Complet list of 1tuj con file
Complete list of 1tuj.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 581
C A 0001 ILE C 2.437 H A 0002 ASP CA
C A 0001 ILE C 2.986 H A 0002 ASP C
C A 0001 ILE C 3.718 H A 0002 ASP CB
C A 0001 ILE CG2 3.749 H A 0006 VAL CG2
C A 0001 ILE CG1 3.750 H A 0085 ASP CB
C A 0001 ILE CG1 3.540 H A 0085 ASP CG
H A 0002 ASP CA 3.797 H A 0003 GLN CA
H A 0002 ASP C 2.432 H A 0003 GLN CA
H A 0002 ASP C 2.936 H A 0003 GLN C
H A 0002 ASP C 3.716 H A 0003 GLN CB
H A 0003 GLN CA 3.788 H A 0004 ASP CA
H A 0003 GLN C 2.436 H A 0004 ASP CA
H A 0003 GLN C 2.995 H A 0004 ASP C
H A 0003 GLN C 3.713 H A 0004 ASP CB
H A 0003 GLN CA 3.651 H A 0006 VAL CG2
H A 0003 GLN CB 3.745 C A 0122 PHE CE2
H A 0004 ASP C 2.435 H A 0005 THR CA
H A 0004 ASP C 3.231 H A 0005 THR C
H A 0004 ASP C 3.678 H A 0005 THR CB
H A 0005 THR CA 3.784 H A 0006 VAL CA
H A 0005 THR C 2.429 H A 0006 VAL CA
H A 0005 THR C 3.100 H A 0006 VAL C
H A 0005 THR C 3.710 H A 0006 VAL CB
H A 0006 VAL C 2.433 H A 0007 VAL CA
H A 0006 VAL C 3.126 H A 0007 VAL C
H A 0006 VAL C 3.717 H A 0007 VAL CB
H A 0006 VAL CG1 3.782 H A 0010 TYR CD2
H A 0006 VAL CG1 3.471 H A 0121 LEU CD1
H A 0006 VAL CG1 3.659 C A 0123 SER CB
H A 0007 VAL C 2.434 H A 0008 ALA CA
H A 0007 VAL C 3.136 H A 0008 ALA C
H A 0007 VAL C 3.687 H A 0008 ALA CB
H A 0008 ALA C 2.433 H A 0009 LYS CA
H A 0008 ALA C 3.169 H A 0009 LYS C
H A 0008 ALA C 3.688 H A 0009 LYS CB
H A 0009 LYS C 2.437 H A 0010 TYR CA
H A 0009 LYS C 2.976 H A 0010 TYR C
H A 0009 LYS C 3.723 H A 0010 TYR CB
H A 0009 LYS CB 3.776 H A 0078 VAL CG1
H A 0010 TYR C 2.434 H A 0011 MET CA
H A 0010 TYR C 3.183 H A 0011 MET C
H A 0010 TYR C 3.676 H A 0011 MET CB
H A 0010 TYR CD1 3.577 H A 0074 MET CE
H A 0010 TYR CE1 3.671 H A 0074 MET CE
H A 0010 TYR CG 3.797 H A 0078 VAL CG1
H A 0010 TYR CD1 3.686 H A 0078 VAL CG1
H A 0010 TYR CE1 3.613 H A 0078 VAL CG1
H A 0010 TYR CE2 3.738 H A 0078 VAL CG1
H A 0010 TYR CZ 3.636 H A 0078 VAL CG1
H A 0011 MET C 2.437 H A 0012 GLU CA
H A 0011 MET C 3.038 H A 0012 GLU C
H A 0011 MET C 3.712 H A 0012 GLU CB
H A 0012 GLU C 2.439 H A 0013 TYR CA
H A 0012 GLU C 3.089 H A 0013 TYR C
H A 0012 GLU C 3.704 H A 0013 TYR CB
H A 0013 TYR C 2.436 H A 0014 LEU CA
H A 0013 TYR C 3.655 H A 0014 LEU C
H A 0013 TYR C 3.259 H A 0014 LEU CB
H A 0013 TYR C 3.288 H A 0014 LEU CG
H A 0013 TYR C 3.795 H A 0014 LEU CD2
H A 0013 TYR CD2 3.710 H A 0014 LEU CG
H A 0013 TYR CD2 3.697 H A 0074 MET CE
H A 0013 TYR CE2 3.367 H A 0074 MET CB
H A 0013 TYR CZ 3.474 H A 0074 MET CB
H A 0013 TYR CG 3.449 H A 0078 VAL CG2
H A 0013 TYR CD1 3.424 H A 0078 VAL CG2
H A 0014 LEU C 2.434 H A 0015 MET CA
H A 0014 LEU C 3.021 H A 0015 MET C
H A 0014 LEU C 3.717 H A 0015 MET CB
H A 0014 LEU C 3.557 H A 0016 PRO CD
H A 0014 LEU CD1 3.523 H A 0058 ILE CG2
H A 0015 MET CA 2.962 H A 0016 PRO CD
H A 0015 MET C 2.464 H A 0016 PRO CA
H A 0015 MET C 3.129 H A 0016 PRO C
H A 0015 MET C 3.653 H A 0016 PRO CB
H A 0015 MET C 3.656 H A 0016 PRO CG
H A 0015 MET C 2.526 H A 0016 PRO CD
H A 0015 MET CB 3.233 H A 0016 PRO CD
H A 0016 PRO C 2.436 H A 0017 ASP CA
H A 0016 PRO C 3.442 H A 0017 ASP C
H A 0016 PRO C 3.526 H A 0017 ASP CB
H A 0016 PRO C 3.626 H A 0017 ASP CG
H A 0017 ASP C 2.437 H A 0018 ILE CA
H A 0017 ASP C 3.273 H A 0018 ILE C
H A 0017 ASP C 3.674 H A 0018 ILE CB
H A 0017 ASP C 3.170 H A 0020 PRO CD
H A 0018 ILE C 2.436 H A 0019 MET CA
H A 0018 ILE C 3.069 H A 0019 MET C
H A 0018 ILE C 3.730 H A 0019 MET CB
H A 0018 ILE CA 3.777 H A 0020 PRO CD
H A 0018 ILE C 3.096 H A 0020 PRO CD
H A 0018 ILE CG1 3.677 H A 0054 VAL CG1
H A 0018 ILE CG1 3.705 H A 0054 VAL CG2
H A 0019 MET CA 3.020 H A 0020 PRO CD
H A 0019 MET C 2.469 H A 0020 PRO CA
H A 0019 MET C 3.119 H A 0020 PRO C
H A 0019 MET C 3.676 H A 0020 PRO CB
H A 0019 MET C 3.611 H A 0020 PRO CG
H A 0019 MET C 2.533 H A 0020 PRO CD
H A 0019 MET CB 3.704 H A 0020 PRO CD
H A 0019 MET CG 3.304 H A 0020 PRO CD
H A 0019 MET CE 3.716 H A 0020 PRO CG
H A 0020 PRO C 2.438 H A 0021 CYS CA
H A 0020 PRO C 3.033 H A 0021 CYS C
H A 0020 PRO C 3.715 H A 0021 CYS CB
H A 0021 CYS C 2.434 H A 0022 ALA CA
H A 0021 CYS C 2.972 H A 0022 ALA C
H A 0021 CYS C 3.700 H A 0022 ALA CB
H A 0021 CYS C 3.723 H A 0024 GLU CB
H A 0021 CYS C 3.590 H A 0050 LEU CD2
H A 0021 CYS CB 3.509 H A 0053 CYS CB
H A 0022 ALA C 2.431 H A 0023 ASP CA
H A 0022 ALA C 3.174 H A 0023 ASP C
H A 0022 ALA C 3.675 H A 0023 ASP CB
H A 0022 ALA CB 3.707 C A 0028 SER CA
H A 0022 ALA CB 3.625 C A 0028 SER CB
H A 0022 ALA CA 3.738 H A 0050 LEU CD2
H A 0023 ASP CA 3.799 H A 0024 GLU CA
H A 0023 ASP C 2.436 H A 0024 GLU CA
H A 0023 ASP C 3.021 H A 0024 GLU C
H A 0023 ASP C 3.711 H A 0024 GLU CB
H A 0024 GLU C 2.423 H A 0025 LEU CA
