Complet list of 2ctp con file
Complete list of 2ctp.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 344
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 3.576 C A 0002 SER C
C A 0001 GLY C 3.379 C A 0002 SER CB
C A 0002 SER C 2.434 C A 0003 SER CA
C A 0002 SER C 2.850 C A 0003 SER C
C A 0002 SER C 3.693 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 3.274 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 2.835 C A 0005 SER C
C A 0004 GLY C 3.199 C A 0005 SER CB
C A 0005 SER C 2.434 C A 0006 SER CA
C A 0005 SER C 3.403 C A 0006 SER C
C A 0005 SER C 3.556 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 3.321 C A 0007 GLY C
C A 0007 GLY CA 3.795 H A 0008 ASP CA
C A 0007 GLY C 2.433 H A 0008 ASP CA
C A 0007 GLY C 3.497 H A 0008 ASP C
C A 0007 GLY C 3.471 H A 0008 ASP CB
C A 0007 GLY C 3.706 H A 0008 ASP CG
H A 0008 ASP C 2.433 H A 0009 TYR CA
H A 0008 ASP C 2.916 H A 0009 TYR C
H A 0008 ASP C 3.709 H A 0009 TYR CB
H A 0009 TYR C 2.433 H A 0010 TYR CA
H A 0009 TYR C 2.869 H A 0010 TYR C
H A 0009 TYR C 3.698 H A 0010 TYR CB
H A 0009 TYR CA 3.615 H A 0055 ALA CB
H A 0009 TYR CB 3.627 H A 0055 ALA CB
H A 0009 TYR CD1 3.717 H A 0055 ALA CA
H A 0009 TYR CD1 3.681 H A 0055 ALA CB
H A 0009 TYR CE2 3.651 H A 0058 VAL CG1
H A 0009 TYR CB 3.717 H A 0059 LEU CD2
H A 0009 TYR CG 3.670 H A 0068 TYR CE1
H A 0009 TYR CG 3.621 H A 0068 TYR CZ
H A 0009 TYR CD2 3.326 H A 0068 TYR CG
H A 0009 TYR CD2 2.994 H A 0068 TYR CD1
H A 0009 TYR CD2 3.558 H A 0068 TYR CD2
H A 0009 TYR CD2 2.940 H A 0068 TYR CE1
H A 0009 TYR CD2 3.514 H A 0068 TYR CE2
H A 0009 TYR CD2 3.212 H A 0068 TYR CZ
H A 0009 TYR CE2 3.496 H A 0068 TYR CG
H A 0009 TYR CE2 2.816 H A 0068 TYR CD1
H A 0009 TYR CE2 3.022 H A 0068 TYR CE1
H A 0009 TYR CZ 3.794 H A 0068 TYR CE1
H A 0010 TYR C 2.434 H A 0011 GLU CA
H A 0010 TYR C 3.014 H A 0011 GLU C
H A 0010 TYR C 3.714 H A 0011 GLU CB
H A 0010 TYR CD1 3.614 C A 0015 VAL CG2
H A 0010 TYR CD2 3.768 C A 0017 ARG CG
H A 0010 TYR CD2 3.115 C A 0017 ARG CD
H A 0010 TYR CE2 3.316 C A 0017 ARG CD
H A 0010 TYR CD1 3.302 H A 0059 LEU CD1
H A 0010 TYR CE1 3.510 H A 0059 LEU CD1
H A 0010 TYR CD2 3.589 H A 0068 TYR CE2
H A 0010 TYR CE2 3.702 H A 0068 TYR CE2
H A 0011 GLU C 2.433 H A 0012 ILE CA
H A 0011 GLU C 2.860 H A 0012 ILE C
H A 0011 GLU C 3.717 H A 0012 ILE CB
H A 0012 ILE C 2.434 H A 0013 LEU CA
H A 0012 ILE C 3.180 H A 0013 LEU C
H A 0012 ILE C 3.678 H A 0013 LEU CB
H A 0012 ILE CG2 3.737 H A 0052 ILE CA
H A 0013 LEU CA 3.792 H A 0014 GLY CA
H A 0013 LEU C 2.419 H A 0014 GLY CA
H A 0013 LEU C 3.377 H A 0014 GLY C
H A 0013 LEU CD1 3.744 H A 0024 LEU CD2
H A 0013 LEU CA 3.557 H A 0031 LEU CD1
H A 0013 LEU C 3.692 H A 0031 LEU CD1
H A 0013 LEU CD2 3.654 H A 0052 ILE CG2
H A 0013 LEU CD1 3.493 H A 0059 LEU CD1
H A 0014 GLY CA 3.797 C A 0015 VAL CA
H A 0014 GLY C 2.434 C A 0015 VAL CA
