Complet list of 1r79 con file
Complete list of 1r79.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 363
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 3.710 C A 0002 SER C
C A 0001 GLY C 3.060 C A 0002 SER CB
C A 0002 SER C 2.435 C A 0003 SER CA
C A 0002 SER C 3.670 C A 0003 SER C
C A 0002 SER C 3.206 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 3.712 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 3.715 C A 0005 SER C
C A 0004 GLY C 3.024 C A 0005 SER CB
C A 0005 SER C 2.434 C A 0006 SER CA
C A 0005 SER C 3.713 C A 0006 SER C
C A 0005 SER C 3.040 C A 0006 SER CB
C A 0006 SER CA 3.791 C A 0007 GLY CA
C A 0006 SER C 2.418 C A 0007 GLY CA
C A 0006 SER C 3.700 C A 0007 GLY C
C A 0007 GLY CA 3.796 C A 0008 THR CA
C A 0007 GLY C 2.434 C A 0008 THR CA
C A 0007 GLY C 3.637 C A 0008 THR C
C A 0007 GLY C 3.309 C A 0008 THR CB
C A 0007 GLY C 3.331 C A 0008 THR CG2
C A 0008 THR C 2.434 C A 0009 THR CA
C A 0008 THR C 3.583 C A 0009 THR C
C A 0008 THR C 3.394 C A 0009 THR CB
C A 0008 THR C 3.368 C A 0009 THR CG2
C A 0009 THR C 2.435 C A 0010 LEU CA
C A 0009 THR C 3.652 C A 0010 LEU C
C A 0009 THR C 3.249 C A 0010 LEU CB
C A 0010 LEU C 2.432 C A 0011 ALA CA
C A 0010 LEU C 3.689 C A 0011 ALA C
C A 0010 LEU C 3.143 C A 0011 ALA CB
C A 0011 ALA C 2.434 C A 0012 SER CA
C A 0011 ALA C 3.520 C A 0012 SER C
C A 0011 ALA C 3.446 C A 0012 SER CB
C A 0012 SER C 2.433 C A 0013 ILE CA
C A 0012 SER C 3.587 C A 0013 ILE C
C A 0012 SER C 3.389 C A 0013 ILE CB
C A 0012 SER C 3.339 C A 0013 ILE CG2
C A 0013 ILE CA 3.791 C A 0014 GLY CA
C A 0013 ILE C 2.417 C A 0014 GLY CA
C A 0013 ILE C 3.710 C A 0014 GLY C
C A 0014 GLY CA 3.797 C A 0015 LYS CA
C A 0014 GLY C 2.434 C A 0015 LYS CA
C A 0014 GLY C 3.267 C A 0015 LYS C
C A 0014 GLY C 3.643 C A 0015 LYS CB
C A 0015 LYS C 2.434 C A 0016 ASP CA
C A 0015 LYS C 3.602 C A 0016 ASP C
C A 0015 LYS C 3.336 C A 0016 ASP CB
C A 0015 LYS C 3.370 C A 0016 ASP CG
C A 0016 ASP C 2.433 C A 0017 ILE CA
C A 0016 ASP C 2.973 C A 0017 ILE C
C A 0016 ASP C 3.736 C A 0017 ILE CB
C A 0017 ILE C 2.433 C A 0018 ILE CA
C A 0017 ILE C 3.218 C A 0018 ILE C
C A 0017 ILE C 3.688 C A 0018 ILE CB
C A 0017 ILE CG2 3.622 C A 0019 GLU CB
C A 0018 ILE C 2.434 C A 0019 GLU CA
C A 0018 ILE C 3.466 C A 0019 GLU C
C A 0018 ILE C 3.504 C A 0019 GLU CB
C A 0018 ILE C 3.610 C A 0019 GLU CG
C A 0018 ILE C 3.710 C A 0019 GLU CD
C A 0019 GLU C 2.434 C A 0020 ASP CA
C A 0019 GLU C 3.395 C A 0020 ASP C
C A 0019 GLU C 3.561 C A 0020 ASP CB
