Complet list of 1uwo con file
Complete list of 1uwo.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 459
C A 0001 SER C 2.422 H A 0002 GLU CA
C A 0001 SER C 3.062 H A 0002 GLU C
C A 0001 SER C 3.685 H A 0002 GLU CB
C A 0001 SER CB 3.714 H A 0004 GLU CB
H A 0002 GLU C 2.423 H A 0003 LEU CA
H A 0002 GLU C 3.066 H A 0003 LEU C
H A 0002 GLU C 3.686 H A 0003 LEU CB
H A 0002 GLU C 3.513 H A 0003 LEU CD1
H A 0002 GLU CB 3.683 H A 0003 LEU CD1
H A 0002 GLU CG 3.498 H A 0003 LEU CD1
H A 0003 LEU C 2.423 H A 0004 GLU CA
H A 0003 LEU C 2.981 H A 0004 GLU C
H A 0003 LEU C 3.695 H A 0004 GLU CB
H A 0004 GLU C 2.422 H A 0005 LYS CA
H A 0004 GLU C 2.960 H A 0005 LYS C
H A 0004 GLU C 3.695 H A 0005 LYS CB
H A 0005 LYS C 2.422 H A 0006 ALA CA
H A 0005 LYS C 3.018 H A 0006 ALA C
H A 0005 LYS C 3.692 H A 0006 ALA CB
H A 0006 ALA C 2.422 H A 0007 MET CA
H A 0006 ALA C 3.100 H A 0007 MET C
H A 0006 ALA C 3.678 H A 0007 MET CB
H A 0006 ALA CA 3.742 H A 0010 LEU CD1
H A 0006 ALA C 3.367 H A 0010 LEU CD1
H A 0006 ALA CB 3.403 H A 0010 LEU CD1
H A 0007 MET C 2.422 H A 0008 VAL CA
H A 0007 MET C 3.011 H A 0008 VAL C
H A 0007 MET C 3.692 H A 0008 VAL CB
H A 0007 MET C 3.657 H A 0011 ILE CG1
H A 0007 MET C 3.318 H A 0011 ILE CD1
H A 0008 VAL C 2.422 H A 0009 ALA CA
H A 0008 VAL C 3.090 H A 0009 ALA C
H A 0008 VAL C 3.680 H A 0009 ALA CB
H A 0009 ALA C 2.423 H A 0010 LEU CA
H A 0009 ALA C 2.835 H A 0010 LEU C
H A 0009 ALA C 3.678 H A 0010 LEU CB
H A 0010 LEU C 2.421 H A 0011 ILE CA
H A 0010 LEU C 2.976 H A 0011 ILE C
H A 0010 LEU C 3.694 H A 0011 ILE CB
H A 0010 LEU CA 3.764 H A 0073 PHE CE2
H A 0010 LEU CA 3.781 H A 0073 PHE CZ
H A 0010 LEU C 3.200 H A 0073 PHE CE2
H A 0010 LEU C 3.553 H A 0073 PHE CZ
H A 0010 LEU CB 3.506 H A 0073 PHE CE2
H A 0010 LEU CB 3.707 H A 0073 PHE CZ
H A 0010 LEU CD2 3.604 H A 0073 PHE CZ
H A 0011 ILE C 2.422 H A 0012 ASP CA
H A 0011 ILE C 2.932 H A 0012 ASP C
H A 0011 ILE C 3.695 H A 0012 ASP CB
H A 0011 ILE CA 3.594 H A 0070 PHE CZ
H A 0011 ILE CB 3.684 H A 0070 PHE CZ
H A 0011 ILE CG1 3.747 H A 0070 PHE CE1
H A 0011 ILE CG1 3.358 H A 0070 PHE CZ
H A 0011 ILE CG2 3.506 H A 0070 PHE CZ
H A 0012 ASP C 2.423 H A 0013 VAL CA
H A 0012 ASP C 3.132 H A 0013 VAL C
H A 0012 ASP C 3.671 H A 0013 VAL CB
H A 0013 VAL C 2.418 H A 0014 PHE CA
H A 0013 VAL C 3.010 H A 0014 PHE C
H A 0013 VAL C 3.692 H A 0014 PHE CB
H A 0013 VAL CG1 3.617 H A 0017 TYR CD1
H A 0013 VAL CG2 3.529 H A 0017 TYR CE1
H A 0013 VAL CG1 2.812 H A 0035 LEU CD2
H A 0013 VAL CG1 3.633 H A 0073 PHE CE1
H A 0013 VAL CG1 3.567 H A 0073 PHE CZ
H A 0014 PHE C 2.423 H A 0015 HIS CA
H A 0014 PHE C 3.140 H A 0015 HIS C
H A 0014 PHE C 3.669 H A 0015 HIS CB
H A 0014 PHE CD2 3.719 H A 0015 HIS CE1
H A 0014 PHE CZ 3.780 C A 0025 HIS C
H A 0014 PHE CE1 3.476 C A 0069 ASP C
H A 0014 PHE CZ 3.468 C A 0069 ASP CA
H A 0014 PHE CZ 3.057 C A 0069 ASP C
H A 0014 PHE CB 3.570 H A 0070 PHE CZ
H A 0014 PHE CG 3.776 H A 0070 PHE CE2
H A 0014 PHE CD2 3.568 H A 0070 PHE CG
H A 0014 PHE CD2 3.008 H A 0070 PHE CD2
H A 0014 PHE CD2 3.049 H A 0070 PHE CE2
H A 0014 PHE CD2 3.642 H A 0070 PHE CZ
H A 0014 PHE CE2 3.682 H A 0070 PHE CA
H A 0014 PHE CE2 3.669 H A 0070 PHE CG
H A 0014 PHE CE2 3.252 H A 0070 PHE CD2
H A 0014 PHE CZ 3.492 H A 0070 PHE CA
H A 0014 PHE CB 3.727 H A 0073 PHE CD2
H A 0014 PHE CD1 3.427 H A 0073 PHE CB
H A 0014 PHE CD1 3.699 H A 0073 PHE CG
H A 0014 PHE CE1 3.761 H A 0073 PHE CB
H A 0015 HIS C 2.423 H A 0016 GLN CA
H A 0015 HIS C 2.980 H A 0016 GLN C
H A 0015 HIS C 3.696 H A 0016 GLN CB
H A 0015 HIS CE1 3.285 C A 0025 HIS CE1
H A 0016 GLN C 2.424 H A 0017 TYR CA
H A 0016 GLN C 2.960 H A 0017 TYR C
H A 0016 GLN C 3.695 H A 0017 TYR CB
H A 0017 TYR C 2.421 H A 0018 SER CA
H A 0017 TYR C 2.970 H A 0018 SER C
H A 0017 TYR C 3.692 H A 0018 SER CB
H A 0017 TYR CB 3.506 H A 0035 LEU CD1
H A 0017 TYR CG 3.538 H A 0035 LEU CG
H A 0017 TYR CG 3.431 H A 0035 LEU CD1
H A 0017 TYR CD1 3.581 H A 0035 LEU CG
H A 0017 TYR CD1 3.742 H A 0035 LEU CD1
H A 0017 TYR CD2 3.673 H A 0035 LEU CG
H A 0017 TYR CE1 3.756 H A 0035 LEU CG
H A 0017 TYR CE1 3.759 H A 0035 LEU CD2
H A 0017 TYR CE1 3.671 C A 0039 GLU CD
H A 0017 TYR CZ 3.388 C A 0039 GLU CD
H A 0018 SER C 2.423 H A 0019 GLY CA
H A 0018 SER C 3.020 H A 0019 GLY C
H A 0018 SER C 3.582 C A 0024 LYS CA
H A 0018 SER CB 3.542 C A 0025 HIS CA
H A 0018 SER CB 3.184 C A 0025 HIS C
H A 0018 SER CB 3.734 C A 0026 LYS CA
H A 0018 SER CB 3.385 C A 0026 LYS C
H A 0019 GLY C 2.422 C A 0020 ARG CA
H A 0019 GLY C 2.899 C A 0020 ARG C
H A 0019 GLY C 3.692 C A 0020 ARG CB
H A 0019 GLY CA 3.427 C A 0024 LYS CA
H A 0019 GLY CA 3.308 C A 0024 LYS CB
C A 0020 ARG C 2.422 C A 0021 GLU CA
C A 0020 ARG C 3.104 C A 0021 GLU C
C A 0020 ARG C 3.676 C A 0021 GLU CB
C A 0021 GLU C 2.424 C A 0022 GLY CA
C A 0021 GLU C 2.837 C A 0022 GLY C
C A 0021 GLU CD 3.423 C A 0028 LYS CB
C A 0022 GLY C 2.422 C A 0023 ASP CA
C A 0022 GLY C 2.942 C A 0023 ASP C
C A 0022 GLY C 3.695 C A 0023 ASP CB
C A 0023 ASP C 2.423 C A 0024 LYS CA
C A 0023 ASP C 3.650 C A 0024 LYS C
C A 0023 ASP C 3.189 C A 0024 LYS CB
C A 0023 ASP C 3.654 C A 0024 LYS CG
C A 0024 LYS C 2.422 C A 0025 HIS CA
C A 0024 LYS C 3.688 C A 0025 HIS C
C A 0024 LYS C 3.054 C A 0025 HIS CB
C A 0024 LYS C 3.541 C A 0025 HIS CG
C A 0024 LYS C 3.643 C A 0025 HIS CD2
C A 0025 HIS C 2.423 C A 0026 LYS CA
C A 0025 HIS C 3.488 C A 0026 LYS C
C A 0025 HIS C 3.447 C A 0026 LYS CB
C A 0025 HIS C 3.457 C A 0026 LYS CG
C A 0025 HIS C 3.614 C A 0026 LYS CE
C A 0025 HIS CB 3.274 C A 0026 LYS CE
C A 0026 LYS C 2.423 C A 0027 LEU CA
C A 0026 LYS C 3.394 C A 0027 LEU C
C A 0026 LYS C 3.538 C A 0027 LEU CB
C A 0026 LYS C 3.746 C A 0027 LEU CD1
C A 0026 LYS CB 3.762 C A 0067 GLU CA
C A 0026 LYS CB 3.579 C A 0067 GLU C
C A 0026 LYS CB 3.672 C A 0067 GLU CB
C A 0026 LYS CD 3.724 C A 0067 GLU CB
C A 0026 LYS CB 3.594 C A 0068 CYS C
C A 0026 LYS CG 3.619 C A 0068 CYS C
C A 0027 LEU C 2.418 C A 0028 LYS CA
C A 0027 LEU C 3.297 C A 0028 LYS C
C A 0027 LEU C 3.586 C A 0028 LYS CB
C A 0027 LEU CA 3.551 H A 0031 GLU CB
C A 0027 LEU C 3.760 H A 0031 GLU CB
C A 0027 LEU CB 3.280 H A 0031 GLU CB
C A 0027 LEU CG 3.216 H A 0031 GLU CB
C A 0027 LEU CD2 3.683 H A 0031 GLU CA
C A 0027 LEU CD2 2.945 H A 0031 GLU C
C A 0027 LEU CD2 3.231 H A 0031 GLU CB
C A 0027 LEU CB 3.583 H A 0032 LEU CG
C A 0027 LEU CB 3.312 H A 0032 LEU CD2
C A 0027 LEU CD2 3.266 H A 0032 LEU CA
C A 0027 LEU CD2 3.420 H A 0032 LEU CD2
C A 0027 LEU CD2 3.373 H A 0035 LEU CD1
C A 0027 LEU CB 3.687 C A 0068 CYS CB
C A 0028 LYS C 2.443 H A 0029 LYS CA
C A 0028 LYS C 2.888 H A 0029 LYS C
C A 0028 LYS C 3.125 H A 0029 LYS CB
H A 0029 LYS C 2.423 H A 0030 SER CA
H A 0029 LYS C 2.878 H A 0030 SER C
H A 0029 LYS C 3.683 H A 0030 SER CB
H A 0030 SER C 2.413 H A 0031 GLU CA
H A 0030 SER C 2.917 H A 0031 GLU C
H A 0030 SER C 3.691 H A 0031 GLU CB
H A 0030 SER C 3.766 H A 0031 GLU CD
H A 0031 GLU C 2.418 H A 0032 LEU CA
H A 0031 GLU C 2.936 H A 0032 LEU C
H A 0031 GLU C 3.691 H A 0032 LEU CB
H A 0032 LEU C 2.423 H A 0033 LYS CA
H A 0032 LEU C 2.851 H A 0033 LYS C
H A 0032 LEU C 3.684 H A 0033 LYS CB
H A 0032 LEU CD1 3.323 H A 0057 MET CE
H A 0032 LEU CD2 3.721 C A 0060 LEU CD2
H A 0032 LEU CD2 3.665 C A 0068 CYS CB
H A 0032 LEU CD2 3.681 H A 0072 GLU CD
H A 0033 LYS C 2.423 H A 0034 GLU CA
H A 0033 LYS C 2.914 H A 0034 GLU C
H A 0033 LYS C 3.696 H A 0034 GLU CB
H A 0033 LYS CB 3.348 H A 0053 VAL CG1
H A 0033 LYS CG 3.696 H A 0053 VAL CG1
H A 0033 LYS CD 3.549 H A 0053 VAL CG1
H A 0033 LYS CE 3.776 H A 0053 VAL CB
H A 0033 LYS CE 3.457 H A 0053 VAL CG1
H A 0033 LYS CE 3.564 H A 0053 VAL CG2
H A 0034 GLU C 2.421 H A 0035 LEU CA
H A 0034 GLU C 2.893 H A 0035 LEU C
H A 0034 GLU C 3.685 H A 0035 LEU CB
H A 0035 LEU C 2.423 H A 0036 ILE CA
H A 0035 LEU C 2.986 H A 0036 ILE C
H A 0035 LEU C 3.692 H A 0036 ILE CB
H A 0035 LEU CA 3.355 C A 0039 GLU CG
H A 0035 LEU C 3.796 C A 0039 GLU CB
H A 0035 LEU C 3.524 C A 0039 GLU CG
H A 0035 LEU CD2 3.475 C A 0039 GLU CG
H A 0036 ILE C 2.421 H A 0037 ASN CA
H A 0036 ILE C 3.271 H A 0037 ASN C
H A 0036 ILE C 3.613 H A 0037 ASN CB
H A 0036 ILE C 3.712 H A 0037 ASN CG
H A 0036 ILE C 3.757 C A 0040 LEU CA
