Complet list of 1bv2 con file
Complete list of 1bv2.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 372
C A 0001 ILE C 2.428 C A 0002 THR CA
C A 0001 ILE C 3.554 C A 0002 THR C
C A 0001 ILE C 3.351 C A 0002 THR CB
C A 0001 ILE CD1 3.611 H A 0006 VAL CG2
C A 0001 ILE CD1 3.790 H A 0037 ALA CB
C A 0001 ILE CG2 3.556 H A 0043 ASP CA
C A 0001 ILE CG2 3.510 H A 0043 ASP CB
C A 0002 THR C 2.433 H A 0003 CYS CA
C A 0002 THR C 2.897 H A 0003 CYS C
C A 0002 THR C 3.698 H A 0003 CYS CB
H A 0003 CYS C 2.446 H A 0004 GLY CA
H A 0003 CYS C 2.871 H A 0004 GLY C
H A 0003 CYS C 3.594 H A 0007 ASN CG
H A 0003 CYS CA 3.716 H A 0050 CYS CB
H A 0003 CYS CB 3.596 H A 0050 CYS CB
H A 0004 GLY C 2.448 H A 0005 GLN CA
H A 0004 GLY C 2.930 H A 0005 GLN C
H A 0004 GLY C 3.734 H A 0005 GLN CB
H A 0005 GLN C 2.441 H A 0006 VAL CA
H A 0005 GLN C 3.013 H A 0006 VAL C
H A 0005 GLN C 3.710 H A 0006 VAL CB
H A 0006 VAL C 2.458 H A 0007 ASN CA
H A 0006 VAL C 2.883 H A 0007 ASN C
H A 0006 VAL C 3.712 H A 0007 ASN CB
H A 0006 VAL CG1 3.592 H A 0051 LEU CD2
H A 0007 ASN CA 3.795 H A 0008 SER CA
H A 0007 ASN C 2.414 H A 0008 SER CA
H A 0007 ASN C 2.980 H A 0008 SER C
H A 0007 ASN C 3.692 H A 0008 SER CB
H A 0008 SER C 2.470 H A 0009 ALA CA
H A 0008 SER C 3.028 H A 0009 ALA C
H A 0008 SER C 3.676 H A 0009 ALA CB
H A 0009 ALA C 2.431 H A 0010 VAL CA
H A 0009 ALA C 3.233 H A 0010 VAL C
H A 0009 ALA C 3.703 H A 0010 VAL CB
H A 0009 ALA CB 3.464 H A 0034 LEU CD1
H A 0010 VAL C 2.473 H A 0011 GLY CA
H A 0010 VAL C 2.975 H A 0011 GLY C
H A 0010 VAL C 3.280 H A 0012 PRO CD
H A 0010 VAL CG2 3.737 H A 0014 LEU CG
H A 0010 VAL CG2 3.638 H A 0014 LEU CD1
H A 0011 GLY CA 2.876 H A 0012 PRO CD
H A 0011 GLY C 2.475 H A 0012 PRO CA
H A 0011 GLY C 3.007 H A 0012 PRO C
H A 0011 GLY C 3.647 H A 0012 PRO CB
H A 0011 GLY C 3.610 H A 0012 PRO CG
H A 0011 GLY C 2.504 H A 0012 PRO CD
H A 0012 PRO C 2.436 H A 0013 CYS CA
H A 0012 PRO C 3.127 H A 0013 CYS C
H A 0012 PRO C 3.614 H A 0013 CYS CB
H A 0012 PRO CB 3.782 H A 0027 CYS CA
H A 0013 CYS C 2.463 H A 0014 LEU CA
H A 0013 CYS C 2.976 H A 0014 LEU C
H A 0013 CYS C 3.740 H A 0014 LEU CB
H A 0013 CYS CA 3.796 H A 0027 CYS CB
H A 0013 CYS CA 3.689 H A 0069 ILE CD1
H A 0013 CYS CB 3.629 H A 0069 ILE CD1
H A 0013 CYS CB 3.799 C A 0081 ILE CD1
H A 0014 LEU C 2.437 H A 0015 THR CA
H A 0014 LEU C 2.840 H A 0015 THR C
H A 0014 LEU C 3.660 H A 0015 THR CB
H A 0014 LEU CA 3.743 H A 0017 ALA CB
H A 0015 THR C 2.430 H A 0016 TYR CA
H A 0015 THR C 2.944 H A 0016 TYR C
H A 0015 THR C 3.697 H A 0016 TYR CB
H A 0016 TYR C 2.467 H A 0017 ALA CA
H A 0016 TYR C 2.966 H A 0017 ALA C
H A 0016 TYR C 3.676 H A 0017 ALA CB
H A 0016 TYR CD1 3.640 C A 0021 ALA C
H A 0016 TYR CG 3.641 C A 0022 GLY C
H A 0016 TYR CD1 3.681 C A 0022 GLY CA
H A 0016 TYR CD1 3.334 C A 0022 GLY C
H A 0016 TYR CE1 3.655 C A 0022 GLY C
H A 0016 TYR CE1 3.609 C A 0065 ASN CG
