Complet list of 2cr7 con file
Complete list of 2cr7.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 337
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 3.706 C A 0002 SER C
C A 0001 GLY C 3.086 C A 0002 SER CB
C A 0002 SER C 2.434 C A 0003 SER CA
C A 0002 SER C 3.072 C A 0003 SER C
C A 0002 SER C 3.707 C A 0003 SER CB
C A 0003 SER CA 3.791 C A 0004 GLY CA
C A 0003 SER C 2.417 C A 0004 GLY CA
C A 0003 SER C 3.716 C A 0004 GLY C
C A 0004 GLY CA 3.797 C A 0005 SER CA
C A 0004 GLY C 2.434 C A 0005 SER CA
C A 0004 GLY C 3.501 C A 0005 SER C
C A 0004 GLY C 3.469 C A 0005 SER CB
C A 0005 SER C 2.434 C A 0006 SER CA
C A 0005 SER C 3.229 C A 0006 SER C
C A 0005 SER C 3.660 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 3.284 C A 0007 GLY C
C A 0007 GLY CA 3.797 C A 0008 VAL CA
C A 0007 GLY C 2.434 C A 0008 VAL CA
C A 0007 GLY C 3.425 C A 0008 VAL C
C A 0007 GLY C 3.565 C A 0008 VAL CB
C A 0007 GLY C 3.671 C A 0008 VAL CG1
C A 0008 VAL C 2.434 C A 0009 HIS CA
C A 0008 VAL C 3.014 C A 0009 HIS C
C A 0008 VAL C 3.713 C A 0009 HIS CB
C A 0009 HIS C 2.434 C A 0010 VAL CA
C A 0009 HIS C 2.830 C A 0010 VAL C
C A 0009 HIS C 3.705 C A 0010 VAL CB
C A 0010 VAL C 2.433 C A 0011 GLU CA
C A 0010 VAL C 2.987 C A 0011 GLU C
C A 0010 VAL C 3.715 C A 0011 GLU CB
C A 0011 GLU C 2.433 C A 0012 ASP CA
C A 0011 GLU C 3.554 C A 0012 ASP C
C A 0011 GLU C 3.403 C A 0012 ASP CB
C A 0012 ASP C 2.433 H A 0013 ALA CA
C A 0012 ASP C 3.340 H A 0013 ALA C
C A 0012 ASP C 3.591 H A 0013 ALA CB
H A 0013 ALA C 2.435 H A 0014 LEU CA
H A 0013 ALA C 2.946 H A 0014 LEU C
H A 0013 ALA C 3.713 H A 0014 LEU CB
H A 0014 LEU C 2.433 H A 0015 THR CA
H A 0014 LEU C 2.886 H A 0015 THR C
H A 0014 LEU C 3.725 H A 0015 THR CB
H A 0014 LEU CD1 3.738 H A 0015 THR CA
H A 0014 LEU CA 3.668 H A 0017 LEU CB
H A 0014 LEU C 3.617 H A 0017 LEU CB
H A 0015 THR C 2.433 H A 0016 TYR CA
H A 0015 THR C 3.041 H A 0016 TYR C
H A 0015 THR C 3.710 H A 0016 TYR CB
H A 0015 THR CB 3.714 H A 0072 PHE CZ
H A 0015 THR CG2 3.500 H A 0072 PHE CZ
H A 0016 TYR C 2.434 H A 0017 LEU CA
H A 0016 TYR C 2.981 H A 0017 LEU C
H A 0016 TYR C 3.714 H A 0017 LEU CB
H A 0016 TYR CE1 3.444 H A 0020 VAL CG2
H A 0016 TYR CE2 3.510 H A 0069 PHE CA
H A 0016 TYR CE2 3.632 H A 0069 PHE CB
H A 0016 TYR CZ 3.440 H A 0069 PHE CB
H A 0016 TYR CB 3.345 H A 0072 PHE CD2
H A 0016 TYR CB 3.253 H A 0072 PHE CE2
H A 0017 LEU C 2.434 H A 0018 ASP CA
H A 0017 LEU C 2.931 H A 0018 ASP C
H A 0017 LEU C 3.711 H A 0018 ASP CB
H A 0017 LEU CD2 3.641 H A 0034 PHE CE1
H A 0018 ASP C 2.433 H A 0019 GLN CA
H A 0018 ASP C 2.857 H A 0019 GLN C
H A 0018 ASP C 3.696 H A 0019 GLN CB
H A 0019 GLN C 2.433 H A 0020 VAL CA
