Complet list of 1a2i con file
Complete list of 1a2i.con file
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 514
C A 0001 ALA CA 2.872 C A 0002 PRO CD
C A 0001 ALA C 2.449 C A 0002 PRO CA
C A 0001 ALA C 3.136 C A 0002 PRO C
C A 0001 ALA C 3.642 C A 0002 PRO CB
C A 0001 ALA C 3.683 C A 0002 PRO CG
C A 0001 ALA C 2.513 C A 0002 PRO CD
C A 0001 ALA CB 3.122 C A 0002 PRO CD
C A 0002 PRO CA 3.785 C A 0003 LYS CA
C A 0002 PRO C 2.418 C A 0003 LYS CA
C A 0002 PRO C 2.853 C A 0003 LYS C
C A 0002 PRO C 3.133 C A 0003 LYS CB
C A 0003 LYS CA 3.785 C A 0004 ALA CA
C A 0003 LYS C 2.419 C A 0004 ALA CA
C A 0003 LYS C 3.094 C A 0004 ALA C
C A 0003 LYS C 3.667 C A 0004 ALA CB
C A 0004 ALA CA 2.873 C A 0005 PRO CD
C A 0004 ALA C 2.449 C A 0005 PRO CA
C A 0004 ALA C 3.136 C A 0005 PRO C
C A 0004 ALA C 3.642 C A 0005 PRO CB
C A 0004 ALA C 3.684 C A 0005 PRO CG
C A 0004 ALA C 2.513 C A 0005 PRO CD
C A 0004 ALA CB 3.481 C A 0005 PRO CD
C A 0004 ALA CB 3.750 C A 0022 HIS CB
C A 0005 PRO CA 3.785 C A 0006 ALA CA
C A 0005 PRO C 2.419 C A 0006 ALA CA
C A 0005 PRO C 2.955 C A 0006 ALA C
C A 0005 PRO C 3.694 C A 0006 ALA CB
C A 0005 PRO CG 3.608 C A 0022 HIS CE1
C A 0005 PRO CD 3.616 C A 0022 HIS CE1
C A 0006 ALA CA 3.785 C A 0007 ASP CA
C A 0006 ALA C 2.418 C A 0007 ASP CA
C A 0006 ALA C 3.253 C A 0007 ASP C
C A 0006 ALA C 3.641 C A 0007 ASP CB
C A 0007 ASP CA 3.786 C A 0008 GLY CA
C A 0007 ASP C 2.419 C A 0008 GLY CA
C A 0007 ASP C 3.175 C A 0008 GLY C
C A 0008 GLY CA 3.785 E A 0009 LEU CA
C A 0008 GLY C 2.418 E A 0009 LEU CA
C A 0008 GLY C 3.083 E A 0009 LEU C
C A 0008 GLY C 3.677 E A 0009 LEU CB
E A 0009 LEU CA 3.785 E A 0010 LYS CA
E A 0009 LEU C 2.418 E A 0010 LYS CA
E A 0009 LEU C 3.403 E A 0010 LYS C
E A 0009 LEU C 3.493 E A 0010 LYS CB
E A 0009 LEU CD1 3.463 E A 0020 PHE CB
E A 0010 LYS CA 3.785 E A 0011 MET CA
E A 0010 LYS C 2.418 E A 0011 MET CA
E A 0010 LYS C 3.547 E A 0011 MET C
E A 0010 LYS C 3.389 E A 0011 MET CB
E A 0010 LYS CB 3.766 E A 0019 VAL CA
E A 0010 LYS CB 3.168 E A 0019 VAL CG2
E A 0011 MET CA 3.785 C A 0012 GLU CA
E A 0011 MET C 2.418 C A 0012 GLU CA
E A 0011 MET C 3.388 C A 0012 GLU C
E A 0011 MET C 3.542 C A 0012 GLU CB
C A 0012 GLU CA 3.784 C A 0013 ALA CA
C A 0012 GLU C 2.418 C A 0013 ALA CA
C A 0012 GLU C 3.279 C A 0013 ALA C
C A 0012 GLU C 3.586 C A 0013 ALA CB
C A 0012 GLU CG 3.698 C A 0017 PRO CB
C A 0013 ALA CA 3.785 C A 0014 THR CA
C A 0013 ALA C 2.419 C A 0014 THR CA
C A 0013 ALA C 3.553 C A 0014 THR C
C A 0013 ALA C 3.318 C A 0014 THR CB
C A 0013 ALA C 3.152 C A 0014 THR CG2
C A 0014 THR CA 3.786 C A 0015 LYS CA
C A 0014 THR C 2.419 C A 0015 LYS CA
C A 0014 THR C 2.992 C A 0015 LYS C
C A 0014 THR C 3.699 C A 0015 LYS CB
C A 0014 THR CG2 3.798 H A 0065 TYR CD2
C A 0014 THR CG2 3.596 H A 0065 TYR CE2
C A 0015 LYS CA 3.785 C A 0016 GLN CA
C A 0015 LYS C 2.418 C A 0016 GLN CA
C A 0015 LYS C 3.507 C A 0016 GLN C
C A 0015 LYS C 3.429 C A 0016 GLN CB
C A 0015 LYS C 3.362 C A 0016 GLN CG
C A 0016 GLN CA 2.873 C A 0017 PRO CD
C A 0016 GLN C 2.448 C A 0017 PRO CA
C A 0016 GLN C 3.136 C A 0017 PRO C
C A 0016 GLN C 3.641 C A 0017 PRO CB
C A 0016 GLN C 3.683 C A 0017 PRO CG
C A 0016 GLN C 2.513 C A 0017 PRO CD
C A 0016 GLN CB 3.672 C A 0106 HIS CE1
C A 0017 PRO CA 3.784 E A 0018 VAL CA
C A 0017 PRO C 2.418 E A 0018 VAL CA
C A 0017 PRO C 3.601 E A 0018 VAL C
C A 0017 PRO C 3.249 E A 0018 VAL CB
C A 0017 PRO C 3.145 E A 0018 VAL CG2
E A 0018 VAL CA 3.785 E A 0019 VAL CA
E A 0018 VAL C 2.419 E A 0019 VAL CA
E A 0018 VAL C 3.468 E A 0019 VAL C
E A 0018 VAL C 3.433 E A 0019 VAL CB
E A 0018 VAL C 3.521 E A 0019 VAL CG2
E A 0018 VAL CG2 3.633 C A 0106 HIS CE1
E A 0019 VAL CA 3.785 E A 0020 PHE CA
E A 0019 VAL C 2.419 E A 0020 PHE CA
E A 0019 VAL C 3.336 E A 0020 PHE C
E A 0019 VAL C 3.549 E A 0020 PHE CB
E A 0020 PHE CA 3.785 C A 0021 ASN CA
E A 0020 PHE C 2.419 C A 0021 ASN CA
E A 0020 PHE C 3.610 C A 0021 ASN C
E A 0020 PHE C 3.300 C A 0021 ASN CB
E A 0020 PHE C 3.286 C A 0021 ASN CG
E A 0020 PHE CE2 3.687 C A 0022 HIS CE1
E A 0020 PHE CE1 3.245 C A 0025 HIS CE1
E A 0020 PHE CZ 3.764 C A 0025 HIS CE1
C A 0021 ASN CA 3.785 C A 0022 HIS CA
C A 0021 ASN C 2.419 C A 0022 HIS CA
C A 0021 ASN C 3.256 C A 0022 HIS C
C A 0021 ASN C 3.611 C A 0022 HIS CB
C A 0022 HIS CA 3.785 C A 0023 SER CA
C A 0022 HIS C 2.418 C A 0023 SER CA
C A 0022 HIS C 3.114 C A 0023 SER C
C A 0022 HIS C 3.688 C A 0023 SER CB
C A 0023 SER CA 3.785 C A 0024 THR CA
C A 0023 SER C 2.418 C A 0024 THR CA
C A 0023 SER C 3.364 C A 0024 THR C
C A 0023 SER C 3.514 C A 0024 THR CB
C A 0023 SER CA 3.310 C A 0026 LYS CG
C A 0023 SER CA 3.320 C A 0026 LYS CD
C A 0023 SER C 3.248 C A 0026 LYS CG
C A 0023 SER C 3.401 C A 0026 LYS CD
C A 0024 THR CA 3.784 C A 0025 HIS CA