H A 0016 TYR CE2 3.748 C A 0065 ASN CG
H A 0016 TYR CZ 3.388 C A 0065 ASN CG
H A 0016 TYR CD2 3.677 H A 0069 ILE CG1
H A 0016 TYR CD2 3.330 H A 0069 ILE CD1
H A 0017 ALA CA 3.793 H A 0018 ARG CA
H A 0017 ALA C 2.437 H A 0018 ARG CA
H A 0017 ALA C 3.083 H A 0018 ARG C
H A 0017 ALA C 3.666 H A 0018 ARG CB
H A 0017 ALA CA 3.534 H A 0066 ALA CA
H A 0017 ALA CB 3.681 H A 0066 ALA CA
H A 0018 ARG C 2.406 C A 0019 GLY CA
H A 0018 ARG C 3.652 C A 0019 GLY C
H A 0018 ARG CA 3.569 C A 0060 GLY C
H A 0018 ARG CB 3.469 C A 0060 GLY C
H A 0018 ARG CG 3.659 C A 0060 GLY C
H A 0018 ARG CA 3.708 C A 0061 LEU CA
C A 0019 GLY CA 3.769 C A 0020 GLY CA
C A 0019 GLY C 2.446 C A 0020 GLY CA
C A 0019 GLY C 3.424 C A 0020 GLY C
C A 0020 GLY C 2.420 C A 0021 ALA CA
C A 0020 GLY C 3.146 C A 0021 ALA C
C A 0020 GLY C 3.608 C A 0021 ALA CB
C A 0021 ALA C 2.433 C A 0022 GLY CA
C A 0021 ALA C 3.598 C A 0022 GLY C
C A 0022 GLY CA 2.857 C A 0023 PRO CA
C A 0022 GLY CA 3.125 C A 0023 PRO C
C A 0022 GLY C 2.486 C A 0023 PRO CA
C A 0022 GLY C 3.162 C A 0023 PRO C
C A 0022 GLY C 3.658 C A 0023 PRO CB
C A 0022 GLY C 3.529 C A 0023 PRO CG
C A 0022 GLY C 2.475 C A 0023 PRO CD
C A 0023 PRO CA 3.791 C A 0024 SER CA
C A 0023 PRO C 2.429 C A 0024 SER CA
C A 0023 PRO C 3.443 C A 0024 SER C
C A 0023 PRO C 3.474 C A 0024 SER CB
C A 0023 PRO CG 3.225 H A 0072 LYS CB
C A 0023 PRO CD 3.236 H A 0072 LYS CB
C A 0023 PRO CD 3.682 H A 0072 LYS CG
C A 0024 SER CA 3.790 H A 0025 ALA CA
C A 0024 SER C 2.439 H A 0025 ALA CA
C A 0024 SER C 2.858 H A 0025 ALA C
C A 0024 SER C 3.682 H A 0025 ALA CB
H A 0025 ALA C 2.455 H A 0026 ALA CA
H A 0025 ALA C 3.063 H A 0026 ALA C
H A 0025 ALA C 3.686 H A 0026 ALA CB
H A 0026 ALA C 2.429 H A 0027 CYS CA
H A 0026 ALA C 2.956 H A 0027 CYS C
H A 0026 ALA C 3.738 H A 0027 CYS CB
H A 0027 CYS C 2.427 H A 0028 CYS CA
H A 0027 CYS C 2.892 H A 0028 CYS C
H A 0027 CYS C 3.674 H A 0028 CYS CB
H A 0028 CYS C 2.463 H A 0029 SER CA
H A 0028 CYS C 2.887 H A 0029 SER C
H A 0028 CYS C 3.703 H A 0029 SER CB
H A 0029 SER C 2.439 H A 0030 GLY CA
H A 0029 SER C 3.006 H A 0030 GLY C
H A 0029 SER C 3.766 H A 0032 ARG CB
H A 0030 GLY C 2.448 H A 0031 VAL CA
H A 0030 GLY C 2.869 H A 0031 VAL C
H A 0030 GLY C 3.713 H A 0031 VAL CB
H A 0030 GLY C 3.649 H A 0034 LEU CD1
H A 0031 VAL C 2.447 H A 0032 ARG CA
H A 0031 VAL C 2.869 H A 0032 ARG C
H A 0031 VAL C 3.661 H A 0032 ARG CB
H A 0031 VAL CB 3.778 C A 0075 VAL CG2
H A 0031 VAL CG1 3.582 C A 0075 VAL CB
H A 0031 VAL CG1 3.412 C A 0075 VAL CG2
H A 0031 VAL CG1 3.632 C A 0077 VAL CG1
H A 0032 ARG C 2.449 H A 0033 SER CA
H A 0032 ARG C 2.863 H A 0033 SER C
H A 0032 ARG C 3.720 H A 0033 SER CB
H A 0032 ARG CG 3.758 C A 0075 VAL CG1
H A 0033 SER C 2.441 H A 0034 LEU CA
H A 0033 SER C 2.894 H A 0034 LEU C
H A 0033 SER C 3.760 H A 0034 LEU CB
H A 0034 LEU C 2.466 H A 0035 LYS CA
H A 0034 LEU C 2.949 H A 0035 LYS C
H A 0034 LEU C 3.736 H A 0035 LYS CB