H A 0024 GLU C 3.332 H A 0025 LEU C
H A 0024 GLU C 3.611 H A 0025 LEU CB
H A 0025 LEU C 2.435 H A 0026 HIS CA
H A 0025 LEU C 3.719 H A 0026 HIS C
H A 0025 LEU C 2.957 H A 0026 HIS CB
H A 0025 LEU CD1 3.666 H A 0046 GLN CD
H A 0025 LEU CG 3.595 H A 0050 LEU CD2
H A 0025 LEU CD1 3.686 H A 0050 LEU CB
H A 0025 LEU CD1 3.516 H A 0050 LEU CD2
H A 0026 HIS CA 3.796 C A 0027 ILE CA
H A 0026 HIS C 2.454 C A 0027 ILE CA
H A 0026 HIS C 3.606 C A 0027 ILE C
H A 0026 HIS C 3.397 C A 0027 ILE CB
H A 0026 HIS C 3.399 C A 0027 ILE CG2
C A 0027 ILE CA 3.797 C A 0028 SER CA
C A 0027 ILE C 2.430 C A 0028 SER CA
C A 0027 ILE C 3.189 C A 0028 SER C
C A 0027 ILE C 3.671 C A 0028 SER CB
C A 0028 SER C 2.434 C A 0029 GLU CA
C A 0028 SER C 2.944 C A 0029 GLU C
C A 0028 SER C 3.708 C A 0029 GLU CB
C A 0028 SER CA 3.620 H A 0050 LEU CD1
C A 0029 GLU C 2.440 C A 0030 ASP CA
C A 0029 GLU C 3.118 C A 0030 ASP C
C A 0029 GLU C 3.704 C A 0030 ASP CB
C A 0029 GLU CD 3.799 C A 0030 ASP CA
C A 0029 GLU CA 3.711 C A 0032 ALA CB
C A 0029 GLU C 3.555 C A 0032 ALA CB
C A 0029 GLU CB 3.499 C A 0043 ASP CB
C A 0029 GLU CB 3.600 H A 0047 LEU CA
C A 0029 GLU CB 3.800 H A 0047 LEU CB
C A 0029 GLU CB 3.633 H A 0047 LEU CG
C A 0029 GLU CG 3.584 H A 0047 LEU CG
C A 0029 GLU CD 3.796 H A 0047 LEU CG
C A 0029 GLU CG 3.398 H A 0051 LYS CB
C A 0029 GLU CD 3.619 H A 0051 LYS CB
C A 0030 ASP C 2.437 C A 0031 ILE CA
C A 0030 ASP C 3.075 C A 0031 ILE C
C A 0030 ASP C 3.730 C A 0031 ILE CB
C A 0030 ASP CA 3.648 C A 0042 ALA CB
C A 0031 ILE C 2.438 C A 0032 ALA CA
C A 0031 ILE C 2.894 C A 0032 ALA C
C A 0031 ILE C 3.703 C A 0032 ALA CB
C A 0032 ALA CA 3.799 C A 0033 THR CA
C A 0032 ALA C 2.444 C A 0033 THR CA
C A 0032 ALA C 3.714 C A 0033 THR C
C A 0032 ALA C 3.037 C A 0033 THR CB
C A 0032 ALA C 3.336 C A 0033 THR CG2
C A 0033 THR C 2.447 C A 0034 ASN CA
C A 0033 THR C 2.886 C A 0034 ASN C
C A 0033 THR C 3.703 C A 0034 ASN CB
C A 0033 THR CG2 3.662 C A 0037 ALA CB
C A 0033 THR CG2 3.774 C A 0042 ALA C
C A 0034 ASN C 2.428 C A 0035 ILE CA
C A 0034 ASN C 3.612 C A 0035 ILE C
C A 0034 ASN C 3.336 C A 0035 ILE CB
C A 0034 ASN C 3.365 C A 0035 ILE CG2
C A 0035 ILE C 2.433 C A 0036 GLN CA
C A 0035 ILE C 3.595 C A 0036 GLN C
C A 0035 ILE C 3.360 C A 0036 GLN CB
C A 0035 ILE CA 3.468 C A 0041 GLY CA
C A 0035 ILE CA 3.739 C A 0041 GLY C
C A 0035 ILE C 3.695 C A 0041 GLY CA
C A 0036 GLN C 2.429 C A 0037 ALA CA
C A 0036 GLN C 3.227 C A 0037 ALA C
C A 0036 GLN C 3.651 C A 0037 ALA CB
C A 0037 ALA C 2.449 C A 0038 ALA CA
C A 0037 ALA C 3.748 C A 0038 ALA C
C A 0037 ALA C 2.950 C A 0038 ALA CB
C A 0037 ALA CB 3.758 C A 0041 GLY CA
C A 0037 ALA CB 3.185 C A 0041 GLY C
C A 0037 ALA CB 3.202 C A 0042 ALA C
C A 0037 ALA CB 3.360 C A 0043 ASP CA
C A 0038 ALA C 2.451 C A 0039 LYS CA
C A 0038 ALA C 2.951 C A 0039 LYS C
C A 0038 ALA C 3.723 C A 0039 LYS CB
C A 0039 LYS C 2.432 C A 0040 ASN CA
C A 0039 LYS C 3.530 C A 0040 ASN C
C A 0039 LYS C 3.430 C A 0040 ASN CB
C A 0039 LYS CE 3.747 H A 0115 ASP CG
C A 0040 ASN CA 3.789 C A 0041 GLY CA
C A 0040 ASN C 2.419 C A 0041 GLY CA
C A 0040 ASN C 3.368 C A 0041 GLY C
C A 0041 GLY C 2.441 C A 0042 ALA CA
C A 0041 GLY C 3.218 C A 0042 ALA C
C A 0041 GLY C 3.657 C A 0042 ALA CB
C A 0042 ALA C 2.440 C A 0043 ASP CA
C A 0042 ALA C 3.722 C A 0043 ASP C
C A 0042 ALA C 2.995 C A 0043 ASP CB
C A 0043 ASP C 2.441 C A 0044 MET CA
C A 0043 ASP C 3.679 C A 0044 MET C
C A 0043 ASP C 3.194 C A 0044 MET CB
C A 0043 ASP CA 3.797 H A 0047 LEU CD1
C A 0043 ASP C 3.444 H A 0047 LEU CB
C A 0043 ASP C 3.384 H A 0047 LEU CD1
C A 0043 ASP CB 3.555 H A 0047 LEU CB
C A 0044 MET C 2.435 C A 0045 SER CA
C A 0044 MET C 3.039 C A 0045 SER C
C A 0044 MET C 3.712 C A 0045 SER CB
C A 0044 MET CA 3.650 H A 0047 LEU CB
C A 0044 MET CG 3.557 H A 0111 ASN CG
C A 0045 SER CA 3.799 H A 0046 GLN CA
C A 0045 SER C 2.431 H A 0046 GLN CA
C A 0045 SER C 3.223 H A 0046 GLN C
C A 0045 SER C 3.653 H A 0046 GLN CB
H A 0046 GLN C 2.438 H A 0047 LEU CA
H A 0046 GLN C 3.109 H A 0047 LEU C
H A 0046 GLN C 3.703 H A 0047 LEU CB
H A 0047 LEU CA 3.776 H A 0048 GLY CA
H A 0047 LEU C 2.411 H A 0048 GLY CA
H A 0047 LEU C 3.050 H A 0048 GLY C
H A 0047 LEU CD2 3.787 H A 0051 LYS CB
H A 0047 LEU CD2 3.608 H A 0051 LYS CD
H A 0047 LEU CD2 3.517 H A 0114 THR CB
H A 0047 LEU CD2 3.613 H A 0114 THR CG2
H A 0048 GLY CA 3.797 H A 0049 CYS CA
H A 0048 GLY C 2.432 H A 0049 CYS CA
H A 0048 GLY C 3.592 H A 0049 CYS C
H A 0048 GLY C 3.346 H A 0049 CYS CB
H A 0048 GLY C 3.547 H A 0052 ALA CB
H A 0048 GLY C 3.605 H A 0107 CYS CA
H A 0048 GLY CA 3.361 H A 0110 GLY CA
H A 0048 GLY CA 3.201 H A 0110 GLY C
H A 0048 GLY C 3.640 H A 0110 GLY CA
H A 0048 GLY CA 3.770 H A 0111 ASN CA