H A 0014 GLY C 3.614 C A 0015 VAL C
H A 0014 GLY C 3.349 C A 0015 VAL CB
H A 0014 GLY C 3.232 C A 0015 VAL CG1
C A 0015 VAL C 2.434 C A 0016 SER CA
C A 0015 VAL C 3.268 C A 0016 SER C
C A 0015 VAL C 3.642 C A 0016 SER CB
C A 0016 SER C 2.434 C A 0017 ARG CA
C A 0016 SER C 3.110 C A 0017 ARG C
C A 0016 SER C 3.699 C A 0017 ARG CB
C A 0017 ARG CA 3.792 C A 0018 GLY CA
C A 0017 ARG C 2.417 C A 0018 GLY CA
C A 0017 ARG C 3.518 C A 0018 GLY C
C A 0018 GLY CA 3.796 C A 0019 ALA CA
C A 0018 GLY C 2.434 C A 0019 ALA CA
C A 0018 GLY C 3.060 C A 0019 ALA C
C A 0018 GLY C 3.700 C A 0019 ALA CB
C A 0019 ALA C 2.435 H A 0020 SER CA
C A 0019 ALA C 3.093 H A 0020 SER C
C A 0019 ALA C 3.704 H A 0020 SER CB
H A 0020 SER C 2.434 H A 0021 ASP CA
H A 0020 SER C 3.000 H A 0021 ASP C
H A 0020 SER C 3.715 H A 0021 ASP CB
H A 0021 ASP C 2.433 H A 0022 GLU CA
H A 0021 ASP C 2.856 H A 0022 GLU C
H A 0021 ASP C 3.696 H A 0022 GLU CB
H A 0022 GLU C 2.434 H A 0023 ASP CA
H A 0022 GLU C 2.998 H A 0023 ASP C
H A 0022 GLU C 3.714 H A 0023 ASP CB
H A 0023 ASP C 2.434 H A 0024 LEU CA
H A 0023 ASP C 2.967 H A 0024 LEU C
H A 0023 ASP C 3.714 H A 0024 LEU CB
H A 0024 LEU C 2.434 H A 0025 LYS CA
H A 0024 LEU C 3.014 H A 0025 LYS C
H A 0024 LEU C 3.714 H A 0025 LYS CB
H A 0024 LEU C 3.600 H A 0056 TYR CE1
H A 0024 LEU CD1 3.668 H A 0059 LEU C
H A 0024 LEU CD1 3.422 H A 0059 LEU CB
H A 0024 LEU CD2 3.528 H A 0059 LEU CB
H A 0024 LEU CD2 3.124 H A 0059 LEU CD1
H A 0025 LYS C 2.434 H A 0026 LYS CA
H A 0025 LYS C 2.833 H A 0026 LYS C
H A 0025 LYS C 3.686 H A 0026 LYS CB
H A 0025 LYS CA 3.369 H A 0056 TYR CE1
H A 0026 LYS C 2.433 H A 0027 ALA CA
H A 0026 LYS C 2.980 H A 0027 ALA C
H A 0026 LYS C 3.707 H A 0027 ALA CB
H A 0027 ALA C 2.434 H A 0028 TYR CA
H A 0027 ALA C 2.893 H A 0028 TYR C
H A 0027 ALA C 3.705 H A 0028 TYR CB
H A 0028 TYR C 2.433 H A 0029 ARG CA
H A 0028 TYR C 3.002 H A 0029 ARG C
H A 0028 TYR C 3.715 H A 0029 ARG CB
H A 0028 TYR CD1 3.462 H A 0052 ILE CG2
H A 0028 TYR CE1 3.702 H A 0052 ILE CG2
H A 0028 TYR CE1 3.384 H A 0053 GLY CA
H A 0028 TYR CZ 3.642 H A 0053 GLY CA
H A 0028 TYR CB 3.479 H A 0056 TYR CD1
H A 0028 TYR CG 3.692 H A 0056 TYR CB
H A 0028 TYR CG 3.584 H A 0056 TYR CG
H A 0028 TYR CG 3.679 H A 0056 TYR CD1
H A 0028 TYR CD1 3.783 H A 0056 TYR CB
H A 0028 TYR CD2 3.434 H A 0056 TYR CG
H A 0028 TYR CD2 3.681 H A 0056 TYR CD1
H A 0028 TYR CD2 3.550 H A 0056 TYR CD2
H A 0028 TYR CE2 3.687 H A 0056 TYR CD2
H A 0029 ARG C 2.433 H A 0030 ARG CA
H A 0029 ARG C 2.830 H A 0030 ARG C
H A 0029 ARG C 3.685 H A 0030 ARG CB
H A 0029 ARG C 3.709 H A 0033 LEU CD2
H A 0030 ARG C 2.434 H A 0031 LEU CA
H A 0030 ARG C 3.165 H A 0031 LEU C
H A 0030 ARG C 3.683 H A 0031 LEU CB
H A 0031 LEU C 2.433 H A 0032 ALA CA
H A 0031 LEU C 2.867 H A 0032 ALA C
H A 0031 LEU C 3.692 H A 0032 ALA CB
H A 0032 ALA C 2.434 H A 0033 LEU CA
H A 0032 ALA C 2.944 H A 0033 LEU C