H A 0035 LYS C 2.462 H A 0036 ALA CA
H A 0035 LYS C 3.199 H A 0036 ALA C
H A 0035 LYS C 3.663 H A 0036 ALA CB
H A 0036 ALA C 2.471 H A 0037 ALA CA
H A 0036 ALA C 3.003 H A 0037 ALA C
H A 0036 ALA C 3.693 H A 0037 ALA CB
H A 0037 ALA CA 3.796 C A 0038 ALA CA
H A 0037 ALA C 2.413 C A 0038 ALA CA
H A 0037 ALA C 3.124 C A 0038 ALA C
H A 0037 ALA C 3.627 C A 0038 ALA CB
C A 0038 ALA C 2.436 C A 0039 SER CA
C A 0038 ALA C 3.535 C A 0039 SER C
C A 0038 ALA C 3.442 C A 0039 SER CB
C A 0038 ALA CA 3.328 H A 0043 ASP CB
C A 0038 ALA CA 3.780 H A 0043 ASP CG
C A 0038 ALA CB 3.378 H A 0043 ASP CB
C A 0039 SER C 2.433 C A 0040 THR CA
C A 0039 SER C 3.445 C A 0040 THR C
C A 0039 SER C 3.522 C A 0040 THR CB
C A 0040 THR C 2.464 H A 0041 THR CA
C A 0040 THR C 2.902 H A 0041 THR C
C A 0040 THR C 3.718 H A 0041 THR CB
H A 0041 THR CA 3.793 H A 0042 ALA CA
H A 0041 THR C 2.435 H A 0042 ALA CA
H A 0041 THR C 2.944 H A 0042 ALA C
H A 0041 THR C 3.667 H A 0042 ALA CB
H A 0042 ALA C 2.439 H A 0043 ASP CA
H A 0042 ALA C 2.936 H A 0043 ASP C
H A 0042 ALA C 3.740 H A 0043 ASP CB
H A 0043 ASP C 2.442 H A 0044 ARG CA
H A 0043 ASP C 2.922 H A 0044 ARG C
H A 0043 ASP C 3.692 H A 0044 ARG CB
H A 0044 ARG C 2.439 H A 0045 ARG CA
H A 0044 ARG C 2.945 H A 0045 ARG C
H A 0044 ARG C 3.709 H A 0045 ARG CB
H A 0044 ARG CG 3.784 C A 0079 TYR CE2
H A 0044 ARG CG 3.547 C A 0090 VAL CG1
H A 0044 ARG CD 3.394 C A 0090 VAL CG1
H A 0045 ARG C 2.454 H A 0046 THR CA
H A 0045 ARG C 2.866 H A 0046 THR C
H A 0045 ARG C 3.721 H A 0046 THR CB
H A 0046 THR C 2.440 H A 0047 ALA CA
H A 0046 THR C 2.913 H A 0047 ALA C
H A 0046 THR C 3.678 H A 0047 ALA CB
H A 0047 ALA C 2.457 H A 0048 CYS CA
H A 0047 ALA C 2.907 H A 0048 CYS C
H A 0047 ALA C 3.724 H A 0048 CYS CB
H A 0047 ALA CB 3.723 C A 0079 TYR CZ
H A 0048 CYS C 2.444 H A 0049 ASN CA
H A 0048 CYS C 2.986 H A 0049 ASN C
H A 0048 CYS C 3.695 H A 0049 ASN CB
H A 0048 CYS CA 3.714 C A 0079 TYR CG
H A 0048 CYS CA 3.372 C A 0079 TYR CD2
H A 0048 CYS CA 3.528 C A 0079 TYR CE2
H A 0048 CYS CB 3.120 C A 0079 TYR CD2
H A 0048 CYS CB 3.310 C A 0079 TYR CE2
H A 0049 ASN C 2.451 H A 0050 CYS CA
H A 0049 ASN C 2.895 H A 0050 CYS C
H A 0049 ASN C 3.686 H A 0050 CYS CB
H A 0050 CYS C 2.448 H A 0051 LEU CA
H A 0050 CYS C 2.945 H A 0051 LEU C
H A 0050 CYS C 3.723 H A 0051 LEU CB
H A 0051 LEU C 2.449 H A 0052 LYS CA
H A 0051 LEU C 2.895 H A 0052 LYS C
H A 0051 LEU C 3.713 H A 0052 LYS CB
H A 0051 LEU CD1 3.236 C A 0079 TYR CD1
H A 0051 LEU CD1 3.713 C A 0079 TYR CE1
H A 0052 LYS C 2.455 H A 0053 ASN CA
H A 0052 LYS C 3.007 H A 0053 ASN C
H A 0052 LYS C 3.710 H A 0053 ASN CB
H A 0052 LYS CE 3.542 C A 0084 SER C
H A 0052 LYS CE 3.358 C A 0085 ILE C
H A 0053 ASN C 2.453 H A 0054 ALA CA
H A 0053 ASN C 2.969 H A 0054 ALA C
H A 0053 ASN C 3.675 H A 0054 ALA CB
H A 0053 ASN CA 3.565 C A 0056 ARG CD
H A 0054 ALA C 2.457 C A 0055 ALA CA
H A 0054 ALA C 3.211 C A 0055 ALA C