H A 0036 ILE C 3.707 C A 0040 LEU C
H A 0036 ILE C 3.553 C A 0040 LEU CB
H A 0036 ILE CG2 3.622 C A 0044 LEU CD1
H A 0036 ILE CG2 2.809 C A 0047 ILE CD1
H A 0036 ILE CG2 3.727 H A 0053 VAL CG2
H A 0036 ILE CD1 3.568 H A 0053 VAL CA
H A 0036 ILE CD1 3.228 H A 0053 VAL CG2
H A 0036 ILE CG1 2.982 H A 0076 PHE CE1
H A 0036 ILE CG1 2.923 H A 0076 PHE CZ
H A 0036 ILE CD1 3.514 H A 0076 PHE CE1
H A 0037 ASN C 2.427 H A 0038 ASN CA
H A 0037 ASN C 2.842 H A 0038 ASN C
H A 0037 ASN C 3.674 H A 0038 ASN CB
H A 0037 ASN C 3.522 C A 0041 SER CB
H A 0038 ASN C 2.420 C A 0039 GLU CA
H A 0038 ASN C 3.411 C A 0039 GLU C
H A 0038 ASN C 3.522 C A 0039 GLU CB
H A 0038 ASN C 3.474 C A 0039 GLU CG
H A 0038 ASN C 3.647 C A 0039 GLU CD
C A 0039 GLU C 2.421 C A 0040 LEU CA
C A 0039 GLU C 3.368 C A 0040 LEU C
C A 0039 GLU C 3.551 C A 0040 LEU CB
C A 0039 GLU C 3.326 C A 0040 LEU CD1
C A 0040 LEU C 2.422 C A 0041 SER CA
C A 0040 LEU C 3.407 C A 0041 SER C
C A 0040 LEU C 3.520 C A 0041 SER CB
C A 0040 LEU CB 3.512 C A 0044 LEU CG
C A 0040 LEU CB 3.512 C A 0044 LEU CD1
C A 0040 LEU CB 3.145 C A 0044 LEU CD2
C A 0040 LEU CG 3.118 C A 0044 LEU CD2
C A 0040 LEU CD2 2.998 C A 0044 LEU CD2
C A 0041 SER C 2.422 C A 0042 HIS CA
C A 0041 SER C 3.496 C A 0042 HIS C
C A 0041 SER C 3.436 C A 0042 HIS CB
C A 0042 HIS C 2.422 C A 0043 PHE CA
C A 0042 HIS C 2.998 C A 0043 PHE C
C A 0042 HIS C 3.694 C A 0043 PHE CB
C A 0043 PHE C 2.421 C A 0044 LEU CA
C A 0043 PHE C 3.445 C A 0044 LEU C
C A 0043 PHE C 3.489 C A 0044 LEU CB
C A 0044 LEU C 2.423 C A 0045 GLU CA
C A 0044 LEU C 3.185 C A 0045 GLU C
C A 0044 LEU C 3.652 C A 0045 GLU CB
C A 0044 LEU CB 3.302 C A 0046 GLU CD
C A 0044 LEU CD1 3.764 C A 0047 ILE CD1
C A 0045 GLU C 2.423 C A 0046 GLU CA
C A 0045 GLU C 3.029 C A 0046 GLU C
C A 0045 GLU C 3.688 C A 0046 GLU CB
C A 0046 GLU C 2.424 C A 0047 ILE CA
C A 0046 GLU C 2.997 C A 0047 ILE C
C A 0046 GLU C 2.935 C A 0047 ILE CB
C A 0046 GLU C 2.945 C A 0047 ILE CG1
C A 0046 GLU CG 3.439 C A 0047 ILE CG1
C A 0047 ILE C 2.439 C A 0048 LYS CA
C A 0047 ILE C 3.182 C A 0048 LYS C
C A 0047 ILE C 2.827 C A 0048 LYS CB
C A 0047 ILE C 2.812 C A 0048 LYS CG
C A 0047 ILE CG2 3.720 H A 0053 VAL CB
C A 0047 ILE CG2 3.049 H A 0053 VAL CG2
C A 0047 ILE CD1 3.724 H A 0053 VAL CG2
C A 0048 LYS C 2.423 C A 0049 GLU CA
C A 0048 LYS C 3.389 C A 0049 GLU C
C A 0048 LYS C 3.534 C A 0049 GLU CB
C A 0048 LYS C 3.584 C A 0049 GLU CG
C A 0048 LYS C 3.696 C A 0049 GLU CD
C A 0049 GLU C 2.429 C A 0050 GLN CA
C A 0049 GLU C 3.131 C A 0050 GLN C
C A 0049 GLU C 2.834 C A 0050 GLN CB
C A 0049 GLU C 2.814 C A 0050 GLN CG
C A 0050 GLN C 2.422 C A 0051 GLU CA
C A 0050 GLN C 3.219 C A 0051 GLU C
C A 0050 GLN C 3.637 C A 0051 GLU CB
C A 0050 GLN C 3.631 H A 0054 ASP CB
C A 0050 GLN CB 3.322 H A 0054 ASP CB
C A 0050 GLN CB 3.289 H A 0054 ASP CG
C A 0051 GLU C 2.419 H A 0052 VAL CA
C A 0051 GLU C 3.218 H A 0052 VAL C
C A 0051 GLU C 3.636 H A 0052 VAL CB
C A 0051 GLU C 3.712 H A 0052 VAL CG2
C A 0051 GLU CG 3.482 H A 0087 PHE CZ
H A 0052 VAL C 2.421 H A 0053 VAL CA
H A 0052 VAL C 3.059 H A 0053 VAL C
H A 0052 VAL C 3.685 H A 0053 VAL CB
H A 0052 VAL C 3.708 H A 0056 VAL CG1
H A 0052 VAL C 3.711 H A 0056 VAL CG2
H A 0052 VAL CB 3.508 H A 0080 VAL CG1
H A 0052 VAL CG1 3.676 H A 0080 VAL CA
H A 0052 VAL CG1 2.958 H A 0080 VAL CG1
H A 0053 VAL C 2.423 H A 0054 ASP CA
H A 0053 VAL C 3.219 H A 0054 ASP C
H A 0053 VAL C 3.638 H A 0054 ASP CB
H A 0053 VAL CA 3.370 H A 0056 VAL CG2
H A 0053 VAL C 3.031 H A 0056 VAL CG2
H A 0054 ASP C 2.424 H A 0055 LYS CA
H A 0054 ASP C 2.995 H A 0055 LYS C
H A 0054 ASP C 3.696 H A 0055 LYS CB
H A 0055 LYS C 2.416 H A 0056 VAL CA
H A 0055 LYS C 2.922 H A 0056 VAL C
H A 0055 LYS C 3.686 H A 0056 VAL CB
H A 0056 VAL C 2.424 H A 0057 MET CA
H A 0056 VAL C 2.824 H A 0057 MET C
H A 0056 VAL C 3.678 H A 0057 MET CB
H A 0056 VAL CA 3.534 C A 0060 LEU CD1
H A 0056 VAL C 3.653 C A 0060 LEU CB
H A 0056 VAL CB 3.235 C A 0060 LEU CD1
H A 0056 VAL CB 3.725 C A 0060 LEU CD2
H A 0056 VAL CG1 3.475 C A 0060 LEU CD1
H A 0056 VAL CG1 3.676 H A 0076 PHE CD1
H A 0057 MET C 2.420 H A 0058 GLU CA
H A 0057 MET C 3.027 H A 0058 GLU C
H A 0057 MET C 3.689 H A 0058 GLU CB
H A 0057 MET C 3.765 C A 0061 ASP CB
H A 0057 MET CE 3.733 C A 0061 ASP CB
H A 0058 GLU C 2.425 H A 0059 THR CA
H A 0058 GLU C 3.139 H A 0059 THR C
H A 0058 GLU C 3.669 H A 0059 THR CB
H A 0059 THR C 2.438 C A 0060 LEU CA
H A 0059 THR C 2.824 C A 0060 LEU C
H A 0059 THR C 3.667 C A 0060 LEU CB
H A 0059 THR CB 3.301 H A 0079 MET CE
C A 0060 LEU C 2.423 C A 0061 ASP CA
C A 0060 LEU C 3.223 C A 0061 ASP C
C A 0060 LEU C 3.637 C A 0061 ASP CB
C A 0060 LEU CA 3.556 H A 0072 GLU CB
C A 0060 LEU C 3.469 H A 0072 GLU CB
C A 0060 LEU CB 3.397 H A 0072 GLU CD
C A 0060 LEU CG 3.186 H A 0072 GLU CD
C A 0060 LEU CD2 3.190 H A 0072 GLU CD
C A 0060 LEU CG 3.397 H A 0076 PHE CB
C A 0060 LEU CD1 3.468 H A 0076 PHE CA
C A 0060 LEU CD1 3.486 H A 0076 PHE CB
C A 0060 LEU CD2 3.305 H A 0076 PHE CB
C A 0060 LEU CD2 3.575 H A 0076 PHE CG
C A 0060 LEU CD2 3.468 H A 0076 PHE CD1
C A 0061 ASP C 2.422 C A 0062 ASN CA
C A 0061 ASP C 3.390 C A 0062 ASN C
C A 0061 ASP C 3.535 C A 0062 ASN CB
C A 0062 ASN C 2.422 C A 0063 ASP CA
C A 0062 ASN C 3.475 C A 0063 ASP C
C A 0062 ASN C 3.460 C A 0063 ASP CB
C A 0063 ASP C 2.422 C A 0064 GLY CA
C A 0063 ASP C 3.147 C A 0064 GLY C
C A 0064 GLY C 2.422 C A 0065 ASP CA
C A 0064 GLY C 3.681 C A 0065 ASP C
C A 0064 GLY C 2.940 C A 0065 ASP CB
C A 0065 ASP C 2.420 C A 0066 GLY CA
C A 0065 ASP C 3.394 C A 0066 GLY C
C A 0066 GLY C 2.423 C A 0067 GLU CA
C A 0066 GLY C 3.208 C A 0067 GLU C
C A 0066 GLY C 3.643 C A 0067 GLU CB
C A 0066 GLY C 3.758 C A 0067 GLU CG
C A 0067 GLU C 2.421 C A 0068 CYS CA
C A 0067 GLU C 3.051 C A 0068 CYS C
C A 0067 GLU C 3.682 C A 0068 CYS CB
C A 0068 CYS C 2.425 C A 0069 ASP CA
C A 0068 CYS C 3.446 C A 0069 ASP C
C A 0068 CYS C 3.493 C A 0069 ASP CB
C A 0068 CYS CA 3.740 H A 0072 GLU CG
C A 0068 CYS CB 3.378 H A 0072 GLU CG
C A 0068 CYS CB 3.383 H A 0072 GLU CD
C A 0069 ASP C 2.423 H A 0070 PHE CA
C A 0069 ASP C 2.900 H A 0070 PHE C
C A 0069 ASP C 3.680 H A 0070 PHE CB
H A 0070 PHE C 2.416 H A 0071 GLN CA
H A 0070 PHE C 2.863 H A 0071 GLN C
H A 0070 PHE C 3.679 H A 0071 GLN CB
H A 0070 PHE CD1 3.768 H A 0073 PHE CD2
H A 0070 PHE CE1 3.407 H A 0073 PHE CD2
H A 0071 GLN C 2.423 H A 0072 GLU CA
H A 0071 GLN C 3.137 H A 0072 GLU C
H A 0071 GLN C 3.676 H A 0072 GLU CB
H A 0072 GLU C 2.420 H A 0073 PHE CA
H A 0072 GLU C 2.950 H A 0073 PHE C
H A 0072 GLU C 3.695 H A 0073 PHE CB
H A 0073 PHE C 2.421 H A 0074 MET CA
H A 0073 PHE C 3.029 H A 0074 MET C
H A 0073 PHE C 3.691 H A 0074 MET CB
H A 0073 PHE CD2 3.436 H A 0074 MET CE
H A 0073 PHE CE2 3.589 H A 0074 MET CE
H A 0074 MET C 2.421 H A 0075 ALA CA
H A 0074 MET C 2.906 H A 0075 ALA C
H A 0074 MET C 3.695 H A 0075 ALA CB
H A 0075 ALA C 2.424 H A 0076 PHE CA
H A 0075 ALA C 3.030 H A 0076 PHE C
H A 0075 ALA C 3.692 H A 0076 PHE CB
H A 0075 ALA CA 3.739 H A 0078 ALA CB
H A 0075 ALA C 3.562 H A 0078 ALA CB
H A 0076 PHE C 2.415 H A 0077 VAL CA
H A 0076 PHE C 2.869 H A 0077 VAL C
H A 0076 PHE C 3.689 H A 0077 VAL CB
H A 0076 PHE CD2 3.448 H A 0077 VAL CG2
H A 0076 PHE C 3.255 H A 0080 VAL CG2
H A 0076 PHE CD1 3.180 H A 0080 VAL CG2
H A 0076 PHE CE1 3.779 H A 0080 VAL CB
H A 0076 PHE CE1 3.479 H A 0080 VAL CG1
H A 0076 PHE CE1 2.956 H A 0080 VAL CG2
H A 0076 PHE CZ 3.424 H A 0080 VAL CG2
H A 0077 VAL C 2.423 H A 0078 ALA CA
H A 0077 VAL C 2.967 H A 0078 ALA C
H A 0077 VAL C 3.696 H A 0078 ALA CB
H A 0077 VAL CA 3.425 H A 0080 VAL CG2
H A 0077 VAL C 3.797 H A 0081 THR CB
H A 0078 ALA C 2.419 H A 0079 MET CA
H A 0078 ALA C 3.045 H A 0079 MET C
H A 0078 ALA C 3.689 H A 0079 MET CB
H A 0079 MET C 2.410 H A 0080 VAL CA
H A 0079 MET C 2.820 H A 0080 VAL C
H A 0079 MET C 3.680 H A 0080 VAL CB
H A 0079 MET CA 3.259 H A 0083 ALA CB
H A 0079 MET C 3.720 H A 0083 ALA CA
H A 0079 MET C 2.858 H A 0083 ALA CB
H A 0079 MET CB 3.430 H A 0083 ALA CB
H A 0080 VAL C 2.421 H A 0081 THR CA
H A 0080 VAL C 3.085 H A 0081 THR C
H A 0080 VAL C 3.685 H A 0081 THR CB
H A 0081 THR C 2.424 H A 0082 THR CA
H A 0081 THR C 3.099 H A 0082 THR C
H A 0081 THR C 3.685 H A 0082 THR CB