C A 0020 ASP C 2.433 C A 0021 ALA CA
C A 0020 ASP C 3.552 C A 0021 ALA C
C A 0020 ASP C 3.399 C A 0021 ALA CB
C A 0020 ASP CG 3.670 C A 0024 ILE CA
C A 0020 ASP CG 3.422 C A 0024 ILE CG1
C A 0021 ALA C 2.433 C A 0022 ASP CA
C A 0021 ALA C 3.564 C A 0022 ASP C
C A 0021 ALA C 3.390 C A 0022 ASP CB
C A 0021 ALA C 3.395 C A 0022 ASP CG
C A 0022 ASP CA 3.792 C A 0023 GLY CA
C A 0022 ASP C 2.418 C A 0023 GLY CA
C A 0022 ASP C 3.717 C A 0023 GLY C
C A 0023 GLY CA 3.795 C A 0024 ILE CA
C A 0023 GLY C 2.433 C A 0024 ILE CA
C A 0023 GLY C 2.810 C A 0024 ILE C
C A 0023 GLY C 3.693 C A 0024 ILE CB
C A 0024 ILE C 2.433 C A 0025 ALA CA
C A 0024 ILE C 3.376 C A 0025 ALA C
C A 0024 ILE C 3.566 C A 0025 ALA CB
C A 0025 ALA C 2.434 C A 0026 MET CA
C A 0025 ALA C 3.400 C A 0026 MET C
C A 0025 ALA C 3.557 C A 0026 MET CB
C A 0026 MET CA 2.868 C A 0027 PRO CD
C A 0026 MET C 2.464 C A 0027 PRO CA
C A 0026 MET C 3.136 C A 0027 PRO C
C A 0026 MET C 3.645 C A 0027 PRO CB
C A 0026 MET C 3.635 C A 0027 PRO CG
C A 0026 MET C 2.498 C A 0027 PRO CD
C A 0026 MET CE 3.293 C A 0061 TRP CZ3
C A 0026 MET CE 3.072 C A 0061 TRP CH2
C A 0027 PRO C 2.435 C A 0028 HIS CA
C A 0027 PRO C 3.414 C A 0028 HIS C
C A 0027 PRO C 3.548 C A 0028 HIS CB
C A 0027 PRO C 3.690 C A 0028 HIS CG
C A 0027 PRO C 3.707 C A 0028 HIS CD2
C A 0027 PRO C 3.578 C A 0078 CYS CB
C A 0028 HIS C 2.433 C A 0029 GLN CA
C A 0028 HIS C 3.115 C A 0029 GLN C
C A 0028 HIS C 3.697 C A 0029 GLN CB
C A 0028 HIS CB 3.647 E A 0030 TRP CE2
C A 0028 HIS CB 3.449 E A 0030 TRP CZ2
C A 0028 HIS CB 3.772 E A 0030 TRP CH2
C A 0028 HIS CE1 3.168 C A 0077 LYS C
C A 0028 HIS CG 3.532 C A 0078 CYS CB
C A 0028 HIS CD2 3.703 C A 0078 CYS CB
C A 0028 HIS CE1 3.236 C A 0078 CYS CA
C A 0028 HIS CE1 3.238 C A 0078 CYS CB
C A 0029 GLN C 2.433 E A 0030 TRP CA
C A 0029 GLN C 3.126 E A 0030 TRP C
C A 0029 GLN C 3.693 E A 0030 TRP CB
E A 0030 TRP C 2.435 E A 0031 LEU CA
E A 0030 TRP C 3.455 E A 0031 LEU C
E A 0030 TRP C 3.514 E A 0031 LEU CB
E A 0030 TRP C 3.614 E A 0057 TRP CE3
E A 0030 TRP CB 3.744 E A 0057 TRP CE3
E A 0030 TRP CZ3 3.448 E A 0066 VAL CG2
E A 0030 TRP CH2 3.646 E A 0066 VAL CG2
E A 0030 TRP CG 3.690 H A 0071 LYS CE
E A 0030 TRP CD1 3.463 H A 0071 LYS CE
E A 0030 TRP CZ2 3.661 C A 0074 LEU CD2
E A 0030 TRP CH2 3.536 C A 0074 LEU CD2
E A 0031 LEU C 2.434 E A 0032 GLU CA
E A 0031 LEU C 2.895 E A 0032 GLU C
E A 0031 LEU C 3.708 E A 0032 GLU CB
E A 0031 LEU CD2 3.700 C A 0034 ASN CG
E A 0031 LEU C 3.295 E A 0057 TRP CE3
E A 0031 LEU C 3.779 E A 0057 TRP CZ3