H A 0054 ALA C 3.652 C A 0055 ALA CB
C A 0055 ALA C 2.462 C A 0056 ARG CA
C A 0055 ALA C 3.409 C A 0056 ARG C
C A 0055 ALA C 3.610 C A 0056 ARG CB
C A 0055 ALA CB 3.749 C A 0082 SER C
C A 0056 ARG C 2.441 C A 0057 GLY CA
C A 0056 ARG C 3.488 C A 0057 GLY C
C A 0057 GLY C 2.443 C A 0058 ILE CA
C A 0057 GLY C 3.483 C A 0058 ILE C
C A 0057 GLY C 3.477 C A 0058 ILE CB
C A 0057 GLY C 3.417 C A 0058 ILE CG1
C A 0058 ILE C 2.445 C A 0059 LYS CA
C A 0058 ILE C 3.303 C A 0059 LYS C
C A 0058 ILE C 3.616 C A 0059 LYS CB
C A 0058 ILE C 3.792 C A 0059 LYS CG
C A 0059 LYS C 2.466 C A 0060 GLY CA
C A 0059 LYS C 3.567 C A 0060 GLY C
C A 0060 GLY C 2.486 C A 0061 LEU CA
C A 0060 GLY C 2.969 C A 0061 LEU C
C A 0060 GLY C 3.689 C A 0061 LEU CB
C A 0061 LEU C 2.439 C A 0062 ASN CA
C A 0061 LEU C 3.430 C A 0062 ASN C
C A 0061 LEU C 3.535 C A 0062 ASN CB
C A 0061 LEU CD1 3.566 H A 0066 ALA CB
C A 0062 ASN C 2.450 C A 0063 ALA CA
C A 0062 ASN C 3.245 C A 0063 ALA C
C A 0062 ASN C 3.632 C A 0063 ALA CB
C A 0062 ASN CB 3.250 C A 0065 ASN CB
C A 0062 ASN CG 3.344 C A 0065 ASN CB
C A 0063 ALA C 2.446 C A 0064 GLY CA
C A 0063 ALA C 3.547 C A 0064 GLY C
C A 0064 GLY C 2.438 C A 0065 ASN CA
C A 0064 GLY C 3.467 C A 0065 ASN C
C A 0064 GLY C 3.416 C A 0065 ASN CB
C A 0065 ASN C 2.448 H A 0066 ALA CA
C A 0065 ASN C 2.907 H A 0066 ALA C
C A 0065 ASN C 3.687 H A 0066 ALA CB
C A 0065 ASN CA 3.594 H A 0068 SER CB
C A 0065 ASN C 3.604 H A 0068 SER CB
H A 0066 ALA C 2.452 H A 0067 ALA CA
H A 0066 ALA C 3.261 H A 0067 ALA C
H A 0066 ALA C 3.612 H A 0067 ALA CB
H A 0067 ALA C 2.448 H A 0068 SER CA
H A 0067 ALA C 3.449 H A 0068 SER C
H A 0067 ALA C 3.535 H A 0068 SER CB
H A 0068 SER C 2.451 H A 0069 ILE CA
H A 0068 SER C 2.904 H A 0069 ILE C
H A 0068 SER C 3.709 H A 0069 ILE CB
H A 0068 SER C 3.434 H A 0070 PRO CD
H A 0068 SER CA 3.708 H A 0071 SER CB
H A 0068 SER C 3.781 H A 0071 SER CB
H A 0069 ILE CA 2.983 H A 0070 PRO CD
H A 0069 ILE C 2.473 H A 0070 PRO CA
H A 0069 ILE C 3.052 H A 0070 PRO C
H A 0069 ILE C 3.661 H A 0070 PRO CB
H A 0069 ILE C 3.597 H A 0070 PRO CG
H A 0069 ILE C 2.512 H A 0070 PRO CD
H A 0069 ILE CB 3.163 H A 0070 PRO CD
H A 0069 ILE CG2 3.572 H A 0070 PRO CD
H A 0070 PRO C 2.463 H A 0071 SER CA
H A 0070 PRO C 3.009 H A 0071 SER C
H A 0070 PRO C 3.725 H A 0071 SER CB
H A 0071 SER C 2.445 H A 0072 LYS CA
H A 0071 SER C 3.344 H A 0072 LYS C
H A 0071 SER C 3.602 H A 0072 LYS CB
H A 0072 LYS C 2.418 H A 0073 CYS CA
H A 0072 LYS C 3.196 H A 0073 CYS C
H A 0072 LYS C 3.675 H A 0073 CYS CB
H A 0073 CYS C 2.432 C A 0074 GLY CA
H A 0073 CYS C 3.256 C A 0074 GLY C
C A 0074 GLY CA 3.790 C A 0075 VAL CA
C A 0074 GLY C 2.415 C A 0075 VAL CA
C A 0074 GLY C 3.297 C A 0075 VAL C
C A 0074 GLY C 3.550 C A 0075 VAL CB
C A 0074 GLY C 3.574 C A 0075 VAL CG2
C A 0075 VAL C 2.530 C A 0076 SER CA
C A 0075 VAL C 3.564 C A 0076 SER C
C A 0075 VAL C 2.957 C A 0076 SER CB