H A 0082 THR C 2.437 H A 0083 ALA CA
H A 0082 THR C 2.823 H A 0083 ALA C
H A 0082 THR C 3.667 H A 0083 ALA CB
H A 0083 ALA C 2.424 H A 0084 CYS CA
H A 0083 ALA C 2.970 H A 0084 CYS C
H A 0083 ALA C 3.695 H A 0084 CYS CB
H A 0083 ALA C 3.793 H A 0086 GLU CB
H A 0084 CYS C 2.422 H A 0085 HIS CA
H A 0084 CYS C 3.032 H A 0085 HIS C
H A 0084 CYS C 3.690 H A 0085 HIS CB
H A 0085 HIS C 2.422 H A 0086 GLU CA
H A 0085 HIS C 3.159 H A 0086 GLU C
H A 0085 HIS C 3.661 H A 0086 GLU CB
H A 0086 GLU C 2.422 H A 0087 PHE CA
H A 0086 GLU C 2.837 H A 0087 PHE C
H A 0086 GLU C 3.678 H A 0087 PHE CB
H A 0087 PHE C 2.422 H A 0088 PHE CA
H A 0087 PHE C 3.084 H A 0088 PHE C
H A 0087 PHE C 3.681 H A 0088 PHE CB
H A 0088 PHE C 2.423 C A 0089 GLU CA
H A 0088 PHE C 3.257 C A 0089 GLU C
H A 0088 PHE C 3.621 C A 0089 GLU CB
C A 0089 GLU C 2.422 C A 0090 HIS CA
C A 0089 GLU C 3.583 C A 0090 HIS C
C A 0089 GLU C 3.322 C A 0090 HIS CB
C A 0090 HIS C 2.422 C A 0091 GLU CA
C A 0090 HIS C 3.010 C A 0091 GLU C
C A 0090 HIS C 3.694 C A 0091 GLU CB
CHARGE_ATTR 2.00 12.00 145
H A 0002 GLU OE1 10.13 H A 0005 LYS NZ
H A 0004 GLU OE1 6.597 H A 0005 LYS NZ
H A 0004 GLU OE2 7.885 H A 0005 LYS NZ
H A 0012 ASP OD1 7.732 H A 0015 HIS ND1
H A 0012 ASP OD1 7.956 H A 0015 HIS NE2
H A 0012 ASP OD2 9.471 H A 0015 HIS ND1
H A 0012 ASP OD2 9.326 H A 0015 HIS NE2
H A 0012 ASP OD1 11.51 C A 0020 ARG NH1
H A 0012 ASP OD1 10.58 C A 0024 LYS NZ
H A 0012 ASP OD1 11.60 C A 0025 HIS ND1
H A 0012 ASP OD1 11.25 C A 0025 HIS NE2
C A 0021 GLU OE1 10.48 H A 0015 HIS ND1
C A 0021 GLU OE1 11.38 C A 0024 LYS NZ
C A 0021 GLU OE1 9.792 C A 0025 HIS ND1
C A 0021 GLU OE1 11.00 C A 0025 HIS NE2
C A 0021 GLU OE2 11.73 C A 0025 HIS ND1
C A 0021 GLU OE1 6.387 C A 0026 LYS NZ
C A 0021 GLU OE2 7.778 C A 0026 LYS NZ
C A 0021 GLU OE1 7.769 C A 0028 LYS NZ
C A 0021 GLU OE2 6.275 C A 0028 LYS NZ
C A 0021 GLU OE2 11.34 H A 0029 LYS NZ
C A 0023 ASP OD1 9.002 H A 0015 HIS ND1
C A 0023 ASP OD1 10.14 H A 0015 HIS NE2
C A 0023 ASP OD2 10.55 H A 0015 HIS ND1
C A 0023 ASP OD2 11.75 H A 0015 HIS NE2
C A 0023 ASP OD1 5.028 C A 0024 LYS NZ
C A 0023 ASP OD2 7.038 C A 0024 LYS NZ
C A 0023 ASP OD1 7.604 C A 0025 HIS ND1
C A 0023 ASP OD1 6.827 C A 0025 HIS NE2
C A 0023 ASP OD2 8.641 C A 0025 HIS ND1
C A 0023 ASP OD2 8.211 C A 0025 HIS NE2
C A 0023 ASP OD1 5.931 C A 0026 LYS NZ
C A 0023 ASP OD2 5.603 C A 0026 LYS NZ
H A 0031 GLU OE1 9.374 C A 0020 ARG NH1
H A 0031 GLU OE1 8.277 C A 0020 ARG NH2
H A 0031 GLU OE2 9.978 C A 0020 ARG NH1
H A 0031 GLU OE2 9.267 C A 0020 ARG NH2
H A 0031 GLU OE2 11.75 C A 0026 LYS NZ
H A 0031 GLU OE1 6.030 C A 0028 LYS NZ
H A 0031 GLU OE2 4.848 C A 0028 LYS NZ
H A 0031 GLU OE1 10.74 H A 0029 LYS NZ
H A 0031 GLU OE2 10.50 H A 0029 LYS NZ
H A 0031 GLU OE1 10.92 H A 0033 LYS NZ
H A 0034 GLU OE1 7.721 C A 0020 ARG NH1
H A 0034 GLU OE1 6.031 C A 0020 ARG NH2
H A 0034 GLU OE2 9.621 C A 0020 ARG NH1
H A 0034 GLU OE2 7.723 C A 0020 ARG NH2
H A 0034 GLU OE1 9.231 C A 0028 LYS NZ
H A 0034 GLU OE2 9.172 C A 0028 LYS NZ
H A 0034 GLU OE1 10.06 H A 0033 LYS NZ
H A 0034 GLU OE2 8.052 H A 0033 LYS NZ
C A 0039 GLU OE1 11.78 C A 0020 ARG NH1
C A 0039 GLU OE1 10.94 C A 0020 ARG NH2
C A 0039 GLU OE2 11.30 C A 0020 ARG NH1
C A 0039 GLU OE2 10.79 C A 0020 ARG NH2
C A 0039 GLU OE1 9.828 C A 0042 HIS ND1
C A 0039 GLU OE2 11.78 C A 0042 HIS ND1
C A 0045 GLU OE1 8.187 C A 0042 HIS ND1
C A 0045 GLU OE1 7.655 C A 0042 HIS NE2
C A 0045 GLU OE2 6.152 C A 0042 HIS ND1
C A 0045 GLU OE2 5.524 C A 0042 HIS NE2
C A 0045 GLU OE1 5.115 C A 0048 LYS NZ
C A 0045 GLU OE2 6.478 C A 0048 LYS NZ
C A 0046 GLU OE1 11.76 H A 0033 LYS NZ
C A 0046 GLU OE2 11.22 H A 0033 LYS NZ
C A 0046 GLU OE1 11.97 C A 0042 HIS ND1
C A 0046 GLU OE1 9.613 C A 0048 LYS NZ
C A 0046 GLU OE2 10.83 C A 0048 LYS NZ
C A 0046 GLU OE2 11.27 H A 0055 LYS NZ
C A 0046 GLU OE1 8.438 H A 0085 HIS ND1
C A 0046 GLU OE1 9.780 H A 0085 HIS NE2
C A 0046 GLU OE2 8.898 H A 0085 HIS ND1
C A 0046 GLU OE2 10.36 H A 0085 HIS NE2
C A 0046 GLU OE2 11.99 C A 0090 HIS NE2
C A 0049 GLU OE1 9.218 H A 0033 LYS NZ
C A 0049 GLU OE2 8.234 H A 0033 LYS NZ
C A 0049 GLU OE1 10.28 C A 0048 LYS NZ
C A 0049 GLU OE2 8.215 C A 0048 LYS NZ
C A 0051 GLU OE1 8.236 H A 0033 LYS NZ
C A 0051 GLU OE2 9.633 H A 0033 LYS NZ
C A 0051 GLU OE1 9.128 C A 0048 LYS NZ
C A 0051 GLU OE2 11.08 C A 0048 LYS NZ
C A 0051 GLU OE1 11.78 H A 0055 LYS NZ
C A 0051 GLU OE2 10.89 H A 0055 LYS NZ
C A 0051 GLU OE2 10.92 C A 0090 HIS NE2
H A 0054 ASP OD1 5.686 H A 0029 LYS NZ
H A 0054 ASP OD2 6.975 H A 0029 LYS NZ
H A 0054 ASP OD1 8.153 H A 0033 LYS NZ
H A 0054 ASP OD2 9.257 H A 0033 LYS NZ
H A 0054 ASP OD1 11.62 H A 0055 LYS NZ
H A 0054 ASP OD2 11.06 H A 0055 LYS NZ
H A 0058 GLU OE1 10.46 H A 0029 LYS NZ
H A 0058 GLU OE2 9.447 H A 0029 LYS NZ
H A 0058 GLU OE1 7.128 H A 0055 LYS NZ
H A 0058 GLU OE2 8.937 H A 0055 LYS NZ
C A 0061 ASP OD1 10.25 H A 0029 LYS NZ
C A 0061 ASP OD2 9.322 H A 0029 LYS NZ
C A 0063 ASP OD2 11.66 C A 0025 HIS ND1
C A 0063 ASP OD1 11.83 C A 0026 LYS NZ
C A 0063 ASP OD2 9.733 C A 0026 LYS NZ
C A 0065 ASP OD1 10.98 C A 0026 LYS NZ
C A 0065 ASP OD2 9.724 C A 0026 LYS NZ
C A 0067 GLU OE1 9.339 C A 0025 HIS ND1
C A 0067 GLU OE1 10.80 C A 0025 HIS NE2
C A 0067 GLU OE2 11.26 C A 0025 HIS ND1
C A 0067 GLU OE1 4.802 C A 0026 LYS NZ
C A 0067 GLU OE2 6.404 C A 0026 LYS NZ
C A 0067 GLU OE2 11.47 C A 0028 LYS NZ
C A 0069 ASP OD1 8.892 H A 0015 HIS ND1
C A 0069 ASP OD1 9.514 H A 0015 HIS NE2
C A 0069 ASP OD2 10.61 H A 0015 HIS ND1
C A 0069 ASP OD2 11.45 H A 0015 HIS NE2
C A 0069 ASP OD1 11.59 C A 0024 LYS NZ
C A 0069 ASP OD1 6.257 C A 0025 HIS ND1
C A 0069 ASP OD1 8.332 C A 0025 HIS NE2
C A 0069 ASP OD2 8.190 C A 0025 HIS ND1
C A 0069 ASP OD2 10.27 C A 0025 HIS NE2
C A 0069 ASP OD1 5.994 C A 0026 LYS NZ
C A 0069 ASP OD2 6.871 C A 0026 LYS NZ
H A 0072 GLU OE1 11.69 H A 0015 HIS ND1
H A 0072 GLU OE2 11.94 C A 0026 LYS NZ
H A 0072 GLU OE2 11.77 H A 0029 LYS NZ
H A 0086 GLU OE1 8.574 H A 0055 LYS NZ
H A 0086 GLU OE2 10.35 H A 0055 LYS NZ
H A 0086 GLU OE1 8.791 H A 0085 HIS ND1
H A 0086 GLU OE1 10.31 H A 0085 HIS NE2
H A 0086 GLU OE2 7.688 H A 0085 HIS ND1
H A 0086 GLU OE2 9.119 H A 0085 HIS NE2
H A 0086 GLU OE1 9.410 C A 0090 HIS ND1
H A 0086 GLU OE1 8.277 C A 0090 HIS NE2
H A 0086 GLU OE2 9.625 C A 0090 HIS ND1
H A 0086 GLU OE2 8.923 C A 0090 HIS NE2
C A 0089 GLU OE1 11.81 H A 0055 LYS NZ
C A 0089 GLU OE1 10.56 H A 0085 HIS ND1
C A 0089 GLU OE2 10.05 H A 0085 HIS ND1
C A 0089 GLU OE2 11.23 H A 0085 HIS NE2
C A 0089 GLU OE1 7.887 C A 0090 HIS ND1
C A 0089 GLU OE1 8.293 C A 0090 HIS NE2
C A 0089 GLU OE2 9.849 C A 0090 HIS ND1
C A 0089 GLU OE2 10.29 C A 0090 HIS NE2
C A 0091 GLU OE1 10.71 H A 0055 LYS NZ
C A 0091 GLU OE1 8.491 C A 0090 HIS ND1
C A 0091 GLU OE1 8.665 C A 0090 HIS NE2
C A 0091 GLU OE2 9.087 C A 0090 HIS ND1
C A 0091 GLU OE2 9.508 C A 0090 HIS NE2
CHARGE_REPU 2.00 12.00 177
H A 0002 GLU OE1 10.05 H A 0004 GLU OE1
H A 0002 GLU OE1 11.61 H A 0004 GLU OE2
H A 0002 GLU OE2 11.43 H A 0004 GLU OE1
H A 0012 ASP OD1 11.26 C A 0039 GLU OE1
H A 0012 ASP OD1 9.480 C A 0039 GLU OE2
H A 0012 ASP OD2 11.82 C A 0039 GLU OE1
H A 0012 ASP OD2 10.18 C A 0039 GLU OE2
H A 0015 HIS ND1 5.839 C A 0024 LYS NZ
H A 0015 HIS NE2 6.186 C A 0024 LYS NZ
H A 0015 HIS ND1 3.951 C A 0025 HIS ND1
H A 0015 HIS ND1 4.347 C A 0025 HIS NE2
H A 0015 HIS NE2 4.345 C A 0025 HIS ND1
H A 0015 HIS NE2 4.241 C A 0025 HIS NE2
H A 0015 HIS ND1 8.040 C A 0026 LYS NZ
H A 0015 HIS NE2 9.248 C A 0026 LYS NZ
C A 0021 GLU OE1 8.675 C A 0023 ASP OD1
C A 0021 GLU OE1 8.183 C A 0023 ASP OD2
C A 0021 GLU OE2 9.801 C A 0023 ASP OD1
C A 0021 GLU OE2 8.920 C A 0023 ASP OD2
C A 0021 GLU OE1 7.413 H A 0031 GLU OE1
C A 0021 GLU OE1 5.569 H A 0031 GLU OE2
C A 0021 GLU OE2 7.588 H A 0031 GLU OE1
C A 0021 GLU OE2 5.511 H A 0031 GLU OE2
C A 0021 GLU OE1 10.63 H A 0034 GLU OE1
C A 0021 GLU OE1 11.86 H A 0034 GLU OE2
C A 0021 GLU OE2 11.09 H A 0034 GLU OE1
C A 0021 GLU OE1 10.51 C A 0061 ASP OD1
C A 0021 GLU OE1 11.94 C A 0061 ASP OD2
C A 0021 GLU OE2 10.57 C A 0061 ASP OD1
C A 0021 GLU OE2 11.69 C A 0061 ASP OD2
C A 0021 GLU OE1 11.08 C A 0065 ASP OD1
C A 0021 GLU OE1 9.265 C A 0065 ASP OD2
C A 0021 GLU OE2 10.42 C A 0065 ASP OD1