E A 0032 GLU CA 3.792 C A 0033 GLY CA
E A 0032 GLU C 2.418 C A 0033 GLY CA
E A 0032 GLU C 3.013 C A 0033 GLY C
E A 0032 GLU CA 3.617 E A 0057 TRP CD2
E A 0032 GLU CA 3.193 E A 0057 TRP CE3
E A 0032 GLU CA 3.245 E A 0057 TRP CZ3
E A 0032 GLU CA 3.722 E A 0057 TRP CH2
E A 0032 GLU CB 3.786 E A 0057 TRP CZ2
E A 0032 GLU CB 3.294 E A 0057 TRP CZ3
E A 0032 GLU CB 3.289 E A 0057 TRP CH2
E A 0032 GLU CD 3.655 E A 0057 TRP CZ2
E A 0032 GLU CD 3.678 E A 0057 TRP CH2
C A 0033 GLY CA 3.797 C A 0034 ASN CA
C A 0033 GLY C 2.434 C A 0034 ASN CA
C A 0033 GLY C 3.038 C A 0034 ASN C
C A 0033 GLY C 2.965 C A 0034 ASN CB
C A 0033 GLY CA 3.584 C A 0035 LEU CD2
C A 0033 GLY C 3.090 C A 0035 LEU CD2
C A 0033 GLY CA 3.697 C A 0054 LEU CA
C A 0033 GLY CA 3.456 C A 0054 LEU C
C A 0034 ASN C 2.435 C A 0035 LEU CA
C A 0034 ASN C 3.355 C A 0035 LEU C
C A 0034 ASN C 3.592 C A 0035 LEU CB
C A 0034 ASN C 3.443 C A 0035 LEU CD2
C A 0035 LEU CA 2.866 C A 0036 PRO CD
C A 0035 LEU C 2.464 C A 0036 PRO CA
C A 0035 LEU C 3.136 C A 0036 PRO C
C A 0035 LEU C 3.645 C A 0036 PRO CB
C A 0035 LEU C 3.635 C A 0036 PRO CG
C A 0035 LEU C 2.498 C A 0036 PRO CD
C A 0035 LEU CB 3.618 C A 0036 PRO CD
C A 0035 LEU CB 3.672 C A 0049 GLY CA
C A 0035 LEU CG 3.325 C A 0056 ASP CB
C A 0035 LEU CD2 3.368 C A 0056 ASP C
C A 0035 LEU CD2 3.349 C A 0056 ASP CB
C A 0035 LEU CD1 3.728 E A 0058 ARG CB
C A 0035 LEU CD1 3.768 E A 0058 ARG CD
C A 0035 LEU CD1 3.498 E A 0065 MET CB
C A 0035 LEU CD1 3.216 E A 0065 MET CG
C A 0036 PRO C 2.434 C A 0037 VAL CA
C A 0036 PRO C 2.997 C A 0037 VAL C
C A 0036 PRO C 3.737 C A 0037 VAL CB
C A 0036 PRO CG 3.733 C A 0039 ALA CA
C A 0036 PRO CG 3.657 C A 0039 ALA CB
C A 0036 PRO CD 3.655 C A 0039 ALA CB
C A 0037 VAL C 2.435 C A 0038 SER CA
C A 0037 VAL C 3.368 C A 0038 SER C
C A 0037 VAL C 3.582 C A 0038 SER CB
C A 0038 SER C 2.433 C A 0039 ALA CA
C A 0038 SER C 3.044 C A 0039 ALA C
C A 0038 SER C 3.702 C A 0039 ALA CB
C A 0039 ALA C 2.435 C A 0040 LYS CA
C A 0039 ALA C 3.692 C A 0040 LYS C
C A 0039 ALA C 3.140 C A 0040 LYS CB
C A 0039 ALA CB 3.565 C A 0048 CYS C
C A 0040 LYS C 2.434 C A 0041 CYS CA
C A 0040 LYS C 3.127 C A 0041 CYS C
C A 0040 LYS C 3.696 C A 0041 CYS CB
C A 0040 LYS CE 3.735 C A 0045 ASP C
C A 0040 LYS CE 3.710 C A 0046 LYS CA
C A 0040 LYS CE 3.302 C A 0046 LYS C
C A 0041 CYS C 2.433 C A 0042 THR CA
C A 0041 CYS C 3.337 C A 0042 THR C
C A 0041 CYS C 3.628 C A 0042 THR CB
C A 0042 THR C 2.434 C A 0043 VAL CA
C A 0042 THR C 3.458 C A 0043 VAL C