H A 0032 ALA C 3.713 H A 0033 LEU CB
H A 0032 ALA CB 3.667 H A 0049 PHE CD1
H A 0032 ALA CB 3.284 H A 0049 PHE CE1
H A 0033 LEU C 2.434 C A 0034 LYS CA
H A 0033 LEU C 3.190 C A 0034 LYS C
H A 0033 LEU C 3.675 C A 0034 LYS CB
C A 0034 LYS C 2.435 C A 0035 PHE CA
C A 0034 LYS C 3.415 C A 0035 PHE C
C A 0034 LYS C 3.549 C A 0035 PHE CB
C A 0034 LYS C 3.730 C A 0035 PHE CG
C A 0034 LYS CD 3.471 C A 0035 PHE CE2
C A 0034 LYS CD 3.561 C A 0035 PHE CZ
C A 0034 LYS CE 3.601 C A 0035 PHE CE1
C A 0034 LYS CE 3.724 C A 0035 PHE CE2
C A 0034 LYS CE 3.221 C A 0035 PHE CZ
C A 0035 PHE C 2.434 C A 0036 HIS CA
C A 0035 PHE C 3.198 C A 0036 HIS C
C A 0035 PHE C 3.672 C A 0036 HIS CB
C A 0035 PHE CD1 3.666 H A 0045 ALA CA
C A 0035 PHE CD1 3.692 H A 0045 ALA C
C A 0035 PHE CD1 3.597 H A 0045 ALA CB
C A 0035 PHE CD2 3.515 H A 0052 ILE CD1
C A 0036 HIS CA 2.867 C A 0037 PRO CD
C A 0036 HIS C 2.464 C A 0037 PRO CA
C A 0036 HIS C 3.136 C A 0037 PRO C
C A 0036 HIS C 3.645 C A 0037 PRO CB
C A 0036 HIS C 3.635 C A 0037 PRO CG
C A 0036 HIS C 2.497 C A 0037 PRO CD
C A 0036 HIS CB 3.593 C A 0037 PRO CD
C A 0036 HIS CG 3.314 C A 0037 PRO CD
C A 0036 HIS CD2 3.758 C A 0037 PRO CD
C A 0036 HIS CE1 3.743 C A 0038 ASP CB
C A 0036 HIS CE1 3.766 C A 0038 ASP CG
C A 0037 PRO C 2.434 C A 0038 ASP CA
C A 0037 PRO C 3.251 C A 0038 ASP C
C A 0037 PRO C 3.650 C A 0038 ASP CB
C A 0037 PRO CA 3.750 H A 0046 THR CG2
C A 0037 PRO CB 3.385 H A 0046 THR CG2
C A 0037 PRO CD 3.715 H A 0046 THR CG2
C A 0038 ASP C 2.434 C A 0039 LYS CA
C A 0038 ASP C 3.224 C A 0039 LYS C
C A 0038 ASP C 3.662 C A 0039 LYS CB
C A 0039 LYS C 2.434 C A 0040 ASN CA
C A 0039 LYS C 3.101 C A 0040 ASN C
C A 0039 LYS C 3.702 C A 0040 ASN CB
C A 0040 ASN C 2.435 C A 0041 HIS CA
C A 0040 ASN C 3.352 C A 0041 HIS C
C A 0040 ASN C 3.593 C A 0041 HIS CB
C A 0040 ASN CG 3.466 H A 0045 ALA CB
C A 0041 HIS C 2.434 H A 0042 ALA CA
C A 0041 HIS C 3.257 H A 0042 ALA C
C A 0041 HIS C 3.638 H A 0042 ALA CB
C A 0041 HIS CD2 3.604 H A 0042 ALA CA
C A 0041 HIS CD2 3.743 H A 0042 ALA CB
H A 0042 ALA CA 2.866 H A 0043 PRO CD
H A 0042 ALA C 2.464 H A 0043 PRO CA
H A 0042 ALA C 3.136 H A 0043 PRO C
H A 0042 ALA C 3.646 H A 0043 PRO CB
H A 0042 ALA C 3.636 H A 0043 PRO CG
H A 0042 ALA C 2.498 H A 0043 PRO CD
H A 0042 ALA CB 3.525 H A 0043 PRO CD
H A 0043 PRO CA 3.792 H A 0044 GLY CA
H A 0043 PRO C 2.418 H A 0044 GLY CA
H A 0043 PRO C 2.824 H A 0044 GLY C
H A 0044 GLY CA 3.796 H A 0045 ALA CA
H A 0044 GLY C 2.434 H A 0045 ALA CA
H A 0044 GLY C 3.094 H A 0045 ALA C
H A 0044 GLY C 3.694 H A 0045 ALA CB
H A 0045 ALA C 2.435 H A 0046 THR CA
H A 0045 ALA C 2.948 H A 0046 THR C
H A 0045 ALA C 3.736 H A 0046 THR CB
H A 0046 THR C 2.434 H A 0047 GLU CA
H A 0046 THR C 2.852 H A 0047 GLU C
H A 0046 THR C 3.695 H A 0047 GLU CB
H A 0047 GLU C 2.433 H A 0048 ALA CA
H A 0047 GLU C 3.031 H A 0048 ALA C