H A 0019 GLN C 2.962 H A 0020 VAL C
H A 0019 GLN C 3.736 H A 0020 VAL CB
H A 0020 VAL C 2.435 H A 0021 LYS CA
H A 0020 VAL C 3.075 H A 0021 LYS C
H A 0020 VAL C 3.707 H A 0021 LYS CB
H A 0020 VAL CG1 3.578 H A 0031 TYR CD1
H A 0020 VAL CG1 3.636 H A 0059 PHE CE1
H A 0020 VAL CG1 3.267 H A 0059 PHE CZ
H A 0021 LYS C 2.433 H A 0022 ILE CA
H A 0021 LYS C 2.990 H A 0022 ILE C
H A 0021 LYS C 3.737 H A 0022 ILE CB
H A 0022 ILE C 2.434 H A 0023 ARG CA
H A 0022 ILE C 2.983 H A 0023 ARG C
H A 0022 ILE C 3.715 H A 0023 ARG CB
H A 0023 ARG C 2.434 H A 0024 PHE CA
H A 0023 ARG C 3.319 H A 0024 PHE C
H A 0023 ARG C 3.613 H A 0024 PHE CB
H A 0024 PHE CA 3.792 C A 0025 GLY CA
H A 0024 PHE C 2.418 C A 0025 GLY CA
H A 0024 PHE C 3.079 C A 0025 GLY C
H A 0024 PHE CG 3.575 H A 0030 THR CG2
H A 0024 PHE CD1 3.418 H A 0030 THR CB
H A 0024 PHE CD1 3.283 H A 0030 THR CG2
H A 0024 PHE CD2 3.785 H A 0030 THR CG2
H A 0024 PHE CE1 3.755 H A 0030 THR CB
H A 0024 PHE CE1 3.229 H A 0030 THR CG2
H A 0024 PHE CE2 3.740 H A 0030 THR CG2
H A 0024 PHE CZ 3.471 H A 0030 THR CG2
H A 0024 PHE CD2 3.568 H A 0059 PHE CE1
H A 0024 PHE CE2 2.917 H A 0059 PHE CD1
H A 0024 PHE CE2 2.932 H A 0059 PHE CE1
H A 0024 PHE CZ 3.203 H A 0059 PHE CD1
H A 0024 PHE CZ 3.666 H A 0059 PHE CE1
H A 0024 PHE CE1 3.739 H A 0062 HIS CD2
H A 0024 PHE CZ 3.742 H A 0062 HIS CG
H A 0024 PHE CZ 3.441 H A 0062 HIS CD2
C A 0025 GLY CA 3.797 C A 0026 SER CA
C A 0025 GLY C 2.434 C A 0026 SER CA
C A 0025 GLY C 3.104 C A 0026 SER C
C A 0025 GLY C 3.701 C A 0026 SER CB
C A 0026 SER C 2.434 H A 0027 ASP CA
C A 0026 SER C 3.490 H A 0027 ASP C
C A 0026 SER C 3.479 H A 0027 ASP CB
C A 0026 SER C 3.406 H A 0028 PRO CD
H A 0027 ASP CA 2.866 H A 0028 PRO CD
H A 0027 ASP C 2.463 H A 0028 PRO CA
H A 0027 ASP C 3.135 H A 0028 PRO C
H A 0027 ASP C 3.645 H A 0028 PRO CB
H A 0027 ASP C 3.635 H A 0028 PRO CG
H A 0027 ASP C 2.497 H A 0028 PRO CD
H A 0028 PRO C 2.433 H A 0029 ALA CA
H A 0028 PRO C 2.970 H A 0029 ALA C
H A 0028 PRO C 3.707 H A 0029 ALA CB
H A 0029 ALA C 2.433 H A 0030 THR CA
H A 0029 ALA C 3.072 H A 0030 THR C
H A 0029 ALA C 3.730 H A 0030 THR CB
H A 0030 THR C 2.433 H A 0031 TYR CA
H A 0030 THR C 2.984 H A 0031 TYR C
H A 0030 THR C 3.714 H A 0031 TYR CB
H A 0031 TYR C 2.434 H A 0032 ASN CA
H A 0031 TYR C 2.911 H A 0032 ASN C
H A 0031 TYR C 3.710 H A 0032 ASN CB
H A 0032 ASN CA 3.791 H A 0033 GLY CA
H A 0032 ASN C 2.418 H A 0033 GLY CA
H A 0032 ASN C 2.900 H A 0033 GLY C
H A 0033 GLY CA 3.796 H A 0034 PHE CA
H A 0033 GLY C 2.434 H A 0034 PHE CA
H A 0033 GLY C 3.008 H A 0034 PHE C
H A 0033 GLY C 3.714 H A 0034 PHE CB
H A 0033 GLY C 3.758 H A 0037 ILE CD1