C A 0076 SER C 2.445 C A 0077 VAL CA
C A 0076 SER C 3.483 C A 0077 VAL C
C A 0076 SER C 3.511 C A 0077 VAL CB
C A 0076 SER C 3.613 C A 0077 VAL CG1
C A 0077 VAL CA 2.902 C A 0078 PRO CD
C A 0077 VAL C 2.473 C A 0078 PRO CA
C A 0077 VAL C 3.204 C A 0078 PRO C
C A 0077 VAL C 3.620 C A 0078 PRO CB
C A 0077 VAL C 3.640 C A 0078 PRO CG
C A 0077 VAL C 2.494 C A 0078 PRO CD
C A 0077 VAL CB 3.570 C A 0078 PRO CD
C A 0078 PRO C 2.468 C A 0079 TYR CA
C A 0078 PRO C 3.466 C A 0079 TYR C
C A 0078 PRO C 3.542 C A 0079 TYR CB
C A 0078 PRO CG 3.363 C A 0079 TYR CD2
C A 0078 PRO CG 3.295 C A 0079 TYR CE2
C A 0078 PRO CG 3.679 C A 0079 TYR CZ
C A 0079 TYR C 2.431 C A 0080 THR CA
C A 0079 TYR C 3.741 C A 0080 THR C
C A 0079 TYR C 3.138 C A 0080 THR CB
C A 0079 TYR C 3.702 C A 0080 THR CG2
C A 0079 TYR CB 3.601 C A 0085 ILE CG1
C A 0079 TYR CB 3.700 C A 0085 ILE CD1
C A 0080 THR C 2.486 C A 0081 ILE CA
C A 0080 THR C 2.869 C A 0081 ILE C
C A 0080 THR C 3.282 C A 0081 ILE CB
C A 0081 ILE C 2.422 C A 0082 SER CA
C A 0081 ILE C 3.499 C A 0082 SER C
C A 0081 ILE C 3.442 C A 0082 SER CB
C A 0082 SER CA 3.796 C A 0083 ALA CA
C A 0082 SER C 2.456 C A 0083 ALA CA
C A 0082 SER C 3.353 C A 0083 ALA C
C A 0082 SER C 3.571 C A 0083 ALA CB
C A 0082 SER C 3.688 C A 0085 ILE CG2
C A 0082 SER CB 3.723 C A 0085 ILE CB
C A 0082 SER CB 3.473 C A 0085 ILE CG2
C A 0083 ALA C 2.439 C A 0084 SER CA
C A 0083 ALA C 3.352 C A 0084 SER C
C A 0083 ALA C 3.582 C A 0084 SER CB
C A 0084 SER C 2.486 C A 0085 ILE CA
C A 0084 SER C 2.971 C A 0085 ILE C
C A 0084 SER C 3.650 C A 0085 ILE CB
C A 0085 ILE C 2.437 C A 0086 ASP CA
C A 0085 ILE C 3.276 C A 0086 ASP C
C A 0085 ILE C 3.649 C A 0086 ASP CB
C A 0086 ASP C 2.477 C A 0087 CYS CA
C A 0086 ASP C 2.932 C A 0087 CYS C
C A 0086 ASP C 3.247 C A 0087 CYS CB
C A 0087 CYS C 2.513 C A 0088 SER CA
C A 0087 CYS C 2.998 C A 0088 SER C
C A 0087 CYS C 3.203 C A 0088 SER CB
C A 0088 SER CA 3.775 C A 0089 ARG CA
C A 0088 SER C 2.470 C A 0089 ARG CA
C A 0088 SER C 3.598 C A 0089 ARG C
C A 0088 SER C 3.319 C A 0089 ARG CB
C A 0088 SER C 3.433 C A 0089 ARG CG
C A 0089 ARG C 2.446 C A 0090 VAL CA
C A 0089 ARG C 3.484 C A 0090 VAL C
C A 0089 ARG C 3.473 C A 0090 VAL CB
C A 0089 ARG C 3.464 C A 0090 VAL CG2
C A 0090 VAL CA 3.799 C A 0091 SER CA
C A 0090 VAL C 2.420 C A 0091 SER CA
C A 0090 VAL C 3.286 C A 0091 SER C
C A 0090 VAL C 3.546 C A 0091 SER CB
CHARGE_ATTR 2.00 12.00 17
H A 0043 ASP OD1 8.611 H A 0044 ARG NH1
H A 0043 ASP OD1 10.89 H A 0044 ARG NH2
H A 0043 ASP OD2 7.108 H A 0044 ARG NH1
H A 0043 ASP OD2 9.365 H A 0044 ARG NH2
H A 0043 ASP OD1 11.42 H A 0045 ARG NH2
H A 0043 ASP OD2 11.56 H A 0045 ARG NH1
H A 0043 ASP OD2 10.57 H A 0045 ARG NH2
C A 0086 ASP OD1 2.895 H A 0052 LYS NZ
C A 0086 ASP OD2 4.009 H A 0052 LYS NZ
C A 0086 ASP OD1 7.465 C A 0056 ARG NH1
C A 0086 ASP OD1 5.565 C A 0056 ARG NH2
C A 0086 ASP OD2 9.580 C A 0056 ARG NH1