C A 0021 GLU OE2 8.446 C A 0065 ASP OD2
C A 0021 GLU OE1 6.420 C A 0067 GLU OE1
C A 0021 GLU OE1 6.641 C A 0067 GLU OE2
C A 0021 GLU OE2 6.740 C A 0067 GLU OE1
C A 0021 GLU OE2 6.256 C A 0067 GLU OE2
C A 0021 GLU OE1 9.525 C A 0069 ASP OD1
C A 0021 GLU OE1 9.256 C A 0069 ASP OD2
C A 0021 GLU OE2 10.98 C A 0069 ASP OD1
C A 0021 GLU OE2 10.41 C A 0069 ASP OD2
C A 0021 GLU OE1 11.19 H A 0072 GLU OE1
C A 0021 GLU OE1 9.853 H A 0072 GLU OE2
C A 0021 GLU OE2 10.92 H A 0072 GLU OE2
C A 0023 ASP OD1 9.889 C A 0067 GLU OE1
C A 0023 ASP OD1 10.63 C A 0067 GLU OE2
C A 0023 ASP OD2 8.728 C A 0067 GLU OE1
C A 0023 ASP OD2 9.152 C A 0067 GLU OE2
C A 0023 ASP OD1 11.62 C A 0069 ASP OD1
C A 0023 ASP OD2 11.58 C A 0069 ASP OD1
C A 0024 LYS NZ 5.610 C A 0025 HIS ND1
C A 0024 LYS NZ 3.805 C A 0025 HIS NE2
C A 0024 LYS NZ 7.782 C A 0026 LYS NZ
C A 0025 HIS ND1 5.155 C A 0026 LYS NZ
C A 0025 HIS NE2 6.206 C A 0026 LYS NZ
C A 0028 LYS NZ 7.775 H A 0029 LYS NZ
H A 0029 LYS NZ 11.09 H A 0033 LYS NZ
H A 0031 GLU OE1 3.698 H A 0034 GLU OE1
H A 0031 GLU OE1 4.498 H A 0034 GLU OE2
H A 0031 GLU OE2 5.695 H A 0034 GLU OE1
H A 0031 GLU OE2 6.595 H A 0034 GLU OE2
H A 0031 GLU OE1 11.99 C A 0039 GLU OE2
H A 0031 GLU OE2 11.68 C A 0067 GLU OE1
H A 0031 GLU OE2 11.55 C A 0067 GLU OE2
H A 0031 GLU OE1 11.76 H A 0072 GLU OE1
H A 0031 GLU OE1 10.80 H A 0072 GLU OE2
H A 0031 GLU OE2 11.96 H A 0072 GLU OE1
H A 0031 GLU OE2 10.77 H A 0072 GLU OE2
H A 0033 LYS NZ 9.073 C A 0048 LYS NZ
H A 0034 GLU OE1 9.848 C A 0039 GLU OE1
H A 0034 GLU OE1 9.779 C A 0039 GLU OE2
H A 0034 GLU OE2 10.46 C A 0039 GLU OE1
H A 0034 GLU OE2 10.71 C A 0039 GLU OE2
C A 0042 HIS ND1 11.42 C A 0048 LYS NZ
C A 0042 HIS NE2 11.47 C A 0048 LYS NZ
C A 0045 GLU OE1 8.380 C A 0046 GLU OE1
C A 0045 GLU OE1 10.19 C A 0046 GLU OE2
C A 0045 GLU OE2 9.287 C A 0046 GLU OE1
C A 0045 GLU OE2 10.97 C A 0046 GLU OE2
C A 0045 GLU OE1 11.83 C A 0051 GLU OE1
C A 0046 GLU OE1 7.978 C A 0051 GLU OE1
C A 0046 GLU OE1 9.546 C A 0051 GLU OE2
C A 0046 GLU OE2 7.720 C A 0051 GLU OE1
C A 0046 GLU OE2 9.108 C A 0051 GLU OE2
C A 0046 GLU OE2 11.03 H A 0086 GLU OE1
C A 0046 GLU OE2 11.67 H A 0086 GLU OE2
C A 0049 GLU OE1 6.312 C A 0051 GLU OE1
C A 0049 GLU OE1 6.140 C A 0051 GLU OE2
C A 0049 GLU OE2 6.128 C A 0051 GLU OE1
C A 0049 GLU OE2 6.672 C A 0051 GLU OE2
C A 0049 GLU OE1 10.55 H A 0054 ASP OD1
C A 0049 GLU OE1 9.572 H A 0054 ASP OD2
C A 0049 GLU OE2 11.26 H A 0054 ASP OD1
C A 0049 GLU OE2 10.63 H A 0054 ASP OD2
C A 0051 GLU OE1 9.147 H A 0054 ASP OD1
C A 0051 GLU OE1 8.574 H A 0054 ASP OD2
C A 0051 GLU OE2 8.819 H A 0054 ASP OD1
C A 0051 GLU OE2 7.774 H A 0054 ASP OD2
H A 0054 ASP OD1 7.895 H A 0058 GLU OE1
H A 0054 ASP OD1 8.114 H A 0058 GLU OE2
H A 0054 ASP OD2 7.349 H A 0058 GLU OE1
H A 0054 ASP OD2 7.952 H A 0058 GLU OE2
H A 0054 ASP OD1 11.28 C A 0061 ASP OD2
H A 0054 ASP OD1 11.81 H A 0072 GLU OE2
H A 0055 LYS NZ 8.093 C A 0090 HIS ND1
H A 0055 LYS NZ 5.969 C A 0090 HIS NE2
H A 0058 GLU OE1 10.76 C A 0061 ASP OD1
H A 0058 GLU OE1 9.204 C A 0061 ASP OD2
H A 0058 GLU OE2 8.941 C A 0061 ASP OD1
H A 0058 GLU OE2 7.228 C A 0061 ASP OD2
H A 0058 GLU OE2 11.69 H A 0072 GLU OE2
C A 0061 ASP OD1 6.853 C A 0063 ASP OD1
C A 0061 ASP OD1 6.895 C A 0063 ASP OD2
C A 0061 ASP OD2 8.073 C A 0063 ASP OD1
C A 0061 ASP OD2 8.441 C A 0063 ASP OD2
C A 0061 ASP OD1 7.375 C A 0065 ASP OD1
C A 0061 ASP OD1 7.714 C A 0065 ASP OD2
C A 0061 ASP OD2 7.728 C A 0065 ASP OD1
C A 0061 ASP OD2 8.274 C A 0065 ASP OD2
C A 0061 ASP OD1 8.513 C A 0067 GLU OE1
C A 0061 ASP OD1 8.874 C A 0067 GLU OE2
C A 0061 ASP OD2 10.09 C A 0067 GLU OE1
C A 0061 ASP OD2 10.08 C A 0067 GLU OE2
C A 0061 ASP OD1 9.134 C A 0069 ASP OD1
C A 0061 ASP OD1 7.064 C A 0069 ASP OD2
C A 0061 ASP OD2 11.25 C A 0069 ASP OD1
C A 0061 ASP OD2 9.146 C A 0069 ASP OD2
C A 0061 ASP OD1 8.630 H A 0072 GLU OE1
C A 0061 ASP OD1 6.754 H A 0072 GLU OE2
C A 0061 ASP OD2 10.11 H A 0072 GLU OE1
C A 0061 ASP OD2 8.211 H A 0072 GLU OE2
C A 0063 ASP OD1 8.002 C A 0065 ASP OD1
C A 0063 ASP OD1 9.270 C A 0065 ASP OD2
C A 0063 ASP OD2 7.137 C A 0065 ASP OD1
C A 0063 ASP OD2 8.049 C A 0065 ASP OD2
C A 0063 ASP OD1 8.984 C A 0067 GLU OE1
C A 0063 ASP OD1 10.08 C A 0067 GLU OE2
C A 0063 ASP OD2 7.015 C A 0067 GLU OE1
C A 0063 ASP OD2 8.299 C A 0067 GLU OE2
C A 0063 ASP OD1 7.280 C A 0069 ASP OD1
C A 0063 ASP OD1 5.673 C A 0069 ASP OD2
C A 0063 ASP OD2 5.616 C A 0069 ASP OD1
C A 0063 ASP OD2 4.051 C A 0069 ASP OD2
C A 0063 ASP OD1 11.78 H A 0072 GLU OE1
C A 0063 ASP OD1 10.81 H A 0072 GLU OE2
C A 0063 ASP OD2 11.51 H A 0072 GLU OE1
C A 0063 ASP OD2 10.47 H A 0072 GLU OE2
C A 0065 ASP OD1 6.221 C A 0067 GLU OE1
C A 0065 ASP OD1 5.283 C A 0067 GLU OE2
C A 0065 ASP OD2 4.979 C A 0067 GLU OE1
C A 0065 ASP OD2 3.528 C A 0067 GLU OE2
C A 0065 ASP OD1 10.56 C A 0069 ASP OD1
C A 0065 ASP OD1 8.857 C A 0069 ASP OD2
C A 0065 ASP OD2 10.32 C A 0069 ASP OD1
C A 0065 ASP OD2 8.792 C A 0069 ASP OD2
C A 0067 GLU OE1 6.401 C A 0069 ASP OD1
C A 0067 GLU OE1 5.679 C A 0069 ASP OD2
C A 0067 GLU OE2 8.509 C A 0069 ASP OD1
C A 0067 GLU OE2 7.576 C A 0069 ASP OD2
C A 0067 GLU OE1 10.97 H A 0072 GLU OE2
C A 0069 ASP OD1 9.337 H A 0072 GLU OE1
C A 0069 ASP OD1 8.906 H A 0072 GLU OE2
C A 0069 ASP OD2 8.784 H A 0072 GLU OE1
C A 0069 ASP OD2 7.960 H A 0072 GLU OE2
H A 0086 GLU OE1 6.020 C A 0089 GLU OE1
H A 0086 GLU OE1 6.914 C A 0089 GLU OE2
H A 0086 GLU OE2 4.707 C A 0089 GLU OE1
H A 0086 GLU OE2 5.116 C A 0089 GLU OE2
H A 0086 GLU OE1 7.849 C A 0091 GLU OE1
H A 0086 GLU OE1 7.833 C A 0091 GLU OE2
H A 0086 GLU OE2 7.970 C A 0091 GLU OE1
H A 0086 GLU OE2 7.375 C A 0091 GLU OE2
C A 0089 GLU OE1 5.571 C A 0091 GLU OE1
C A 0089 GLU OE1 4.215 C A 0091 GLU OE2
C A 0089 GLU OE2 7.142 C A 0091 GLU OE1
C A 0089 GLU OE2 5.386 C A 0091 GLU OE2
HB_MM 2.00 3.20 167
H A 0002 GLU N 2.197 C A 0001 SER O
H A 0003 LEU N 2.197 H A 0002 GLU O
H A 0004 GLU N 2.196 H A 0003 LEU O
H A 0005 LYS N 2.197 H A 0004 GLU O
H A 0006 ALA N 2.196 H A 0005 LYS O
H A 0007 MET N 2.698 H A 0003 LEU O
H A 0007 MET N 2.875 H A 0004 GLU O
H A 0007 MET N 3.092 H A 0005 LYS O
H A 0007 MET N 2.196 H A 0006 ALA O
H A 0008 VAL N 2.196 H A 0007 MET O
H A 0009 ALA N 2.196 H A 0008 VAL O
H A 0010 LEU N 2.914 H A 0006 ALA O
H A 0010 LEU N 2.197 H A 0009 ALA O
H A 0011 ILE N 2.973 H A 0007 MET O
H A 0011 ILE N 2.796 H A 0009 ALA O
H A 0011 ILE N 2.197 H A 0010 LEU O
H A 0012 ASP N 3.191 H A 0008 VAL O
H A 0012 ASP N 2.627 H A 0009 ALA O
H A 0012 ASP N 2.197 H A 0011 ILE O
H A 0013 VAL N 3.121 H A 0009 ALA O
H A 0013 VAL N 3.006 H A 0010 LEU O
H A 0013 VAL N 2.939 H A 0011 ILE O
H A 0013 VAL N 2.197 H A 0012 ASP O
H A 0014 PHE N 3.104 H A 0010 LEU O
H A 0014 PHE N 2.795 H A 0011 ILE O
H A 0014 PHE N 2.194 H A 0013 VAL O
H A 0015 HIS N 2.197 H A 0014 PHE O
H A 0016 GLN N 2.951 H A 0012 ASP O
H A 0016 GLN N 2.196 H A 0015 HIS O
H A 0017 TYR N 2.988 H A 0013 VAL O
H A 0017 TYR N 2.197 H A 0016 GLN O
H A 0018 SER N 3.134 H A 0014 PHE O
H A 0018 SER N 2.196 H A 0017 TYR O
H A 0019 GLY N 2.815 H A 0015 HIS O
H A 0019 GLY N 2.881 H A 0016 GLN O
H A 0019 GLY N 2.960 H A 0017 TYR O
H A 0019 GLY N 2.197 H A 0018 SER O
C A 0020 ARG N 2.951 H A 0017 TYR O
C A 0020 ARG N 2.197 H A 0019 GLY O
C A 0021 GLU N 3.056 H A 0019 GLY O
C A 0021 GLU N 2.197 C A 0020 ARG O
C A 0022 GLY N 2.806 C A 0020 ARG O
C A 0022 GLY N 2.197 C A 0021 GLU O
C A 0023 ASP N 2.431 C A 0021 GLU O
C A 0023 ASP N 2.197 C A 0022 GLY O
C A 0024 LYS N 2.196 C A 0023 ASP O
C A 0025 HIS N 2.196 C A 0024 LYS O
C A 0026 LYS N 2.197 C A 0025 HIS O
C A 0027 LEU N 2.197 C A 0026 LYS O
C A 0028 LYS N 2.195 C A 0027 LEU O
H A 0029 LYS N 2.199 C A 0028 LYS O
H A 0030 SER N 2.351 C A 0028 LYS O
H A 0030 SER N 2.195 H A 0029 LYS O
H A 0031 GLU N 3.035 C A 0028 LYS O
H A 0031 GLU N 2.771 H A 0029 LYS O
H A 0031 GLU N 2.194 H A 0030 SER O
H A 0032 LEU N 2.695 H A 0029 LYS O
H A 0032 LEU N 2.195 H A 0031 GLU O
H A 0033 LYS N 2.197 H A 0032 LEU O
H A 0034 GLU N 3.037 H A 0030 SER O
H A 0034 GLU N 3.090 H A 0031 GLU O
H A 0034 GLU N 2.892 H A 0032 LEU O
H A 0034 GLU N 2.197 H A 0033 LYS O
H A 0035 LEU N 2.885 H A 0032 LEU O
H A 0035 LEU N 2.195 H A 0034 GLU O
H A 0036 ILE N 3.030 H A 0032 LEU O