H A 0034 PHE C 2.434 H A 0035 LEU CA
H A 0034 PHE C 2.946 H A 0035 LEU C
H A 0034 PHE C 3.712 H A 0035 LEU CB
H A 0034 PHE CA 3.535 H A 0037 ILE CD1
H A 0034 PHE CE1 3.676 H A 0038 MET CG
H A 0034 PHE CB 3.406 H A 0058 LEU CD2
H A 0034 PHE CD2 3.734 H A 0058 LEU CD2
H A 0034 PHE CD2 3.706 H A 0059 PHE CE2
H A 0034 PHE CD2 3.462 H A 0059 PHE CZ
H A 0035 LEU C 2.434 H A 0036 GLU CA
H A 0035 LEU C 3.044 H A 0036 GLU C
H A 0035 LEU C 3.712 H A 0036 GLU CB
H A 0036 GLU C 2.434 H A 0037 ILE CA
H A 0036 GLU C 2.912 H A 0037 ILE C
H A 0036 GLU C 3.730 H A 0037 ILE CB
H A 0037 ILE C 2.433 H A 0038 MET CA
H A 0037 ILE C 2.981 H A 0038 MET C
H A 0037 ILE C 3.715 H A 0038 MET CB
H A 0037 ILE CG2 3.781 H A 0051 VAL CG2
H A 0037 ILE CG1 3.762 H A 0054 ARG CB
H A 0037 ILE CG2 3.475 H A 0054 ARG CB
H A 0038 MET C 2.435 H A 0039 LYS CA
H A 0038 MET C 2.847 H A 0039 LYS C
H A 0038 MET C 3.693 H A 0039 LYS CB
H A 0038 MET CE 3.796 H A 0051 VAL CG2
H A 0039 LYS C 2.434 H A 0040 GLU CA
H A 0039 LYS C 2.887 H A 0040 GLU C
H A 0039 LYS C 3.705 H A 0040 GLU CB
H A 0040 GLU C 2.434 H A 0041 PHE CA
H A 0040 GLU C 3.045 H A 0041 PHE C
H A 0040 GLU C 3.711 H A 0041 PHE CB
H A 0041 PHE C 2.434 H A 0042 LYS CA
H A 0041 PHE C 3.049 H A 0042 LYS C
H A 0041 PHE C 3.710 H A 0042 LYS CB
H A 0041 PHE CA 3.441 C A 0046 ILE CG1
H A 0041 PHE CB 3.631 C A 0046 ILE CG1
H A 0041 PHE CE2 3.780 H A 0047 ASP C
H A 0042 LYS C 2.434 H A 0043 SER CA
H A 0042 LYS C 3.421 H A 0043 SER C
H A 0042 LYS C 3.542 H A 0043 SER CB
H A 0043 SER C 2.434 C A 0044 GLN CA
H A 0043 SER C 2.971 C A 0044 GLN C
H A 0043 SER C 3.032 C A 0044 GLN CB
H A 0043 SER C 3.568 C A 0044 GLN CG
C A 0044 GLN C 2.434 C A 0045 SER CA
C A 0044 GLN C 3.296 C A 0045 SER C
C A 0044 GLN C 3.627 C A 0045 SER CB
C A 0045 SER C 2.433 C A 0046 ILE CA
C A 0045 SER C 3.500 C A 0046 ILE C
C A 0045 SER C 3.495 C A 0046 ILE CB
C A 0045 SER C 3.568 C A 0046 ILE CG2
C A 0046 ILE C 2.434 H A 0047 ASP CA
C A 0046 ILE C 3.461 H A 0047 ASP C
C A 0046 ILE C 3.506 H A 0047 ASP CB
C A 0046 ILE C 3.588 H A 0047 ASP CG
C A 0046 ILE CD1 3.433 H A 0051 VAL CA
C A 0046 ILE CD1 3.567 H A 0051 VAL CB
H A 0047 ASP C 2.434 H A 0048 THR CA
H A 0047 ASP C 2.888 H A 0048 THR C
H A 0047 ASP C 3.726 H A 0048 THR CB
H A 0047 ASP C 3.403 H A 0049 PRO CD
H A 0047 ASP CB 3.767 H A 0049 PRO CD
H A 0048 THR CA 2.867 H A 0049 PRO CD
H A 0048 THR C 2.465 H A 0049 PRO CA
H A 0048 THR C 3.136 H A 0049 PRO C
H A 0048 THR C 3.646 H A 0049 PRO CB
H A 0048 THR C 3.635 H A 0049 PRO CG
H A 0048 THR C 2.498 H A 0049 PRO CD
H A 0048 THR CB 2.988 H A 0049 PRO CD
H A 0048 THR CG2 3.271 H A 0049 PRO CD
H A 0049 PRO CA 3.791 H A 0050 GLY CA