H A 0049 CYS CA 3.800 H A 0050 LEU CA
H A 0049 CYS C 2.434 H A 0050 LEU CA
H A 0049 CYS C 2.872 H A 0050 LEU C
H A 0049 CYS C 3.712 H A 0050 LEU CB
H A 0049 CYS CA 3.436 H A 0052 ALA CB
H A 0049 CYS C 3.679 H A 0052 ALA CB
H A 0050 LEU CA 3.792 H A 0051 LYS CA
H A 0050 LEU C 2.427 H A 0051 LYS CA
H A 0050 LEU C 3.175 H A 0051 LYS C
H A 0050 LEU C 3.678 H A 0051 LYS CB
H A 0051 LYS C 2.429 H A 0052 ALA CA
H A 0051 LYS C 3.098 H A 0052 ALA C
H A 0051 LYS C 3.694 H A 0052 ALA CB
H A 0052 ALA CA 3.796 H A 0053 CYS CA
H A 0052 ALA C 2.438 H A 0053 CYS CA
H A 0052 ALA C 3.023 H A 0053 CYS C
H A 0052 ALA C 3.713 H A 0053 CYS CB
H A 0052 ALA CA 3.754 H A 0055 MET CG
H A 0053 CYS CA 3.797 H A 0054 VAL CA
H A 0053 CYS C 2.431 H A 0054 VAL CA
H A 0053 CYS C 3.058 H A 0054 VAL C
H A 0053 CYS C 3.727 H A 0054 VAL CB
H A 0053 CYS CA 3.549 H A 0056 LYS CG
H A 0053 CYS C 3.603 H A 0056 LYS CG
H A 0054 VAL C 2.438 H A 0055 MET CA
H A 0054 VAL C 3.125 H A 0055 MET C
H A 0054 VAL C 3.699 H A 0055 MET CB
H A 0055 MET C 2.436 H A 0056 LYS CA
H A 0055 MET C 3.041 H A 0056 LYS C
H A 0055 MET C 3.709 H A 0056 LYS CB
H A 0055 MET CB 3.520 C A 0060 MET CE
H A 0056 LYS CA 3.799 H A 0057 ARG CA
H A 0056 LYS C 2.436 H A 0057 ARG CA
H A 0056 LYS C 3.089 H A 0057 ARG C
H A 0056 LYS C 3.700 H A 0057 ARG CB
H A 0056 LYS CA 3.622 E A 0061 LEU CB
H A 0056 LYS CB 3.581 E A 0061 LEU CB
H A 0056 LYS CE 3.660 E A 0061 LEU CD2
H A 0057 ARG C 2.438 H A 0058 ILE CA
H A 0057 ARG C 3.369 H A 0058 ILE C
H A 0057 ARG C 3.616 H A 0058 ILE CB
H A 0058 ILE C 2.441 C A 0059 GLU CA
H A 0058 ILE C 3.027 C A 0059 GLU C
H A 0058 ILE C 3.011 C A 0059 GLU CB
H A 0058 ILE C 3.662 C A 0059 GLU CG
C A 0059 GLU C 2.437 C A 0060 MET CA
C A 0059 GLU C 3.493 C A 0060 MET C
C A 0059 GLU C 3.486 C A 0060 MET CB
C A 0060 MET C 2.437 E A 0061 LEU CA
C A 0060 MET C 3.563 E A 0061 LEU C
C A 0060 MET C 3.393 E A 0061 LEU CB
C A 0060 MET CG 3.541 C A 0067 TYR C
C A 0060 MET CA 3.734 H A 0070 PRO CG
C A 0060 MET CB 3.565 H A 0070 PRO CG
C A 0060 MET CG 3.618 H A 0070 PRO CG
C A 0060 MET CG 3.746 H A 0071 VAL CG2
E A 0061 LEU C 2.433 E A 0062 LYS CA
E A 0061 LEU C 3.375 E A 0062 LYS C
E A 0061 LEU C 3.573 E A 0062 LYS CB
E A 0062 LYS CA 3.791 C A 0063 GLY CA
E A 0062 LYS C 2.419 C A 0063 GLY CA
E A 0062 LYS C 3.133 C A 0063 GLY C
C A 0063 GLY CA 3.789 C A 0064 THR CA
C A 0063 GLY C 2.433 C A 0064 THR CA
C A 0063 GLY C 3.594 C A 0064 THR C
C A 0063 GLY C 3.369 C A 0064 THR CB
C A 0063 GLY C 3.297 C A 0064 THR CG2
C A 0064 THR CA 3.800 E A 0065 GLU CA
C A 0064 THR C 2.436 E A 0065 GLU CA
C A 0064 THR C 3.303 E A 0065 GLU C
C A 0064 THR C 3.621 E A 0065 GLU CB
C A 0064 THR CA 3.450 H A 0109 ILE CD1
C A 0064 THR C 3.494 H A 0109 ILE CD1
E A 0065 GLU CA 3.793 E A 0066 LEU CA
E A 0065 GLU C 2.425 E A 0066 LEU CA
E A 0065 GLU C 3.212 E A 0066 LEU C
E A 0065 GLU C 3.638 E A 0066 LEU CB
E A 0065 GLU CB 3.469 C A 0067 TYR CE2
E A 0066 LEU C 2.443 C A 0067 TYR CA
E A 0066 LEU C 3.426 C A 0067 TYR C
E A 0066 LEU C 3.555 C A 0067 TYR CB
E A 0066 LEU CD2 3.462 H A 0100 ALA CB
E A 0066 LEU CB 3.456 H A 0109 ILE CG2
E A 0066 LEU CD1 3.538 H A 0113 TYR CD1
E A 0066 LEU CD1 3.525 H A 0113 TYR CE1
E A 0066 LEU CD2 3.703 H A 0113 TYR CD1
C A 0067 TYR C 2.434 H A 0068 VAL CA
C A 0067 TYR C 3.713 H A 0068 VAL C
C A 0067 TYR C 3.130 H A 0068 VAL CB
H A 0068 VAL C 2.440 H A 0069 GLU CA
H A 0068 VAL C 2.972 H A 0069 GLU C
H A 0068 VAL C 3.725 H A 0069 GLU CB
H A 0068 VAL C 3.535 H A 0070 PRO CD
H A 0068 VAL CG1 3.495 H A 0072 TYR CE2
H A 0068 VAL CG1 3.539 H A 0072 TYR CZ
H A 0068 VAL CG2 3.498 H A 0072 TYR CE1
H A 0068 VAL CG2 3.636 H A 0072 TYR CZ
H A 0068 VAL CG2 3.491 H A 0093 ALA CB
H A 0068 VAL CB 3.588 H A 0097 ILE CD1
H A 0068 VAL CG1 3.477 H A 0097 ILE CD1
H A 0069 GLU CA 2.975 H A 0070 PRO CD
H A 0069 GLU C 2.468 H A 0070 PRO CA
H A 0069 GLU C 3.007 H A 0070 PRO C
H A 0069 GLU C 3.675 H A 0070 PRO CB
H A 0069 GLU C 3.617 H A 0070 PRO CG
H A 0069 GLU C 2.523 H A 0070 PRO CD
H A 0069 GLU CB 3.207 H A 0070 PRO CD
H A 0070 PRO CA 3.798 H A 0071 VAL CA
H A 0070 PRO C 2.432 H A 0071 VAL CA
H A 0070 PRO C 3.087 H A 0071 VAL C
H A 0070 PRO C 3.725 H A 0071 VAL CB
H A 0071 VAL CA 3.788 H A 0072 TYR CA
H A 0071 VAL C 2.427 H A 0072 TYR CA
H A 0071 VAL C 2.961 H A 0072 TYR C
H A 0071 VAL C 3.708 H A 0072 TYR CB
H A 0071 VAL CA 3.449 H A 0074 MET CG
H A 0071 VAL C 3.634 H A 0074 MET CG
H A 0071 VAL CG1 3.786 H A 0075 ILE CG1
H A 0071 VAL CG1 3.654 H A 0075 ILE CD1
H A 0072 TYR CA 3.797 H A 0073 LYS CA
H A 0072 TYR C 2.434 H A 0073 LYS CA
H A 0072 TYR C 3.236 H A 0073 LYS C
H A 0072 TYR C 3.655 H A 0073 LYS CB
H A 0072 TYR CA 3.325 H A 0090 LYS CE
H A 0072 TYR C 3.576 H A 0090 LYS CE
H A 0072 TYR CB 3.498 H A 0090 LYS CE