C A 0042 THR C 3.539 C A 0043 VAL CB
C A 0042 THR C 3.669 C A 0043 VAL CG2
C A 0042 THR CG2 3.461 E A 0066 VAL CG1
C A 0043 VAL C 2.435 C A 0044 CYS CA
C A 0043 VAL C 3.456 C A 0044 CYS C
C A 0043 VAL C 3.513 C A 0044 CYS CB
C A 0043 VAL CG2 3.601 E A 0066 VAL CG1
C A 0043 VAL CB 3.767 H A 0070 CYS CB
C A 0043 VAL CG1 3.736 H A 0070 CYS CB
C A 0043 VAL CG2 3.607 C A 0074 LEU CB
C A 0043 VAL CG2 3.411 C A 0074 LEU CD1
C A 0044 CYS C 2.434 C A 0045 ASP CA
C A 0044 CYS C 3.069 C A 0045 ASP C
C A 0044 CYS C 2.937 C A 0045 ASP CB
C A 0044 CYS C 3.296 C A 0045 ASP CG
C A 0045 ASP C 2.434 C A 0046 LYS CA
C A 0045 ASP C 3.510 C A 0046 LYS C
C A 0045 ASP C 3.459 C A 0046 LYS CB
C A 0045 ASP C 3.671 C A 0046 LYS CG
C A 0046 LYS C 2.435 C A 0047 THR CA
C A 0046 LYS C 2.944 C A 0047 THR C
C A 0046 LYS C 3.735 C A 0047 THR CB
C A 0047 THR C 2.434 C A 0048 CYS CA
C A 0047 THR C 3.502 C A 0048 CYS C
C A 0047 THR C 3.467 C A 0048 CYS CB
C A 0048 CYS CA 3.791 C A 0049 GLY CA
C A 0048 CYS C 2.418 C A 0049 GLY CA
C A 0048 CYS C 3.571 C A 0049 GLY C
C A 0049 GLY CA 3.797 C A 0050 SER CA
C A 0049 GLY C 2.434 C A 0050 SER CA
C A 0049 GLY C 3.340 C A 0050 SER C
C A 0049 GLY C 3.601 C A 0050 SER CB
C A 0050 SER C 2.434 C A 0051 VAL CA
C A 0050 SER C 2.954 C A 0051 VAL C
C A 0050 SER C 3.736 C A 0051 VAL CB
C A 0050 SER CB 3.754 C A 0053 ARG CB
C A 0050 SER CB 3.706 C A 0054 LEU CA
C A 0051 VAL C 2.435 C A 0052 LEU CA
C A 0051 VAL C 3.468 C A 0052 LEU C
C A 0051 VAL C 3.502 C A 0052 LEU CB
C A 0051 VAL C 3.779 C A 0052 LEU CG
C A 0052 LEU C 2.433 C A 0053 ARG CA
C A 0052 LEU C 3.574 C A 0053 ARG C
C A 0052 LEU C 3.380 C A 0053 ARG CB
C A 0052 LEU C 3.477 C A 0053 ARG CG
C A 0053 ARG C 2.435 C A 0054 LEU CA
C A 0053 ARG C 2.872 C A 0054 LEU C
C A 0053 ARG C 3.151 C A 0054 LEU CB
C A 0054 LEU C 2.433 C A 0055 GLN CA
C A 0054 LEU C 3.466 C A 0055 GLN C
C A 0054 LEU C 3.502 C A 0055 GLN CB
C A 0054 LEU C 3.690 C A 0055 GLN CG
C A 0055 GLN C 2.434 C A 0056 ASP CA
C A 0055 GLN C 2.805 C A 0056 ASP C
C A 0055 GLN C 3.672 C A 0056 ASP CB
C A 0056 ASP C 2.434 E A 0057 TRP CA
C A 0056 ASP C 3.408 E A 0057 TRP C
C A 0056 ASP C 3.551 E A 0057 TRP CB
C A 0056 ASP C 3.692 E A 0057 TRP CG
C A 0056 ASP C 3.758 E A 0057 TRP CD1
E A 0057 TRP C 2.433 E A 0058 ARG CA
E A 0057 TRP C 3.666 E A 0058 ARG C
E A 0057 TRP C 3.216 E A 0058 ARG CB
E A 0057 TRP CD1 3.784 H A 0068 THR CG2
E A 0058 ARG C 2.433 E A 0059 CYS CA
E A 0058 ARG C 3.024 E A 0059 CYS C
E A 0058 ARG C 3.712 E A 0059 CYS CB