H A 0049 PRO C 2.418 H A 0050 GLY CA
H A 0049 PRO C 3.271 H A 0050 GLY C
H A 0050 GLY CA 3.797 H A 0051 VAL CA
H A 0050 GLY C 2.434 H A 0051 VAL CA
H A 0050 GLY C 3.119 H A 0051 VAL C
H A 0050 GLY C 3.720 H A 0051 VAL CB
H A 0051 VAL C 2.433 H A 0052 ILE CA
H A 0051 VAL C 3.065 H A 0052 ILE C
H A 0051 VAL C 3.731 H A 0052 ILE CB
H A 0052 ILE C 2.434 H A 0053 ARG CA
H A 0052 ILE C 2.967 H A 0053 ARG C
H A 0052 ILE C 3.715 H A 0053 ARG CB
H A 0053 ARG C 2.433 H A 0054 ARG CA
H A 0053 ARG C 3.087 H A 0054 ARG C
H A 0053 ARG C 3.704 H A 0054 ARG CB
H A 0054 ARG C 2.435 H A 0055 VAL CA
H A 0054 ARG C 2.959 H A 0055 VAL C
H A 0054 ARG C 3.736 H A 0055 VAL CB
H A 0055 VAL C 2.434 H A 0056 SER CA
H A 0055 VAL C 2.868 H A 0056 SER C
H A 0055 VAL C 3.700 H A 0056 SER CB
H A 0055 VAL CG1 3.271 H A 0059 PHE CD2
H A 0055 VAL CG1 3.526 H A 0059 PHE CE2
H A 0056 SER C 2.434 H A 0057 GLN CA
H A 0056 SER C 2.963 H A 0057 GLN C
H A 0056 SER C 3.715 H A 0057 GLN CB
H A 0057 GLN C 2.434 H A 0058 LEU CA
H A 0057 GLN C 2.992 H A 0058 LEU C
H A 0057 GLN C 3.714 H A 0058 LEU CB
H A 0058 LEU C 2.434 H A 0059 PHE CA
H A 0058 LEU C 3.228 H A 0059 PHE C
H A 0058 LEU C 3.660 H A 0059 PHE CB
H A 0058 LEU CD2 3.731 H A 0059 PHE CD1
H A 0058 LEU CD2 3.257 H A 0059 PHE CE1
H A 0058 LEU CD2 3.314 H A 0059 PHE CZ
H A 0059 PHE C 2.435 C A 0060 HIS CA
H A 0059 PHE C 2.970 C A 0060 HIS C
H A 0059 PHE C 3.715 C A 0060 HIS CB
H A 0059 PHE C 3.433 H A 0066 ILE CD1
H A 0059 PHE CB 3.530 H A 0066 ILE CG1
C A 0060 HIS C 2.434 C A 0061 GLU CA
C A 0060 HIS C 3.183 C A 0061 GLU C
C A 0060 HIS C 3.678 C A 0061 GLU CB
C A 0060 HIS CD2 3.678 C A 0061 GLU CG
C A 0060 HIS CE1 3.465 C A 0061 GLU CG
C A 0061 GLU C 2.435 H A 0062 HIS CA
C A 0061 GLU C 3.580 H A 0062 HIS C
C A 0061 GLU C 3.372 H A 0062 HIS CB
C A 0061 GLU C 3.363 H A 0062 HIS CG
C A 0061 GLU C 3.043 H A 0062 HIS CD2
C A 0061 GLU CB 3.595 H A 0062 HIS CD2
C A 0061 GLU C 3.636 H A 0063 PRO CD
H A 0062 HIS CA 2.868 H A 0063 PRO CD
H A 0062 HIS C 2.464 H A 0063 PRO CA
H A 0062 HIS C 3.136 H A 0063 PRO C
H A 0062 HIS C 3.646 H A 0063 PRO CB
H A 0062 HIS C 3.635 H A 0063 PRO CG
H A 0062 HIS C 2.498 H A 0063 PRO CD
H A 0062 HIS CB 3.617 H A 0065 LEU CD1
H A 0063 PRO C 2.433 H A 0064 ASP CA
H A 0063 PRO C 3.069 H A 0064 ASP C
H A 0063 PRO C 3.706 H A 0064 ASP CB
H A 0064 ASP C 2.435 H A 0065 LEU CA
H A 0064 ASP C 3.160 H A 0065 LEU C
H A 0064 ASP C 3.686 H A 0065 LEU CB
H A 0065 LEU C 2.433 H A 0066 ILE CA
H A 0065 LEU C 2.959 H A 0066 ILE C
H A 0065 LEU C 3.736 H A 0066 ILE CB
H A 0066 ILE C 2.434 H A 0067 VAL CA
H A 0066 ILE C 3.148 H A 0067 VAL C
H A 0066 ILE C 3.713 H A 0067 VAL CB