C A 0024 THR C 2.419 C A 0025 HIS CA
C A 0024 THR C 3.304 C A 0025 HIS C
C A 0024 THR C 3.582 C A 0025 HIS CB
C A 0025 HIS CA 3.784 C A 0026 LYS CA
C A 0025 HIS C 2.419 C A 0026 LYS CA
C A 0025 HIS C 3.018 C A 0026 LYS C
C A 0025 HIS C 3.694 C A 0026 LYS CB
C A 0025 HIS CA 3.666 C A 0028 VAL CG2
C A 0025 HIS CB 3.649 C A 0028 VAL CG2
C A 0026 LYS CA 3.785 C A 0027 SER CA
C A 0026 LYS C 2.419 C A 0027 SER CA
C A 0026 LYS C 3.109 C A 0027 SER C
C A 0026 LYS C 3.690 C A 0027 SER CB
C A 0027 SER CA 3.785 C A 0028 VAL CA
C A 0027 SER C 2.418 C A 0028 VAL CA
C A 0027 SER C 3.206 C A 0028 VAL C
C A 0027 SER C 3.626 C A 0028 VAL CB
C A 0027 SER C 3.800 C A 0028 VAL CG2
C A 0028 VAL CA 3.785 H A 0029 LYS CA
C A 0028 VAL C 2.419 H A 0029 LYS CA
C A 0028 VAL C 3.075 H A 0029 LYS C
C A 0028 VAL C 3.679 H A 0029 LYS CB
C A 0028 VAL CG1 3.610 H A 0032 ASP CB
C A 0028 VAL CG1 3.640 H A 0032 ASP CG
H A 0029 LYS CA 3.784 H A 0030 CYS CA
H A 0029 LYS C 2.419 H A 0030 CYS CA
H A 0029 LYS C 2.932 H A 0030 CYS C
H A 0029 LYS C 3.719 H A 0030 CYS CB
H A 0029 LYS C 3.757 H A 0032 ASP CB
H A 0030 CYS CA 3.785 H A 0031 GLY CA
H A 0030 CYS C 2.418 H A 0031 GLY CA
H A 0030 CYS C 3.120 H A 0031 GLY C
H A 0031 GLY CA 3.785 H A 0032 ASP CA
H A 0031 GLY C 2.419 H A 0032 ASP CA
H A 0031 GLY C 3.128 H A 0032 ASP C
H A 0031 GLY C 3.690 H A 0032 ASP CB
H A 0032 ASP CA 3.785 H A 0033 CYS CA
H A 0032 ASP C 2.419 H A 0033 CYS CA
H A 0032 ASP C 3.335 H A 0033 CYS C
H A 0032 ASP C 3.567 H A 0033 CYS CB
H A 0033 CYS CA 3.785 H A 0034 HIS CA
H A 0033 CYS C 2.418 H A 0034 HIS CA
H A 0033 CYS C 3.100 H A 0034 HIS C
H A 0033 CYS C 3.678 H A 0034 HIS CB
H A 0034 HIS CA 3.785 C A 0035 HIS CA
H A 0034 HIS C 2.419 C A 0035 HIS CA
H A 0034 HIS C 2.820 C A 0035 HIS C
H A 0034 HIS C 3.698 C A 0035 HIS CB
C A 0035 HIS CA 2.872 C A 0036 PRO CD
C A 0035 HIS C 2.448 C A 0036 PRO CA
C A 0035 HIS C 3.136 C A 0036 PRO C
C A 0035 HIS C 3.642 C A 0036 PRO CB
C A 0035 HIS C 3.683 C A 0036 PRO CG
C A 0035 HIS C 2.513 C A 0036 PRO CD
C A 0035 HIS CB 3.453 C A 0036 PRO CD
C A 0035 HIS CE1 3.058 C A 0037 VAL CG2
C A 0035 HIS CB 3.606 C A 0076 PHE CD1
C A 0035 HIS CB 3.624 C A 0076 PHE CE1
C A 0036 PRO CA 3.785 C A 0037 VAL CA
C A 0036 PRO C 2.418 C A 0037 VAL CA
C A 0036 PRO C 3.498 C A 0037 VAL C
C A 0036 PRO C 3.400 C A 0037 VAL CB
C A 0036 PRO C 3.413 C A 0037 VAL CG2
C A 0037 VAL CA 3.785 C A 0038 ASN CA
C A 0037 VAL C 2.418 C A 0038 ASN CA
C A 0037 VAL C 3.150 C A 0038 ASN C
C A 0037 VAL C 2.816 C A 0038 ASN CB
C A 0038 ASN CA 3.785 C A 0039 GLY CA
C A 0038 ASN C 2.419 C A 0039 GLY CA
C A 0038 ASN C 3.330 C A 0039 GLY C
C A 0039 GLY CA 3.785 C A 0040 LYS CA
C A 0039 GLY C 2.418 C A 0040 LYS CA
C A 0039 GLY C 3.358 C A 0040 LYS C
C A 0039 GLY C 3.530 C A 0040 LYS CB
C A 0040 LYS CA 3.784 C A 0041 GLU CA
C A 0040 LYS C 2.419 C A 0041 GLU CA
C A 0040 LYS C 3.432 C A 0041 GLU C
C A 0040 LYS C 3.505 C A 0041 GLU CB
C A 0041 GLU CA 3.785 C A 0042 ASP CA
C A 0041 GLU C 2.418 C A 0042 ASP CA
C A 0041 GLU C 3.629 C A 0042 ASP C
C A 0041 GLU C 3.262 C A 0042 ASP CB
C A 0042 ASP CA 3.785 C A 0043 TYR CA
C A 0042 ASP C 2.418 C A 0043 TYR CA
C A 0042 ASP C 3.316 C A 0043 TYR C
C A 0042 ASP C 3.561 C A 0043 TYR CB
C A 0042 ASP C 3.799 C A 0043 TYR CG
C A 0042 ASP C 3.496 C A 0043 TYR CD1
C A 0043 TYR CA 3.785 C A 0044 ARG CA
C A 0043 TYR C 2.419 C A 0044 ARG CA
C A 0043 TYR C 3.506 C A 0044 ARG C
C A 0043 TYR C 3.448 C A 0044 ARG CB
C A 0044 ARG CA 3.784 C A 0045 LYS CA
C A 0044 ARG C 2.418 C A 0045 LYS CA
C A 0044 ARG C 3.193 C A 0045 LYS C
C A 0044 ARG C 3.633 C A 0045 LYS CB
C A 0045 LYS CA 3.785 C A 0046 CYS CA
C A 0045 LYS C 2.419 C A 0046 CYS CA
C A 0045 LYS C 2.904 C A 0046 CYS C
C A 0045 LYS C 3.720 C A 0046 CYS CB
C A 0046 CYS CA 3.785 C A 0047 GLY CA
C A 0046 CYS C 2.419 C A 0047 GLY CA
C A 0046 CYS C 3.174 C A 0047 GLY C
C A 0047 GLY CA 3.785 C A 0048 THR CA
C A 0047 GLY C 2.418 C A 0048 THR CA
C A 0047 GLY C 3.228 C A 0048 THR C
C A 0047 GLY C 3.599 C A 0048 THR CB
C A 0048 THR CA 3.785 C A 0049 ALA CA
C A 0048 THR C 2.419 C A 0049 ALA CA
C A 0048 THR C 2.909 C A 0049 ALA C
C A 0048 THR C 3.694 C A 0049 ALA CB
C A 0049 ALA CA 3.786 C A 0050 GLY CA
C A 0049 ALA C 2.419 C A 0050 GLY CA
C A 0049 ALA C 3.495 C A 0050 GLY C
C A 0050 GLY CA 3.785 C A 0051 CYS CA
C A 0050 GLY C 2.418 C A 0051 CYS CA
C A 0050 GLY C 3.361 C A 0051 CYS C
C A 0050 GLY C 3.547 C A 0051 CYS CB
C A 0051 CYS CA 3.786 C A 0052 HIS CA
C A 0051 CYS C 2.419 C A 0052 HIS CA
C A 0051 CYS C 3.369 C A 0052 HIS C
C A 0051 CYS C 3.535 C A 0052 HIS CB
C A 0051 CYS C 3.779 C A 0052 HIS CG
C A 0052 HIS CA 3.785 C A 0053 ASP CA
C A 0052 HIS C 2.419 C A 0053 ASP CA
C A 0052 HIS C 3.563 C A 0053 ASP C
C A 0052 HIS C 3.375 C A 0053 ASP CB