H A 0047 GLU C 3.704 H A 0048 ALA CB
H A 0048 ALA C 2.434 H A 0049 PHE CA
H A 0048 ALA C 2.825 H A 0049 PHE C
H A 0048 ALA C 3.682 H A 0049 PHE CB
H A 0049 PHE C 2.434 H A 0050 LYS CA
H A 0049 PHE C 2.912 H A 0050 LYS C
H A 0049 PHE C 3.709 H A 0050 LYS CB
H A 0050 LYS C 2.433 H A 0051 ALA CA
H A 0050 LYS C 3.024 H A 0051 ALA C
H A 0050 LYS C 3.704 H A 0051 ALA CB
H A 0051 ALA C 2.432 H A 0052 ILE CA
H A 0051 ALA C 2.832 H A 0052 ILE C
H A 0051 ALA C 3.705 H A 0052 ILE CB
H A 0052 ILE CA 3.791 H A 0053 GLY CA
H A 0052 ILE C 2.418 H A 0053 GLY CA
H A 0052 ILE C 2.904 H A 0053 GLY C
H A 0053 GLY CA 3.796 H A 0054 THR CA
H A 0053 GLY C 2.434 H A 0054 THR CA
H A 0053 GLY C 2.835 H A 0054 THR C
H A 0053 GLY C 3.706 H A 0054 THR CB
H A 0054 THR C 2.434 H A 0055 ALA CA
H A 0054 THR C 3.088 H A 0055 ALA C
H A 0054 THR C 3.696 H A 0055 ALA CB
H A 0055 ALA C 2.434 H A 0056 TYR CA
H A 0055 ALA C 2.991 H A 0056 TYR C
H A 0055 ALA C 3.715 H A 0056 TYR CB
H A 0056 TYR C 2.434 H A 0057 ALA CA
H A 0056 TYR C 2.888 H A 0057 ALA C
H A 0056 TYR C 3.697 H A 0057 ALA CB
H A 0057 ALA C 2.434 H A 0058 VAL CA
H A 0057 ALA C 3.171 H A 0058 VAL C
H A 0057 ALA C 3.706 H A 0058 VAL CB
H A 0058 VAL C 2.435 H A 0059 LEU CA
H A 0058 VAL C 2.928 H A 0059 LEU C
H A 0058 VAL C 3.711 H A 0059 LEU CB
H A 0058 VAL CA 3.638 H A 0064 LYS CB
H A 0058 VAL C 3.786 H A 0064 LYS CB
H A 0058 VAL CG1 3.460 H A 0064 LYS C
H A 0058 VAL CG1 3.463 H A 0064 LYS CB
H A 0059 LEU C 2.434 H A 0060 SER CA
H A 0059 LEU C 3.058 H A 0060 SER C
H A 0059 LEU C 3.709 H A 0060 SER CB
H A 0059 LEU CD2 3.720 H A 0068 TYR CD2
H A 0060 SER C 2.433 H A 0061 ASN CA
H A 0060 SER C 3.268 H A 0061 ASN C
H A 0060 SER C 3.641 H A 0061 ASN CB
H A 0061 ASN CA 2.866 H A 0062 PRO CD
H A 0061 ASN C 2.464 H A 0062 PRO CA
H A 0061 ASN C 3.136 H A 0062 PRO C
H A 0061 ASN C 3.645 H A 0062 PRO CB
H A 0061 ASN C 3.635 H A 0062 PRO CG
H A 0061 ASN C 2.498 H A 0062 PRO CD
H A 0061 ASN CB 3.517 H A 0062 PRO CD
H A 0061 ASN CB 3.712 H A 0064 LYS CB
H A 0061 ASN CB 3.435 H A 0064 LYS CG
H A 0062 PRO C 2.434 H A 0063 GLU CA
H A 0062 PRO C 3.153 H A 0063 GLU C
H A 0062 PRO C 3.688 H A 0063 GLU CB
H A 0063 GLU C 2.434 H A 0064 LYS CA
H A 0063 GLU C 3.117 H A 0064 LYS C
H A 0063 GLU C 3.697 H A 0064 LYS CB
H A 0063 GLU CA 3.774 H A 0066 LYS CG
H A 0064 LYS C 2.433 H A 0065 ARG CA
H A 0064 LYS C 3.200 H A 0065 ARG C
H A 0064 LYS C 3.671 H A 0065 ARG CB
H A 0064 LYS C 3.679 H A 0067 GLN CG
H A 0065 ARG C 2.434 H A 0066 LYS CA
H A 0065 ARG C 2.901 H A 0066 LYS C
H A 0065 ARG C 3.708 H A 0066 LYS CB
H A 0066 LYS C 2.433 H A 0067 GLN CA
H A 0066 LYS C 3.084 H A 0067 GLN C
H A 0066 LYS C 3.704 H A 0067 GLN CB
H A 0066 LYS CD 3.626 H A 0067 GLN CA
H A 0067 GLN C 2.433 H A 0068 TYR CA
H A 0067 GLN C 3.125 H A 0068 TYR C
H A 0067 GLN C 3.695 H A 0068 TYR CB
H A 0068 TYR C 2.433 H A 0069 ASP CA