H A 0072 TYR CD1 3.542 H A 0090 LYS CG
H A 0072 TYR CD1 3.603 H A 0090 LYS CD
H A 0072 TYR CD1 3.586 H A 0090 LYS CE
H A 0072 TYR CE1 3.766 H A 0090 LYS CG
H A 0073 LYS C 2.424 H A 0074 MET CA
H A 0073 LYS C 3.155 H A 0074 MET C
H A 0073 LYS C 3.680 H A 0074 MET CB
H A 0073 LYS C 3.707 H A 0076 GLU CG
H A 0074 MET CA 3.800 H A 0075 ILE CA
H A 0074 MET C 2.427 H A 0075 ILE CA
H A 0074 MET C 2.949 H A 0075 ILE C
H A 0074 MET C 3.743 H A 0075 ILE CB
H A 0075 ILE CA 3.794 H A 0076 GLU CA
H A 0075 ILE C 2.434 H A 0076 GLU CA
H A 0075 ILE C 3.018 H A 0076 GLU C
H A 0075 ILE C 3.710 H A 0076 GLU CB
H A 0075 ILE CG2 3.548 H A 0079 HIS CD2
H A 0075 ILE C 3.792 H A 0086 ILE CG2
H A 0075 ILE CG2 3.627 H A 0086 ILE CG2
H A 0075 ILE CG2 3.755 H A 0089 VAL CB
H A 0075 ILE CD1 3.559 H A 0089 VAL CG1
H A 0076 GLU C 2.438 H A 0077 VAL CA
H A 0076 GLU C 3.237 H A 0077 VAL C
H A 0076 GLU C 3.687 H A 0077 VAL CB
H A 0076 GLU CA 3.767 H A 0086 ILE CG2
H A 0077 VAL C 2.443 H A 0078 VAL CA
H A 0077 VAL C 2.932 H A 0078 VAL C
H A 0077 VAL C 3.738 H A 0078 VAL CB
H A 0078 VAL C 2.437 H A 0079 HIS CA
H A 0078 VAL C 3.482 H A 0079 HIS C
H A 0078 VAL C 3.492 H A 0079 HIS CB
H A 0078 VAL C 3.693 H A 0079 HIS CG
H A 0078 VAL CG1 3.580 H A 0079 HIS CD2
H A 0079 HIS C 2.434 C A 0080 ALA CA
H A 0079 HIS C 3.080 C A 0080 ALA C
H A 0079 HIS C 3.700 C A 0080 ALA CB
H A 0079 HIS CE1 3.638 H A 0089 VAL CG2
C A 0080 ALA CA 3.791 C A 0081 GLY CA
C A 0080 ALA C 2.419 C A 0081 GLY CA
C A 0080 ALA C 3.632 C A 0081 GLY C
C A 0081 GLY CA 3.798 C A 0082 ASN CA
C A 0081 GLY C 2.437 C A 0082 ASN CA
C A 0081 GLY C 3.424 C A 0082 ASN C
C A 0081 GLY C 3.540 C A 0082 ASN CB
C A 0081 GLY C 3.723 C A 0082 ASN CG
C A 0082 ASN C 2.435 H A 0083 ALA CA
C A 0082 ASN C 3.194 H A 0083 ALA C
C A 0082 ASN C 3.668 H A 0083 ALA CB
C A 0082 ASN CB 3.716 H A 0085 ASP CB
C A 0082 ASN CB 3.714 H A 0085 ASP CG
H A 0083 ALA C 2.427 H A 0084 ASP CA
H A 0083 ALA C 3.157 H A 0084 ASP C
H A 0083 ALA C 3.685 H A 0084 ASP CB
H A 0084 ASP C 2.428 H A 0085 ASP CA
H A 0084 ASP C 2.917 H A 0085 ASP C
H A 0084 ASP C 3.723 H A 0085 ASP CB
H A 0084 ASP CA 3.759 H A 0087 GLN CB
H A 0085 ASP CA 3.784 H A 0086 ILE CA
H A 0085 ASP C 2.431 H A 0086 ILE CA
H A 0085 ASP C 3.117 H A 0086 ILE C
H A 0085 ASP C 3.707 H A 0086 ILE CB
H A 0086 ILE CA 3.797 H A 0087 GLN CA
H A 0086 ILE C 2.442 H A 0087 GLN CA
H A 0086 ILE C 3.134 H A 0087 GLN C
H A 0086 ILE C 3.700 H A 0087 GLN CB
H A 0087 GLN C 2.434 H A 0088 LEU CA
H A 0087 GLN C 3.128 H A 0088 LEU C
H A 0087 GLN C 3.694 H A 0088 LEU CB
H A 0088 LEU C 2.437 H A 0089 VAL CA
H A 0088 LEU C 2.955 H A 0089 VAL C
H A 0088 LEU C 3.741 H A 0089 VAL CB
H A 0089 VAL C 2.438 H A 0090 LYS CA
H A 0089 VAL C 2.982 H A 0090 LYS C
H A 0089 VAL C 3.712 H A 0090 LYS CB
H A 0089 VAL CA 3.758 H A 0092 ILE CD1
H A 0090 LYS CA 3.792 H A 0091 GLY CA
H A 0090 LYS C 2.421 H A 0091 GLY CA
H A 0090 LYS C 3.108 H A 0091 GLY C
H A 0091 GLY CA 3.795 H A 0092 ILE CA
H A 0091 GLY C 2.436 H A 0092 ILE CA
H A 0091 GLY C 3.015 H A 0092 ILE C
H A 0091 GLY C 3.737 H A 0092 ILE CB
H A 0092 ILE C 2.433 H A 0093 ALA CA
H A 0092 ILE C 3.001 H A 0093 ALA C
H A 0092 ILE C 3.705 H A 0093 ALA CB
H A 0092 ILE CG2 3.450 H A 0120 LYS CB
H A 0092 ILE CD1 3.745 H A 0121 LEU CB
H A 0093 ALA C 2.436 H A 0094 ASN CA
H A 0093 ALA C 3.002 H A 0094 ASN C
H A 0093 ALA C 3.717 H A 0094 ASN CB
H A 0094 ASN C 2.436 H A 0095 GLU CA
H A 0094 ASN C 3.044 H A 0095 GLU C
H A 0094 ASN C 3.714 H A 0095 GLU CB
H A 0095 GLU C 2.435 H A 0096 CYS CA
H A 0095 GLU C 3.171 H A 0096 CYS C
H A 0095 GLU C 3.677 H A 0096 CYS CB
H A 0095 GLU CG 3.771 H A 0120 LYS CE
H A 0096 CYS C 2.435 H A 0097 ILE CA
H A 0096 CYS C 3.142 H A 0097 ILE C
H A 0096 CYS C 3.721 H A 0097 ILE CB
H A 0096 CYS C 3.709 H A 0113 TYR CD1
H A 0096 CYS CB 3.478 H A 0113 TYR CD1
H A 0096 CYS CB 3.574 H A 0113 TYR CE1
H A 0096 CYS CA 3.531 H A 0116 CYS CB
H A 0096 CYS CB 3.575 H A 0116 CYS CB
H A 0097 ILE C 2.433 H A 0098 GLU CA
H A 0097 ILE C 3.044 H A 0098 GLU C
H A 0097 ILE C 3.712 H A 0098 GLU CB
H A 0097 ILE CG1 3.592 H A 0113 TYR CE1
H A 0098 GLU CA 3.797 H A 0099 ASN CA
H A 0098 GLU C 2.434 H A 0099 ASN CA
H A 0098 GLU C 3.296 H A 0099 ASN C
H A 0098 GLU C 3.624 H A 0099 ASN CB
H A 0099 ASN C 2.436 H A 0100 ALA CA
H A 0099 ASN C 3.148 H A 0100 ALA C
H A 0099 ASN C 3.683 H A 0100 ALA CB
H A 0100 ALA C 2.478 H A 0101 LYS CA
H A 0100 ALA C 2.921 H A 0101 LYS C
H A 0100 ALA C 3.289 H A 0101 LYS CB
H A 0100 ALA C 3.193 H A 0101 LYS CG
H A 0100 ALA C 3.744 H A 0101 LYS CD
H A 0100 ALA CA 3.467 H A 0112 LYS CB
H A 0100 ALA CB 3.513 H A 0112 LYS CB
H A 0101 LYS CA 3.794 C A 0102 GLY CA
H A 0101 LYS C 2.417 C A 0102 GLY CA