C A 0052 HIS CE1 3.542 H A 0068 VAL CG1
C A 0053 ASP CA 3.785 C A 0054 SER CA
C A 0053 ASP C 2.419 C A 0054 SER CA
C A 0053 ASP C 3.381 C A 0054 SER C
C A 0053 ASP C 3.551 C A 0054 SER CB
C A 0054 SER CA 3.785 C A 0055 MET CA
C A 0054 SER C 2.418 C A 0055 MET CA
C A 0054 SER C 2.890 C A 0055 MET C
C A 0054 SER C 3.072 C A 0055 MET CB
C A 0054 SER CB 3.695 C A 0063 LYS C
C A 0055 MET CA 3.785 C A 0056 ASP CA
C A 0055 MET C 2.419 C A 0056 ASP CA
C A 0055 MET C 3.346 C A 0056 ASP C
C A 0055 MET C 3.588 C A 0056 ASP CB
C A 0056 ASP CA 3.785 C A 0057 LYS CA
C A 0056 ASP C 2.419 C A 0057 LYS CA
C A 0056 ASP C 3.035 C A 0057 LYS C
C A 0056 ASP C 2.945 C A 0057 LYS CB
C A 0057 LYS CA 3.785 C A 0058 LYS CA
C A 0057 LYS C 2.419 C A 0058 LYS CA
C A 0057 LYS C 3.148 C A 0058 LYS C
C A 0057 LYS C 3.654 C A 0058 LYS CB
C A 0057 LYS CE 3.687 C A 0058 LYS CA
C A 0057 LYS CG 3.755 H A 0066 TYR CG
C A 0057 LYS CG 3.627 H A 0066 TYR CD1
C A 0057 LYS CE 3.589 H A 0066 TYR CE1
C A 0058 LYS CA 3.785 C A 0059 ASP CA
C A 0058 LYS C 2.419 C A 0059 ASP CA
C A 0058 LYS C 3.590 C A 0059 ASP C
C A 0058 LYS C 3.335 C A 0059 ASP CB
C A 0059 ASP CA 3.785 C A 0060 LYS CA
C A 0059 ASP C 2.418 C A 0060 LYS CA
C A 0059 ASP C 2.813 C A 0060 LYS C
C A 0059 ASP C 3.183 C A 0060 LYS CB
C A 0059 ASP C 2.944 C A 0060 LYS CG
C A 0060 LYS CA 3.785 C A 0061 SER CA
C A 0060 LYS C 2.418 C A 0061 SER CA
C A 0060 LYS C 3.668 C A 0061 SER C
C A 0060 LYS C 3.156 C A 0061 SER CB
C A 0060 LYS CA 3.662 H A 0067 HIS CB
C A 0060 LYS CA 3.495 H A 0067 HIS CG
C A 0061 SER CA 3.785 C A 0062 ALA CA
C A 0061 SER C 2.418 C A 0062 ALA CA
C A 0061 SER C 3.692 C A 0062 ALA C
C A 0061 SER C 2.931 C A 0062 ALA CB
C A 0062 ALA CA 3.786 C A 0063 LYS CA
C A 0062 ALA C 2.419 C A 0063 LYS CA
C A 0062 ALA C 2.999 C A 0063 LYS C
C A 0062 ALA C 3.698 C A 0063 LYS CB
C A 0063 LYS CA 3.785 H A 0064 GLY CA
C A 0063 LYS C 2.418 H A 0064 GLY CA
C A 0063 LYS C 3.016 H A 0064 GLY C
H A 0064 GLY CA 3.784 H A 0065 TYR CA
H A 0064 GLY C 2.419 H A 0065 TYR CA
H A 0064 GLY C 2.931 H A 0065 TYR C
H A 0064 GLY C 3.647 H A 0065 TYR CB
H A 0064 GLY C 3.794 H A 0067 HIS CB
H A 0065 TYR CA 3.785 H A 0066 TYR CA
H A 0065 TYR C 2.419 H A 0066 TYR CA
H A 0065 TYR C 3.144 H A 0066 TYR C
H A 0065 TYR C 3.632 H A 0066 TYR CB
H A 0065 TYR CA 3.606 H A 0068 VAL CG2
H A 0065 TYR C 3.606 H A 0068 VAL CG2
H A 0066 TYR CA 3.785 H A 0067 HIS CA
H A 0066 TYR C 2.419 H A 0067 HIS CA
H A 0066 TYR C 3.304 H A 0067 HIS C
H A 0066 TYR C 3.582 H A 0067 HIS CB
H A 0066 TYR CD2 3.466 C A 0070 HIS CE1
H A 0066 TYR CE2 3.745 C A 0070 HIS CE1
H A 0067 HIS CA 3.784 H A 0068 VAL CA
H A 0067 HIS C 2.418 H A 0068 VAL CA
H A 0067 HIS C 3.191 H A 0068 VAL C
H A 0067 HIS C 3.635 H A 0068 VAL CB
H A 0067 HIS CD2 3.603 H A 0068 VAL CG1
H A 0067 HIS C 3.579 C A 0071 ASP CB
H A 0067 HIS CG 3.563 C A 0071 ASP CB
H A 0067 HIS CE1 3.275 C A 0071 ASP CB
H A 0067 HIS CE1 2.912 C A 0071 ASP CG
H A 0067 HIS CE1 3.197 C A 0074 THR CG2
H A 0068 VAL CA 3.785 C A 0069 MET CA
H A 0068 VAL C 2.419 C A 0069 MET CA
H A 0068 VAL C 3.470 C A 0069 MET C
H A 0068 VAL C 3.475 C A 0069 MET CB
H A 0068 VAL C 3.508 C A 0069 MET CG
C A 0069 MET CA 3.785 C A 0070 HIS CA
C A 0069 MET C 2.419 C A 0070 HIS CA
C A 0069 MET C 3.551 C A 0070 HIS C
C A 0069 MET C 3.345 C A 0070 HIS CB
C A 0069 MET C 3.262 C A 0070 HIS CG
C A 0069 MET CB 3.597 C A 0070 HIS CE1
C A 0070 HIS CA 3.785 C A 0071 ASP CA
C A 0070 HIS C 2.418 C A 0071 ASP CA
C A 0070 HIS C 2.793 C A 0071 ASP C
C A 0070 HIS C 3.681 C A 0071 ASP CB
C A 0070 HIS CA 3.714 H A 0080 VAL CG2
C A 0071 ASP CA 3.785 C A 0072 LYS CA
C A 0071 ASP C 2.419 C A 0072 LYS CA
C A 0071 ASP C 3.328 C A 0072 LYS C
C A 0071 ASP C 3.554 C A 0072 LYS CB
C A 0071 ASP C 3.618 C A 0072 LYS CG
C A 0071 ASP CB 3.611 C A 0074 THR CG2
C A 0072 LYS CA 3.785 C A 0073 ASN CA
C A 0072 LYS C 2.418 C A 0073 ASN CA
C A 0072 LYS C 3.095 C A 0073 ASN C
C A 0072 LYS C 3.697 C A 0073 ASN CB
C A 0072 LYS CG 3.621 H A 0081 GLY CA
C A 0073 ASN CA 3.785 C A 0074 THR CA
C A 0073 ASN C 2.418 C A 0074 THR CA
C A 0073 ASN C 3.493 C A 0074 THR C
C A 0073 ASN C 3.394 C A 0074 THR CB
C A 0073 ASN C 3.412 C A 0074 THR CG2
C A 0074 THR CA 3.785 C A 0075 LYS CA
C A 0074 THR C 2.419 C A 0075 LYS CA
C A 0074 THR C 2.992 C A 0075 LYS C
C A 0074 THR C 3.698 C A 0075 LYS CB
C A 0075 LYS CA 3.785 C A 0076 PHE CA
C A 0075 LYS C 2.419 C A 0076 PHE CA
C A 0075 LYS C 3.476 C A 0076 PHE C
C A 0075 LYS C 3.438 C A 0076 PHE CB
C A 0075 LYS C 3.619 C A 0076 PHE CG
C A 0076 PHE CA 3.784 C A 0077 LYS CA
C A 0076 PHE C 2.419 C A 0077 LYS CA
C A 0076 PHE C 2.996 C A 0077 LYS C
C A 0076 PHE C 3.698 C A 0077 LYS CB
C A 0077 LYS CA 3.785 H A 0078 SER CA
C A 0077 LYS C 2.419 H A 0078 SER CA