H A 0067 VAL CA 3.791 H A 0068 GLY CA
H A 0067 VAL C 2.417 H A 0068 GLY CA
H A 0067 VAL C 2.934 H A 0068 GLY C
H A 0068 GLY CA 3.796 H A 0069 PHE CA
H A 0068 GLY C 2.434 H A 0069 PHE CA
H A 0068 GLY C 2.942 H A 0069 PHE C
H A 0068 GLY C 3.714 H A 0069 PHE CB
H A 0069 PHE C 2.433 H A 0070 ASN CA
H A 0069 PHE C 2.824 H A 0070 ASN C
H A 0069 PHE C 3.682 H A 0070 ASN CB
H A 0069 PHE CE1 3.518 H A 0073 LEU CG
H A 0069 PHE CE1 3.559 H A 0073 LEU CD2
H A 0069 PHE CE2 3.622 H A 0073 LEU CD1
H A 0069 PHE CZ 3.497 H A 0073 LEU CG
H A 0069 PHE CZ 3.468 H A 0073 LEU CD1
H A 0069 PHE CZ 3.570 H A 0073 LEU CD2
H A 0070 ASN C 2.434 H A 0071 ALA CA
H A 0070 ASN C 3.013 H A 0071 ALA C
H A 0070 ASN C 3.705 H A 0071 ALA CB
H A 0071 ALA C 2.434 H A 0072 PHE CA
H A 0071 ALA C 2.866 H A 0072 PHE C
H A 0071 ALA C 3.700 H A 0072 PHE CB
H A 0072 PHE C 2.435 H A 0073 LEU CA
H A 0072 PHE C 2.817 H A 0073 LEU C
H A 0072 PHE C 3.677 H A 0073 LEU CB
H A 0073 LEU CA 2.867 C A 0074 PRO CD
H A 0073 LEU C 2.464 C A 0074 PRO CA
H A 0073 LEU C 3.136 C A 0074 PRO C
H A 0073 LEU C 3.646 C A 0074 PRO CB
H A 0073 LEU C 3.635 C A 0074 PRO CG
H A 0073 LEU C 2.498 C A 0074 PRO CD
H A 0073 LEU CB 3.680 C A 0074 PRO CD
H A 0073 LEU CD2 3.752 C A 0074 PRO CD
C A 0074 PRO C 2.434 C A 0075 SER CA
C A 0074 PRO C 2.956 C A 0075 SER C
C A 0074 PRO C 3.714 C A 0075 SER CB
C A 0075 SER CA 3.792 C A 0076 GLY CA
C A 0075 SER C 2.418 C A 0076 GLY CA
C A 0075 SER C 3.697 C A 0076 GLY C
C A 0076 GLY CA 2.865 C A 0077 PRO CD
C A 0076 GLY C 2.465 C A 0077 PRO CA
C A 0076 GLY C 3.137 C A 0077 PRO C
C A 0076 GLY C 3.646 C A 0077 PRO CB
C A 0076 GLY C 3.635 C A 0077 PRO CG
C A 0076 GLY C 2.498 C A 0077 PRO CD
C A 0077 PRO C 2.434 C A 0078 SER CA
C A 0077 PRO C 3.028 C A 0078 SER C
C A 0077 PRO C 3.713 C A 0078 SER CB
C A 0078 SER C 2.434 C A 0079 SER CA
C A 0078 SER C 2.867 C A 0079 SER C
C A 0078 SER C 3.699 C A 0079 SER CB
C A 0079 SER CA 3.792 C A 0080 GLY CA
C A 0079 SER C 2.418 C A 0080 GLY CA
C A 0079 SER C 3.478 C A 0080 GLY C
CHARGE_ATTR 2.00 12.00 56
C A 0011 GLU OE1 9.090 C A 0009 HIS ND1
C A 0011 GLU OE1 9.922 C A 0009 HIS NE2
C A 0011 GLU OE2 10.89 C A 0009 HIS ND1
C A 0011 GLU OE2 11.87 C A 0009 HIS NE2
C A 0012 ASP OD1 9.839 C A 0009 HIS ND1
C A 0012 ASP OD1 10.30 C A 0009 HIS NE2
C A 0012 ASP OD2 8.132 C A 0009 HIS ND1
C A 0012 ASP OD2 8.591 C A 0009 HIS NE2
H A 0018 ASP OD1 3.090 H A 0021 LYS NZ
H A 0018 ASP OD2 3.878 H A 0021 LYS NZ
H A 0027 ASP OD1 10.60 C A 0060 HIS ND1
H A 0027 ASP OD1 8.466 C A 0060 HIS NE2
H A 0027 ASP OD2 10.64 C A 0060 HIS ND1
H A 0027 ASP OD2 8.515 C A 0060 HIS NE2
H A 0027 ASP OD1 9.565 H A 0062 HIS ND1