E A 0058 ARG CB 3.623 E A 0065 MET CA
E A 0058 ARG CB 3.310 E A 0065 MET CG
E A 0059 CYS C 2.435 C A 0060 LEU CA
E A 0059 CYS C 3.339 C A 0060 LEU C
E A 0059 CYS C 3.602 C A 0060 LEU CB
C A 0060 LEU C 2.433 C A 0061 TRP CA
C A 0060 LEU C 3.180 C A 0061 TRP C
C A 0060 LEU C 3.677 C A 0061 TRP CB
C A 0060 LEU C 3.679 C A 0061 TRP CD1
C A 0060 LEU CD2 3.434 C A 0061 TRP CD1
C A 0061 TRP C 2.434 C A 0062 CYS CA
C A 0061 TRP C 3.168 C A 0062 CYS C
C A 0061 TRP C 3.683 C A 0062 CYS CB
C A 0061 TRP CB 3.371 C A 0080 GLY C
C A 0061 TRP CG 3.751 C A 0080 GLY C
C A 0061 TRP CE3 3.645 C A 0080 GLY CA
C A 0061 TRP CB 3.783 C A 0081 PRO CA
C A 0061 TRP CG 3.750 C A 0081 PRO CA
C A 0061 TRP CG 3.633 C A 0081 PRO CD
C A 0061 TRP CD1 3.509 C A 0081 PRO CB
C A 0061 TRP CD2 3.454 C A 0081 PRO CD
C A 0061 TRP CE2 3.705 C A 0081 PRO CD
C A 0062 CYS C 2.434 C A 0063 LYS CA
C A 0062 CYS C 3.027 C A 0063 LYS C
C A 0062 CYS C 2.976 C A 0063 LYS CB
C A 0062 CYS C 3.524 C A 0063 LYS CG
C A 0063 LYS C 2.434 C A 0064 ALA CA
C A 0063 LYS C 3.457 C A 0064 ALA C
C A 0063 LYS C 3.500 C A 0064 ALA CB
C A 0064 ALA C 2.434 E A 0065 MET CA
C A 0064 ALA C 3.281 E A 0065 MET C
C A 0064 ALA C 3.635 E A 0065 MET CB
E A 0065 MET C 2.434 E A 0066 VAL CA
E A 0065 MET C 3.632 E A 0066 VAL C
E A 0065 MET C 3.320 E A 0066 VAL CB
E A 0065 MET C 3.224 E A 0066 VAL CG1
E A 0066 VAL C 2.435 C A 0067 HIS CA
E A 0066 VAL C 3.196 C A 0067 HIS C
E A 0066 VAL C 3.673 C A 0067 HIS CB
C A 0067 HIS C 2.434 H A 0068 THR CA
C A 0067 HIS C 2.964 H A 0068 THR C
C A 0067 HIS C 3.737 H A 0068 THR CB
H A 0068 THR C 2.434 H A 0069 SER CA
H A 0068 THR C 3.118 H A 0069 SER C
H A 0068 THR C 3.697 H A 0069 SER CB
H A 0069 SER C 2.434 H A 0070 CYS CA
H A 0069 SER C 2.985 H A 0070 CYS C
H A 0069 SER C 3.716 H A 0070 CYS CB
H A 0070 CYS C 2.435 H A 0071 LYS CA
H A 0070 CYS C 2.892 H A 0071 LYS C
H A 0070 CYS C 3.706 H A 0071 LYS CB
H A 0070 CYS C 3.714 H A 0073 SER CB
H A 0071 LYS C 2.434 H A 0072 GLU CA
H A 0071 LYS C 2.957 H A 0072 GLU C
H A 0071 LYS C 3.715 H A 0072 GLU CB
H A 0072 GLU C 2.435 H A 0073 SER CA
H A 0072 GLU C 3.034 H A 0073 SER C
H A 0072 GLU C 3.712 H A 0073 SER CB
H A 0073 SER C 2.435 C A 0074 LEU CA
H A 0073 SER C 2.967 C A 0074 LEU C
H A 0073 SER C 3.714 C A 0074 LEU CB
C A 0074 LEU C 2.434 C A 0075 LEU CA
C A 0074 LEU C 3.400 C A 0075 LEU C
C A 0074 LEU C 3.559 C A 0075 LEU CB
C A 0074 LEU C 3.719 C A 0075 LEU CG
C A 0075 LEU C 2.434 C A 0076 THR CA
C A 0075 LEU C 2.814 C A 0076 THR C