H A 0036 ILE N 3.015 H A 0033 LYS O
H A 0036 ILE N 2.999 H A 0034 GLU O
H A 0036 ILE N 2.195 H A 0035 LEU O
H A 0037 ASN N 2.974 H A 0033 LYS O
H A 0037 ASN N 2.772 H A 0034 GLU O
H A 0037 ASN N 2.194 H A 0036 ILE O
H A 0038 ASN N 2.665 H A 0034 GLU O
H A 0038 ASN N 2.198 H A 0037 ASN O
C A 0039 GLU N 3.026 H A 0035 LEU O
C A 0039 GLU N 2.501 H A 0037 ASN O
C A 0039 GLU N 2.195 H A 0038 ASN O
C A 0040 LEU N 3.060 H A 0035 LEU O
C A 0040 LEU N 2.824 H A 0036 ILE O
C A 0040 LEU N 3.078 H A 0037 ASN O
C A 0040 LEU N 2.195 C A 0039 GLU O
C A 0041 SER N 2.921 H A 0037 ASN O
C A 0041 SER N 2.196 C A 0040 LEU O
C A 0042 HIS N 2.197 C A 0041 SER O
C A 0043 PHE N 2.197 C A 0042 HIS O
C A 0044 LEU N 2.196 C A 0043 PHE O
C A 0045 GLU N 2.197 C A 0044 LEU O
C A 0046 GLU N 2.197 C A 0045 GLU O
C A 0047 ILE N 2.196 C A 0046 GLU O
C A 0048 LYS N 2.205 C A 0047 ILE O
C A 0049 GLU N 2.898 C A 0047 ILE O
C A 0049 GLU N 2.197 C A 0048 LYS O
C A 0050 GLN N 2.201 C A 0049 GLU O
C A 0051 GLU N 2.197 C A 0050 GLN O
H A 0052 VAL N 2.195 C A 0051 GLU O
H A 0053 VAL N 2.198 H A 0052 VAL O
H A 0054 ASP N 2.199 H A 0053 VAL O
H A 0055 LYS N 2.198 H A 0054 ASP O
H A 0056 VAL N 2.964 H A 0052 VAL O
H A 0056 VAL N 2.196 H A 0055 LYS O
H A 0057 MET N 2.191 H A 0056 VAL O
H A 0058 GLU N 2.873 H A 0055 LYS O
H A 0058 GLU N 2.489 H A 0056 VAL O
H A 0058 GLU N 2.196 H A 0057 MET O
H A 0059 THR N 2.655 H A 0056 VAL O
H A 0059 THR N 2.198 H A 0058 GLU O
C A 0060 LEU N 2.601 H A 0056 VAL O
C A 0060 LEU N 2.204 H A 0059 THR O
C A 0061 ASP N 2.571 H A 0059 THR O
C A 0061 ASP N 2.196 C A 0060 LEU O
C A 0062 ASN N 2.196 C A 0061 ASP O
C A 0063 ASP N 2.196 C A 0062 ASN O
C A 0064 GLY N 2.197 C A 0063 ASP O
C A 0065 ASP N 2.197 C A 0064 GLY O
C A 0066 GLY N 2.197 C A 0065 ASP O
C A 0067 GLU N 2.197 C A 0066 GLY O
C A 0068 CYS N 3.161 C A 0027 LEU O
C A 0068 CYS N 2.196 C A 0067 GLU O
C A 0069 ASP N 2.198 C A 0068 CYS O
H A 0070 PHE N 2.194 C A 0069 ASP O
H A 0071 GLN N 3.119 C A 0069 ASP O
H A 0071 GLN N 2.194 H A 0070 PHE O
H A 0072 GLU N 2.841 C A 0069 ASP O
H A 0072 GLU N 2.939 H A 0070 PHE O
H A 0072 GLU N 2.198 H A 0071 GLN O
H A 0073 PHE N 2.932 C A 0069 ASP O
H A 0073 PHE N 2.678 H A 0070 PHE O
H A 0073 PHE N 2.194 H A 0072 GLU O
H A 0074 MET N 2.199 H A 0073 PHE O
H A 0075 ALA N 2.196 H A 0074 MET O
H A 0076 PHE N 2.712 H A 0072 GLU O
H A 0076 PHE N 3.186 H A 0073 PHE O
H A 0076 PHE N 2.794 H A 0074 MET O
H A 0076 PHE N 2.199 H A 0075 ALA O
H A 0077 VAL N 3.107 H A 0074 MET O
H A 0077 VAL N 2.201 H A 0076 PHE O
H A 0078 ALA N 2.932 H A 0074 MET O
H A 0078 ALA N 2.723 H A 0076 PHE O
H A 0078 ALA N 2.198 H A 0077 VAL O
H A 0079 MET N 2.867 H A 0076 PHE O
H A 0079 MET N 2.198 H A 0078 ALA O
H A 0080 VAL N 3.094 H A 0076 PHE O
H A 0080 VAL N 2.173 H A 0079 MET O
H A 0081 THR N 2.911 H A 0077 VAL O
H A 0081 THR N 2.432 H A 0079 MET O
H A 0081 THR N 2.195 H A 0080 VAL O
H A 0082 THR N 3.078 H A 0078 ALA O
H A 0082 THR N 2.937 H A 0079 MET O
H A 0082 THR N 2.198 H A 0081 THR O
H A 0083 ALA N 2.387 H A 0079 MET O
H A 0083 ALA N 2.203 H A 0082 THR O
H A 0084 CYS N 2.800 H A 0082 THR O
H A 0084 CYS N 2.199 H A 0083 ALA O
H A 0085 HIS N 2.563 H A 0082 THR O
H A 0085 HIS N 2.196 H A 0084 CYS O
H A 0086 GLU N 2.764 H A 0082 THR O
H A 0086 GLU N 2.911 H A 0083 ALA O
H A 0086 GLU N 2.990 H A 0084 CYS O
H A 0086 GLU N 2.196 H A 0085 HIS O
H A 0087 PHE N 3.069 H A 0084 CYS O
H A 0087 PHE N 2.196 H A 0086 GLU O
H A 0088 PHE N 2.542 H A 0086 GLU O
H A 0088 PHE N 2.195 H A 0087 PHE O
C A 0089 GLU N 2.749 H A 0086 GLU O
C A 0089 GLU N 2.197 H A 0088 PHE O
C A 0090 HIS N 2.197 C A 0089 GLU O
C A 0091 GLU N 2.197 C A 0090 HIS O
HB_MS 2.00 3.20 9
H A 0002 GLU N 3.141 C A 0001 SER OG
H A 0005 LYS N 3.164 H A 0004 GLU OE1
H A 0014 PHE O 2.536 H A 0018 SER OG
H A 0015 HIS O 2.820 H A 0018 SER OG
H A 0019 GLY N 3.085 H A 0018 SER OG
C A 0025 HIS N 2.618 H A 0018 SER OG
H A 0037 ASN O 2.780 C A 0041 SER OG
H A 0073 PHE N 3.035 H A 0072 GLU OE1
H A 0077 VAL O 2.321 H A 0081 THR OG1
HB_SS 2.00 3.20 2
C A 0039 GLU OE1 2.811 H A 0017 TYR OH
C A 0039 GLU OE2 2.635 H A 0017 TYR OH
AROMATIC 0.00 8.00 3
H A 0015 HIS 5.878 H A 0070 PHE
H A 0055 LYS 7.205 C A 0090 HIS
C A 0024 LYS 4.385 C A 0025 HIS
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 69
C A 0001 SER CB 3.439 C B 0039 GLU CA
C A 0001 SER CB 3.797 C B 0039 GLU C
H A 0002 GLU CG 3.698 H B 0009 ALA CA
H A 0002 GLU CG 3.445 H B 0009 ALA C
H A 0002 GLU CG 3.324 H B 0009 ALA CB
H A 0002 GLU CD 3.133 H B 0009 ALA CA
H A 0002 GLU CD 3.252 H B 0009 ALA C
H A 0002 GLU CD 3.150 H B 0009 ALA CB
H A 0002 GLU CB 3.677 H B 0013 VAL CG2
H A 0002 GLU CG 3.517 H B 0013 VAL CG2
H A 0003 LEU CG 3.725 H B 0010 LEU CD2
H A 0003 LEU CD1 3.307 H B 0013 VAL CG2
H A 0003 LEU CD2 3.728 H B 0035 LEU CG
H A 0003 LEU CB 3.663 C B 0039 GLU CB
H A 0003 LEU CB 3.305 C B 0040 LEU CD1
H A 0006 ALA CB 3.629 H B 0006 ALA CB
H A 0010 LEU CG 3.564 H B 0003 LEU CD1
H A 0010 LEU CD2 2.867 H B 0003 LEU CD1
H A 0010 LEU CG 3.615 H B 0006 ALA CB
H A 0010 LEU CD1 2.974 H B 0006 ALA CB
H A 0010 LEU CD1 3.700 H B 0010 LEU CD1
H A 0011 ILE CG1 3.741 H B 0081 THR CG2
H A 0011 ILE CD1 3.648 H B 0081 THR CG2
H A 0013 VAL CG2 3.746 H B 0002 GLU CB
H A 0013 VAL CG1 3.598 H B 0003 LEU CD2
H A 0013 VAL CG2 3.436 H B 0003 LEU CD2
H A 0035 LEU CD2 3.624 H B 0003 LEU CG
H A 0035 LEU CD2 3.286 H B 0003 LEU CD2
C A 0039 GLU CB 3.620 H B 0003 LEU CB
C A 0039 GLU CB 3.567 H B 0003 LEU CD2
C A 0039 GLU CG 3.509 H B 0003 LEU CD2
C A 0039 GLU CD 3.566 H B 0003 LEU CD2
C A 0040 LEU CD1 3.577 H B 0003 LEU CB
C A 0043 PHE CG 3.287 H B 0007 MET CE
C A 0043 PHE CD1 3.641 H B 0007 MET CE
C A 0043 PHE CD2 3.309 H B 0007 MET CE
C A 0043 PHE CE2 3.680 H B 0007 MET CE
H A 0070 PHE CB 3.537 H B 0082 THR CB
H A 0070 PHE CB 3.527 H B 0082 THR CG2
H A 0070 PHE CG 3.671 H B 0082 THR CB
H A 0071 GLN CA 3.557 H B 0078 ALA CB
H A 0071 GLN C 3.702 H B 0078 ALA CB
H A 0071 GLN CG 3.696 H B 0079 MET CG
H A 0071 GLN CD 3.555 H B 0079 MET CG
H A 0073 PHE CZ 3.663 H B 0003 LEU CD1
H A 0074 MET C 3.739 H B 0074 MET C
H A 0074 MET C 3.780 H B 0074 MET CB
H A 0074 MET CB 3.671 H B 0074 MET C
H A 0074 MET CG 3.729 H B 0074 MET C
H A 0074 MET CG 3.752 H B 0077 VAL C
H A 0074 MET CG 3.597 H B 0077 VAL CB
H A 0074 MET CB 3.053 H B 0078 ALA CA
H A 0074 MET CB 2.835 H B 0078 ALA CB
H A 0074 MET CG 3.694 H B 0078 ALA CA
H A 0075 ALA CA 3.331 H B 0075 ALA CA
H A 0075 ALA CA 3.530 H B 0075 ALA CB
H A 0075 ALA CB 3.559 H B 0075 ALA CA
H A 0075 ALA CB 3.271 H B 0075 ALA CB
H A 0077 VAL CG1 3.800 H B 0074 MET CE
H A 0078 ALA CB 3.581 H B 0071 GLN CA
H A 0078 ALA CB 3.748 H B 0071 GLN C
H A 0078 ALA CA 3.119 H B 0074 MET CB
H A 0078 ALA CA 3.790 H B 0074 MET CG
H A 0078 ALA CB 2.841 H B 0074 MET CB
H A 0081 THR CG2 3.487 H B 0011 ILE CG1
H A 0081 THR CG2 3.410 H B 0011 ILE CD1
H A 0082 THR CB 3.452 H B 0070 PHE CB
H A 0082 THR CB 3.575 H B 0070 PHE CG
H A 0082 THR CG2 3.473 H B 0070 PHE CB
CHARGE_ATTR 2.00 12.00 58
H A 0002 GLU OE2 10.28 H B 0015 HIS ND1
H A 0004 GLU OE1 4.695 C B 0042 HIS ND1
H A 0004 GLU OE1 4.754 C B 0042 HIS NE2
H A 0004 GLU OE2 3.284 C B 0042 HIS ND1
H A 0004 GLU OE2 4.306 C B 0042 HIS NE2
H A 0004 GLU OE2 11.80 H B 0085 HIS ND1
H A 0004 GLU OE2 11.02 H B 0085 HIS NE2
H A 0005 LYS NZ 11.41 H B 0002 GLU OE1
H A 0005 LYS NZ 9.801 H B 0002 GLU OE2
H A 0012 ASP OD1 11.51 H B 0085 HIS NE2
H A 0012 ASP OD2 11.69 H B 0085 HIS NE2
H A 0015 HIS ND1 8.367 H B 0086 GLU OE1
H A 0015 HIS ND1 7.369 H B 0086 GLU OE2
H A 0015 HIS NE2 6.647 H B 0086 GLU OE1
H A 0015 HIS NE2 6.105 H B 0086 GLU OE2
H A 0015 HIS ND1 11.16 C B 0089 GLU OE1
H A 0015 HIS NE2 9.813 C B 0089 GLU OE1
H A 0015 HIS NE2 11.82 C B 0089 GLU OE2
C A 0024 LYS NZ 10.39 H B 0086 GLU OE1
C A 0024 LYS NZ 9.447 H B 0086 GLU OE2
C A 0024 LYS NZ 10.26 C B 0089 GLU OE1
C A 0024 LYS NZ 11.56 C B 0089 GLU OE2
C A 0025 HIS ND1 6.952 H B 0086 GLU OE1
C A 0025 HIS ND1 5.236 H B 0086 GLU OE2
C A 0025 HIS NE2 7.091 H B 0086 GLU OE1
C A 0025 HIS NE2 5.806 H B 0086 GLU OE2
C A 0025 HIS ND1 8.377 C B 0089 GLU OE1
C A 0025 HIS ND1 10.22 C B 0089 GLU OE2
C A 0025 HIS NE2 7.709 C B 0089 GLU OE1
C A 0025 HIS NE2 9.408 C B 0089 GLU OE2