C A 0077 LYS C 3.288 H A 0078 SER C
C A 0077 LYS C 3.614 H A 0078 SER CB
H A 0078 SER CA 3.785 H A 0079 CYS CA
H A 0078 SER C 2.418 H A 0079 CYS CA
H A 0078 SER C 2.842 H A 0079 CYS C
H A 0078 SER C 3.716 H A 0079 CYS CB
H A 0079 CYS CA 3.784 H A 0080 VAL CA
H A 0079 CYS C 2.419 H A 0080 VAL CA
H A 0079 CYS C 2.983 H A 0080 VAL C
H A 0079 CYS C 3.695 H A 0080 VAL CB
H A 0080 VAL CA 3.786 H A 0081 GLY CA
H A 0080 VAL C 2.419 H A 0081 GLY CA
H A 0080 VAL C 2.925 H A 0081 GLY C
H A 0080 VAL C 3.535 H A 0084 VAL CG2
H A 0080 VAL CG1 3.436 H A 0084 VAL CG2
H A 0080 VAL CG1 3.707 C A 0098 THR CB
H A 0081 GLY CA 3.786 H A 0082 CYS CA
H A 0081 GLY C 2.419 H A 0082 CYS CA
H A 0081 GLY C 2.962 H A 0082 CYS C
H A 0081 GLY C 3.716 H A 0082 CYS CB
H A 0082 CYS CA 3.785 H A 0083 HIS CA
H A 0082 CYS C 2.419 H A 0083 HIS CA
H A 0082 CYS C 2.900 H A 0083 HIS C
H A 0082 CYS C 3.709 H A 0083 HIS CB
H A 0083 HIS CA 3.785 H A 0084 VAL CA
H A 0083 HIS C 2.419 H A 0084 VAL CA
H A 0083 HIS C 2.926 H A 0084 VAL C
H A 0083 HIS C 3.700 H A 0084 VAL CB
H A 0083 HIS C 3.589 C A 0098 THR CG2
H A 0083 HIS CB 3.493 C A 0098 THR CG2
H A 0084 VAL CA 3.785 H A 0085 GLU CA
H A 0084 VAL C 2.418 H A 0085 GLU CA
H A 0084 VAL C 3.097 H A 0085 GLU C
H A 0084 VAL C 3.690 H A 0085 GLU CB
H A 0084 VAL CA 3.729 C A 0098 THR CG2
H A 0084 VAL CG2 3.610 C A 0098 THR CG2
H A 0085 GLU CA 3.785 H A 0086 VAL CA
H A 0085 GLU C 2.419 H A 0086 VAL CA
H A 0085 GLU C 3.074 H A 0086 VAL C
H A 0085 GLU C 3.677 H A 0086 VAL CB
H A 0086 VAL CA 3.785 H A 0087 ALA CA
H A 0086 VAL C 2.419 H A 0087 ALA CA
H A 0086 VAL C 3.016 H A 0087 ALA C
H A 0086 VAL C 3.686 H A 0087 ALA CB
H A 0087 ALA CA 3.785 H A 0088 GLY CA
H A 0087 ALA C 2.418 H A 0088 GLY CA
H A 0087 ALA C 2.829 H A 0088 GLY C
H A 0087 ALA CB 3.647 H A 0093 LYS C
H A 0087 ALA CB 3.783 H A 0093 LYS CB
H A 0087 ALA CB 3.407 H A 0094 LYS CA
H A 0087 ALA CB 3.609 H A 0094 LYS CB
H A 0088 GLY CA 3.785 C A 0089 ALA CA
H A 0088 GLY C 2.418 C A 0089 ALA CA
H A 0088 GLY C 3.411 C A 0089 ALA C
H A 0088 GLY C 3.489 C A 0089 ALA CB
C A 0089 ALA CA 3.785 C A 0090 ASP CA
C A 0089 ALA C 2.418 C A 0090 ASP CA
C A 0089 ALA C 3.398 C A 0090 ASP C
C A 0089 ALA C 3.551 C A 0090 ASP CB
C A 0090 ASP CA 3.785 C A 0091 ALA CA
C A 0090 ASP C 2.419 C A 0091 ALA CA
C A 0090 ASP C 2.963 C A 0091 ALA C
C A 0090 ASP C 2.974 C A 0091 ALA CB
C A 0091 ALA CA 3.785 H A 0092 ALA CA
C A 0091 ALA C 2.419 H A 0092 ALA CA
C A 0091 ALA C 3.164 H A 0092 ALA C
C A 0091 ALA C 2.801 H A 0092 ALA CB
H A 0092 ALA CA 3.786 H A 0093 LYS CA
H A 0092 ALA C 2.419 H A 0093 LYS CA
H A 0092 ALA C 3.009 H A 0093 LYS C
H A 0092 ALA C 3.696 H A 0093 LYS CB
H A 0093 LYS CA 3.785 H A 0094 LYS CA
H A 0093 LYS C 2.419 H A 0094 LYS CA
H A 0093 LYS C 2.992 H A 0094 LYS C
H A 0093 LYS C 3.699 H A 0094 LYS CB
H A 0093 LYS C 3.765 C A 0097 LEU CB
H A 0094 LYS CA 3.786 C A 0095 LYS CA
H A 0094 LYS C 2.419 C A 0095 LYS CA
H A 0094 LYS C 3.289 C A 0095 LYS C
H A 0094 LYS C 3.580 C A 0095 LYS CB
H A 0094 LYS CG 3.772 C A 0098 THR CB
H A 0094 LYS CG 3.685 C A 0098 THR CG2
C A 0095 LYS CA 3.785 C A 0096 ASP CA
C A 0095 LYS C 2.419 C A 0096 ASP CA
C A 0095 LYS C 3.481 C A 0096 ASP C
C A 0095 LYS C 3.475 C A 0096 ASP CB
C A 0095 LYS C 3.800 C A 0099 GLY CA
C A 0096 ASP CA 3.784 C A 0097 LEU CA
C A 0096 ASP C 2.419 C A 0097 LEU CA
C A 0096 ASP C 3.485 C A 0097 LEU C
C A 0096 ASP C 3.413 C A 0097 LEU CB
C A 0096 ASP C 3.631 C A 0097 LEU CG
C A 0096 ASP C 3.549 C A 0097 LEU CD2
C A 0096 ASP C 3.586 C A 0104 LYS CG
C A 0096 ASP CB 3.496 C A 0104 LYS CG
C A 0096 ASP CG 3.526 C A 0104 LYS CG
C A 0097 LEU CA 3.786 C A 0098 THR CA
C A 0097 LEU C 2.419 C A 0098 THR CA
C A 0097 LEU C 3.476 C A 0098 THR C
C A 0097 LEU C 3.414 C A 0098 THR CB
C A 0097 LEU C 3.341 C A 0098 THR CG2
C A 0098 THR CA 3.785 C A 0099 GLY CA
C A 0098 THR C 2.419 C A 0099 GLY CA
C A 0098 THR C 2.995 C A 0099 GLY C
C A 0099 GLY CA 3.784 C A 0100 CYS CA
C A 0099 GLY C 2.418 C A 0100 CYS CA
C A 0099 GLY C 3.121 C A 0100 CYS C
C A 0099 GLY C 3.678 C A 0100 CYS CB
C A 0099 GLY CA 3.773 C A 0103 SER CB
C A 0099 GLY C 3.744 C A 0103 SER CB
C A 0100 CYS CA 3.784 C A 0101 LYS CA
C A 0100 CYS C 2.418 C A 0101 LYS CA
C A 0100 CYS C 3.495 C A 0101 LYS C
C A 0100 CYS C 3.401 C A 0101 LYS CB
C A 0101 LYS CA 3.786 C A 0102 LYS CA
C A 0101 LYS C 2.419 C A 0102 LYS CA
C A 0101 LYS C 3.057 C A 0102 LYS C
C A 0101 LYS C 2.924 C A 0102 LYS CB
C A 0102 LYS CA 3.785 C A 0103 SER CA
C A 0102 LYS C 2.419 C A 0103 SER CA
C A 0102 LYS C 3.476 C A 0103 SER C
C A 0102 LYS C 3.466 C A 0103 SER CB
C A 0103 SER CA 3.785 C A 0104 LYS CA
C A 0103 SER C 2.418 C A 0104 LYS CA
C A 0103 SER C 3.083 C A 0104 LYS C
C A 0103 SER C 3.677 C A 0104 LYS CB
C A 0104 LYS CA 3.784 C A 0105 CYS CA