H A 0027 ASP OD1 7.878 H A 0062 HIS NE2
H A 0027 ASP OD2 9.506 H A 0062 HIS ND1
H A 0027 ASP OD2 7.622 H A 0062 HIS NE2
H A 0036 GLU OE1 4.664 H A 0039 LYS NZ
H A 0036 GLU OE2 3.018 H A 0039 LYS NZ
H A 0036 GLU OE1 10.96 H A 0042 LYS NZ
H A 0036 GLU OE2 9.648 H A 0042 LYS NZ
H A 0036 GLU OE1 8.325 H A 0054 ARG NH1
H A 0036 GLU OE1 8.238 H A 0054 ARG NH2
H A 0036 GLU OE2 9.861 H A 0054 ARG NH1
H A 0036 GLU OE2 10.06 H A 0054 ARG NH2
H A 0040 GLU OE1 11.09 H A 0039 LYS NZ
H A 0040 GLU OE2 10.51 H A 0039 LYS NZ
H A 0040 GLU OE1 9.453 H A 0053 ARG NH1
H A 0040 GLU OE1 7.172 H A 0053 ARG NH2
H A 0040 GLU OE2 9.543 H A 0053 ARG NH1
H A 0040 GLU OE2 7.402 H A 0053 ARG NH2
H A 0040 GLU OE1 6.789 H A 0054 ARG NH1
H A 0040 GLU OE1 5.207 H A 0054 ARG NH2
H A 0040 GLU OE2 5.016 H A 0054 ARG NH1
H A 0040 GLU OE2 4.017 H A 0054 ARG NH2
H A 0047 ASP OD1 11.12 H A 0053 ARG NH2
H A 0047 ASP OD2 10.39 H A 0053 ARG NH1
H A 0047 ASP OD2 9.679 H A 0053 ARG NH2
C A 0061 GLU OE1 10.85 H A 0023 ARG NH1
C A 0061 GLU OE1 5.234 C A 0060 HIS ND1
C A 0061 GLU OE1 5.266 C A 0060 HIS NE2
C A 0061 GLU OE2 5.167 C A 0060 HIS ND1
C A 0061 GLU OE2 4.850 C A 0060 HIS NE2
C A 0061 GLU OE1 7.575 H A 0062 HIS ND1
C A 0061 GLU OE1 6.424 H A 0062 HIS NE2
C A 0061 GLU OE2 8.797 H A 0062 HIS ND1
C A 0061 GLU OE2 7.219 H A 0062 HIS NE2
H A 0064 ASP OD1 8.577 H A 0023 ARG NH1
H A 0064 ASP OD1 7.527 H A 0023 ARG NH2
H A 0064 ASP OD2 6.495 H A 0023 ARG NH1
H A 0064 ASP OD2 5.567 H A 0023 ARG NH2
H A 0064 ASP OD1 8.425 H A 0062 HIS ND1
H A 0064 ASP OD1 10.07 H A 0062 HIS NE2
H A 0064 ASP OD2 7.050 H A 0062 HIS ND1
H A 0064 ASP OD2 8.720 H A 0062 HIS NE2
CHARGE_REPU 2.00 12.00 29
C A 0011 GLU OE1 8.989 C A 0012 ASP OD1
C A 0011 GLU OE1 9.332 C A 0012 ASP OD2
C A 0011 GLU OE2 9.248 C A 0012 ASP OD1
C A 0011 GLU OE2 9.983 C A 0012 ASP OD2
H A 0023 ARG NH1 4.943 H A 0062 HIS ND1
H A 0023 ARG NH1 6.290 H A 0062 HIS NE2
H A 0023 ARG NH2 6.208 H A 0062 HIS ND1
H A 0023 ARG NH2 7.960 H A 0062 HIS NE2
H A 0027 ASP OD1 11.33 C A 0061 GLU OE1
H A 0027 ASP OD1 10.53 C A 0061 GLU OE2
H A 0027 ASP OD2 10.57 C A 0061 GLU OE1
H A 0027 ASP OD2 9.551 C A 0061 GLU OE2
H A 0036 GLU OE1 8.362 H A 0040 GLU OE1
H A 0036 GLU OE1 7.473 H A 0040 GLU OE2
H A 0036 GLU OE2 9.885 H A 0040 GLU OE1
H A 0036 GLU OE2 8.899 H A 0040 GLU OE2
H A 0039 LYS NZ 7.700 H A 0042 LYS NZ
H A 0040 GLU OE1 11.09 H A 0047 ASP OD1
H A 0040 GLU OE1 10.94 H A 0047 ASP OD2
H A 0053 ARG NH1 9.911 H A 0054 ARG NH1
H A 0053 ARG NH1 9.074 H A 0054 ARG NH2
H A 0053 ARG NH2 8.432 H A 0054 ARG NH1
H A 0053 ARG NH2 7.315 H A 0054 ARG NH2
C A 0060 HIS ND1 9.738 H A 0062 HIS ND1
C A 0060 HIS ND1 8.465 H A 0062 HIS NE2