C A 0026 LYS NZ 11.35 H B 0086 GLU OE1
C A 0026 LYS NZ 9.309 H B 0086 GLU OE2
C A 0026 LYS NZ 11.15 C B 0089 GLU OE1
C A 0039 GLU OE1 9.994 H B 0005 LYS NZ
C A 0039 GLU OE2 10.78 H B 0005 LYS NZ
C A 0042 HIS ND1 7.122 H B 0004 GLU OE1
C A 0042 HIS ND1 8.072 H B 0004 GLU OE2
C A 0042 HIS NE2 8.331 H B 0004 GLU OE1
C A 0042 HIS NE2 9.198 H B 0004 GLU OE2
H A 0086 GLU OE1 11.76 H B 0015 HIS ND1
H A 0086 GLU OE1 11.30 H B 0015 HIS NE2
H A 0086 GLU OE2 11.02 H B 0015 HIS ND1
H A 0086 GLU OE2 10.20 H B 0015 HIS NE2
H A 0086 GLU OE1 8.778 C B 0025 HIS ND1
H A 0086 GLU OE1 9.279 C B 0025 HIS NE2
H A 0086 GLU OE2 7.900 C B 0025 HIS ND1
H A 0086 GLU OE2 7.955 C B 0025 HIS NE2
H A 0086 GLU OE2 11.76 C B 0026 LYS NZ
C A 0089 GLU OE2 11.77 H B 0015 HIS NE2
C A 0089 GLU OE2 11.34 C B 0024 LYS NZ
C A 0089 GLU OE1 10.30 C B 0025 HIS ND1
C A 0089 GLU OE1 10.03 C B 0025 HIS NE2
C A 0089 GLU OE2 9.184 C B 0025 HIS ND1
C A 0089 GLU OE2 8.576 C B 0025 HIS NE2
C A 0089 GLU OE2 11.20 C B 0026 LYS NZ
C A 0091 GLU OE2 11.33 C B 0025 HIS ND1
C A 0091 GLU OE2 11.71 C B 0025 HIS NE2
C A 0091 GLU OE2 11.33 C B 0026 LYS NZ
CHARGE_REPU 2.00 12.00 69
H A 0002 GLU OE1 11.30 H B 0004 GLU OE2
H A 0002 GLU OE2 11.85 H B 0004 GLU OE2
H A 0002 GLU OE1 6.790 H B 0012 ASP OD1
H A 0002 GLU OE1 5.372 H B 0012 ASP OD2
H A 0002 GLU OE2 5.410 H B 0012 ASP OD1
H A 0002 GLU OE2 4.268 H B 0012 ASP OD2
H A 0002 GLU OE1 5.950 C B 0039 GLU OE1
H A 0002 GLU OE1 7.417 C B 0039 GLU OE2
H A 0002 GLU OE2 5.141 C B 0039 GLU OE1
H A 0002 GLU OE2 6.902 C B 0039 GLU OE2
H A 0004 GLU OE1 9.654 C B 0039 GLU OE1
H A 0004 GLU OE1 9.310 C B 0039 GLU OE2
H A 0004 GLU OE2 10.92 C B 0039 GLU OE1
H A 0004 GLU OE2 10.65 C B 0039 GLU OE2
H A 0005 LYS NZ 10.33 C B 0042 HIS ND1
H A 0005 LYS NZ 9.986 C B 0042 HIS NE2
H A 0012 ASP OD1 7.554 H B 0002 GLU OE1
H A 0012 ASP OD1 8.510 H B 0002 GLU OE2
H A 0012 ASP OD2 6.766 H B 0002 GLU OE1
H A 0012 ASP OD2 7.507 H B 0002 GLU OE2
H A 0015 HIS ND1 10.34 H B 0085 HIS ND1
H A 0015 HIS ND1 8.881 H B 0085 HIS NE2
H A 0015 HIS NE2 8.186 H B 0085 HIS ND1
H A 0015 HIS NE2 6.676 H B 0085 HIS NE2
C A 0024 LYS NZ 10.95 H B 0085 HIS NE2
C A 0025 HIS ND1 10.23 H B 0085 HIS ND1
C A 0025 HIS ND1 9.463 H B 0085 HIS NE2
C A 0025 HIS NE2 9.857 H B 0085 HIS ND1
C A 0025 HIS NE2 8.913 H B 0085 HIS NE2
C A 0039 GLU OE1 7.199 H B 0002 GLU OE1
C A 0039 GLU OE1 8.257 H B 0002 GLU OE2
C A 0039 GLU OE2 6.435 H B 0002 GLU OE1
C A 0039 GLU OE2 7.433 H B 0002 GLU OE2
C A 0039 GLU OE1 9.614 H B 0004 GLU OE1
C A 0039 GLU OE1 10.59 H B 0004 GLU OE2
C A 0039 GLU OE2 10.61 H B 0004 GLU OE1
C A 0039 GLU OE2 11.39 H B 0004 GLU OE2
C A 0042 HIS ND1 9.591 H B 0005 LYS NZ
C A 0042 HIS NE2 10.72 H B 0005 LYS NZ
C A 0063 ASP OD2 11.90 H B 0086 GLU OE2
C A 0069 ASP OD1 9.350 H B 0086 GLU OE1
C A 0069 ASP OD1 7.307 H B 0086 GLU OE2
C A 0069 ASP OD2 11.42 H B 0086 GLU OE1
C A 0069 ASP OD2 9.408 H B 0086 GLU OE2
C A 0069 ASP OD1 10.96 C B 0089 GLU OE1
H A 0085 HIS ND1 10.33 H B 0015 HIS ND1
H A 0085 HIS ND1 9.698 H B 0015 HIS NE2
H A 0085 HIS NE2 9.158 H B 0015 HIS ND1
H A 0085 HIS NE2 8.564 H B 0015 HIS NE2
H A 0085 HIS ND1 11.26 C B 0025 HIS ND1
H A 0085 HIS ND1 10.14 C B 0025 HIS NE2
H A 0085 HIS NE2 11.08 C B 0025 HIS ND1
H A 0085 HIS NE2 9.751 C B 0025 HIS NE2
H A 0086 GLU OE1 8.737 C B 0069 ASP OD1
H A 0086 GLU OE1 6.593 C B 0069 ASP OD2
H A 0086 GLU OE2 9.265 C B 0069 ASP OD1
H A 0086 GLU OE2 7.252 C B 0069 ASP OD2
H A 0086 GLU OE1 11.19 H B 0072 GLU OE2
C A 0089 GLU OE1 11.30 C B 0069 ASP OD1
C A 0089 GLU OE1 9.626 C B 0069 ASP OD2
C A 0089 GLU OE2 11.35 C B 0069 ASP OD1
C A 0089 GLU OE2 9.848 C B 0069 ASP OD2
C A 0091 GLU OE1 11.49 C B 0063 ASP OD2
C A 0091 GLU OE1 11.63 C B 0067 GLU OE2
C A 0091 GLU OE2 11.43 C B 0067 GLU OE2
C A 0091 GLU OE1 10.15 C B 0069 ASP OD1
C A 0091 GLU OE1 8.881 C B 0069 ASP OD2
C A 0091 GLU OE2 10.14 C B 0069 ASP OD1
C A 0091 GLU OE2 8.918 C B 0069 ASP OD2
HB_MS 2.00 3.20 1
C A 0001 SER OG 2.344 H B 0038 ASN O
HB_SS 2.00 3.20 1
C A 0001 SER OG 2.890 C B 0039 GLU OE2
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 448
C B 0001 SER C 2.422 H B 0002 GLU CA
C B 0001 SER C 3.051 H B 0002 GLU C
C B 0001 SER C 3.686 H B 0002 GLU CB
C B 0001 SER CB 3.008 H B 0004 GLU CB
H B 0002 GLU C 2.422 H B 0003 LEU CA
H B 0002 GLU C 3.092 H B 0003 LEU C
H B 0002 GLU C 3.682 H B 0003 LEU CB
H B 0002 GLU C 3.744 H B 0003 LEU CD2
H B 0002 GLU CB 3.762 H B 0003 LEU CD2
H B 0003 LEU C 2.422 H B 0004 GLU CA
H B 0003 LEU C 3.021 H B 0004 GLU C
H B 0003 LEU C 3.692 H B 0004 GLU CB
H B 0004 GLU C 2.421 H B 0005 LYS CA
H B 0004 GLU C 2.916 H B 0005 LYS C
H B 0004 GLU C 3.693 H B 0005 LYS CB
H B 0004 GLU C 3.772 H B 0007 MET CB
H B 0005 LYS C 2.422 H B 0006 ALA CA
H B 0005 LYS C 3.002 H B 0006 ALA C
H B 0005 LYS C 3.693 H B 0006 ALA CB
H B 0006 ALA C 2.422 H B 0007 MET CA
H B 0006 ALA C 3.035 H B 0007 MET C
H B 0006 ALA C 3.690 H B 0007 MET CB
H B 0007 MET C 2.423 H B 0008 VAL CA
H B 0007 MET C 3.048 H B 0008 VAL C
H B 0007 MET C 3.688 H B 0008 VAL CB
H B 0007 MET C 3.654 H B 0011 ILE CD1
H B 0007 MET CG 3.215 H B 0011 ILE CD1
H B 0007 MET CE 3.627 H B 0011 ILE CD1
H B 0008 VAL C 2.422 H B 0009 ALA CA
H B 0008 VAL C 3.009 H B 0009 ALA C
H B 0008 VAL C 3.693 H B 0009 ALA CB
H B 0009 ALA C 2.422 H B 0010 LEU CA
H B 0009 ALA C 2.885 H B 0010 LEU C
H B 0009 ALA C 3.690 H B 0010 LEU CB
H B 0010 LEU C 2.422 H B 0011 ILE CA
H B 0010 LEU C 2.927 H B 0011 ILE C
H B 0010 LEU C 3.695 H B 0011 ILE CB
H B 0010 LEU CA 3.625 H B 0073 PHE CE2
H B 0010 LEU CA 3.508 H B 0073 PHE CZ
H B 0010 LEU C 3.154 H B 0073 PHE CE2
H B 0010 LEU C 3.427 H B 0073 PHE CZ
H B 0010 LEU CB 3.350 H B 0073 PHE CE2
H B 0010 LEU CB 3.429 H B 0073 PHE CZ
H B 0010 LEU CG 3.753 H B 0073 PHE CZ
H B 0010 LEU CD2 3.700 H B 0073 PHE CE1
H B 0010 LEU CD2 3.633 H B 0073 PHE CE2
H B 0010 LEU CD2 3.123 H B 0073 PHE CZ
H B 0010 LEU CD2 3.409 H B 0077 VAL CG2
H B 0011 ILE C 2.421 H B 0012 ASP CA
H B 0011 ILE C 3.024 H B 0012 ASP C
H B 0011 ILE C 3.691 H B 0012 ASP CB
H B 0011 ILE CA 3.684 H B 0070 PHE CZ
H B 0011 ILE CG1 3.738 H B 0070 PHE CZ
H B 0011 ILE CG2 3.759 H B 0070 PHE CZ
H B 0012 ASP C 2.422 H B 0013 VAL CA
H B 0012 ASP C 3.098 H B 0013 VAL C
H B 0012 ASP C 3.680 H B 0013 VAL CB
H B 0012 ASP C 3.724 H B 0016 GLN CB
H B 0013 VAL C 2.417 H B 0014 PHE CA
H B 0013 VAL C 3.082 H B 0014 PHE C
H B 0013 VAL C 3.681 H B 0014 PHE CB
H B 0013 VAL CA 3.639 H B 0017 TYR CD1
H B 0013 VAL CG1 3.324 H B 0017 TYR CD1
H B 0013 VAL CG1 3.716 H B 0017 TYR CE1
H B 0013 VAL CG2 3.662 H B 0017 TYR CE1
H B 0013 VAL CG1 3.124 H B 0035 LEU CG
H B 0013 VAL CG1 2.868 H B 0035 LEU CD1
H B 0013 VAL CG1 2.822 H B 0035 LEU CD2
H B 0014 PHE C 2.424 H B 0015 HIS CA
H B 0014 PHE C 3.128 H B 0015 HIS C
H B 0014 PHE C 3.673 H B 0015 HIS CB
H B 0014 PHE CE1 3.643 C B 0069 ASP C
H B 0014 PHE CZ 3.578 C B 0069 ASP CA
H B 0014 PHE CZ 3.089 C B 0069 ASP C
H B 0014 PHE CB 3.594 H B 0070 PHE CE2
H B 0014 PHE CB 3.562 H B 0070 PHE CZ
H B 0014 PHE CG 3.757 H B 0070 PHE CD2
H B 0014 PHE CG 3.564 H B 0070 PHE CE2
H B 0014 PHE CD2 3.711 H B 0070 PHE CG
H B 0014 PHE CD2 2.926 H B 0070 PHE CD2
H B 0014 PHE CD2 2.992 H B 0070 PHE CE2
H B 0014 PHE CE2 3.778 H B 0070 PHE CA
H B 0014 PHE CE2 3.260 H B 0070 PHE CD2
H B 0014 PHE CZ 3.639 H B 0070 PHE CA
H B 0014 PHE CD1 3.425 H B 0073 PHE CB
H B 0014 PHE CD1 3.530 H B 0073 PHE CG
H B 0014 PHE CE1 3.464 H B 0073 PHE CB
H B 0015 HIS C 2.422 H B 0016 GLN CA
H B 0015 HIS C 3.164 H B 0016 GLN C
H B 0015 HIS C 3.661 H B 0016 GLN CB
H B 0016 GLN C 2.423 H B 0017 TYR CA
H B 0016 GLN C 2.991 H B 0017 TYR C
H B 0016 GLN C 3.694 H B 0017 TYR CB
H B 0017 TYR C 2.422 H B 0018 SER CA
H B 0017 TYR C 3.059 H B 0018 SER C
H B 0017 TYR C 3.686 H B 0018 SER CB
H B 0017 TYR CA 3.140 C B 0020 ARG CG
H B 0017 TYR CA 3.632 C B 0020 ARG CD
H B 0017 TYR C 3.102 C B 0020 ARG CG
H B 0017 TYR CB 3.559 C B 0027 LEU CD2
H B 0017 TYR CG 2.973 H B 0035 LEU CD1
H B 0017 TYR CD1 3.187 H B 0035 LEU CD1
H B 0017 TYR CD2 2.826 H B 0035 LEU CD1
H B 0017 TYR CE1 3.259 H B 0035 LEU CD1
H B 0017 TYR CE2 2.909 H B 0035 LEU CD1
H B 0017 TYR CZ 3.127 H B 0035 LEU CD1
H B 0017 TYR CE1 3.704 C B 0039 GLU CD