H A 0101 LYS C 2.958 C A 0102 GLY C
C A 0102 GLY C 2.438 C A 0103 GLU CA
C A 0102 GLY C 3.008 C A 0103 GLU C
C A 0102 GLY C 3.716 C A 0103 GLU CB
C A 0103 GLU C 2.431 C A 0104 THR CA
C A 0103 GLU C 3.208 C A 0104 THR C
C A 0103 GLU C 3.688 C A 0104 THR CB
C A 0103 GLU CB 3.752 H A 0108 ASN CG
C A 0103 GLU CG 3.571 H A 0108 ASN CG
C A 0103 GLU CA 3.671 H A 0109 ILE CG1
C A 0103 GLU C 3.574 H A 0109 ILE CG1
C A 0103 GLU CB 3.590 H A 0109 ILE CG1
C A 0104 THR CA 3.798 H A 0105 ASP CA
C A 0104 THR C 2.429 H A 0105 ASP CA
C A 0104 THR C 3.145 H A 0105 ASP C
C A 0104 THR C 3.684 H A 0105 ASP CB
H A 0105 ASP C 2.436 H A 0106 GLU CA
H A 0105 ASP C 2.980 H A 0106 GLU C
H A 0105 ASP C 3.716 H A 0106 GLU CB
H A 0105 ASP CB 3.587 H A 0108 ASN CB
H A 0106 GLU C 2.438 H A 0107 CYS CA
H A 0106 GLU C 2.966 H A 0107 CYS C
H A 0106 GLU C 3.714 H A 0107 CYS CB
H A 0107 CYS C 2.432 H A 0108 ASN CA
H A 0107 CYS C 3.093 H A 0108 ASN C
H A 0107 CYS C 3.703 H A 0108 ASN CB
H A 0108 ASN C 2.437 H A 0109 ILE CA
H A 0108 ASN C 3.000 H A 0109 ILE C
H A 0108 ASN C 3.748 H A 0109 ILE CB
H A 0109 ILE CA 3.784 H A 0110 GLY CA
H A 0109 ILE C 2.417 H A 0110 GLY CA
H A 0109 ILE C 3.086 H A 0110 GLY C
H A 0110 GLY C 2.437 H A 0111 ASN CA
H A 0110 GLY C 2.981 H A 0111 ASN C
H A 0110 GLY C 3.723 H A 0111 ASN CB
H A 0111 ASN CA 3.798 H A 0112 LYS CA
H A 0111 ASN C 2.430 H A 0112 LYS CA
H A 0111 ASN C 3.148 H A 0112 LYS C
H A 0111 ASN C 3.680 H A 0112 LYS CB
H A 0111 ASN CA 3.473 H A 0114 THR CG2
H A 0111 ASN C 3.496 H A 0114 THR CG2
H A 0112 LYS C 2.439 H A 0113 TYR CA
H A 0112 LYS C 3.149 H A 0113 TYR C
H A 0112 LYS C 3.694 H A 0113 TYR CB
H A 0113 TYR C 2.429 H A 0114 THR CA
H A 0113 TYR C 3.148 H A 0114 THR C
H A 0113 TYR C 3.713 H A 0114 THR CB
H A 0114 THR C 2.446 H A 0115 ASP CA
H A 0114 THR C 2.918 H A 0115 ASP C
H A 0114 THR C 3.708 H A 0115 ASP CB
H A 0115 ASP C 2.441 H A 0116 CYS CA
H A 0115 ASP C 2.985 H A 0116 CYS C
H A 0115 ASP C 3.714 H A 0116 CYS CB
H A 0116 CYS C 2.432 H A 0117 TYR CA
H A 0116 CYS C 3.005 H A 0117 TYR C
H A 0116 CYS C 3.713 H A 0117 TYR CB
H A 0117 TYR C 2.440 H A 0118 ILE CA
H A 0117 TYR C 3.217 H A 0118 ILE C
H A 0117 TYR C 3.699 H A 0118 ILE CB
H A 0117 TYR CD2 3.270 C A 0123 SER C
H A 0117 TYR CE2 3.293 C A 0123 SER C
H A 0118 ILE C 2.428 H A 0119 GLU CA
H A 0118 ILE C 3.096 H A 0119 GLU C
H A 0118 ILE C 3.699 H A 0119 GLU CB
H A 0118 ILE CA 3.355 C A 0122 PHE CA
H A 0118 ILE CA 3.688 C A 0122 PHE C
H A 0118 ILE C 3.421 C A 0122 PHE CA
H A 0118 ILE CD1 3.712 C A 0122 PHE C
H A 0119 GLU C 2.435 H A 0120 LYS CA
H A 0119 GLU C 3.264 H A 0120 LYS C
H A 0119 GLU C 3.655 H A 0120 LYS CB
H A 0120 LYS C 2.435 H A 0121 LEU CA
H A 0120 LYS C 3.345 H A 0121 LEU C
H A 0120 LYS C 3.607 H A 0121 LEU CB
H A 0121 LEU C 2.442 C A 0122 PHE CA
H A 0121 LEU C 3.129 C A 0122 PHE C
H A 0121 LEU C 2.933 C A 0122 PHE CB
H A 0121 LEU CD1 3.703 C A 0123 SER CA
H A 0121 LEU CD1 3.281 C A 0123 SER C
C A 0122 PHE C 2.432 C A 0123 SER CA
C A 0122 PHE C 3.654 C A 0123 SER C
C A 0122 PHE C 3.233 C A 0123 SER CB
C A 0122 PHE CD2 3.694 C A 0123 SER CB
CHARGE_ATTR 2.00 12.00 93
H A 0002 ASP OD2 11.76 H A 0009 LYS NZ
H A 0002 ASP OD1 11.16 H A 0079 HIS ND1
H A 0002 ASP OD2 10.12 H A 0079 HIS ND1
H A 0002 ASP OD2 11.88 H A 0079 HIS NE2
H A 0012 GLU OE1 6.658 H A 0009 LYS NZ
H A 0012 GLU OE2 4.907 H A 0009 LYS NZ
H A 0017 ASP OD1 5.242 H A 0057 ARG NH1
H A 0017 ASP OD1 6.746 H A 0057 ARG NH2
H A 0017 ASP OD2 7.405 H A 0057 ARG NH1
H A 0017 ASP OD2 8.870 H A 0057 ARG NH2
H A 0023 ASP OD1 8.220 H A 0026 HIS ND1
H A 0023 ASP OD1 9.254 H A 0026 HIS NE2
H A 0023 ASP OD2 9.407 H A 0026 HIS ND1
H A 0023 ASP OD2 10.33 H A 0026 HIS NE2
H A 0024 GLU OE1 6.170 H A 0056 LYS NZ
H A 0024 GLU OE2 5.541 H A 0056 LYS NZ
H A 0024 GLU OE1 8.366 H A 0057 ARG NH1
H A 0024 GLU OE1 8.846 H A 0057 ARG NH2
H A 0024 GLU OE2 10.42 H A 0057 ARG NH1
H A 0024 GLU OE2 10.77 H A 0057 ARG NH2
C A 0029 GLU OE1 5.659 H A 0051 LYS NZ
C A 0029 GLU OE2 6.692 H A 0051 LYS NZ
C A 0030 ASP OD1 8.878 H A 0051 LYS NZ
C A 0030 ASP OD2 10.68 H A 0051 LYS NZ
C A 0043 ASP OD1 11.96 H A 0026 HIS ND1
C A 0043 ASP OD2 10.60 H A 0026 HIS ND1
C A 0043 ASP OD2 11.84 H A 0026 HIS NE2
C A 0043 ASP OD1 10.02 C A 0039 LYS NZ
C A 0043 ASP OD2 11.49 C A 0039 LYS NZ
C A 0043 ASP OD1 10.46 H A 0051 LYS NZ
C A 0043 ASP OD2 11.76 H A 0051 LYS NZ
C A 0059 GLU OE1 10.83 H A 0057 ARG NH1
C A 0059 GLU OE1 8.848 H A 0057 ARG NH2
C A 0059 GLU OE2 10.06 H A 0057 ARG NH1
C A 0059 GLU OE2 8.376 H A 0057 ARG NH2
C A 0059 GLU OE1 5.825 E A 0062 LYS NZ
C A 0059 GLU OE2 7.390 E A 0062 LYS NZ
C A 0059 GLU OE1 10.45 H A 0073 LYS NZ
C A 0059 GLU OE2 8.996 H A 0073 LYS NZ
E A 0065 GLU OE2 11.97 H A 0056 LYS NZ