C A 0060 HIS NE2 8.661 H A 0062 HIS ND1
C A 0060 HIS NE2 7.106 H A 0062 HIS NE2
C A 0061 GLU OE1 10.85 H A 0064 ASP OD1
C A 0061 GLU OE1 10.19 H A 0064 ASP OD2
HB_MM 2.00 3.20 137
C A 0002 SER N 2.250 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 VAL N 2.250 C A 0007 GLY O
C A 0009 HIS N 2.251 C A 0008 VAL O
C A 0010 VAL N 2.250 C A 0009 HIS O
C A 0011 GLU N 2.251 C A 0010 VAL O
C A 0012 ASP N 2.512 C A 0010 VAL O
C A 0012 ASP N 2.250 C A 0011 GLU O
H A 0013 ALA N 2.250 C A 0012 ASP O
H A 0014 LEU N 2.250 H A 0013 ALA O
H A 0015 THR N 2.953 H A 0013 ALA O
H A 0015 THR N 2.250 H A 0014 LEU O
H A 0016 TYR N 2.250 H A 0015 THR O
H A 0017 LEU N 2.762 H A 0014 LEU O
H A 0017 LEU N 2.250 H A 0016 TYR O
H A 0018 ASP N 2.940 H A 0014 LEU O
H A 0018 ASP N 2.250 H A 0017 LEU O
H A 0019 GLN N 2.250 H A 0018 ASP O
H A 0020 VAL N 2.998 H A 0017 LEU O
H A 0020 VAL N 2.905 H A 0018 ASP O
H A 0020 VAL N 2.250 H A 0019 GLN O
H A 0021 LYS N 2.559 H A 0018 ASP O
H A 0021 LYS N 3.187 H A 0019 GLN O
H A 0021 LYS N 2.249 H A 0020 VAL O
H A 0022 ILE N 2.989 H A 0018 ASP O
H A 0022 ILE N 3.086 H A 0019 GLN O
H A 0022 ILE N 2.250 H A 0021 LYS O
H A 0023 ARG N 2.896 H A 0019 GLN O
H A 0023 ARG N 2.251 H A 0022 ILE O
H A 0024 PHE N 3.053 H A 0020 VAL O
H A 0024 PHE N 2.250 H A 0023 ARG O
C A 0025 GLY N 2.965 H A 0021 LYS O
C A 0025 GLY N 3.192 H A 0022 ILE O
C A 0025 GLY N 2.250 H A 0024 PHE O
C A 0026 SER N 2.250 C A 0025 GLY O
H A 0027 ASP N 2.249 C A 0026 SER O
H A 0028 PRO N 2.253 H A 0027 ASP O
H A 0029 ALA N 2.249 H A 0028 PRO O
H A 0030 THR N 2.250 H A 0029 ALA O
H A 0031 TYR N 3.156 H A 0028 PRO O
H A 0031 TYR N 2.250 H A 0030 THR O
H A 0032 ASN N 2.930 H A 0028 PRO O
H A 0032 ASN N 2.249 H A 0031 TYR O
H A 0033 GLY N 2.250 H A 0032 ASN O
H A 0034 PHE N 2.921 H A 0031 TYR O
H A 0034 PHE N 2.936 H A 0032 ASN O
H A 0034 PHE N 2.250 H A 0033 GLY O
H A 0035 LEU N 3.133 H A 0031 TYR O
H A 0035 LEU N 2.777 H A 0032 ASN O
H A 0035 LEU N 2.250 H A 0034 PHE O
H A 0036 GLU N 2.251 H A 0035 LEU O
H A 0037 ILE N 3.060 H A 0033 GLY O
H A 0037 ILE N 3.076 H A 0034 PHE O
H A 0037 ILE N 2.250 H A 0036 GLU O
H A 0038 MET N 3.159 H A 0034 PHE O
H A 0038 MET N 3.120 H A 0036 GLU O
H A 0038 MET N 2.250 H A 0037 ILE O
H A 0039 LYS N 3.001 H A 0036 GLU O
H A 0039 LYS N 2.249 H A 0038 MET O
H A 0040 GLU N 2.938 H A 0038 MET O
H A 0040 GLU N 2.251 H A 0039 LYS O
H A 0041 PHE N 2.688 H A 0038 MET O
H A 0041 PHE N 3.111 H A 0039 LYS O
H A 0041 PHE N 2.250 H A 0040 GLU O
H A 0042 LYS N 2.928 H A 0038 MET O
H A 0042 LYS N 2.839 H A 0039 LYS O
H A 0042 LYS N 2.249 H A 0041 PHE O
H A 0043 SER N 2.819 H A 0039 LYS O