H A 0068 TYR C 3.127 H A 0069 ASP C
H A 0068 TYR C 3.694 H A 0069 ASP CB
H A 0068 TYR CA 3.756 C A 0072 GLY CA
H A 0068 TYR C 3.725 C A 0072 GLY CA
H A 0069 ASP C 2.433 H A 0070 GLN CA
H A 0069 ASP C 3.044 H A 0070 GLN C
H A 0069 ASP C 3.710 H A 0070 GLN CB
H A 0070 GLN C 2.434 H A 0071 PHE CA
H A 0070 GLN C 3.378 H A 0071 PHE C
H A 0070 GLN C 3.575 H A 0071 PHE CB
H A 0070 GLN C 3.759 H A 0071 PHE CG
H A 0070 GLN CB 3.647 H A 0071 PHE CD1
H A 0071 PHE CA 3.791 C A 0072 GLY CA
H A 0071 PHE C 2.418 C A 0072 GLY CA
H A 0071 PHE C 3.440 C A 0072 GLY C
C A 0072 GLY CA 3.797 C A 0073 SER CA
C A 0072 GLY C 2.435 C A 0073 SER CA
C A 0072 GLY C 2.822 C A 0073 SER C
C A 0072 GLY C 3.682 C A 0073 SER CB
C A 0073 SER CA 3.791 C A 0074 GLY CA
C A 0073 SER C 2.418 C A 0074 GLY CA
C A 0073 SER C 3.336 C A 0074 GLY C
C A 0074 GLY CA 2.866 C A 0075 PRO CD
C A 0074 GLY C 2.464 C A 0075 PRO CA
C A 0074 GLY C 3.135 C A 0075 PRO C
C A 0074 GLY C 3.645 C A 0075 PRO CB
C A 0074 GLY C 3.636 C A 0075 PRO CG
C A 0074 GLY C 2.498 C A 0075 PRO CD
C A 0075 PRO C 2.435 C A 0076 SER CA
C A 0075 PRO C 2.900 C A 0076 SER C
C A 0075 PRO C 3.708 C A 0076 SER CB
C A 0076 SER C 2.435 C A 0077 SER CA
C A 0076 SER C 3.476 C A 0077 SER C
C A 0076 SER C 3.494 C A 0077 SER CB
C A 0077 SER CA 3.792 C A 0078 GLY CA
C A 0077 SER C 2.418 C A 0078 GLY CA
C A 0077 SER C 3.466 C A 0078 GLY C
CHARGE_ATTR 2.00 12.00 54
H A 0008 ASP OD1 5.902 C A 0017 ARG NH1
H A 0008 ASP OD1 7.489 C A 0017 ARG NH2
H A 0008 ASP OD2 4.973 C A 0017 ARG NH1
H A 0008 ASP OD2 6.974 C A 0017 ARG NH2
H A 0011 GLU OE1 8.347 C A 0017 ARG NH1
H A 0011 GLU OE1 10.61 C A 0017 ARG NH2
H A 0011 GLU OE2 6.429 C A 0017 ARG NH1
H A 0011 GLU OE2 8.719 C A 0017 ARG NH2
H A 0021 ASP OD1 10.12 H A 0025 LYS NZ
H A 0021 ASP OD2 9.859 H A 0025 LYS NZ
H A 0021 ASP OD1 4.649 H A 0065 ARG NH1
H A 0021 ASP OD1 6.458 H A 0065 ARG NH2
H A 0021 ASP OD2 5.829 H A 0065 ARG NH1
H A 0021 ASP OD2 7.692 H A 0065 ARG NH2
H A 0022 GLU OE1 3.809 H A 0025 LYS NZ
H A 0022 GLU OE2 5.759 H A 0025 LYS NZ
H A 0022 GLU OE1 6.574 H A 0026 LYS NZ
H A 0022 GLU OE2 6.300 H A 0026 LYS NZ
H A 0022 GLU OE1 10.22 H A 0029 ARG NH1
H A 0022 GLU OE1 11.90 H A 0029 ARG NH2
H A 0022 GLU OE1 11.93 H A 0065 ARG NH1
H A 0023 ASP OD1 9.609 H A 0025 LYS NZ
H A 0023 ASP OD2 11.29 H A 0025 LYS NZ
H A 0023 ASP OD1 6.348 H A 0026 LYS NZ
H A 0023 ASP OD2 7.499 H A 0026 LYS NZ
H A 0023 ASP OD1 9.208 H A 0065 ARG NH1
H A 0023 ASP OD1 8.730 H A 0065 ARG NH2
H A 0023 ASP OD2 9.576 H A 0065 ARG NH1
H A 0023 ASP OD2 8.581 H A 0065 ARG NH2
C A 0038 ASP OD1 11.87 H A 0029 ARG NH2
C A 0038 ASP OD2 11.77 H A 0029 ARG NH1
C A 0038 ASP OD2 10.20 H A 0029 ARG NH2
C A 0038 ASP OD1 5.014 C A 0036 HIS ND1
C A 0038 ASP OD1 6.246 C A 0036 HIS NE2
C A 0038 ASP OD2 3.294 C A 0036 HIS ND1
C A 0038 ASP OD2 4.152 C A 0036 HIS NE2
C A 0038 ASP OD1 9.141 C A 0039 LYS NZ