C A 0086 ASP OD2 7.570 C A 0056 ARG NH2
C A 0086 ASP OD1 9.182 C A 0089 ARG NH1
C A 0086 ASP OD1 10.16 C A 0089 ARG NH2
C A 0086 ASP OD2 7.817 C A 0089 ARG NH1
C A 0086 ASP OD2 9.185 C A 0089 ARG NH2
CHARGE_REPU 2.00 12.00 12
H A 0032 ARG NH1 10.11 H A 0035 LYS NZ
H A 0032 ARG NH2 8.615 H A 0035 LYS NZ
H A 0035 LYS NZ 10.14 H A 0044 ARG NH1
H A 0035 LYS NZ 10.24 H A 0044 ARG NH2
H A 0044 ARG NH1 8.739 H A 0045 ARG NH1
H A 0044 ARG NH1 6.784 H A 0045 ARG NH2
H A 0044 ARG NH2 8.997 H A 0045 ARG NH1
H A 0044 ARG NH2 6.852 H A 0045 ARG NH2
H A 0052 LYS NZ 7.207 C A 0056 ARG NH1
H A 0052 LYS NZ 5.416 C A 0056 ARG NH2
H A 0052 LYS NZ 9.911 C A 0089 ARG NH1
H A 0052 LYS NZ 10.86 C A 0089 ARG NH2
HB_MM 2.00 3.20 181
C A 0002 THR N 2.228 C A 0001 ILE O
H A 0003 CYS N 2.230 C A 0002 THR O
H A 0004 GLY N 2.222 H A 0003 CYS O
H A 0005 GLN N 3.046 C A 0002 THR O
H A 0005 GLN N 2.991 H A 0003 CYS O
H A 0005 GLN N 2.238 H A 0004 GLY O
H A 0006 VAL N 3.104 C A 0002 THR O
H A 0006 VAL N 2.800 H A 0003 CYS O
H A 0006 VAL N 2.219 H A 0005 GLN O
H A 0007 ASN N 2.757 H A 0003 CYS O
H A 0007 ASN N 2.223 H A 0006 VAL O
H A 0008 SER N 2.938 H A 0004 GLY O
H A 0008 SER N 3.178 H A 0005 GLN O
H A 0008 SER N 3.200 H A 0006 VAL O
H A 0008 SER N 2.232 H A 0007 ASN O
H A 0009 ALA N 2.803 H A 0005 GLN O
H A 0009 ALA N 3.050 H A 0006 VAL O
H A 0009 ALA N 2.233 H A 0008 SER O
H A 0010 VAL N 2.895 H A 0006 VAL O
H A 0010 VAL N 3.143 H A 0008 SER O
H A 0010 VAL N 2.226 H A 0009 ALA O
H A 0011 GLY N 2.978 H A 0008 SER O
H A 0011 GLY N 2.209 H A 0010 VAL O
H A 0012 PRO N 3.011 H A 0010 VAL O
H A 0012 PRO N 2.226 H A 0011 GLY O
H A 0013 CYS N 2.731 H A 0010 VAL O
H A 0013 CYS N 3.191 H A 0011 GLY O
H A 0013 CYS N 2.226 H A 0012 PRO O
H A 0014 LEU N 2.842 H A 0010 VAL O
H A 0014 LEU N 3.179 H A 0011 GLY O
H A 0014 LEU N 2.222 H A 0013 CYS O
H A 0015 THR N 3.041 H A 0013 CYS O
H A 0015 THR N 2.221 H A 0014 LEU O
H A 0016 TYR N 2.891 H A 0013 CYS O
H A 0016 TYR N 2.232 H A 0015 THR O
H A 0017 ALA N 2.848 H A 0013 CYS O
H A 0017 ALA N 3.100 H A 0014 LEU O
H A 0017 ALA N 2.236 H A 0016 TYR O
H A 0018 ARG N 2.842 H A 0014 LEU O
H A 0018 ARG N 2.896 H A 0016 TYR O
H A 0018 ARG N 2.232 H A 0017 ALA O
C A 0019 GLY N 2.967 H A 0015 THR O
C A 0019 GLY N 2.783 H A 0016 TYR O
C A 0019 GLY N 2.214 H A 0018 ARG O
C A 0020 GLY N 2.861 H A 0015 THR O
C A 0020 GLY N 2.238 C A 0019 GLY O
C A 0021 ALA N 2.221 C A 0020 GLY O
C A 0022 GLY N 2.230 C A 0021 ALA O
C A 0023 PRO N 2.229 C A 0022 GLY O
C A 0024 SER N 2.230 C A 0023 PRO O
H A 0025 ALA N 2.239 C A 0024 SER O
H A 0026 ALA N 2.978 C A 0024 SER O
H A 0026 ALA N 2.239 H A 0025 ALA O
H A 0027 CYS N 2.820 C A 0024 SER O
H A 0027 CYS N 2.224 H A 0026 ALA O
H A 0028 CYS N 2.914 C A 0024 SER O
H A 0028 CYS N 2.220 H A 0027 CYS O
H A 0029 SER N 2.825 H A 0025 ALA O
H A 0029 SER N 2.223 H A 0028 CYS O
H A 0030 GLY N 2.758 H A 0026 ALA O
