 GLU OE2
C A 0019 ASP OD2 9.222 C A 0022 GLU OE1
C A 0019 ASP OD2 7.198 C A 0022 GLU OE2
C A 0019 ASP OD1 10.69 H A 0041 ASP OD1
C A 0019 ASP OD2 11.99 H A 0041 ASP OD1
C A 0027 GLU OE1 11.76 H A 0041 ASP OD1
C A 0027 GLU OE2 10.19 H A 0041 ASP OD1
C A 0027 GLU OE2 11.43 H A 0041 ASP OD2
C A 0027 GLU OE1 8.376 C A 0060 GLU OE1
C A 0027 GLU OE1 9.445 C A 0060 GLU OE2
C A 0027 GLU OE2 6.333 C A 0060 GLU OE1
C A 0027 GLU OE2 7.634 C A 0060 GLU OE2
C A 0033 ARG NH1 10.74 C A 0040 HIS NE2
C A 0033 ARG NH2 10.89 C A 0040 HIS NE2
C A 0033 ARG NH1 9.319 C A 0063 HIS ND1
C A 0033 ARG NH1 10.30 C A 0063 HIS NE2
C A 0033 ARG NH2 7.215 C A 0063 HIS ND1
C A 0033 ARG NH2 8.215 C A 0063 HIS NE2
C A 0040 HIS ND1 11.89 H A 0045 ARG NH1
C A 0040 HIS ND1 10.58 H A 0045 ARG NH2
C A 0040 HIS ND1 8.890 H A 0046 ARG NH1
C A 0040 HIS ND1 10.87 H A 0046 ARG NH2
C A 0040 HIS NE2 10.82 H A 0046 ARG NH1
H A 0041 ASP OD1 5.390 C A 0060 GLU OE1
H A 0041 ASP OD1 4.483 C A 0060 GLU OE2
H A 0041 ASP OD2 5.726 C A 0060 GLU OE1
H A 0041 ASP OD2 4.585 C A 0060 GLU OE2
H A 0045 ARG NH1 10.73 H A 0046 ARG NH1
H A 0045 ARG NH2 9.182 H A 0046 ARG NH1
H A 0045 ARG NH2 10.50 H A 0046 ARG NH2
C A 0053 ASP OD1 10.24 C A 0057 GLU OE1
C A 0053 ASP OD1 11.97 C A 0057 GLU OE2
C A 0053 ASP OD2 11.44 C A 0057 GLU OE1
C A 0074 ASP OD1 8.772 C A 0082 GLU OE1
C A 0074 ASP OD1 7.771 C A 0082 GLU OE2
C A 0074 ASP OD2 9.901 C A 0082 GLU OE1
C A 0074 ASP OD2 9.252 C A 0082 GLU OE2
C A 0082 GLU OE1 8.372 C A 0083 GLU OE1
C A 0082 GLU OE1 9.819 C A 0083 GLU OE2
C A 0082 GLU OE2 10.35 C A 0083 GLU OE1
C A 0082 GLU OE2 11.74 C A 0083 GLU OE2
HB_MM 2.00 3.20 116
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 PRO N 2.253 C A 0007 GLY O
C A 0009 ARG N 2.986 C A 0007 GLY O
C A 0009 ARG N 2.251 C A 0008 PRO O
C A 0010 GLU N 2.250 C A 0009 ARG O
C A 0011 PRO N 2.253 C A 0010 GLU O
C A 0012 VAL N 2.251 C A 0011 PRO O
C A 0013 VAL N 2.251 C A 0012 VAL O
C A 0014 ASN N 2.249 C A 0013 VAL O
C A 0015 ASP N 2.250 C A 0014 ASN O
C A 0016 GLU N 3.072 C A 0014 ASN O
C A 0016 GLU N 2.251 C A 0015 ASP O
C A 0017 MET N 3.181 C A 0015 ASP O
C A 0017 MET N 2.250 C A 0016 GLU O
C A 0018 CYS N 2.250 C A 0017 MET O
C A 0019 ASP N 2.250 C A 0018 CYS O
C A 0020 VAL N 2.251 C A 0019 ASP O
C A 0021 CYS N 2.250 C A 0020 VAL O
C A 0022 GLU N 2.577 C A 0018 CYS O
C A 0022 GLU N 2.251 C A 0021 CYS O
C A 0023 VAL N 2.251 C A 0022 GLU O
C A 0024 TRP N 2.250 C A 0023 VAL O
C A 0025 THR N 2.251 C A 0024 TRP O
C A 0026 ALA N 2.250 C A 0025 THR O
C A 0027 GLU N 3.121 C A 0025 THR O
C A 0027 GLU N 2.251 C A 0026 ALA O
C A 0028 SER N 2.251 C A 0027 GLU O
C A 0029 LEU N 2.250 C A 0028 SER O
C A 0030 PHE N 2.250 C A 0029 LEU O
C A 0031 PRO N 2.254 C A 0030 PHE O
C A 0032 CYS N 2.251 C A 0031 PRO O
C A 0033 ARG N 2.249 C A 0032 CYS O
C A 0034 VAL N 2.250 C A 0033 ARG O
C A 0035 CYS N 2.249 C A 0034 VAL O
C A 0036 THR N 2.542 C A 0034 VAL O
C A 0036 THR N 2.250 C A 0035 CYS O
C A 0037 ARG N 2.878 C A 0035 CYS O
C A 0037 ARG N 2.250 C A 0036 THR O
C A 0038 VAL N 2.909 C A 0036 THR O