H A 0043 SER N 3.095 H A 0040 GLU O
H A 0043 SER N 2.964 H A 0041 PHE O
H A 0043 SER N 2.250 H A 0042 LYS O
C A 0044 GLN N 2.950 H A 0041 PHE O
C A 0044 GLN N 2.251 H A 0043 SER O
C A 0045 SER N 2.970 H A 0040 GLU O
C A 0045 SER N 3.133 H A 0043 SER O
C A 0045 SER N 2.251 C A 0044 GLN O
C A 0046 ILE N 2.250 C A 0045 SER O
H A 0047 ASP N 2.250 C A 0046 ILE O
H A 0048 THR N 2.250 H A 0047 ASP O
H A 0049 PRO N 2.253 H A 0048 THR O
H A 0050 GLY N 2.626 H A 0047 ASP O
H A 0050 GLY N 3.070 H A 0048 THR O
H A 0050 GLY N 2.250 H A 0049 PRO O
H A 0051 VAL N 2.944 H A 0047 ASP O
H A 0051 VAL N 2.251 H A 0050 GLY O
H A 0052 ILE N 2.251 H A 0051 VAL O
H A 0053 ARG N 2.251 H A 0052 ILE O
H A 0054 ARG N 2.250 H A 0053 ARG O
H A 0055 VAL N 3.104 H A 0051 VAL O
H A 0055 VAL N 2.251 H A 0054 ARG O
H A 0056 SER N 2.859 H A 0052 ILE O
H A 0056 SER N 2.250 H A 0055 VAL O
H A 0057 GLN N 3.150 H A 0055 VAL O
H A 0057 GLN N 2.250 H A 0056 SER O
H A 0058 LEU N 3.054 H A 0054 ARG O
H A 0058 LEU N 2.754 H A 0055 VAL O
H A 0058 LEU N 2.251 H A 0057 GLN O
H A 0059 PHE N 2.773 H A 0055 VAL O
H A 0059 PHE N 2.249 H A 0058 LEU O
C A 0060 HIS N 2.899 H A 0056 SER O
C A 0060 HIS N 3.057 H A 0058 LEU O
C A 0060 HIS N 2.250 H A 0059 PHE O
C A 0061 GLU N 3.184 H A 0059 PHE O
C A 0061 GLU N 2.251 C A 0060 HIS O
H A 0062 HIS N 2.732 H A 0059 PHE O
H A 0062 HIS N 2.250 C A 0061 GLU O
H A 0063 PRO N 2.253 H A 0062 HIS O
H A 0064 ASP N 2.250 H A 0063 PRO O
H A 0065 LEU N 2.250 H A 0064 ASP O
H A 0066 ILE N 2.250 H A 0065 LEU O
H A 0067 VAL N 2.251 H A 0066 ILE O
H A 0068 GLY N 3.042 H A 0064 ASP O
H A 0068 GLY N 2.249 H A 0067 VAL O
H A 0069 PHE N 3.001 H A 0065 LEU O
H A 0069 PHE N 2.250 H A 0068 GLY O
H A 0070 ASN N 3.197 H A 0067 VAL O
H A 0070 ASN N 2.249 H A 0069 PHE O
H A 0071 ALA N 3.065 H A 0069 PHE O
H A 0071 ALA N 2.250 H A 0070 ASN O
H A 0072 PHE N 2.753 H A 0068 GLY O
H A 0072 PHE N 2.831 H A 0069 PHE O
H A 0072 PHE N 2.250 H A 0071 ALA O
H A 0073 LEU N 2.783 H A 0069 PHE O
H A 0073 LEU N 3.029 H A 0071 ALA O
H A 0073 LEU N 2.250 H A 0072 PHE O
C A 0074 PRO N 2.253 H A 0073 LEU O
C A 0075 SER N 2.250 C A 0074 PRO O
C A 0076 GLY N 2.249 C A 0075 SER O
C A 0077 PRO N 2.253 C A 0076 GLY O
C A 0078 SER N 3.078 C A 0076 GLY O
C A 0078 SER N 2.250 C A 0077 PRO O
C A 0079 SER N 2.250 C A 0078 SER O
C A 0080 GLY N 2.249 C A 0079 SER O
HB_MS 2.00 3.20 4
H A 0028 PRO O 2.966 H A 0032 ASN ND2
H A 0040 GLU O 3.103 C A 0045 SER OG
H A 0065 LEU O 2.778 H A 0016 TYR OH
H A 0066 ILE O 2.897 H A 0070 ASN ND2
HB_SS 2.00 3.20 1
H A 0027 ASP OD1 2.818 H A 0030 THR OG1
AROMATIC 0.00 8.00 2
H A 0023 ARG 6.000 H A 0062 HIS
H A 0024 PHE 5.011 H A 0059 PHE