E A 0065 GLU OE1 10.43 E A 0062 LYS NZ
E A 0065 GLU OE2 10.60 E A 0062 LYS NZ
H A 0069 GLU OE1 10.06 H A 0073 LYS NZ
H A 0069 GLU OE2 11.05 H A 0073 LYS NZ
H A 0069 GLU OE1 11.54 H A 0090 LYS NZ
H A 0076 GLU OE1 7.836 H A 0073 LYS NZ
H A 0076 GLU OE2 6.013 H A 0073 LYS NZ
H A 0076 GLU OE1 11.87 H A 0079 HIS NE2
H A 0076 GLU OE2 11.61 H A 0079 HIS NE2
H A 0076 GLU OE1 5.262 H A 0090 LYS NZ
H A 0076 GLU OE2 5.934 H A 0090 LYS NZ
H A 0084 ASP OD1 10.59 H A 0090 LYS NZ
H A 0084 ASP OD2 11.72 H A 0090 LYS NZ
H A 0085 ASP OD1 7.422 H A 0079 HIS ND1
H A 0085 ASP OD1 9.317 H A 0079 HIS NE2
H A 0085 ASP OD2 5.814 H A 0079 HIS ND1
H A 0085 ASP OD2 7.671 H A 0079 HIS NE2
H A 0085 ASP OD2 12.00 H A 0090 LYS NZ
H A 0095 GLU OE1 10.57 H A 0101 LYS NZ
H A 0095 GLU OE1 11.88 H A 0112 LYS NZ
H A 0095 GLU OE1 6.181 H A 0120 LYS NZ
H A 0095 GLU OE2 4.830 H A 0120 LYS NZ
H A 0098 GLU OE1 11.91 H A 0101 LYS NZ
H A 0098 GLU OE2 11.59 H A 0101 LYS NZ
H A 0098 GLU OE1 9.733 H A 0120 LYS NZ
H A 0098 GLU OE2 11.56 H A 0120 LYS NZ
C A 0103 GLU OE1 11.45 C A 0039 LYS NZ
C A 0103 GLU OE1 5.225 H A 0101 LYS NZ
C A 0103 GLU OE2 4.483 H A 0101 LYS NZ
C A 0103 GLU OE1 8.094 H A 0112 LYS NZ
C A 0103 GLU OE2 8.959 H A 0112 LYS NZ
H A 0105 ASP OD1 10.78 H A 0056 LYS NZ
H A 0105 ASP OD2 9.985 H A 0056 LYS NZ
H A 0105 ASP OD2 11.26 H A 0112 LYS NZ
H A 0106 GLU OE1 3.095 H A 0056 LYS NZ
H A 0106 GLU OE2 3.644 H A 0056 LYS NZ
H A 0106 GLU OE1 10.45 E A 0062 LYS NZ
H A 0115 ASP OD1 4.369 C A 0039 LYS NZ
H A 0115 ASP OD2 5.630 C A 0039 LYS NZ
H A 0115 ASP OD1 10.94 H A 0051 LYS NZ
H A 0115 ASP OD2 11.32 H A 0051 LYS NZ
H A 0115 ASP OD1 11.91 H A 0101 LYS NZ
H A 0115 ASP OD2 10.55 H A 0101 LYS NZ
H A 0115 ASP OD1 5.880 H A 0112 LYS NZ
H A 0115 ASP OD2 5.600 H A 0112 LYS NZ
H A 0115 ASP OD1 10.16 H A 0120 LYS NZ
H A 0115 ASP OD2 8.502 H A 0120 LYS NZ
H A 0119 GLU OE1 9.475 C A 0039 LYS NZ
H A 0119 GLU OE2 9.142 C A 0039 LYS NZ
H A 0119 GLU OE1 10.49 H A 0112 LYS NZ
H A 0119 GLU OE2 10.70 H A 0112 LYS NZ
H A 0119 GLU OE1 6.628 H A 0120 LYS NZ
H A 0119 GLU OE2 7.904 H A 0120 LYS NZ
CHARGE_REPU 2.00 12.00 86
H A 0002 ASP OD1 5.541 H A 0004 ASP OD1
H A 0002 ASP OD1 7.545 H A 0004 ASP OD2
H A 0002 ASP OD2 6.298 H A 0004 ASP OD1
H A 0002 ASP OD2 7.987 H A 0004 ASP OD2
H A 0002 ASP OD1 10.30 H A 0085 ASP OD1
H A 0002 ASP OD1 9.336 H A 0085 ASP OD2
H A 0002 ASP OD2 9.540 H A 0085 ASP OD1
H A 0002 ASP OD2 8.719 H A 0085 ASP OD2
H A 0009 LYS NZ 9.674 H A 0079 HIS ND1
H A 0009 LYS NZ 10.22 H A 0079 HIS NE2
H A 0012 GLU OE1 11.99 H A 0017 ASP OD2
H A 0012 GLU OE2 11.47 H A 0017 ASP OD2
H A 0017 ASP OD1 11.51 H A 0024 GLU OE1
H A 0017 ASP OD1 10.87 C A 0059 GLU OE2
H A 0023 ASP OD1 10.08 H A 0024 GLU OE1
H A 0023 ASP OD1 10.59 H A 0024 GLU OE2
H A 0023 ASP OD2 8.353 H A 0024 GLU OE1
H A 0023 ASP OD2 9.108 H A 0024 GLU OE2
H A 0024 GLU OE2 11.80 C A 0029 GLU OE2
H A 0024 GLU OE1 7.631 H A 0106 GLU OE1
H A 0024 GLU OE1 7.193 H A 0106 GLU OE2
H A 0024 GLU OE2 6.472 H A 0106 GLU OE1
H A 0024 GLU OE2 5.538 H A 0106 GLU OE2
C A 0029 GLU OE1 5.231 C A 0030 ASP OD1
C A 0029 GLU OE1 6.497 C A 0030 ASP OD2
C A 0029 GLU OE2 5.004 C A 0030 ASP OD1
C A 0029 GLU OE2 5.668 C A 0030 ASP OD2
C A 0029 GLU OE1 6.632 C A 0043 ASP OD1
C A 0029 GLU OE1 7.088 C A 0043 ASP OD2
C A 0029 GLU OE2 7.744 C A 0043 ASP OD1
C A 0029 GLU OE2 7.862 C A 0043 ASP OD2
C A 0030 ASP OD1 10.70 C A 0043 ASP OD1
C A 0030 ASP OD1 10.26 C A 0043 ASP OD2
C A 0030 ASP OD2 11.36 C A 0043 ASP OD1
C A 0030 ASP OD2 10.55 C A 0043 ASP OD2
C A 0039 LYS NZ 10.95 H A 0101 LYS NZ
C A 0039 LYS NZ 3.983 H A 0112 LYS NZ
C A 0043 ASP OD1 10.88 H A 0105 ASP OD2
C A 0043 ASP OD1 11.28 H A 0106 GLU OE2
C A 0043 ASP OD1 11.74 H A 0115 ASP OD1
H A 0051 LYS NZ 11.41 H A 0056 LYS NZ
H A 0051 LYS NZ 11.96 H A 0079 HIS NE2
H A 0056 LYS NZ 10.86 H A 0057 ARG NH1
H A 0056 LYS NZ 10.30 H A 0057 ARG NH2
H A 0056 LYS NZ 9.558 E A 0062 LYS NZ
H A 0057 ARG NH1 10.35 E A 0062 LYS NZ
H A 0057 ARG NH2 8.180 E A 0062 LYS NZ
C A 0059 GLU OE1 11.25 H A 0069 GLU OE1
C A 0059 GLU OE1 10.30 H A 0069 GLU OE2
C A 0059 GLU OE2 11.59 H A 0069 GLU OE1
C A 0059 GLU OE2 10.89 H A 0069 GLU OE2
E A 0065 GLU OE1 10.37 H A 0069 GLU OE2
E A 0065 GLU OE2 11.98 H A 0069 GLU OE2
E A 0065 GLU OE2 11.02 C A 0103 GLU OE2
E A 0065 GLU OE2 10.83 H A 0106 GLU OE1
H A 0069 GLU OE1 11.64 H A 0076 GLU OE2
H A 0073 LYS NZ 10.97 H A 0090 LYS NZ
H A 0079 HIS ND1 9.925 H A 0090 LYS NZ
H A 0079 HIS NE2 9.439 H A 0090 LYS NZ
H A 0084 ASP OD1 7.742 H A 0085 ASP OD1
H A 0084 ASP OD1 9.230 H A 0085 ASP OD2
H A 0084 ASP OD2 6.508 H A 0085 ASP OD1
H A 0084 ASP OD2 8.340 H A 0085 ASP OD2
H A 0095 GLU OE1 4.185 H A 0098 GLU OE1
H A 0095 GLU OE1 5.700 H A 0098 GLU OE2