C A 0038 VAL N 2.251 C A 0037 ARG O
C A 0039 PHE N 2.984 C A 0030 PHE O
C A 0039 PHE N 2.250 C A 0038 VAL O
C A 0040 HIS N 2.250 C A 0039 PHE O
H A 0041 ASP N 2.250 C A 0040 HIS O
H A 0042 GLY N 3.006 C A 0040 HIS O
H A 0042 GLY N 2.250 H A 0041 ASP O
H A 0043 CYS N 2.793 C A 0040 HIS O
H A 0043 CYS N 2.250 H A 0042 GLY O
H A 0044 LEU N 3.071 H A 0042 GLY O
H A 0044 LEU N 2.251 H A 0043 CYS O
H A 0045 ARG N 2.251 H A 0044 LEU O
H A 0046 ARG N 2.806 H A 0042 GLY O
H A 0046 ARG N 2.250 H A 0045 ARG O
H A 0047 MET N 2.249 H A 0046 ARG O
C A 0048 GLY N 2.938 H A 0044 LEU O
C A 0048 GLY N 3.051 H A 0046 ARG O
C A 0048 GLY N 2.250 H A 0047 MET O
C A 0049 TYR N 2.769 H A 0044 LEU O
C A 0049 TYR N 2.250 C A 0048 GLY O
C A 0050 ILE N 2.250 C A 0049 TYR O
C A 0051 GLN N 2.251 C A 0050 ILE O
C A 0052 GLY N 2.776 C A 0050 ILE O
C A 0052 GLY N 2.250 C A 0051 GLN O
C A 0053 ASP N 2.250 C A 0052 GLY O
C A 0054 SER N 2.823 C A 0052 GLY O
C A 0054 SER N 2.250 C A 0053 ASP O
C A 0055 ALA N 2.250 C A 0054 SER O
C A 0056 ALA N 2.971 C A 0054 SER O
C A 0056 ALA N 2.251 C A 0055 ALA O
C A 0057 GLU N 2.250 C A 0056 ALA O
C A 0058 VAL N 2.251 C A 0057 GLU O
C A 0059 THR N 2.251 C A 0058 VAL O
C A 0060 GLU N 2.250 C A 0059 THR O
C A 0061 MET N 2.250 C A 0060 GLU O
C A 0062 ALA N 2.250 C A 0061 MET O
C A 0063 HIS N 2.250 C A 0062 ALA O
C A 0064 THR N 2.951 C A 0062 ALA O
C A 0064 THR N 2.251 C A 0063 HIS O
C A 0065 GLU N 2.251 C A 0064 THR O
C A 0066 THR N 2.250 C A 0065 GLU O
C A 0067 GLY N 2.251 C A 0066 THR O
C A 0068 TRP N 2.250 C A 0067 GLY O
C A 0069 SER N 2.251 C A 0068 TRP O
C A 0070 CYS N 2.250 C A 0069 SER O
C A 0071 HIS N 2.251 C A 0070 CYS O
C A 0072 TYR N 2.250 C A 0071 HIS O
C A 0073 CYS N 3.167 C A 0071 HIS O
C A 0073 CYS N 2.249 C A 0072 TYR O
C A 0074 ASP N 2.936 C A 0070 CYS O
C A 0074 ASP N 3.025 C A 0071 HIS O
C A 0074 ASP N 2.250 C A 0073 CYS O
C A 0075 ASN N 2.937 C A 0073 CYS O
C A 0075 ASN N 2.250 C A 0074 ASP O
C A 0076 ILE N 2.252 C A 0075 ASN O
C A 0077 ASN N 2.250 C A 0076 ILE O
C A 0078 LEU N 2.250 C A 0077 ASN O
C A 0079 LEU N 2.251 C A 0078 LEU O
C A 0080 LEU N 2.249 C A 0079 LEU O
C A 0081 THR N 2.250 C A 0080 LEU O
C A 0082 GLU N 3.126 C A 0080 LEU O
C A 0082 GLU N 2.250 C A 0081 THR O
C A 0083 GLU N 2.251 C A 0082 GLU O
C A 0084 SER N 2.834 C A 0082 GLU O
C A 0084 SER N 2.251 C A 0083 GLU O
C A 0085 GLY N 2.251 C A 0084 SER O
C A 0086 PRO N 2.253 C A 0085 GLY O
C A 0087 SER N 2.252 C A 0086 PRO O
C A 0088 SER N 3.021 C A 0086 PRO O
C A 0088 SER N 2.251 C A 0087 SER O
C A 0089 GLY N 2.952 C A 0087 SER O
C A 0089 GLY N 2.249 C A 0088 SER O
HB_MS 2.00 3.20 8
C A 0004 GLY N 2.987 C A 0003 SER OG
C A 0004 GLY O 2.730 C A 0005 SER OG
C A 0020 VAL N 3.127 C A 0019 ASP OD1
C A 0024 TRP O 2.701 C A 0025 THR OG1
C A 0026 ALA O 3.026 C A 0033 ARG NH2
C A 0027 GLU O 2.896 C A 0033 ARG NH2
H A 0042 GLY N 2.649 H A 0041 ASP OD1
C A 0078 LEU N 3.110 C A 0077 ASN OD1
AROMATIC 0.00 8.00 4
C A 0037 ARG 7.445 C A 0072 TYR
C A 0033 ARG 7.964 C A 0063 HIS
C A 0033 ARG 5.355 C A 0024 TRP
C A 0037 ARG 7.537 C A 0039 PHE