C A 0075 LEU C 3.696 C A 0076 THR CB
C A 0076 THR C 2.435 C A 0077 LYS CA
C A 0076 THR C 3.305 C A 0077 LYS C
C A 0076 THR C 3.623 C A 0077 LYS CB
C A 0077 LYS C 2.434 C A 0078 CYS CA
C A 0077 LYS C 3.342 C A 0078 CYS C
C A 0077 LYS C 3.599 C A 0078 CYS CB
C A 0078 CYS C 2.434 C A 0079 SER CA
C A 0078 CYS C 3.280 C A 0079 SER C
C A 0078 CYS C 3.635 C A 0079 SER CB
C A 0079 SER CA 3.791 C A 0080 GLY CA
C A 0079 SER C 2.418 C A 0080 GLY CA
C A 0079 SER C 3.584 C A 0080 GLY C
C A 0080 GLY CA 2.866 C A 0081 PRO CD
C A 0080 GLY C 2.464 C A 0081 PRO CA
C A 0080 GLY C 3.135 C A 0081 PRO C
C A 0080 GLY C 3.646 C A 0081 PRO CB
C A 0080 GLY C 3.636 C A 0081 PRO CG
C A 0080 GLY C 2.498 C A 0081 PRO CD
C A 0081 PRO C 2.434 C A 0082 SER CA
C A 0081 PRO C 3.716 C A 0082 SER C
C A 0081 PRO C 3.015 C A 0082 SER CB
C A 0082 SER C 2.434 C A 0083 SER CA
C A 0082 SER C 3.554 C A 0083 SER C
C A 0082 SER C 3.407 C A 0083 SER CB
C A 0083 SER CA 3.791 C A 0084 GLY CA
C A 0083 SER C 2.418 C A 0084 GLY CA
C A 0083 SER C 3.392 C A 0084 GLY C
CHARGE_ATTR 2.00 12.00 31
C A 0016 ASP OD1 9.555 C A 0015 LYS NZ
C A 0016 ASP OD2 8.906 C A 0015 LYS NZ
C A 0020 ASP OD1 11.00 C A 0077 LYS NZ
C A 0020 ASP OD2 9.518 C A 0077 LYS NZ
E A 0032 GLU OE1 11.29 C A 0053 ARG NH1
E A 0032 GLU OE2 9.919 C A 0053 ARG NH1
E A 0032 GLU OE2 10.44 C A 0053 ARG NH2
E A 0032 GLU OE1 7.664 H A 0071 LYS NZ
E A 0032 GLU OE2 9.612 H A 0071 LYS NZ
C A 0045 ASP OD1 6.054 C A 0040 LYS NZ
C A 0045 ASP OD2 7.095 C A 0040 LYS NZ
C A 0045 ASP OD1 11.12 C A 0046 LYS NZ
C A 0045 ASP OD2 9.838 C A 0046 LYS NZ
C A 0045 ASP OD1 9.897 C A 0067 HIS ND1
C A 0045 ASP OD1 11.08 C A 0067 HIS NE2
C A 0045 ASP OD2 9.579 C A 0067 HIS ND1
C A 0045 ASP OD2 11.02 C A 0067 HIS NE2
C A 0056 ASP OD2 11.50 C A 0040 LYS NZ
C A 0056 ASP OD2 11.81 C A 0046 LYS NZ
C A 0056 ASP OD1 9.583 C A 0053 ARG NH1
C A 0056 ASP OD1 10.96 C A 0053 ARG NH2
C A 0056 ASP OD2 11.42 C A 0053 ARG NH1
C A 0056 ASP OD2 11.27 E A 0058 ARG NH1
C A 0056 ASP OD1 6.258 C A 0067 HIS ND1
C A 0056 ASP OD1 4.707 C A 0067 HIS NE2
C A 0056 ASP OD2 5.552 C A 0067 HIS ND1
C A 0056 ASP OD2 3.867 C A 0067 HIS NE2
C A 0056 ASP OD1 9.132 H A 0071 LYS NZ
C A 0056 ASP OD2 9.888 H A 0071 LYS NZ
H A 0072 GLU OE1 10.51 H A 0071 LYS NZ
H A 0072 GLU OE2 9.431 H A 0071 LYS NZ
CHARGE_REPU 2.00 12.00 28
C A 0019 GLU OE1 6.839 C A 0020 ASP OD1
C A 0019 GLU OE1 7.039 C A 0020 ASP OD2
C A 0019 GLU OE2 7.806 C A 0020 ASP OD1
C A 0019 GLU OE2 7.515 C A 0020 ASP OD2
C A 0019 GLU OE1 11.25 C A 0022 ASP OD2