C A 0104 LYS C 2.418 C A 0105 CYS CA
C A 0104 LYS C 3.157 C A 0105 CYS C
C A 0104 LYS C 3.665 C A 0105 CYS CB
C A 0105 CYS CA 3.785 C A 0106 HIS CA
C A 0105 CYS C 2.418 C A 0106 HIS CA
C A 0105 CYS C 3.266 C A 0106 HIS C
C A 0105 CYS C 3.605 C A 0106 HIS CB
C A 0106 HIS CA 3.785 C A 0107 GLU CA
C A 0106 HIS C 2.419 C A 0107 GLU CA
C A 0106 HIS C 3.430 C A 0107 GLU C
C A 0106 HIS C 3.507 C A 0107 GLU CB
CHARGE_ATTR 2.00 12.00 148
C A 0007 ASP OD1 9.295 C A 0022 HIS ND1
C A 0007 ASP OD1 11.45 C A 0022 HIS NE2
C A 0007 ASP OD2 9.938 C A 0022 HIS ND1
C A 0007 ASP OD2 11.96 C A 0025 HIS ND1
C A 0007 ASP OD1 11.88 C A 0026 LYS NZ
C A 0007 ASP OD2 11.45 C A 0026 LYS NZ
C A 0012 GLU OE1 5.777 E A 0010 LYS NZ
C A 0012 GLU OE2 6.970 E A 0010 LYS NZ
C A 0012 GLU OE1 9.686 C A 0015 LYS NZ
C A 0012 GLU OE2 8.669 C A 0015 LYS NZ
C A 0012 GLU OE2 10.93 C A 0106 HIS ND1
C A 0012 GLU OE2 11.78 C A 0106 HIS NE2
H A 0032 ASP OD1 11.11 C A 0022 HIS NE2
H A 0032 ASP OD2 11.99 C A 0022 HIS NE2
H A 0032 ASP OD1 9.411 C A 0025 HIS ND1
H A 0032 ASP OD1 8.438 C A 0025 HIS NE2
H A 0032 ASP OD2 9.880 C A 0025 HIS ND1
H A 0032 ASP OD2 9.021 C A 0025 HIS NE2
H A 0032 ASP OD1 10.04 H A 0029 LYS NZ
H A 0032 ASP OD2 9.286 H A 0029 LYS NZ
H A 0032 ASP OD1 10.19 H A 0034 HIS ND1
H A 0032 ASP OD1 9.788 H A 0034 HIS NE2
H A 0032 ASP OD2 11.57 H A 0034 HIS ND1
H A 0032 ASP OD2 10.97 H A 0034 HIS NE2
H A 0032 ASP OD1 10.16 C A 0035 HIS ND1
H A 0032 ASP OD1 10.08 C A 0035 HIS NE2
H A 0032 ASP OD2 11.79 C A 0035 HIS ND1
H A 0032 ASP OD2 11.98 C A 0035 HIS NE2
H A 0032 ASP OD1 4.337 C A 0077 LYS NZ
H A 0032 ASP OD2 3.370 C A 0077 LYS NZ
H A 0032 ASP OD1 10.78 H A 0083 HIS ND1
H A 0032 ASP OD1 9.144 H A 0083 HIS NE2
H A 0032 ASP OD2 11.61 H A 0083 HIS ND1
H A 0032 ASP OD2 9.939 H A 0083 HIS NE2
C A 0041 GLU OE2 10.32 C A 0022 HIS NE2
C A 0041 GLU OE1 4.556 H A 0029 LYS NZ
C A 0041 GLU OE2 5.406 H A 0029 LYS NZ
C A 0041 GLU OE1 8.628 H A 0034 HIS ND1
C A 0041 GLU OE1 9.157 H A 0034 HIS NE2
C A 0041 GLU OE2 6.532 H A 0034 HIS ND1
C A 0041 GLU OE2 7.174 H A 0034 HIS NE2
C A 0041 GLU OE1 9.657 C A 0035 HIS ND1
C A 0041 GLU OE1 11.19 C A 0035 HIS NE2
C A 0041 GLU OE2 8.117 C A 0035 HIS ND1
C A 0041 GLU OE2 9.401 C A 0035 HIS NE2
C A 0041 GLU OE1 11.62 C A 0040 LYS NZ
C A 0041 GLU OE2 11.39 C A 0040 LYS NZ
C A 0042 ASP OD1 11.52 C A 0022 HIS NE2
C A 0042 ASP OD2 11.84 C A 0022 HIS NE2
C A 0042 ASP OD1 6.091 H A 0034 HIS ND1
C A 0042 ASP OD1 7.986 H A 0034 HIS NE2
C A 0042 ASP OD2 7.035 H A 0034 HIS ND1
C A 0042 ASP OD2 8.720 H A 0034 HIS NE2
C A 0042 ASP OD1 8.027 C A 0035 HIS ND1
C A 0042 ASP OD1 8.663 C A 0035 HIS NE2
C A 0042 ASP OD2 10.06 C A 0035 HIS ND1
C A 0042 ASP OD2 10.46 C A 0035 HIS NE2
C A 0042 ASP OD1 6.033 C A 0040 LYS NZ
C A 0042 ASP OD2 5.855 C A 0040 LYS NZ
C A 0042 ASP OD1 7.388 C A 0044 ARG NH1
C A 0042 ASP OD1 7.395 C A 0044 ARG NH2
C A 0042 ASP OD2 5.646 C A 0044 ARG NH1
C A 0042 ASP OD2 5.350 C A 0044 ARG NH2
C A 0042 ASP OD1 11.08 C A 0045 LYS NZ
C A 0042 ASP OD2 9.585 C A 0045 LYS NZ
C A 0042 ASP OD1 10.59 C A 0052 HIS NE2
C A 0042 ASP OD2 11.86 C A 0052 HIS NE2
C A 0053 ASP OD1 9.632 C A 0052 HIS ND1
C A 0053 ASP OD1 11.20 C A 0052 HIS NE2
C A 0053 ASP OD2 9.911 C A 0052 HIS ND1
C A 0053 ASP OD2 11.34 C A 0052 HIS NE2
C A 0053 ASP OD1 6.860 C A 0063 LYS NZ
C A 0053 ASP OD2 5.709 C A 0063 LYS NZ
C A 0056 ASP OD1 10.60 C A 0057 LYS NZ
C A 0056 ASP OD2 9.308 C A 0057 LYS NZ
C A 0056 ASP OD1 9.581 C A 0058 LYS NZ
C A 0056 ASP OD2 7.587 C A 0058 LYS NZ
C A 0056 ASP OD1 11.53 C A 0060 LYS NZ
C A 0056 ASP OD2 9.360 C A 0060 LYS NZ
C A 0056 ASP OD1 10.47 C A 0063 LYS NZ
C A 0056 ASP OD2 11.06 C A 0063 LYS NZ
C A 0056 ASP OD2 10.71 H A 0067 HIS ND1
C A 0056 ASP OD2 11.71 H A 0067 HIS NE2
C A 0059 ASP OD1 11.22 C A 0052 HIS ND1
C A 0059 ASP OD2 9.059 C A 0052 HIS ND1
C A 0059 ASP OD2 11.04 C A 0052 HIS NE2
C A 0059 ASP OD1 10.67 C A 0057 LYS NZ
C A 0059 ASP OD2 11.13 C A 0057 LYS NZ
C A 0059 ASP OD1 7.803 C A 0058 LYS NZ
C A 0059 ASP OD2 9.539 C A 0058 LYS NZ
C A 0059 ASP OD1 8.493 C A 0060 LYS NZ
C A 0059 ASP OD2 9.477 C A 0060 LYS NZ
C A 0059 ASP OD1 10.08 C A 0063 LYS NZ
C A 0059 ASP OD2 8.290 C A 0063 LYS NZ
C A 0059 ASP OD1 8.820 H A 0067 HIS ND1
C A 0059 ASP OD1 9.440 H A 0067 HIS NE2
C A 0059 ASP OD2 7.772 H A 0067 HIS ND1
C A 0059 ASP OD2 8.000 H A 0067 HIS NE2
C A 0071 ASP OD1 11.03 C A 0052 HIS ND1
C A 0071 ASP OD1 11.60 C A 0052 HIS NE2
C A 0071 ASP OD2 11.15 C A 0052 HIS ND1
C A 0071 ASP OD1 10.98 C A 0057 LYS NZ
C A 0071 ASP OD2 8.831 C A 0057 LYS NZ
C A 0071 ASP OD2 10.25 C A 0058 LYS NZ
C A 0071 ASP OD1 8.473 C A 0060 LYS NZ
C A 0071 ASP OD2 6.584 C A 0060 LYS NZ
C A 0071 ASP OD1 3.381 H A 0067 HIS ND1
C A 0071 ASP OD1 4.131 H A 0067 HIS NE2