C A 0038 ASP OD2 9.068 C A 0039 LYS NZ
H A 0047 GLU OE1 9.731 H A 0050 LYS NZ
H A 0047 GLU OE2 8.318 H A 0050 LYS NZ
H A 0063 GLU OE1 7.734 H A 0064 LYS NZ
H A 0063 GLU OE2 6.612 H A 0064 LYS NZ
H A 0063 GLU OE1 7.338 H A 0066 LYS NZ
H A 0063 GLU OE2 7.544 H A 0066 LYS NZ
H A 0069 ASP OD1 5.611 C A 0017 ARG NH1
H A 0069 ASP OD1 4.890 C A 0017 ARG NH2
H A 0069 ASP OD2 7.768 C A 0017 ARG NH1
H A 0069 ASP OD2 7.010 C A 0017 ARG NH2
H A 0069 ASP OD1 7.745 H A 0065 ARG NH1
H A 0069 ASP OD1 6.343 H A 0065 ARG NH2
H A 0069 ASP OD2 5.910 H A 0065 ARG NH1
H A 0069 ASP OD2 4.978 H A 0065 ARG NH2
H A 0069 ASP OD1 11.44 H A 0066 LYS NZ
H A 0069 ASP OD2 10.20 H A 0066 LYS NZ
CHARGE_REPU 2.00 12.00 42
H A 0008 ASP OD1 5.674 H A 0011 GLU OE1
H A 0008 ASP OD1 5.326 H A 0011 GLU OE2
H A 0008 ASP OD2 4.336 H A 0011 GLU OE1
H A 0008 ASP OD2 3.414 H A 0011 GLU OE2
H A 0008 ASP OD1 8.974 H A 0069 ASP OD1
H A 0008 ASP OD1 10.44 H A 0069 ASP OD2
H A 0008 ASP OD2 9.110 H A 0069 ASP OD1
H A 0008 ASP OD2 10.85 H A 0069 ASP OD2
H A 0011 GLU OE2 10.58 H A 0069 ASP OD1
C A 0017 ARG NH1 11.28 H A 0065 ARG NH2
C A 0017 ARG NH2 10.86 H A 0065 ARG NH2
H A 0021 ASP OD1 8.397 H A 0022 GLU OE1
H A 0021 ASP OD1 9.310 H A 0022 GLU OE2
H A 0021 ASP OD2 7.580 H A 0022 GLU OE1
H A 0021 ASP OD2 8.118 H A 0022 GLU OE2
H A 0021 ASP OD1 8.678 H A 0023 ASP OD1
H A 0021 ASP OD1 9.878 H A 0023 ASP OD2
H A 0021 ASP OD2 8.792 H A 0023 ASP OD1
H A 0021 ASP OD2 10.33 H A 0023 ASP OD2
H A 0021 ASP OD1 11.53 H A 0069 ASP OD1
H A 0021 ASP OD1 9.670 H A 0069 ASP OD2
H A 0021 ASP OD2 11.40 H A 0069 ASP OD2
H A 0022 GLU OE1 7.211 H A 0023 ASP OD1
H A 0022 GLU OE1 9.265 H A 0023 ASP OD2
H A 0022 GLU OE2 7.218 H A 0023 ASP OD1
H A 0022 GLU OE2 9.378 H A 0023 ASP OD2
H A 0025 LYS NZ 7.859 H A 0026 LYS NZ
H A 0025 LYS NZ 6.474 H A 0029 ARG NH1
H A 0025 LYS NZ 8.104 H A 0029 ARG NH2
H A 0026 LYS NZ 10.03 H A 0030 ARG NH1
H A 0029 ARG NH1 9.665 C A 0036 HIS ND1
H A 0029 ARG NH1 8.086 C A 0036 HIS NE2
H A 0029 ARG NH2 8.129 C A 0036 HIS ND1
H A 0029 ARG NH2 6.838 C A 0036 HIS NE2
H A 0029 ARG NH1 11.80 C A 0039 LYS NZ
H A 0029 ARG NH2 9.639 C A 0039 LYS NZ
H A 0030 ARG NH1 10.88 C A 0034 LYS NZ
H A 0030 ARG NH2 9.674 C A 0034 LYS NZ
C A 0034 LYS NZ 11.97 C A 0041 HIS ND1
C A 0036 HIS ND1 7.486 C A 0039 LYS NZ
C A 0036 HIS NE2 8.820 C A 0039 LYS NZ
H A 0064 LYS NZ 11.79 H A 0066 LYS NZ
HB_MM 2.00 3.20 150
C A 0002 SER N 2.250 C A 0001 GLY O
C A 0003 SER N 2.251 C A 0002 SER O
C A 0004 GLY N 2.250 C A 0003 SER O
C A 0005 SER N 2.251 C A 0004 GLY O
C A 0006 SER N 2.735 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
H A 0008 ASP N 2.250 C A 0007 GLY O
H A 0009 TYR N 2.249 H A 0008 ASP O
H A 0010 TYR N 2.250 H A 0009 TYR O
H A 0011 GLU N 3.048 H A 0008 ASP O
H A 0011 GLU N 2.972 H A 0009 TYR O
H A 0011 GLU N 2.250 H A 0010 TYR O
H A 0012 ILE N 2.791 H A 0008 ASP O