C A 0019 GLU OE2 11.91 C A 0022 ASP OD2
C A 0020 ASP OD1 6.062 C A 0022 ASP OD1
C A 0020 ASP OD1 4.645 C A 0022 ASP OD2
C A 0020 ASP OD2 6.909 C A 0022 ASP OD1
C A 0020 ASP OD2 5.288 C A 0022 ASP OD2
C A 0028 HIS ND1 11.02 E A 0058 ARG NH1
C A 0028 HIS ND1 10.27 H A 0071 LYS NZ
C A 0028 HIS NE2 10.97 H A 0071 LYS NZ
C A 0028 HIS ND1 10.56 C A 0077 LYS NZ
C A 0028 HIS NE2 8.583 C A 0077 LYS NZ
E A 0032 GLU OE1 9.790 C A 0056 ASP OD1
E A 0032 GLU OE1 11.42 C A 0056 ASP OD2
E A 0032 GLU OE2 9.932 C A 0056 ASP OD1
E A 0032 GLU OE2 11.64 C A 0056 ASP OD2
C A 0040 LYS NZ 10.15 C A 0046 LYS NZ
C A 0040 LYS NZ 9.770 C A 0067 HIS ND1
C A 0040 LYS NZ 9.813 C A 0067 HIS NE2
C A 0046 LYS NZ 7.414 C A 0067 HIS ND1
C A 0046 LYS NZ 8.073 C A 0067 HIS NE2
E A 0058 ARG NH1 3.533 C A 0063 LYS NZ
E A 0058 ARG NH2 4.637 C A 0063 LYS NZ
C A 0067 HIS ND1 9.845 H A 0071 LYS NZ
C A 0067 HIS NE2 10.46 H A 0071 LYS NZ
HB_MM 2.00 3.20 103
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 2.251 C A 0005 SER O
C A 0007 GLY N 2.250 C A 0006 SER O
C A 0008 THR N 2.250 C A 0007 GLY O
C A 0009 THR N 2.251 C A 0008 THR O
C A 0010 LEU N 2.250 C A 0009 THR O
C A 0011 ALA N 2.250 C A 0010 LEU O
C A 0012 SER N 2.251 C A 0011 ALA O
C A 0013 ILE N 2.251 C A 0012 SER O
C A 0014 GLY N 2.250 C A 0013 ILE O
C A 0015 LYS N 2.249 C A 0014 GLY O
C A 0016 ASP N 2.249 C A 0015 LYS O
C A 0017 ILE N 2.250 C A 0016 ASP O
C A 0018 ILE N 2.958 C A 0016 ASP O
C A 0018 ILE N 2.251 C A 0017 ILE O
C A 0019 GLU N 3.073 C A 0017 ILE O
C A 0019 GLU N 2.251 C A 0018 ILE O
C A 0020 ASP N 2.250 C A 0019 GLU O
C A 0021 ALA N 2.250 C A 0020 ASP O
C A 0022 ASP N 2.250 C A 0021 ALA O
C A 0023 GLY N 2.250 C A 0022 ASP O
C A 0024 ILE N 2.251 C A 0023 GLY O
C A 0025 ALA N 2.250 C A 0024 ILE O
C A 0026 MET N 2.250 C A 0025 ALA O
C A 0027 PRO N 2.254 C A 0026 MET O
C A 0028 HIS N 2.250 C A 0027 PRO O
C A 0029 GLN N 2.250 C A 0028 HIS O
E A 0030 TRP N 2.917 C A 0028 HIS O
E A 0030 TRP N 2.250 C A 0029 GLN O
E A 0031 LEU N 2.250 E A 0030 TRP O
E A 0032 GLU N 2.250 E A 0031 LEU O
C A 0033 GLY N 3.120 E A 0031 LEU O
C A 0033 GLY N 2.250 E A 0032 GLU O
C A 0033 GLY N 3.029 C A 0055 GLN O
C A 0033 GLY N 2.444 C A 0056 ASP O
C A 0034 ASN N 2.250 C A 0033 GLY O
C A 0035 LEU N 2.249 C A 0034 ASN O
C A 0036 PRO N 2.253 C A 0035 LEU O
C A 0037 VAL N 2.250 C A 0036 PRO O
C A 0038 SER N 2.250 C A 0037 VAL O
C A 0039 ALA N 3.141 C A 0036 PRO O
C A 0039 ALA N 2.250 C A 0038 SER O
C A 0040 LYS N 2.249 C A 0039 ALA O