H B 0017 TYR CZ 3.715 C B 0039 GLU CG
H B 0017 TYR CZ 3.339 C B 0039 GLU CD
H B 0018 SER C 2.422 H B 0019 GLY CA
H B 0018 SER C 3.328 H B 0019 GLY C
H B 0018 SER C 3.679 C B 0024 LYS CA
H B 0018 SER CB 3.666 C B 0024 LYS C
H B 0018 SER CB 3.745 C B 0025 HIS CA
H B 0018 SER CB 3.723 C B 0025 HIS C
H B 0019 GLY C 2.422 C B 0020 ARG CA
H B 0019 GLY C 3.226 C B 0020 ARG C
H B 0019 GLY C 3.635 C B 0020 ARG CB
H B 0019 GLY C 3.771 C B 0020 ARG CG
C B 0020 ARG C 2.422 C B 0021 GLU CA
C B 0020 ARG C 3.429 C B 0021 GLU C
C B 0020 ARG C 3.503 C B 0021 GLU CB
C B 0021 GLU C 2.423 C B 0022 GLY CA
C B 0021 GLU C 2.883 C B 0022 GLY C
C B 0022 GLY C 2.423 C B 0023 ASP CA
C B 0022 GLY C 2.897 C B 0023 ASP C
C B 0022 GLY C 3.028 C B 0023 ASP CB
C B 0023 ASP C 2.422 C B 0024 LYS CA
C B 0023 ASP C 3.691 C B 0024 LYS C
C B 0023 ASP C 3.024 C B 0024 LYS CB
C B 0023 ASP C 3.174 C B 0024 LYS CG
C B 0024 LYS C 2.422 C B 0025 HIS CA
C B 0024 LYS C 3.688 C B 0025 HIS C
C B 0024 LYS C 3.053 C B 0025 HIS CB
C B 0025 HIS C 2.423 C B 0026 LYS CA
C B 0025 HIS C 3.490 C B 0026 LYS C
C B 0025 HIS C 3.445 C B 0026 LYS CB
C B 0025 HIS C 3.314 C B 0026 LYS CG
C B 0025 HIS CB 3.668 C B 0026 LYS CE
C B 0026 LYS C 2.423 C B 0027 LEU CA
C B 0026 LYS C 3.386 C B 0027 LEU C
C B 0026 LYS C 3.548 C B 0027 LEU CB
C B 0026 LYS C 3.730 C B 0027 LEU CD1
C B 0026 LYS CB 3.281 C B 0067 GLU CA
C B 0026 LYS CB 3.277 C B 0067 GLU C
C B 0026 LYS CB 3.219 C B 0067 GLU CB
C B 0026 LYS CG 3.601 C B 0067 GLU CB
C B 0026 LYS CB 3.717 C B 0068 CYS C
C B 0027 LEU C 2.415 C B 0028 LYS CA
C B 0027 LEU C 3.097 C B 0028 LYS C
C B 0027 LEU C 3.680 C B 0028 LYS CB
C B 0027 LEU CA 3.466 H B 0031 GLU CB
C B 0027 LEU CA 3.479 H B 0031 GLU CD
C B 0027 LEU CB 3.183 H B 0031 GLU CB
C B 0027 LEU CG 2.991 H B 0031 GLU CB
C B 0027 LEU CD2 3.629 H B 0031 GLU CA
C B 0027 LEU CD2 3.068 H B 0031 GLU C
C B 0027 LEU CD2 3.068 H B 0031 GLU CB
C B 0027 LEU CB 3.480 H B 0032 LEU CG
C B 0027 LEU CB 3.242 H B 0032 LEU CD2
C B 0028 LYS C 2.410 H B 0029 LYS CA
C B 0028 LYS C 2.833 H B 0029 LYS C
C B 0028 LYS C 3.674 H B 0029 LYS CB
C B 0028 LYS CA 3.767 C B 0066 GLY C
H B 0029 LYS C 2.427 H B 0030 SER CA
H B 0029 LYS C 3.182 H B 0030 SER C
H B 0029 LYS C 3.661 H B 0030 SER CB
H B 0029 LYS CB 3.476 H B 0057 MET CG
H B 0030 SER C 2.417 H B 0031 GLU CA
H B 0030 SER C 2.922 H B 0031 GLU C
H B 0030 SER C 3.694 H B 0031 GLU CB
H B 0031 GLU C 2.419 H B 0032 LEU CA
H B 0031 GLU C 2.999 H B 0032 LEU C
H B 0031 GLU C 3.688 H B 0032 LEU CB
H B 0032 LEU C 2.428 H B 0033 LYS CA
H B 0032 LEU C 2.831 H B 0033 LYS C
H B 0032 LEU C 3.679 H B 0033 LYS CB
H B 0032 LEU C 3.631 H B 0036 ILE CG1
H B 0032 LEU C 3.798 H B 0036 ILE CD1
H B 0032 LEU CD1 3.214 H B 0057 MET CE
H B 0032 LEU CD2 3.497 C B 0060 LEU CD2
H B 0032 LEU CD2 3.538 C B 0068 CYS CB
H B 0033 LYS C 2.420 H B 0034 GLU CA
H B 0033 LYS C 2.883 H B 0034 GLU C
H B 0033 LYS C 3.691 H B 0034 GLU CB
H B 0033 LYS CA 3.270 H B 0036 ILE CG1
H B 0033 LYS C 3.357 H B 0036 ILE CG1
H B 0033 LYS CB 3.761 H B 0053 VAL CG1
H B 0033 LYS CG 3.643 H B 0053 VAL CG1
H B 0033 LYS CD 3.671 H B 0053 VAL CB
H B 0033 LYS CD 2.823 H B 0053 VAL CG1
H B 0033 LYS CD 3.786 H B 0053 VAL CG2
H B 0034 GLU C 2.422 H B 0035 LEU CA
H B 0034 GLU C 2.833 H B 0035 LEU C
H B 0034 GLU C 3.675 H B 0035 LEU CB
H B 0035 LEU C 2.424 H B 0036 ILE CA
H B 0035 LEU C 2.941 H B 0036 ILE C
H B 0035 LEU C 3.703 H B 0036 ILE CB
H B 0035 LEU CA 3.389 C B 0039 GLU CG
H B 0035 LEU C 3.766 C B 0039 GLU CG
H B 0035 LEU CG 3.534 C B 0039 GLU CG
H B 0035 LEU CD1 3.419 C B 0039 GLU CG
H B 0035 LEU CD2 3.584 H B 0073 PHE CE1
H B 0036 ILE C 2.421 H B 0037 ASN CA
H B 0036 ILE C 3.256 H B 0037 ASN C
H B 0036 ILE C 3.622 H B 0037 ASN CB
H B 0036 ILE C 3.765 H B 0037 ASN CG
H B 0036 ILE C 3.779 C B 0040 LEU CA
H B 0036 ILE C 3.748 C B 0040 LEU C
H B 0036 ILE C 3.550 C B 0040 LEU CB
H B 0036 ILE CB 3.250 C B 0047 ILE CD1
H B 0036 ILE CG2 2.891 C B 0047 ILE CD1
H B 0036 ILE CB 3.681 H B 0053 VAL CG2
H B 0036 ILE CG1 3.310 H B 0053 VAL CG2
H B 0036 ILE CG2 3.503 H B 0053 VAL CG2
H B 0036 ILE CD1 2.825 H B 0076 PHE CE1
H B 0036 ILE CD1 2.819 H B 0076 PHE CZ
H B 0037 ASN C 2.428 H B 0038 ASN CA
H B 0037 ASN C 2.844 H B 0038 ASN C
H B 0037 ASN C 3.674 H B 0038 ASN CB
H B 0037 ASN CG 3.491 C B 0047 ILE CG1
H B 0037 ASN CG 3.545 C B 0047 ILE CD1
H B 0038 ASN C 2.419 C B 0039 GLU CA
H B 0038 ASN C 3.464 C B 0039 GLU C
H B 0038 ASN C 3.471 C B 0039 GLU CB
H B 0038 ASN C 3.387 C B 0039 GLU CG
H B 0038 ASN C 3.599 C B 0039 GLU CD
C B 0039 GLU C 2.421 C B 0040 LEU CA
C B 0039 GLU C 3.378 C B 0040 LEU C
C B 0039 GLU C 3.544 C B 0040 LEU CB
C B 0039 GLU C 3.523 C B 0040 LEU CD1
C B 0040 LEU C 2.423 C B 0041 SER CA
C B 0040 LEU C 3.375 C B 0041 SER C
C B 0040 LEU C 3.546 C B 0041 SER CB
C B 0040 LEU CA 3.796 C B 0044 LEU CD1
C B 0040 LEU C 3.729 C B 0044 LEU CD1
C B 0040 LEU CB 3.150 C B 0044 LEU CD1
C B 0040 LEU CB 3.798 C B 0044 LEU CD2
C B 0040 LEU CG 3.271 C B 0044 LEU CD1
C B 0040 LEU CD2 3.405 C B 0044 LEU CD1
C B 0040 LEU CD2 3.227 C B 0044 LEU CD2
C B 0040 LEU CD2 3.720 H B 0080 VAL CB
C B 0041 SER C 2.423 C B 0042 HIS CA
C B 0041 SER C 3.344 C B 0042 HIS C
C B 0041 SER C 3.571 C B 0042 HIS CB
C B 0042 HIS C 2.423 C B 0043 PHE CA
C B 0042 HIS C 3.186 C B 0043 PHE C
C B 0042 HIS C 3.652 C B 0043 PHE CB
C B 0043 PHE C 2.422 C B 0044 LEU CA
C B 0043 PHE C 3.360 C B 0044 LEU C
C B 0043 PHE C 3.558 C B 0044 LEU CB
C B 0043 PHE C 3.604 C B 0044 LEU CG
C B 0043 PHE C 3.744 C B 0044 LEU CD1
C B 0044 LEU C 2.422 C B 0045 GLU CA
C B 0044 LEU C 2.870 C B 0045 GLU C
C B 0044 LEU C 3.057 C B 0045 GLU CB
C B 0044 LEU CD2 3.660 H B 0080 VAL CB
C B 0044 LEU CD2 3.766 H B 0080 VAL CG1
C B 0045 GLU C 2.423 C B 0046 GLU CA
C B 0045 GLU C 3.190 C B 0046 GLU C
C B 0045 GLU C 3.650 C B 0046 GLU CB
C B 0046 GLU C 2.422 C B 0047 ILE CA
C B 0046 GLU C 2.937 C B 0047 ILE C
C B 0046 GLU C 2.983 C B 0047 ILE CB
C B 0046 GLU C 3.185 C B 0047 ILE CG1
C B 0047 ILE C 2.422 C B 0048 LYS CA
C B 0047 ILE C 3.400 C B 0048 LYS C
C B 0047 ILE C 3.527 C B 0048 LYS CB
C B 0047 ILE C 3.475 C B 0048 LYS CG
C B 0047 ILE C 3.538 C B 0048 LYS CD
C B 0047 ILE CG1 3.744 H B 0053 VAL CG2
C B 0047 ILE CG2 3.430 H B 0053 VAL CG2
C B 0047 ILE CD1 3.083 H B 0053 VAL CG2
C B 0048 LYS C 2.422 C B 0049 GLU CA
C B 0048 LYS C 3.082 C B 0049 GLU C
C B 0048 LYS C 2.849 C B 0049 GLU CB
C B 0048 LYS CB 3.671 C B 0051 GLU CB
C B 0049 GLU C 2.423 C B 0050 GLN CA
C B 0049 GLU C 3.068 C B 0050 GLN C
C B 0049 GLU C 2.864 C B 0050 GLN CB
C B 0049 GLU C 3.000 C B 0050 GLN CG
C B 0050 GLN C 2.422 C B 0051 GLU CA
C B 0050 GLN C 3.212 C B 0051 GLU C
C B 0050 GLN C 3.641 C B 0051 GLU CB
C B 0051 GLU C 2.421 H B 0052 VAL CA
C B 0051 GLU C 3.198 H B 0052 VAL C
C B 0051 GLU C 3.648 H B 0052 VAL CB
C B 0051 GLU C 3.744 H B 0052 VAL CG2
H B 0052 VAL C 2.423 H B 0053 VAL CA
H B 0052 VAL C 3.073 H B 0053 VAL C
H B 0052 VAL C 3.686 H B 0053 VAL CB
H B 0052 VAL C 3.674 H B 0056 VAL CG1
H B 0052 VAL C 3.583 H B 0056 VAL CG2
H B 0052 VAL CG1 3.772 H B 0056 VAL CG1
H B 0052 VAL CB 3.379 H B 0080 VAL CG1
H B 0052 VAL CG1 3.690 H B 0080 VAL CA
H B 0052 VAL CG1 2.948 H B 0080 VAL CG1
H B 0053 VAL C 2.423 H B 0054 ASP CA
H B 0053 VAL C 3.180 H B 0054 ASP C
H B 0053 VAL C 3.654 H B 0054 ASP CB
H B 0053 VAL CA 3.236 H B 0056 VAL CG2
H B 0053 VAL C 3.154 H B 0056 VAL CG2
H B 0054 ASP C 2.423 H B 0055 LYS CA
H B 0054 ASP C 2.980 H B 0055 LYS C
H B 0054 ASP C 3.696 H B 0055 LYS CB
H B 0055 LYS C 2.414 H B 0056 VAL CA
H B 0055 LYS C 2.946 H B 0056 VAL C
H B 0055 LYS C 3.682 H B 0056 VAL CB
H B 0056 VAL C 2.416 H B 0057 MET CA
H B 0056 VAL C 2.831 H B 0057 MET C
H B 0056 VAL C 3.678 H B 0057 MET CB
H B 0056 VAL CA 3.633 C B 0060 LEU CD1
H B 0056 VAL CB 3.285 C B 0060 LEU CD1
H B 0056 VAL CG1 3.797 C B 0060 LEU CD1
H B 0057 MET C 2.421 H B 0058 GLU CA
H B 0057 MET C 3.098 H B 0058 GLU C
H B 0057 MET C 3.676 H B 0058 GLU CB
H B 0057 MET C 3.759 C B 0061 ASP CG
H B 0057 MET CE 3.121 C B 0061 ASP CG
H B 0058 GLU C 2.425 H B 0059 THR CA
H B 0058 GLU C 3.175 H B 0059 THR C
H B 0058 GLU C 3.659 H B 0059 THR CB
H B 0059 THR C 2.429 C B 0060 LEU CA
H B 0059 THR C 2.833 C B 0060 LEU C