C A 0071 ASP OD2 2.806 H A 0067 HIS ND1
C A 0071 ASP OD2 4.594 H A 0067 HIS NE2
C A 0071 ASP OD1 9.017 C A 0070 HIS ND1
C A 0071 ASP OD1 10.92 C A 0070 HIS NE2
C A 0071 ASP OD2 8.046 C A 0070 HIS ND1
C A 0071 ASP OD2 9.947 C A 0070 HIS NE2
C A 0071 ASP OD1 7.280 C A 0072 LYS NZ
C A 0071 ASP OD2 7.050 C A 0072 LYS NZ
H A 0085 GLU OE1 7.108 C A 0077 LYS NZ
H A 0085 GLU OE2 5.459 C A 0077 LYS NZ
H A 0085 GLU OE1 10.89 H A 0094 LYS NZ
H A 0085 GLU OE2 11.87 H A 0094 LYS NZ
C A 0090 ASP OD1 7.483 H A 0093 LYS NZ
C A 0090 ASP OD2 5.814 H A 0093 LYS NZ
C A 0090 ASP OD2 11.87 H A 0094 LYS NZ
C A 0090 ASP OD1 10.87 C A 0095 LYS NZ
C A 0090 ASP OD2 11.62 C A 0095 LYS NZ
C A 0096 ASP OD1 9.702 H A 0083 HIS ND1
C A 0096 ASP OD1 11.24 H A 0083 HIS NE2
C A 0096 ASP OD2 9.258 H A 0083 HIS ND1
C A 0096 ASP OD2 10.44 H A 0083 HIS NE2
C A 0096 ASP OD1 8.462 H A 0093 LYS NZ
C A 0096 ASP OD2 7.272 H A 0093 LYS NZ
C A 0096 ASP OD1 8.859 C A 0095 LYS NZ
C A 0096 ASP OD2 10.69 C A 0095 LYS NZ
C A 0096 ASP OD1 11.99 C A 0101 LYS NZ
C A 0096 ASP OD1 9.405 C A 0102 LYS NZ
C A 0096 ASP OD2 11.14 C A 0102 LYS NZ
C A 0096 ASP OD1 5.888 C A 0104 LYS NZ
C A 0096 ASP OD2 3.664 C A 0104 LYS NZ
C A 0096 ASP OD1 11.79 C A 0106 HIS ND1
C A 0107 GLU OE1 10.93 E A 0010 LYS NZ
C A 0107 GLU OE1 11.72 C A 0101 LYS NZ
C A 0107 GLU OE2 10.04 C A 0101 LYS NZ
C A 0107 GLU OE2 11.00 C A 0102 LYS NZ
C A 0107 GLU OE1 11.57 C A 0104 LYS NZ
C A 0107 GLU OE1 9.007 C A 0106 HIS ND1
C A 0107 GLU OE1 11.06 C A 0106 HIS NE2
C A 0107 GLU OE2 9.421 C A 0106 HIS ND1
C A 0107 GLU OE2 11.51 C A 0106 HIS NE2
CHARGE_REPU 2.00 12.00 148
C A 0003 LYS NZ 9.115 C A 0026 LYS NZ
E A 0010 LYS NZ 11.92 C A 0106 HIS ND1
C A 0012 GLU OE2 11.78 C A 0053 ASP OD1
C A 0022 HIS ND1 6.946 C A 0025 HIS ND1
C A 0022 HIS ND1 8.758 C A 0025 HIS NE2
C A 0022 HIS NE2 7.105 C A 0025 HIS ND1
C A 0022 HIS NE2 8.648 C A 0025 HIS NE2
C A 0022 HIS ND1 10.59 C A 0026 LYS NZ
C A 0022 HIS NE2 11.28 C A 0026 LYS NZ
C A 0022 HIS NE2 11.89 H A 0029 LYS NZ
C A 0022 HIS ND1 7.931 H A 0034 HIS ND1
C A 0022 HIS ND1 5.954 H A 0034 HIS NE2
C A 0022 HIS NE2 5.948 H A 0034 HIS ND1
C A 0022 HIS NE2 3.870 H A 0034 HIS NE2
C A 0022 HIS NE2 11.87 C A 0045 LYS NZ
C A 0022 HIS NE2 11.97 H A 0083 HIS NE2
C A 0025 HIS ND1 10.86 C A 0026 LYS NZ
C A 0025 HIS ND1 11.27 H A 0034 HIS ND1
C A 0025 HIS ND1 9.460 H A 0034 HIS NE2
C A 0025 HIS NE2 11.93 H A 0034 HIS ND1
C A 0025 HIS NE2 10.37 H A 0034 HIS NE2
C A 0025 HIS ND1 11.50 C A 0077 LYS NZ
C A 0025 HIS NE2 10.12 C A 0077 LYS NZ
C A 0025 HIS ND1 7.924 H A 0083 HIS ND1
C A 0025 HIS ND1 5.945 H A 0083 HIS NE2
C A 0025 HIS NE2 5.923 H A 0083 HIS ND1
C A 0025 HIS NE2 3.848 H A 0083 HIS NE2
C A 0025 HIS ND1 11.69 H A 0093 LYS NZ
C A 0025 HIS NE2 10.67 H A 0093 LYS NZ
C A 0025 HIS ND1 11.20 C A 0104 LYS NZ
C A 0025 HIS NE2 10.88 C A 0104 LYS NZ
H A 0029 LYS NZ 10.60 H A 0034 HIS ND1
H A 0029 LYS NZ 10.21 H A 0034 HIS NE2
H A 0032 ASP OD1 11.09 C A 0041 GLU OE1
H A 0032 ASP OD1 9.699 C A 0041 GLU OE2
H A 0032 ASP OD2 11.18 C A 0041 GLU OE1
H A 0032 ASP OD2 10.15 C A 0041 GLU OE2
H A 0032 ASP OD1 11.19 H A 0085 GLU OE1
H A 0032 ASP OD1 9.482 H A 0085 GLU OE2
H A 0032 ASP OD2 10.43 H A 0085 GLU OE1
H A 0032 ASP OD2 8.823 H A 0085 GLU OE2
H A 0034 HIS ND1 8.290 C A 0035 HIS ND1
H A 0034 HIS ND1 8.034 C A 0035 HIS NE2
H A 0034 HIS NE2 10.04 C A 0035 HIS ND1
H A 0034 HIS NE2 9.728 C A 0035 HIS NE2
H A 0034 HIS ND1 10.37 C A 0044 ARG NH1
H A 0034 HIS ND1 11.24 C A 0044 ARG NH2
H A 0034 HIS NE2 11.87 C A 0044 ARG NH1
H A 0034 HIS ND1 10.65 C A 0045 LYS NZ
H A 0034 HIS NE2 11.21 C A 0045 LYS NZ
H A 0034 HIS ND1 11.52 C A 0052 HIS ND1
H A 0034 HIS ND1 9.644 C A 0052 HIS NE2
H A 0034 HIS NE2 11.24 C A 0052 HIS NE2
C A 0035 HIS ND1 11.62 C A 0040 LYS NZ
C A 0035 HIS ND1 7.924 C A 0052 HIS ND1
C A 0035 HIS ND1 5.914 C A 0052 HIS NE2
C A 0035 HIS NE2 5.940 C A 0052 HIS ND1
C A 0035 HIS NE2 3.855 C A 0052 HIS NE2
C A 0035 HIS NE2 11.61 C A 0063 LYS NZ
C A 0035 HIS ND1 11.24 H A 0067 HIS NE2
C A 0035 HIS NE2 11.61 H A 0067 HIS ND1
C A 0035 HIS NE2 9.708 H A 0067 HIS NE2
C A 0035 HIS ND1 8.124 C A 0075 LYS NZ
C A 0035 HIS NE2 9.318 C A 0075 LYS NZ
C A 0040 LYS NZ 8.885 C A 0044 ARG NH1
C A 0040 LYS NZ 7.695 C A 0044 ARG NH2
C A 0041 GLU OE1 8.401 C A 0042 ASP OD1
C A 0041 GLU OE1 10.07 C A 0042 ASP OD2
C A 0041 GLU OE2 7.173 C A 0042 ASP OD1
C A 0041 GLU OE2 8.953 C A 0042 ASP OD2
C A 0044 ARG NH1 6.134 C A 0045 LYS NZ
C A 0044 ARG NH2 7.594 C A 0045 LYS NZ
C A 0052 HIS ND1 7.303 C A 0063 LYS NZ
C A 0052 HIS NE2 8.746 C A 0063 LYS NZ
C A 0052 HIS ND1 8.442 H A 0067 HIS ND1
C A 0052 HIS ND1 7.152 H A 0067 HIS NE2
C A 0052 HIS NE2 9.498 H A 0067 HIS ND1
C A 0052 HIS NE2 7.939 H A 0067 HIS NE2