H A 0012 ILE N 2.885 H A 0009 TYR O
H A 0012 ILE N 2.250 H A 0011 GLU O
H A 0013 LEU N 3.120 H A 0009 TYR O
H A 0013 LEU N 2.798 H A 0011 GLU O
H A 0013 LEU N 2.250 H A 0012 ILE O
H A 0014 GLY N 2.815 H A 0010 TYR O
H A 0014 GLY N 2.667 H A 0011 GLU O
H A 0014 GLY N 2.249 H A 0013 LEU O
C A 0015 VAL N 3.063 H A 0010 TYR O
C A 0015 VAL N 2.250 H A 0014 GLY O
C A 0016 SER N 2.250 C A 0015 VAL O
C A 0017 ARG N 2.251 C A 0016 SER O
C A 0018 GLY N 3.052 C A 0016 SER O
C A 0018 GLY N 2.249 C A 0017 ARG O
C A 0019 ALA N 2.250 C A 0018 GLY O
H A 0020 SER N 2.250 C A 0019 ALA O
H A 0021 ASP N 2.249 H A 0020 SER O
H A 0022 GLU N 2.251 H A 0021 ASP O
H A 0023 ASP N 2.923 H A 0021 ASP O
H A 0023 ASP N 2.249 H A 0022 GLU O
H A 0024 LEU N 2.984 H A 0020 SER O
H A 0024 LEU N 2.764 H A 0021 ASP O
H A 0024 LEU N 2.250 H A 0023 ASP O
H A 0025 LYS N 2.769 H A 0021 ASP O
H A 0025 LYS N 2.250 H A 0024 LEU O
H A 0026 LYS N 2.910 H A 0022 GLU O
H A 0026 LYS N 2.250 H A 0025 LYS O
H A 0027 ALA N 3.138 H A 0023 ASP O
H A 0027 ALA N 3.010 H A 0025 LYS O
H A 0027 ALA N 2.249 H A 0026 LYS O
H A 0028 TYR N 2.843 H A 0024 LEU O
H A 0028 TYR N 2.819 H A 0025 LYS O
H A 0028 TYR N 2.250 H A 0027 ALA O
H A 0029 ARG N 2.774 H A 0025 LYS O
H A 0029 ARG N 3.068 H A 0027 ALA O
H A 0029 ARG N 2.250 H A 0028 TYR O
H A 0030 ARG N 3.038 H A 0026 LYS O
H A 0030 ARG N 3.180 H A 0027 ALA O
H A 0030 ARG N 2.250 H A 0029 ARG O
H A 0031 LEU N 3.120 H A 0027 ALA O
H A 0031 LEU N 2.519 H A 0029 ARG O
H A 0031 LEU N 2.250 H A 0030 ARG O
H A 0032 ALA N 2.919 H A 0028 TYR O
H A 0032 ALA N 2.805 H A 0029 ARG O
H A 0032 ALA N 2.249 H A 0031 LEU O
H A 0033 LEU N 2.917 H A 0029 ARG O
H A 0033 LEU N 3.014 H A 0031 LEU O
H A 0033 LEU N 2.250 H A 0032 ALA O
C A 0034 LYS N 2.542 H A 0031 LEU O
C A 0034 LYS N 3.015 H A 0032 ALA O
C A 0034 LYS N 2.249 H A 0033 LEU O
C A 0035 PHE N 2.787 H A 0031 LEU O
C A 0035 PHE N 2.801 H A 0032 ALA O
C A 0035 PHE N 2.250 C A 0034 LYS O
C A 0036 HIS N 2.527 H A 0032 ALA O
C A 0036 HIS N 2.251 C A 0035 PHE O
C A 0037 PRO N 2.253 C A 0036 HIS O
C A 0038 ASP N 2.249 C A 0037 PRO O
C A 0039 LYS N 2.249 C A 0038 ASP O
C A 0040 ASN N 2.697 C A 0036 HIS O
C A 0040 ASN N 2.250 C A 0039 LYS O
C A 0041 HIS N 2.251 C A 0040 ASN O
H A 0042 ALA N 2.250 C A 0041 HIS O
H A 0043 PRO N 2.253 H A 0042 ALA O
H A 0044 GLY N 2.250 H A 0043 PRO O
H A 0045 ALA N 2.651 H A 0043 PRO O
H A 0045 ALA N 2.250 H A 0044 GLY O
H A 0046 THR N 2.589 H A 0043 PRO O
H A 0046 THR N 2.251 H A 0045 ALA O
H A 0047 GLU N 2.871 H A 0043 PRO O
H A 0047 GLU N 2.251 H A 0046 THR O
H A 0048 ALA N 2.974 H A 0045 ALA O
H A 0048 ALA N 2.740 H A 0046 THR O
H A 0048 ALA N 2.249 H A 0047 GLU O
H A 0049 PHE N 2.602 H A 0046 THR O
H A 0049 PHE N 2.250 H A 0048 ALA O
H A 0050 LYS N 2.792 H A 0048 ALA O
H A 0050 LYS N 2.249 H A 0049 PHE O
H A 0051 ALA N 2.553 H A 0048 ALA O