H A 0095 GLU OE2 5.078 H A 0098 GLU OE1
H A 0095 GLU OE2 6.787 H A 0098 GLU OE2
H A 0095 GLU OE1 11.67 H A 0115 ASP OD1
H A 0095 GLU OE1 9.491 H A 0115 ASP OD2
H A 0095 GLU OE2 10.28 H A 0115 ASP OD2
H A 0095 GLU OE1 10.91 H A 0119 GLU OE1
H A 0095 GLU OE2 10.60 H A 0119 GLU OE1
H A 0095 GLU OE2 11.84 H A 0119 GLU OE2
H A 0101 LYS NZ 6.983 H A 0112 LYS NZ
C A 0103 GLU OE1 8.989 H A 0105 ASP OD1
C A 0103 GLU OE1 8.149 H A 0105 ASP OD2
C A 0103 GLU OE2 10.49 H A 0105 ASP OD1
C A 0103 GLU OE2 9.637 H A 0105 ASP OD2
H A 0105 ASP OD1 8.162 H A 0106 GLU OE1
H A 0105 ASP OD1 7.587 H A 0106 GLU OE2
H A 0105 ASP OD2 7.808 H A 0106 GLU OE1
H A 0105 ASP OD2 6.999 H A 0106 GLU OE2
H A 0115 ASP OD1 5.684 H A 0119 GLU OE1
H A 0115 ASP OD1 5.124 H A 0119 GLU OE2
H A 0115 ASP OD2 5.420 H A 0119 GLU OE1
H A 0115 ASP OD2 5.460 H A 0119 GLU OE2
HB_MM 2.00 3.20 216
H A 0002 ASP N 2.252 C A 0001 ILE O
H A 0003 GLN N 2.252 H A 0002 ASP O
H A 0004 ASP N 3.092 H A 0002 ASP O
H A 0004 ASP N 2.253 H A 0003 GLN O
H A 0005 THR N 2.774 H A 0002 ASP O
H A 0005 THR N 3.088 H A 0003 GLN O
H A 0005 THR N 2.251 H A 0004 ASP O
H A 0006 VAL N 3.164 H A 0002 ASP O
H A 0006 VAL N 2.875 H A 0003 GLN O
H A 0006 VAL N 2.249 H A 0005 THR O
H A 0007 VAL N 3.032 H A 0003 GLN O
H A 0007 VAL N 2.249 H A 0006 VAL O
H A 0008 ALA N 2.248 H A 0007 VAL O
H A 0009 LYS N 3.024 H A 0005 THR O
H A 0009 LYS N 2.249 H A 0008 ALA O
H A 0010 TYR N 3.114 H A 0006 VAL O
H A 0010 TYR N 2.246 H A 0009 LYS O
H A 0011 MET N 3.014 H A 0009 LYS O
H A 0011 MET N 2.249 H A 0010 TYR O
H A 0012 GLU N 3.083 H A 0008 ALA O
H A 0012 GLU N 2.248 H A 0011 MET O
H A 0013 TYR N 2.710 H A 0009 LYS O
H A 0013 TYR N 3.157 H A 0011 MET O
H A 0013 TYR N 2.250 H A 0012 GLU O
H A 0014 LEU N 3.031 H A 0011 MET O
H A 0014 LEU N 2.252 H A 0013 TYR O
H A 0015 MET N 2.615 H A 0011 MET O
H A 0015 MET N 2.249 H A 0014 LEU O
H A 0016 PRO N 2.254 H A 0015 MET O
H A 0017 ASP N 3.093 H A 0014 LEU O
H A 0017 ASP N 2.986 H A 0015 MET O
H A 0017 ASP N 2.251 H A 0016 PRO O
H A 0018 ILE N 2.845 H A 0014 LEU O
H A 0018 ILE N 3.114 H A 0015 MET O
H A 0018 ILE N 2.252 H A 0017 ASP O
H A 0019 MET N 2.250 H A 0018 ILE O
H A 0020 PRO N 2.250 H A 0019 MET O
H A 0021 CYS N 2.254 H A 0020 PRO O
H A 0022 ALA N 2.244 H A 0021 CYS O
H A 0023 ASP N 3.108 H A 0021 CYS O
H A 0023 ASP N 2.247 H A 0022 ALA O
H A 0024 GLU N 2.897 H A 0020 PRO O
H A 0024 GLU N 2.752 H A 0021 CYS O
H A 0024 GLU N 2.251 H A 0023 ASP O
H A 0025 LEU N 2.250 H A 0024 GLU O
H A 0026 HIS N 2.252 H A 0025 LEU O
C A 0027 ILE N 3.105 H A 0022 ALA O
C A 0027 ILE N 2.262 H A 0026 HIS O
C A 0028 SER N 2.252 C A 0027 ILE O
C A 0029 GLU N 2.250 C A 0028 SER O
C A 0030 ASP N 2.751 C A 0028 SER O
C A 0030 ASP N 2.252 C A 0029 GLU O
C A 0031 ILE N 3.161 C A 0028 SER O
C A 0031 ILE N 2.252 C A 0030 ASP O
C A 0032 ALA N 2.779 C A 0028 SER O
C A 0032 ALA N 3.028 C A 0030 ASP O
C A 0032 ALA N 2.254 C A 0031 ILE O
C A 0033 THR N 2.874 C A 0031 ILE O
C A 0033 THR N 2.257 C A 0032 ALA O
C A 0034 ASN N 2.251 C A 0033 THR O
C A 0035 ILE N 2.244 C A 0034 ASN O
C A 0036 GLN N 2.251 C A 0035 ILE O
C A 0036 GLN N 3.001 C A 0041 GLY O
C A 0037 ALA N 2.243 C A 0036 GLN O
C A 0037 ALA N 2.905 C A 0041 GLY O
C A 0038 ALA N 2.258 C A 0037 ALA O
C A 0039 LYS N 2.258 C A 0038 ALA O
C A 0040 ASN N 2.248 C A 0039 LYS O
C A 0041 GLY N 2.254 C A 0040 ASN O
C A 0042 ALA N 2.250 C A 0041 GLY O
C A 0043 ASP N 2.254 C A 0042 ALA O
C A 0044 MET N 2.250 C A 0043 ASP O
C A 0045 SER N 2.253 C A 0044 MET O
H A 0046 GLN N 2.249 C A 0045 SER O
H A 0047 LEU N 2.250 H A 0046 GLN O
H A 0048 GLY N 3.102 C A 0044 MET O
H A 0048 GLY N 2.250 H A 0047 LEU O
H A 0049 CYS N 2.771 H A 0047 LEU O
H A 0049 CYS N 2.251 H A 0048 GLY O
H A 0050 LEU N 2.775 H A 0046 GLN O
H A 0050 LEU N 2.253 H A 0049 CYS O
H A 0051 LYS N 3.067 H A 0049 CYS O
H A 0051 LYS N 2.253 H A 0050 LEU O
H A 0052 ALA N 2.617 H A 0049 CYS O
H A 0052 ALA N 2.256 H A 0051 LYS O
H A 0053 CYS N 2.692 H A 0049 CYS O
H A 0053 CYS N 2.256 H A 0052 ALA O
H A 0054 VAL N 2.249 H A 0053 CYS O
H A 0055 MET N 2.961 H A 0052 ALA O
H A 0055 MET N 2.254 H A 0054 VAL O
H A 0056 LYS N 2.252 H A 0055 MET O
H A 0057 ARG N 3.117 H A 0053 CYS O
H A 0057 ARG N 3.085 H A 0055 MET O
H A 0057 ARG N 2.251 H A 0056 LYS O
H A 0058 ILE N 3.087 H A 0055 MET O
H A 0058 ILE N 2.253 H A 0057 ARG O
C A 0059 GLU N 2.254 H A 0058 ILE O
C A 0060 MET N 3.029 H A 0055 MET O
C A 0060 MET N 2.252 C A 0059 GLU O
E A 0061 LEU N 2.250 C A 0060 MET O
E A 0062 LYS N 2.247 E A 0061 LEU O
E A 0062 LYS N 3.139 E A 0065 GLU O
C A 0063 GLY N 2.251 E A 0062 LYS O
C A 0064 THR N 2.762 E A 0062 LYS O
C A 0064 THR N 2.252 C A 0063 GLY O
E A 0065 GLU N 2.253 C A 0064 THR O