C A 0041 CYS N 2.250 C A 0040 LYS O
C A 0041 CYS N 3.152 C A 0046 LYS O
C A 0042 THR N 2.250 C A 0041 CYS O
C A 0042 THR N 2.938 E A 0065 MET O
C A 0043 VAL N 2.250 C A 0042 THR O
C A 0044 CYS N 2.251 C A 0043 VAL O
C A 0045 ASP N 3.189 C A 0041 CYS O
C A 0045 ASP N 2.250 C A 0044 CYS O
C A 0046 LYS N 2.250 C A 0045 ASP O
C A 0047 THR N 2.250 C A 0046 LYS O
C A 0048 CYS N 3.103 C A 0046 LYS O
C A 0048 CYS N 2.250 C A 0047 THR O
C A 0049 GLY N 2.250 C A 0048 CYS O
C A 0050 SER N 2.250 C A 0049 GLY O
C A 0051 VAL N 2.250 C A 0050 SER O
C A 0052 LEU N 2.251 C A 0051 VAL O
C A 0053 ARG N 2.251 C A 0052 LEU O
C A 0054 LEU N 2.251 C A 0053 ARG O
C A 0055 GLN N 3.089 C A 0053 ARG O
C A 0055 GLN N 2.250 C A 0054 LEU O
C A 0056 ASP N 2.250 C A 0055 GLN O
E A 0057 TRP N 2.250 C A 0056 ASP O
E A 0058 ARG N 2.250 E A 0057 TRP O
E A 0059 CYS N 2.250 E A 0058 ARG O
E A 0059 CYS N 2.731 C A 0064 ALA O
C A 0060 LEU N 2.250 E A 0059 CYS O
C A 0061 TRP N 2.249 C A 0060 LEU O
C A 0062 CYS N 2.250 C A 0061 TRP O
C A 0063 LYS N 2.249 C A 0062 CYS O
C A 0064 ALA N 2.250 C A 0063 LYS O
E A 0065 MET N 2.250 C A 0064 ALA O
E A 0066 VAL N 2.771 E A 0057 TRP O
E A 0066 VAL N 2.250 E A 0065 MET O
C A 0067 HIS N 2.251 E A 0066 VAL O
H A 0068 THR N 2.251 C A 0067 HIS O
H A 0069 SER N 2.250 H A 0068 THR O
H A 0070 CYS N 2.249 H A 0069 SER O
H A 0071 LYS N 2.688 C A 0067 HIS O
H A 0071 LYS N 3.128 H A 0069 SER O
H A 0071 LYS N 2.249 H A 0070 CYS O
H A 0072 GLU N 2.250 H A 0071 LYS O
H A 0073 SER N 2.772 H A 0070 CYS O
H A 0073 SER N 3.029 H A 0071 LYS O
H A 0073 SER N 2.250 H A 0072 GLU O
C A 0074 LEU N 2.896 H A 0070 CYS O
C A 0074 LEU N 2.902 H A 0071 LYS O
C A 0074 LEU N 2.250 H A 0073 SER O
C A 0075 LEU N 2.249 C A 0074 LEU O
C A 0076 THR N 2.251 C A 0075 LEU O
C A 0077 LYS N 2.250 C A 0076 THR O
C A 0078 CYS N 2.250 C A 0077 LYS O
C A 0079 SER N 2.250 C A 0078 CYS O
C A 0080 GLY N 2.250 C A 0079 SER O
C A 0081 PRO N 2.253 C A 0080 GLY O
C A 0082 SER N 2.251 C A 0081 PRO O
C A 0083 SER N 2.250 C A 0082 SER O
C A 0084 GLY N 2.250 C A 0083 SER O
HB_MS 2.00 3.20 8
C A 0021 ALA N 2.770 C A 0020 ASP OD1
C A 0022 ASP N 2.775 C A 0020 ASP OD1
C A 0023 GLY N 3.010 C A 0020 ASP OD1
C A 0024 ILE N 3.041 C A 0020 ASP OD1
C A 0024 ILE N 2.957 C A 0020 ASP OD2
C A 0049 GLY N 3.152 C A 0056 ASP OD2
H A 0069 SER N 2.820 H A 0068 THR OG1
C A 0076 THR O 3.000 C A 0028 HIS NE2
AROMATIC 0.00 8.00 3
C A 0028 HIS 5.218 E A 0030 TRP
H A 0071 LYS 5.274 E A 0030 TRP
H A 0071 LYS 4.470 E A 0057 TRP