H A 0030 GLY N 2.934 H A 0027 CYS O
H A 0030 GLY N 2.911 H A 0028 CYS O
H A 0030 GLY N 2.216 H A 0029 SER O
H A 0031 VAL N 2.810 H A 0027 CYS O
H A 0031 VAL N 2.887 H A 0028 CYS O
H A 0031 VAL N 2.209 H A 0030 GLY O
H A 0032 ARG N 2.846 H A 0028 CYS O
H A 0032 ARG N 3.100 H A 0030 GLY O
H A 0032 ARG N 2.220 H A 0031 VAL O
H A 0033 SER N 2.770 H A 0029 SER O
H A 0033 SER N 2.808 H A 0030 GLY O
H A 0033 SER N 2.221 H A 0032 ARG O
H A 0034 LEU N 2.852 H A 0030 GLY O
H A 0034 LEU N 2.873 H A 0031 VAL O
H A 0034 LEU N 3.157 H A 0032 ARG O
H A 0034 LEU N 2.213 H A 0033 SER O
H A 0035 LYS N 2.909 H A 0031 VAL O
H A 0035 LYS N 2.938 H A 0032 ARG O
H A 0035 LYS N 2.239 H A 0034 LEU O
H A 0036 ALA N 2.880 H A 0032 ARG O
H A 0036 ALA N 3.057 H A 0033 SER O
H A 0036 ALA N 3.048 H A 0034 LEU O
H A 0036 ALA N 2.231 H A 0035 LYS O
H A 0037 ALA N 2.743 H A 0033 SER O
H A 0037 ALA N 3.061 H A 0034 LEU O
H A 0037 ALA N 2.220 H A 0036 ALA O
C A 0038 ALA N 2.905 H A 0034 LEU O
C A 0038 ALA N 2.228 H A 0037 ALA O
C A 0039 SER N 2.224 C A 0038 ALA O
C A 0040 THR N 2.226 C A 0039 SER O
H A 0041 THR N 2.243 C A 0040 THR O
H A 0042 ALA N 3.018 C A 0040 THR O
H A 0042 ALA N 2.234 H A 0041 THR O
H A 0043 ASP N 2.910 C A 0040 THR O
H A 0043 ASP N 2.227 H A 0042 ALA O
H A 0044 ARG N 2.962 C A 0040 THR O
H A 0044 ARG N 2.240 H A 0043 ASP O
H A 0045 ARG N 2.865 H A 0041 THR O
H A 0045 ARG N 2.216 H A 0044 ARG O
H A 0046 THR N 2.875 H A 0042 ALA O
H A 0046 THR N 3.051 H A 0043 ASP O
H A 0046 THR N 2.234 H A 0045 ARG O
H A 0047 ALA N 2.893 H A 0043 ASP O
H A 0047 ALA N 3.180 H A 0044 ARG O
H A 0047 ALA N 2.221 H A 0046 THR O
H A 0048 CYS N 2.901 H A 0044 ARG O
H A 0048 CYS N 2.986 H A 0045 ARG O
H A 0048 CYS N 2.216 H A 0047 ALA O
H A 0049 ASN N 2.929 H A 0045 ARG O
H A 0049 ASN N 3.180 H A 0047 ALA O
H A 0049 ASN N 2.233 H A 0048 CYS O
H A 0050 CYS N 2.797 H A 0046 THR O
H A 0050 CYS N 3.012 H A 0047 ALA O
H A 0050 CYS N 2.218 H A 0049 ASN O
H A 0051 LEU N 2.804 H A 0047 ALA O
H A 0051 LEU N 3.113 H A 0049 ASN O
H A 0051 LEU N 2.224 H A 0050 CYS O
H A 0052 LYS N 2.929 H A 0048 CYS O
H A 0052 LYS N 2.931 H A 0049 ASN O
H A 0052 LYS N 2.228 H A 0051 LEU O
H A 0053 ASN N 2.836 H A 0049 ASN O
H A 0053 ASN N 3.072 H A 0051 LEU O
H A 0053 ASN N 2.229 H A 0052 LYS O
H A 0054 ALA N 2.882 H A 0050 CYS O
H A 0054 ALA N 2.993 H A 0051 LEU O
H A 0054 ALA N 2.223 H A 0053 ASN O
C A 0055 ALA N 2.876 H A 0051 LEU O
C A 0055 ALA N 3.197 H A 0053 ASN O
C A 0055 ALA N 2.229 H A 0054 ALA O
C A 0056 ARG N 3.075 H A 0053 ASN O
C A 0056 ARG N 2.786 H A 0054 ALA O
C A 0056 ARG N 2.224 C A 0055 ALA O
C A 0057 GLY N 2.231 C A 0056 ARG O
C A 0058 ILE N 2.224 C A 0057 GLY O
C A 0059 LYS N 2.225 C A 0058 ILE O
C A 0060 GLY N 2.235 C A 0059 LYS O
C A 0061 LEU N 2.237 C A 0060 GLY O
C A 0062 ASN N 2.956 H A 0017 ALA O
C A 0062 ASN N 2.229 C A 0061 LEU O
C A 0063 ALA N 2.233 C A 0062 ASN O
C A 0064 GLY N 2.230 C A 0063 ALA O