C A 0052 HIS ND1 10.83 C A 0070 HIS ND1
C A 0052 HIS NE2 11.63 C A 0070 HIS ND1
C A 0052 HIS NE2 11.80 C A 0075 LYS NZ
C A 0053 ASP OD1 9.878 C A 0056 ASP OD1
C A 0053 ASP OD1 11.24 C A 0056 ASP OD2
C A 0053 ASP OD2 10.77 C A 0056 ASP OD1
C A 0053 ASP OD1 11.10 C A 0059 ASP OD2
C A 0053 ASP OD2 11.51 C A 0059 ASP OD2
C A 0056 ASP OD1 5.344 C A 0059 ASP OD1
C A 0056 ASP OD1 6.183 C A 0059 ASP OD2
C A 0056 ASP OD2 3.679 C A 0059 ASP OD1
C A 0056 ASP OD2 4.959 C A 0059 ASP OD2
C A 0056 ASP OD2 11.90 C A 0071 ASP OD2
C A 0057 LYS NZ 7.871 C A 0058 LYS NZ
C A 0057 LYS NZ 7.244 C A 0060 LYS NZ
C A 0057 LYS NZ 9.474 H A 0067 HIS ND1
C A 0057 LYS NZ 11.50 H A 0067 HIS NE2
C A 0057 LYS NZ 7.705 C A 0070 HIS ND1
C A 0057 LYS NZ 8.349 C A 0070 HIS NE2
C A 0057 LYS NZ 10.55 C A 0072 LYS NZ
C A 0057 LYS NZ 10.49 C A 0106 HIS NE2
C A 0058 LYS NZ 4.078 C A 0060 LYS NZ
C A 0058 LYS NZ 10.93 H A 0067 HIS ND1
C A 0059 ASP OD1 11.59 C A 0071 ASP OD1
C A 0059 ASP OD1 10.24 C A 0071 ASP OD2
C A 0059 ASP OD2 10.79 C A 0071 ASP OD1
C A 0059 ASP OD2 9.708 C A 0071 ASP OD2
C A 0060 LYS NZ 7.914 H A 0067 HIS ND1
C A 0060 LYS NZ 9.801 H A 0067 HIS NE2
C A 0060 LYS NZ 11.85 C A 0070 HIS ND1
C A 0060 LYS NZ 10.85 C A 0072 LYS NZ
H A 0067 HIS ND1 7.922 C A 0070 HIS ND1
H A 0067 HIS ND1 10.06 C A 0070 HIS NE2
H A 0067 HIS NE2 9.091 C A 0070 HIS ND1
H A 0067 HIS NE2 11.25 C A 0070 HIS NE2
H A 0067 HIS ND1 9.267 C A 0072 LYS NZ
H A 0067 HIS NE2 10.66 C A 0072 LYS NZ
C A 0070 HIS ND1 8.161 C A 0072 LYS NZ
C A 0070 HIS NE2 8.743 C A 0072 LYS NZ
C A 0070 HIS ND1 10.57 H A 0083 HIS ND1
C A 0070 HIS ND1 11.34 H A 0083 HIS NE2
C A 0070 HIS NE2 9.812 H A 0083 HIS ND1
C A 0070 HIS NE2 10.80 H A 0083 HIS NE2
C A 0070 HIS ND1 8.042 C A 0106 HIS ND1
C A 0070 HIS ND1 5.981 C A 0106 HIS NE2
C A 0070 HIS NE2 5.967 C A 0106 HIS ND1
C A 0070 HIS NE2 3.852 C A 0106 HIS NE2
C A 0072 LYS NZ 11.18 H A 0083 HIS ND1
C A 0072 LYS NZ 7.328 H A 0094 LYS NZ
C A 0072 LYS NZ 11.48 C A 0106 HIS NE2
C A 0077 LYS NZ 11.01 H A 0083 HIS ND1
C A 0077 LYS NZ 9.834 H A 0083 HIS NE2
H A 0083 HIS ND1 8.980 H A 0093 LYS NZ
H A 0083 HIS NE2 9.433 H A 0093 LYS NZ
H A 0083 HIS ND1 10.33 H A 0094 LYS NZ
H A 0083 HIS ND1 9.922 C A 0104 LYS NZ
H A 0083 HIS NE2 10.37 C A 0104 LYS NZ
H A 0083 HIS ND1 11.00 C A 0106 HIS ND1
H A 0083 HIS ND1 10.12 C A 0106 HIS NE2
H A 0083 HIS NE2 11.27 C A 0106 HIS NE2
C A 0090 ASP OD2 11.80 C A 0096 ASP OD2
H A 0093 LYS NZ 6.763 C A 0104 LYS NZ
H A 0094 LYS NZ 8.572 C A 0095 LYS NZ
C A 0095 LYS NZ 11.38 C A 0102 LYS NZ
C A 0096 ASP OD1 11.16 C A 0107 GLU OE1
C A 0096 ASP OD1 11.61 C A 0107 GLU OE2
C A 0096 ASP OD2 10.97 C A 0107 GLU OE1
C A 0096 ASP OD2 11.81 C A 0107 GLU OE2
C A 0101 LYS NZ 5.536 C A 0102 LYS NZ
C A 0101 LYS NZ 11.71 C A 0106 HIS ND1
HB_MM 2.00 3.20 158
C A 0002 PRO N 2.293 C A 0001 ALA O
C A 0003 LYS N 2.261 C A 0002 PRO O
C A 0004 ALA N 2.261 C A 0003 LYS O
C A 0005 PRO N 2.293 C A 0004 ALA O
C A 0006 ALA N 2.262 C A 0005 PRO O
C A 0007 ASP N 2.261 C A 0006 ALA O
C A 0008 GLY N 2.262 C A 0007 ASP O
E A 0009 LEU N 2.261 C A 0008 GLY O
E A 0010 LYS N 3.039 C A 0008 GLY O
E A 0010 LYS N 2.261 E A 0009 LEU O
E A 0011 MET N 2.261 E A 0010 LYS O
E A 0011 MET N 2.813 E A 0018 VAL O
C A 0012 GLU N 2.262 E A 0011 MET O
C A 0013 ALA N 2.262 C A 0012 GLU O
C A 0014 THR N 2.262 C A 0013 ALA O
C A 0015 LYS N 2.262 C A 0014 THR O
C A 0016 GLN N 2.939 C A 0014 THR O
C A 0016 GLN N 2.261 C A 0015 LYS O
C A 0017 PRO N 2.293 C A 0016 GLN O
E A 0018 VAL N 2.262 C A 0017 PRO O
E A 0019 VAL N 2.262 E A 0018 VAL O
E A 0020 PHE N 2.638 E A 0009 LEU O
E A 0020 PHE N 2.262 E A 0019 VAL O
C A 0021 ASN N 2.262 E A 0020 PHE O
C A 0022 HIS N 2.262 C A 0021 ASN O
C A 0023 SER N 2.261 C A 0022 HIS O
C A 0024 THR N 3.176 C A 0022 HIS O
C A 0024 THR N 2.262 C A 0023 SER O
C A 0025 HIS N 2.262 C A 0024 THR O
C A 0026 LYS N 2.261 C A 0025 HIS O
C A 0027 SER N 2.262 C A 0026 LYS O
C A 0028 VAL N 3.032 C A 0025 HIS O
C A 0028 VAL N 2.261 C A 0027 SER O
H A 0029 LYS N 2.262 C A 0028 VAL O
H A 0030 CYS N 2.262 H A 0029 LYS O
H A 0031 GLY N 3.154 H A 0029 LYS O
H A 0031 GLY N 2.261 H A 0030 CYS O
H A 0032 ASP N 2.700 H A 0029 LYS O
H A 0032 ASP N 3.177 H A 0030 CYS O
H A 0032 ASP N 2.261 H A 0031 GLY O
H A 0033 CYS N 2.262 H A 0032 ASP O
H A 0034 HIS N 2.753 H A 0030 CYS O
H A 0034 HIS N 2.261 H A 0033 CYS O
C A 0035 HIS N 2.660 H A 0033 CYS O
C A 0035 HIS N 2.261 H A 0034 HIS O
C A 0036 PRO N 2.293 C A 0035 HIS O
C A 0037 VAL N 2.261 C A 0036 PRO O
C A 0038 ASN N 2.261 C A 0037 VAL O
C A 0039 GLY N 2.262 C A 0038 ASN O
C A 0040 LYS N 2.261 C A 0039 GLY O
C A 0041 GLU N 2.262 C A 0040 LYS O
C A 0042 ASP N 2.261 C A 0041 GLU O
C A 0043 TYR N 2.261 C A 0042 ASP O
C A 0044 ARG N 2.262 C A 0043 TYR O