H A 0051 ALA N 3.171 H A 0049 PHE O
H A 0051 ALA N 2.250 H A 0050 LYS O
H A 0052 ILE N 3.102 H A 0048 ALA O
H A 0052 ILE N 2.250 H A 0051 ALA O
H A 0053 GLY N 3.124 H A 0049 PHE O
H A 0053 GLY N 3.058 H A 0051 ALA O
H A 0053 GLY N 2.250 H A 0052 ILE O
H A 0054 THR N 2.881 H A 0051 ALA O
H A 0054 THR N 2.250 H A 0053 GLY O
H A 0055 ALA N 2.904 H A 0052 ILE O
H A 0055 ALA N 2.702 H A 0053 GLY O
H A 0055 ALA N 2.249 H A 0054 THR O
H A 0056 TYR N 3.093 H A 0052 ILE O
H A 0056 TYR N 2.589 H A 0053 GLY O
H A 0056 TYR N 2.249 H A 0055 ALA O
H A 0057 ALA N 2.735 H A 0053 GLY O
H A 0057 ALA N 2.250 H A 0056 TYR O
H A 0058 VAL N 3.071 H A 0055 ALA O
H A 0058 VAL N 2.696 H A 0056 TYR O
H A 0058 VAL N 2.250 H A 0057 ALA O
H A 0059 LEU N 3.156 H A 0055 ALA O
H A 0059 LEU N 3.140 H A 0056 TYR O
H A 0059 LEU N 2.249 H A 0058 VAL O
H A 0060 SER N 2.694 H A 0056 TYR O
H A 0060 SER N 2.812 H A 0058 VAL O
H A 0060 SER N 2.250 H A 0059 LEU O
H A 0061 ASN N 2.672 H A 0058 VAL O
H A 0061 ASN N 2.250 H A 0060 SER O
H A 0062 PRO N 2.252 H A 0061 ASN O
H A 0063 GLU N 2.251 H A 0062 PRO O
H A 0064 LYS N 2.250 H A 0063 GLU O
H A 0065 ARG N 2.846 H A 0061 ASN O
H A 0065 ARG N 2.251 H A 0064 LYS O
H A 0066 LYS N 2.991 H A 0062 PRO O
H A 0066 LYS N 2.249 H A 0065 ARG O
H A 0067 GLN N 2.959 H A 0065 ARG O
H A 0067 GLN N 2.251 H A 0066 LYS O
H A 0068 TYR N 2.634 H A 0065 ARG O
H A 0068 TYR N 2.250 H A 0067 GLN O
H A 0069 ASP N 2.768 H A 0065 ARG O
H A 0069 ASP N 2.250 H A 0068 TYR O
H A 0070 GLN N 2.913 H A 0066 LYS O
H A 0070 GLN N 2.250 H A 0069 ASP O
H A 0071 PHE N 3.092 H A 0067 GLN O
H A 0071 PHE N 2.250 H A 0070 GLN O
C A 0072 GLY N 3.106 H A 0067 GLN O
C A 0072 GLY N 3.127 H A 0068 TYR O
C A 0072 GLY N 2.249 H A 0071 PHE O
C A 0073 SER N 2.250 C A 0072 GLY O
C A 0074 GLY N 2.944 C A 0072 GLY O
C A 0074 GLY N 2.250 C A 0073 SER O
C A 0075 PRO N 2.252 C A 0074 GLY O
C A 0076 SER N 2.994 C A 0074 GLY O
C A 0076 SER N 2.250 C A 0075 PRO O
C A 0077 SER N 3.113 C A 0075 PRO O
C A 0077 SER N 2.249 C A 0076 SER O
C A 0078 GLY N 2.250 C A 0077 SER O
HB_MS 2.00 3.20 10
C A 0004 GLY O 2.828 C A 0006 SER OG
H A 0009 TYR N 2.786 H A 0068 TYR OH
C A 0018 GLY O 2.928 H A 0065 ARG NH2
C A 0019 ALA O 2.917 H A 0065 ARG NH2
C A 0034 LYS O 3.086 C A 0040 ASN ND2
C A 0041 HIS N 2.649 C A 0040 ASN OD1
H A 0042 ALA N 2.772 C A 0040 ASN OD1
H A 0057 ALA O 2.801 H A 0060 SER OG
H A 0061 ASN N 2.944 H A 0060 SER OG
C A 0074 GLY N 2.677 C A 0073 SER OG
HB_SS 2.00 3.20 4
H A 0008 ASP OD1 2.937 H A 0068 TYR OH
H A 0023 ASP OD1 3.129 H A 0020 SER OG
H A 0069 ASP OD1 3.170 H A 0010 TYR OH
H A 0069 ASP OD2 2.458 H A 0010 TYR OH
AROMATIC 0.00 8.00 7
C A 0017 ARG 6.728 H A 0010 TYR
H A 0065 ARG 6.393 H A 0010 TYR
H A 0066 LYS 7.480 H A 0071 PHE
C A 0034 LYS 4.604 C A 0035 PHE
H A 0028 TYR 4.353 H A 0056 TYR
H A 0029 ARG 7.320 C A 0036 HIS
H A 0029 ARG 6.656 H A 0028 TYR