E A 0066 LEU N 2.248 E A 0065 GLU O
C A 0067 TYR N 2.822 C A 0060 MET O
C A 0067 TYR N 2.253 E A 0066 LEU O
H A 0068 VAL N 2.252 C A 0067 TYR O
H A 0069 GLU N 2.251 H A 0068 VAL O
H A 0070 PRO N 2.255 H A 0069 GLU O
H A 0071 VAL N 2.960 H A 0068 VAL O
H A 0071 VAL N 3.034 H A 0069 GLU O
H A 0071 VAL N 2.251 H A 0070 PRO O
H A 0072 TYR N 2.971 H A 0068 VAL O
H A 0072 TYR N 2.878 H A 0069 GLU O
H A 0072 TYR N 2.247 H A 0071 VAL O
H A 0073 LYS N 2.929 H A 0071 VAL O
H A 0073 LYS N 2.251 H A 0072 TYR O
H A 0074 MET N 2.997 H A 0071 VAL O
H A 0074 MET N 2.246 H A 0073 LYS O
H A 0075 ILE N 2.861 H A 0071 VAL O
H A 0075 ILE N 2.245 H A 0074 MET O
H A 0076 GLU N 2.958 H A 0074 MET O
H A 0076 GLU N 2.254 H A 0075 ILE O
H A 0077 VAL N 3.148 H A 0074 MET O
H A 0077 VAL N 2.251 H A 0076 GLU O
H A 0078 VAL N 2.699 H A 0074 MET O
H A 0078 VAL N 2.254 H A 0077 VAL O
H A 0079 HIS N 2.800 H A 0077 VAL O
H A 0079 HIS N 2.248 H A 0078 VAL O
C A 0080 ALA N 2.878 H A 0077 VAL O
C A 0080 ALA N 2.251 H A 0079 HIS O
C A 0081 GLY N 2.251 C A 0080 ALA O
C A 0082 ASN N 2.252 C A 0081 GLY O
H A 0083 ALA N 2.252 C A 0082 ASN O
H A 0084 ASP N 2.248 H A 0083 ALA O
H A 0085 ASP N 2.249 H A 0084 ASP O
H A 0086 ILE N 3.048 H A 0084 ASP O
H A 0086 ILE N 2.255 H A 0085 ASP O
H A 0087 GLN N 2.705 H A 0084 ASP O
H A 0087 GLN N 2.254 H A 0086 ILE O
H A 0088 LEU N 2.620 H A 0084 ASP O
H A 0088 LEU N 2.251 H A 0087 GLN O
H A 0089 VAL N 2.254 H A 0088 LEU O
H A 0090 LYS N 3.000 H A 0088 LEU O
H A 0090 LYS N 2.253 H A 0089 VAL O
H A 0091 GLY N 2.981 H A 0088 LEU O
H A 0091 GLY N 2.252 H A 0090 LYS O
H A 0092 ILE N 3.117 H A 0088 LEU O
H A 0092 ILE N 3.143 H A 0089 VAL O
H A 0092 ILE N 2.252 H A 0091 GLY O
H A 0093 ALA N 3.145 H A 0089 VAL O
H A 0093 ALA N 2.251 H A 0092 ILE O
H A 0094 ASN N 3.131 H A 0091 GLY O
H A 0094 ASN N 3.171 H A 0092 ILE O
H A 0094 ASN N 2.253 H A 0093 ALA O
H A 0095 GLU N 3.117 H A 0092 ILE O
H A 0095 GLU N 2.251 H A 0094 ASN O
H A 0096 CYS N 3.035 H A 0093 ALA O
H A 0096 CYS N 2.250 H A 0095 GLU O
H A 0097 ILE N 2.980 H A 0093 ALA O
H A 0097 ILE N 3.145 H A 0094 ASN O
H A 0097 ILE N 2.252 H A 0096 CYS O
H A 0098 GLU N 3.024 H A 0094 ASN O
H A 0098 GLU N 2.249 H A 0097 ILE O
H A 0099 ASN N 3.087 H A 0097 ILE O
H A 0099 ASN N 2.252 H A 0098 GLU O
H A 0100 ALA N 2.994 H A 0096 CYS O
H A 0100 ALA N 2.250 H A 0099 ASN O
H A 0101 LYS N 2.721 H A 0097 ILE O
H A 0101 LYS N 2.271 H A 0100 ALA O
C A 0102 GLY N 2.567 H A 0100 ALA O
C A 0102 GLY N 2.252 H A 0101 LYS O
C A 0103 GLU N 2.949 H A 0100 ALA O
C A 0103 GLU N 2.252 C A 0102 GLY O
C A 0104 THR N 2.248 C A 0103 GLU O
H A 0105 ASP N 2.250 C A 0104 THR O
H A 0106 GLU N 2.251 H A 0105 ASP O
H A 0107 CYS N 2.253 H A 0106 GLU O
H A 0108 ASN N 3.144 H A 0105 ASP O
H A 0108 ASN N 2.960 H A 0106 GLU O
H A 0108 ASN N 2.248 H A 0107 CYS O
H A 0109 ILE N 2.948 H A 0105 ASP O
H A 0109 ILE N 2.921 H A 0106 GLU O
H A 0109 ILE N 2.254 H A 0108 ASN O
H A 0110 GLY N 3.119 H A 0106 GLU O
H A 0110 GLY N 2.254 H A 0109 ILE O
H A 0111 ASN N 2.969 H A 0107 CYS O
H A 0111 ASN N 2.246 H A 0110 GLY O
H A 0112 LYS N 2.246 H A 0111 ASN O
H A 0113 TYR N 2.975 H A 0109 ILE O
H A 0113 TYR N 3.105 H A 0110 GLY O
H A 0113 TYR N 2.255 H A 0112 LYS O
H A 0114 THR N 2.616 H A 0110 GLY O
H A 0114 THR N 2.249 H A 0113 TYR O
H A 0115 ASP N 2.256 H A 0114 THR O
H A 0116 CYS N 2.253 H A 0115 ASP O
H A 0117 TYR N 2.982 H A 0114 THR O
H A 0117 TYR N 2.248 H A 0116 CYS O
H A 0118 ILE N 3.084 H A 0114 THR O
H A 0118 ILE N 2.891 H A 0115 ASP O
H A 0118 ILE N 3.117 H A 0116 CYS O
H A 0118 ILE N 2.253 H A 0117 TYR O
H A 0119 GLU N 3.083 H A 0115 ASP O
H A 0119 GLU N 3.043 H A 0116 CYS O
H A 0119 GLU N 2.240 H A 0118 ILE O
H A 0120 LYS N 3.040 H A 0116 CYS O
H A 0120 LYS N 2.248 H A 0119 GLU O
H A 0121 LEU N 2.248 H A 0120 LYS O
C A 0122 PHE N 2.729 H A 0117 TYR O
C A 0122 PHE N 3.027 H A 0118 ILE O
C A 0122 PHE N 2.254 H A 0121 LEU O
C A 0123 SER N 2.838 H A 0121 LEU O
C A 0123 SER N 2.248 C A 0122 PHE O
HB_MS 2.00 3.20 10
C A 0030 ASP N 2.710 C A 0029 GLU OE2
C A 0035 ILE N 2.817 C A 0034 ASN OD1
C A 0042 ALA N 3.163 C A 0040 ASN OD1
C A 0044 MET N 2.719 C A 0043 ASP OD1
H A 0046 GLN N 2.680 C A 0043 ASP OD1
H A 0047 LEU N 2.640 C A 0043 ASP OD1
H A 0105 ASP N 2.860 C A 0104 THR OG1
H A 0107 CYS N 2.886 H A 0105 ASP OD2
H A 0108 ASN N 2.940 H A 0105 ASP OD2
H A 0112 LYS O 2.813 H A 0099 ASN ND2
HB_SS 2.00 3.20 1
H A 0079 HIS NE2 2.928 H A 0010 TYR OH
AROMATIC 0.00 8.00 3
H A 0051 LYS 7.536 H A 0113 TYR
H A 0051 LYS 6.206 H A 0117 TYR
H A 0010 TYR 5.169 H A 0079 HIS
SS_BOND 1.50 2.80 3
H A 0021 CYS SG 2.031 H A 0053 CYS SG
H A 0049 CYS SG 2.031 H A 0107 CYS SG
H A 0096 CYS SG 2.032 H A 0116 CYS SG