C A 0065 ASN N 2.227 C A 0064 GLY O
H A 0066 ALA N 3.102 H A 0017 ALA O
H A 0066 ALA N 2.223 C A 0065 ASN O
H A 0067 ALA N 2.239 H A 0066 ALA O
H A 0068 SER N 2.805 C A 0065 ASN O
H A 0068 SER N 3.163 H A 0066 ALA O
H A 0068 SER N 2.225 H A 0067 ALA O
H A 0069 ILE N 2.218 H A 0068 SER O
H A 0070 PRO N 3.080 H A 0068 SER O
H A 0070 PRO N 2.217 H A 0069 ILE O
H A 0071 SER N 2.741 H A 0068 SER O
H A 0071 SER N 2.235 H A 0070 PRO O
H A 0072 LYS N 2.712 H A 0068 SER O
H A 0072 LYS N 2.934 H A 0070 PRO O
H A 0072 LYS N 2.227 H A 0071 SER O
H A 0073 CYS N 2.889 H A 0069 ILE O
H A 0073 CYS N 2.223 H A 0072 LYS O
C A 0074 GLY N 2.781 H A 0070 PRO O
C A 0074 GLY N 2.225 H A 0073 CYS O
C A 0075 VAL N 2.224 C A 0074 GLY O
C A 0076 SER N 2.261 C A 0075 VAL O
C A 0077 VAL N 2.218 C A 0076 SER O
C A 0078 PRO N 2.227 C A 0077 VAL O
C A 0079 TYR N 2.230 C A 0078 PRO O
C A 0080 THR N 2.226 C A 0079 TYR O
C A 0081 ILE N 2.235 C A 0080 THR O
C A 0082 SER N 3.030 C A 0080 THR O
C A 0082 SER N 2.214 C A 0081 ILE O
C A 0083 ALA N 2.239 C A 0082 SER O
C A 0084 SER N 2.229 C A 0083 ALA O
C A 0085 ILE N 2.231 C A 0084 SER O
C A 0086 ASP N 2.580 C A 0084 SER O
C A 0086 ASP N 2.211 C A 0085 ILE O
C A 0087 CYS N 3.116 C A 0085 ILE O
C A 0087 CYS N 2.239 C A 0086 ASP O
C A 0088 SER N 2.244 C A 0087 CYS O
C A 0089 ARG N 2.706 C A 0087 CYS O
C A 0089 ARG N 2.241 C A 0088 SER O
C A 0090 VAL N 2.230 C A 0089 ARG O
C A 0091 SER N 2.224 C A 0090 VAL O
HB_MS 2.00 3.20 26
C A 0001 ILE O 3.181 C A 0002 THR OG1
C A 0001 ILE N 3.013 H A 0043 ASP OD1
H A 0003 CYS O 2.824 H A 0007 ASN ND2
H A 0004 GLY O 3.032 H A 0008 SER OG
H A 0011 GLY O 3.181 H A 0015 THR OG1
H A 0016 TYR O 2.685 C A 0065 ASN ND2
H A 0025 ALA N 2.622 C A 0024 SER OG
C A 0039 SER N 2.968 H A 0043 ASP OD2
C A 0040 THR N 2.980 C A 0039 SER OG
C A 0040 THR N 2.987 H A 0043 ASP OD2
H A 0042 ALA N 2.876 H A 0041 THR OG1
H A 0042 ALA O 2.728 H A 0046 THR OG1
H A 0044 ARG O 2.753 C A 0079 TYR OH
H A 0045 ARG O 2.545 H A 0049 ASN ND2
C A 0063 ALA N 2.676 C A 0062 ASN OD1
C A 0064 GLY N 3.011 C A 0062 ASN OD1
C A 0075 VAL O 2.578 C A 0076 SER OG
C A 0076 SER O 2.861 H A 0035 LYS NZ
C A 0083 ALA O 2.794 H A 0052 LYS NZ
C A 0083 ALA N 2.692 C A 0082 SER OG
C A 0084 SER O 2.590 H A 0052 LYS NZ
C A 0084 SER N 3.025 C A 0082 SER OG
C A 0085 ILE N 2.721 C A 0084 SER OG
C A 0086 ASP O 2.976 C A 0088 SER OG
C A 0087 CYS O 2.641 C A 0088 SER OG
C A 0091 SER O 2.906 H A 0045 ARG NH2
HB_SS 2.00 3.20 5
H A 0016 TYR OH 2.796 C A 0065 ASN OD1
H A 0035 LYS NZ 2.888 C A 0076 SER OG
H A 0043 ASP OD2 3.040 C A 0039 SER OG
C A 0056 ARG NH1 2.994 H A 0053 ASN OD1
H A 0072 LYS NZ 2.851 H A 0016 TYR OH
AROMATIC 0.00 8.00 1
H A 0072 LYS 4.694 H A 0016 TYR
SS_BOND 1.50 2.80 4
H A 0003 CYS SG 2.020 H A 0050 CYS SG
H A 0013 CYS SG 2.019 H A 0027 CYS SG
H A 0028 CYS SG 2.021 H A 0073 CYS SG
H A 0048 CYS SG 2.019 C A 0087 CYS SG