C A 0045 LYS N 2.262 C A 0044 ARG O
C A 0046 CYS N 2.261 C A 0045 LYS O
C A 0047 GLY N 2.261 C A 0046 CYS O
C A 0048 THR N 3.066 C A 0045 LYS O
C A 0048 THR N 2.849 C A 0046 CYS O
C A 0048 THR N 2.261 C A 0047 GLY O
C A 0049 ALA N 2.262 C A 0048 THR O
C A 0050 GLY N 2.711 C A 0048 THR O
C A 0050 GLY N 2.262 C A 0049 ALA O
C A 0051 CYS N 2.592 C A 0048 THR O
C A 0051 CYS N 2.261 C A 0050 GLY O
C A 0052 HIS N 2.261 C A 0051 CYS O
C A 0053 ASP N 2.261 C A 0052 HIS O
C A 0054 SER N 2.262 C A 0053 ASP O
C A 0055 MET N 2.261 C A 0054 SER O
C A 0056 ASP N 2.875 C A 0054 SER O
C A 0056 ASP N 2.262 C A 0055 MET O
C A 0057 LYS N 2.261 C A 0056 ASP O
C A 0058 LYS N 2.502 C A 0056 ASP O
C A 0058 LYS N 2.261 C A 0057 LYS O
C A 0059 ASP N 2.878 C A 0057 LYS O
C A 0059 ASP N 2.261 C A 0058 LYS O
C A 0060 LYS N 2.261 C A 0059 ASP O
C A 0061 SER N 2.262 C A 0060 LYS O
C A 0062 ALA N 2.261 C A 0061 SER O
C A 0063 LYS N 2.261 C A 0062 ALA O
H A 0064 GLY N 3.095 C A 0062 ALA O
H A 0064 GLY N 2.261 C A 0063 LYS O
H A 0065 TYR N 2.736 C A 0063 LYS O
H A 0065 TYR N 2.261 H A 0064 GLY O
H A 0066 TYR N 3.151 H A 0064 GLY O
H A 0066 TYR N 2.261 H A 0065 TYR O
H A 0067 HIS N 2.613 H A 0064 GLY O
H A 0067 HIS N 3.186 H A 0065 TYR O
H A 0067 HIS N 2.262 H A 0066 TYR O
H A 0068 VAL N 2.979 H A 0064 GLY O
H A 0068 VAL N 2.262 H A 0067 HIS O
C A 0069 MET N 2.261 H A 0068 VAL O
C A 0070 HIS N 2.261 C A 0069 MET O
C A 0071 ASP N 2.863 H A 0067 HIS O
C A 0071 ASP N 2.261 C A 0070 HIS O
C A 0072 LYS N 3.121 C A 0070 HIS O
C A 0072 LYS N 2.262 C A 0071 ASP O
C A 0073 ASN N 2.262 C A 0072 LYS O
C A 0074 THR N 2.661 C A 0072 LYS O
C A 0074 THR N 2.261 C A 0073 ASN O
C A 0075 LYS N 2.261 C A 0074 THR O
C A 0076 PHE N 3.158 C A 0074 THR O
C A 0076 PHE N 2.261 C A 0075 LYS O
C A 0077 LYS N 2.262 C A 0076 PHE O
H A 0078 SER N 2.261 C A 0077 LYS O
H A 0079 CYS N 2.262 H A 0078 SER O
H A 0080 VAL N 2.262 H A 0079 CYS O
H A 0081 GLY N 2.986 H A 0078 SER O
H A 0081 GLY N 2.261 H A 0080 VAL O
H A 0082 CYS N 2.592 H A 0078 SER O
H A 0082 CYS N 2.261 H A 0081 GLY O
H A 0083 HIS N 2.873 H A 0079 CYS O
H A 0083 HIS N 3.181 H A 0080 VAL O
H A 0083 HIS N 2.262 H A 0082 CYS O
H A 0084 VAL N 2.492 H A 0080 VAL O
H A 0084 VAL N 3.188 H A 0081 GLY O
H A 0084 VAL N 3.171 H A 0082 CYS O
H A 0084 VAL N 2.261 H A 0083 HIS O
H A 0085 GLU N 2.735 H A 0082 CYS O
H A 0085 GLU N 3.165 H A 0083 HIS O
H A 0085 GLU N 2.262 H A 0084 VAL O
H A 0086 VAL N 2.700 H A 0082 CYS O
H A 0086 VAL N 2.891 H A 0083 HIS O
H A 0086 VAL N 2.262 H A 0085 GLU O
H A 0087 ALA N 2.494 H A 0083 HIS O
H A 0087 ALA N 2.261 H A 0086 VAL O
H A 0088 GLY N 2.618 H A 0084 VAL O
H A 0088 GLY N 2.262 H A 0087 ALA O
C A 0089 ALA N 2.994 H A 0087 ALA O
C A 0089 ALA N 2.261 H A 0088 GLY O
C A 0090 ASP N 2.890 H A 0087 ALA O
C A 0090 ASP N 2.261 C A 0089 ALA O
C A 0091 ALA N 2.262 C A 0090 ASP O
H A 0092 ALA N 2.261 C A 0091 ALA O
H A 0093 LYS N 2.868 C A 0091 ALA O
H A 0093 LYS N 2.261 H A 0092 ALA O
H A 0094 LYS N 2.261 H A 0093 LYS O
C A 0095 LYS N 3.028 H A 0092 ALA O
C A 0095 LYS N 2.912 H A 0093 LYS O
C A 0095 LYS N 2.261 H A 0094 LYS O
C A 0096 ASP N 3.033 H A 0092 ALA O
C A 0096 ASP N 2.738 H A 0093 LYS O
C A 0096 ASP N 2.262 C A 0095 LYS O
C A 0097 LEU N 2.421 H A 0093 LYS O
C A 0097 LEU N 2.262 C A 0096 ASP O
C A 0098 THR N 2.261 C A 0097 LEU O
C A 0099 GLY N 2.799 H A 0094 LYS O
C A 0099 GLY N 2.262 C A 0098 THR O
C A 0100 CYS N 2.262 C A 0099 GLY O
C A 0101 LYS N 2.262 C A 0100 CYS O
C A 0102 LYS N 2.262 C A 0101 LYS O
C A 0103 SER N 2.262 C A 0102 LYS O
C A 0103 SER N 2.581 C A 0106 HIS O
C A 0104 LYS N 3.159 C A 0096 ASP O
C A 0104 LYS N 2.262 C A 0103 SER O
C A 0105 CYS N 2.261 C A 0104 LYS O
C A 0106 HIS N 2.263 C A 0105 CYS O
C A 0107 GLU N 2.261 C A 0106 HIS O
HB_MS 2.00 3.20 20
C A 0016 GLN N 3.097 C A 0014 THR OG1
C A 0016 GLN O 2.837 C A 0014 THR OG1
E A 0020 PHE O 3.079 C A 0021 ASN ND2
C A 0021 ASN O 2.865 C A 0025 HIS ND1
C A 0045 LYS O 2.480 C A 0048 THR OG1
C A 0055 MET N 3.105 C A 0054 SER OG
C A 0060 LYS O 2.905 C A 0061 SER OG
C A 0062 ALA O 2.671 C A 0052 HIS ND1
C A 0063 LYS O 2.952 C A 0054 SER OG
H A 0066 TYR O 2.593 C A 0070 HIS ND1
C A 0070 HIS O 3.115 H A 0078 SER OG
C A 0071 ASP O 2.688 H A 0078 SER OG
C A 0073 ASN N 3.192 C A 0071 ASP OD1
C A 0076 PHE O 2.475 C A 0074 THR OG1
H A 0079 CYS N 2.990 H A 0078 SER OG
H A 0081 GLY N 2.716 H A 0078 SER OG
H A 0094 LYS O 2.503 C A 0098 THR OG1
C A 0097 LEU O 2.657 H A 0083 HIS ND1
C A 0099 GLY O 2.643 C A 0103 SER OG
C A 0106 HIS O 3.060 C A 0103 SER OG
AROMATIC 0.00 8.00 5
C A 0072 LYS 7.820 C A 0070 HIS
E A 0020 PHE 5.076 C A 0022 HIS
C A 0035 HIS 4.177 C A 0076 PHE
C A 0057 LYS 4.240 H A 0066 TYR
C A 0075 LYS 5.308 C A 0076 PHE