H B 0059 THR C 3.677 C B 0060 LEU CB
C B 0060 LEU C 2.421 C B 0061 ASP CA
C B 0060 LEU C 2.987 C B 0061 ASP C
C B 0060 LEU C 3.693 C B 0061 ASP CB
C B 0060 LEU CA 3.759 H B 0072 GLU CB
C B 0060 LEU CG 3.383 H B 0076 PHE CB
C B 0060 LEU CD1 3.417 H B 0076 PHE CB
C B 0060 LEU CD2 3.192 H B 0076 PHE CB
C B 0060 LEU CD2 3.311 H B 0076 PHE CG
C B 0060 LEU CD2 3.116 H B 0076 PHE CD1
C B 0061 ASP C 2.425 C B 0062 ASN CA
C B 0061 ASP C 2.835 C B 0062 ASN C
C B 0061 ASP C 3.677 C B 0062 ASN CB
C B 0062 ASN C 2.421 C B 0063 ASP CA
C B 0062 ASN C 3.691 C B 0063 ASP C
C B 0062 ASN C 3.030 C B 0063 ASP CB
C B 0062 ASN CG 3.575 C B 0069 ASP CG
C B 0063 ASP C 2.422 C B 0064 GLY CA
C B 0063 ASP C 3.219 C B 0064 GLY C
C B 0064 GLY C 2.422 C B 0065 ASP CA
C B 0064 GLY C 3.679 C B 0065 ASP C
C B 0064 GLY C 2.971 C B 0065 ASP CB
C B 0065 ASP C 2.419 C B 0066 GLY CA
C B 0065 ASP C 3.392 C B 0066 GLY C
C B 0066 GLY C 2.422 C B 0067 GLU CA
C B 0066 GLY C 3.596 C B 0067 GLU C
C B 0066 GLY C 3.302 C B 0067 GLU CB
C B 0066 GLY C 3.771 C B 0067 GLU CG
C B 0067 GLU C 2.423 C B 0068 CYS CA
C B 0067 GLU C 3.127 C B 0068 CYS C
C B 0067 GLU C 3.673 C B 0068 CYS CB
C B 0068 CYS C 2.424 C B 0069 ASP CA
C B 0068 CYS C 3.383 C B 0069 ASP C
C B 0068 CYS C 3.538 C B 0069 ASP CB
C B 0069 ASP C 2.421 H B 0070 PHE CA
C B 0069 ASP C 2.977 H B 0070 PHE C
C B 0069 ASP C 3.688 H B 0070 PHE CB
C B 0069 ASP CB 3.755 H B 0072 GLU CG
H B 0070 PHE C 2.415 H B 0071 GLN CA
H B 0070 PHE C 2.900 H B 0071 GLN C
H B 0070 PHE C 3.688 H B 0071 GLN CB
H B 0070 PHE CA 3.795 H B 0073 PHE CB
H B 0070 PHE C 3.775 H B 0073 PHE CB
H B 0070 PHE CE1 3.616 H B 0073 PHE CD2
H B 0071 GLN C 2.425 H B 0072 GLU CA
H B 0071 GLN C 3.128 H B 0072 GLU C
H B 0071 GLN C 3.674 H B 0072 GLU CB
H B 0072 GLU C 2.423 H B 0073 PHE CA
H B 0072 GLU C 3.015 H B 0073 PHE C
H B 0072 GLU C 3.692 H B 0073 PHE CB
H B 0073 PHE C 2.418 H B 0074 MET CA
H B 0073 PHE C 2.974 H B 0074 MET C
H B 0073 PHE C 3.694 H B 0074 MET CB
H B 0074 MET C 2.420 H B 0075 ALA CA
H B 0074 MET C 2.869 H B 0075 ALA C
H B 0074 MET C 3.692 H B 0075 ALA CB
H B 0075 ALA C 2.423 H B 0076 PHE CA
H B 0075 ALA C 2.922 H B 0076 PHE C
H B 0075 ALA C 3.697 H B 0076 PHE CB
H B 0075 ALA C 3.538 H B 0078 ALA CB
H B 0076 PHE C 2.417 H B 0077 VAL CA
H B 0076 PHE C 2.859 H B 0077 VAL C
H B 0076 PHE C 3.686 H B 0077 VAL CB
H B 0076 PHE CD2 3.449 H B 0077 VAL CA
H B 0076 PHE CD2 3.141 H B 0077 VAL CG2
H B 0076 PHE CE2 3.445 H B 0077 VAL CG2
H B 0076 PHE C 3.187 H B 0080 VAL CG2
H B 0076 PHE CG 3.667 H B 0080 VAL CG2
H B 0076 PHE CD1 3.257 H B 0080 VAL CG2
H B 0076 PHE CE1 3.575 H B 0080 VAL CG1
H B 0076 PHE CE1 3.083 H B 0080 VAL CG2
H B 0076 PHE CE2 3.754 H B 0080 VAL CG2
H B 0076 PHE CZ 3.355 H B 0080 VAL CG2
H B 0077 VAL C 2.422 H B 0078 ALA CA
H B 0077 VAL C 2.937 H B 0078 ALA C
H B 0077 VAL C 3.695 H B 0078 ALA CB
H B 0077 VAL CA 3.369 H B 0080 VAL CG2
H B 0077 VAL C 3.780 H B 0080 VAL CG2
H B 0077 VAL C 3.787 H B 0081 THR CB
H B 0078 ALA C 2.418 H B 0079 MET CA
H B 0078 ALA C 3.051 H B 0079 MET C
H B 0078 ALA C 3.685 H B 0079 MET CB
H B 0079 MET C 2.413 H B 0080 VAL CA
H B 0079 MET C 2.819 H B 0080 VAL C
H B 0079 MET C 3.685 H B 0080 VAL CB
H B 0079 MET CA 3.317 H B 0083 ALA CB
H B 0079 MET C 3.750 H B 0083 ALA CA
H B 0079 MET C 2.879 H B 0083 ALA CB
H B 0079 MET CB 3.480 H B 0083 ALA CB
H B 0080 VAL C 2.421 H B 0081 THR CA
H B 0080 VAL C 3.076 H B 0081 THR C
H B 0080 VAL C 3.686 H B 0081 THR CB
H B 0081 THR C 2.425 H B 0082 THR CA
H B 0081 THR C 3.102 H B 0082 THR C
H B 0081 THR C 3.685 H B 0082 THR CB
H B 0082 THR C 2.439 H B 0083 ALA CA
H B 0082 THR C 2.827 H B 0083 ALA C
H B 0082 THR C 3.664 H B 0083 ALA CB
H B 0082 THR CA 3.641 H B 0085 HIS CB
H B 0083 ALA C 2.423 H B 0084 CYS CA
H B 0083 ALA C 3.221 H B 0084 CYS C
H B 0083 ALA C 3.638 H B 0084 CYS CB
H B 0084 CYS C 2.423 H B 0085 HIS CA
H B 0084 CYS C 3.009 H B 0085 HIS C
H B 0084 CYS C 3.693 H B 0085 HIS CB
H B 0084 CYS C 3.629 H B 0087 PHE CB
H B 0085 HIS C 2.423 H B 0086 GLU CA
H B 0085 HIS C 2.838 H B 0086 GLU C
H B 0085 HIS C 3.679 H B 0086 GLU CB
H B 0086 GLU C 2.422 H B 0087 PHE CA
H B 0086 GLU C 2.843 H B 0087 PHE C
H B 0086 GLU C 3.681 H B 0087 PHE CB
H B 0087 PHE C 2.422 H B 0088 PHE CA
H B 0087 PHE C 2.837 H B 0088 PHE C
H B 0087 PHE C 3.679 H B 0088 PHE CB
H B 0088 PHE C 2.423 C B 0089 GLU CA
H B 0088 PHE C 2.839 C B 0089 GLU C
H B 0088 PHE C 3.679 C B 0089 GLU CB
C B 0089 GLU C 2.422 C B 0090 HIS CA
C B 0089 GLU C 3.260 C B 0090 HIS C
C B 0089 GLU C 3.618 C B 0090 HIS CB
C B 0090 HIS C 2.423 C B 0091 GLU CA
C B 0090 HIS C 2.864 C B 0091 GLU C
C B 0090 HIS C 3.067 C B 0091 GLU CB
CHARGE_ATTR 2.00 12.00 133
H B 0002 GLU OE1 8.072 H B 0005 LYS NZ
H B 0002 GLU OE2 7.468 H B 0005 LYS NZ
H B 0004 GLU OE1 4.464 H B 0005 LYS NZ
H B 0004 GLU OE2 6.300 H B 0005 LYS NZ
H B 0012 ASP OD1 7.053 H B 0015 HIS ND1
H B 0012 ASP OD1 8.633 H B 0015 HIS NE2
H B 0012 ASP OD2 8.946 H B 0015 HIS ND1
H B 0012 ASP OD2 10.59 H B 0015 HIS NE2
C B 0021 GLU OE1 9.976 C B 0020 ARG NH1
C B 0021 GLU OE1 8.300 C B 0020 ARG NH2
C B 0021 GLU OE2 9.083 C B 0020 ARG NH1
C B 0021 GLU OE2 7.369 C B 0020 ARG NH2
C B 0021 GLU OE1 5.307 C B 0028 LYS NZ
C B 0021 GLU OE2 7.372 C B 0028 LYS NZ
C B 0021 GLU OE1 11.94 H B 0029 LYS NZ
C B 0023 ASP OD1 8.362 C B 0024 LYS NZ
C B 0023 ASP OD2 10.03 C B 0024 LYS NZ
C B 0023 ASP OD1 9.708 C B 0025 HIS ND1
C B 0023 ASP OD1 10.38 C B 0025 HIS NE2
C B 0023 ASP OD2 10.11 C B 0025 HIS ND1
C B 0023 ASP OD2 11.16 C B 0025 HIS NE2
C B 0023 ASP OD1 5.255 C B 0026 LYS NZ
C B 0023 ASP OD2 5.666 C B 0026 LYS NZ
C B 0023 ASP OD1 4.870 C B 0028 LYS NZ
C B 0023 ASP OD2 3.170 C B 0028 LYS NZ
H B 0031 GLU OE1 10.50 H B 0015 HIS ND1
H B 0031 GLU OE1 11.12 H B 0015 HIS NE2
H B 0031 GLU OE2 11.91 H B 0015 HIS ND1
H B 0031 GLU OE1 8.388 C B 0020 ARG NH1
H B 0031 GLU OE1 7.889 C B 0020 ARG NH2
H B 0031 GLU OE2 9.956 C B 0020 ARG NH1
H B 0031 GLU OE2 9.220 C B 0020 ARG NH2
H B 0031 GLU OE1 10.25 C B 0025 HIS ND1
H B 0031 GLU OE1 11.47 C B 0025 HIS NE2
H B 0031 GLU OE2 10.60 C B 0025 HIS ND1
H B 0031 GLU OE2 12.00 C B 0025 HIS NE2
H B 0031 GLU OE1 9.833 C B 0026 LYS NZ
H B 0031 GLU OE2 8.991 C B 0026 LYS NZ
H B 0031 GLU OE1 6.340 C B 0028 LYS NZ
H B 0031 GLU OE2 4.621 C B 0028 LYS NZ
H B 0031 GLU OE2 11.50 H B 0029 LYS NZ
H B 0034 GLU OE1 9.067 C B 0020 ARG NH1
H B 0034 GLU OE1 9.959 C B 0020 ARG NH2
H B 0034 GLU OE2 7.556 C B 0020 ARG NH1
H B 0034 GLU OE2 8.348 C B 0020 ARG NH2
H B 0034 GLU OE1 11.82 H B 0029 LYS NZ
H B 0034 GLU OE1 7.544 H B 0033 LYS NZ
H B 0034 GLU OE2 9.094 H B 0033 LYS NZ
C B 0039 GLU OE1 10.34 C B 0020 ARG NH1
C B 0039 GLU OE2 9.701 C B 0020 ARG NH1
C B 0039 GLU OE2 11.76 C B 0020 ARG NH2
C B 0039 GLU OE2 11.75 C B 0042 HIS NE2
C B 0045 GLU OE2 11.75 C B 0042 HIS NE2
C B 0045 GLU OE1 5.973 C B 0048 LYS NZ
C B 0045 GLU OE2 8.074 C B 0048 LYS NZ
C B 0046 GLU OE1 9.643 H B 0033 LYS NZ
C B 0046 GLU OE2 11.53 H B 0033 LYS NZ
C B 0046 GLU OE1 11.80 C B 0042 HIS NE2
C B 0046 GLU OE2 10.68 C B 0042 HIS ND1
C B 0046 GLU OE2 9.908 C B 0042 HIS NE2
C B 0046 GLU OE1 11.72 C B 0048 LYS NZ
C B 0046 GLU OE2 11.29 C B 0048 LYS NZ
C B 0049 GLU OE1 9.612 H B 0033 LYS NZ
C B 0049 GLU OE2 7.902 H B 0033 LYS NZ
C B 0049 GLU OE1 10.11 C B 0048 LYS NZ
C B 0049 GLU OE2 11.23 C B 0048 LYS NZ
C B 0051 GLU OE1 11.36 H B 0033 LYS NZ
C B 0051 GLU OE1 4.798 C B 0048 LYS NZ
C B 0051 GLU OE2 5.229 C B 0048 LYS NZ
C B 0051 GLU OE1 7.791 H B 0055 LYS NZ
C B 0051 GLU OE2 6.901 H B 0055 LYS NZ
C B 0051 GLU OE2 11.37 H B 0085 HIS ND1
C B 0051 GLU OE1 10.76 C B 0090 HIS ND1
C B 0051 GLU OE1 11.05 C B 0090 HIS NE2
C B 0051 GLU OE2 10.19 C B 0090 HIS ND1
C B 0051 GLU OE2 10.58 C B 0090 HIS NE2
H B 0054 ASP OD1 9.226 H B 0029 LYS NZ
H B 0054 ASP OD2 8.313 H B 0029 LYS NZ
H B 0054 ASP OD1 8.694 H B 0033 LYS NZ
H B 0054 ASP OD2 6.791 H B 0033 LYS NZ
H B 0054 ASP OD1 8.566 H B 0055 LYS NZ
H B 0054 ASP OD2 9.940 H B 0055 LYS NZ
H B 0058 GLU OE1 11.79 H B 0029 LYS NZ
H B 0058 GLU OE2 9.965 H B 0029 LYS NZ
H B 0058 GLU OE2 11.80 H B 0033 LYS NZ
H B 0058 GLU OE1 7.296 H B 0055 LYS NZ
H B 0058 GLU OE2 9.001 H B 0055 LYS NZ
C B 0061 ASP OD1 11.46 C B 0026 LYS NZ
C B 0061 ASP OD1 10.98 C B 0028 LYS NZ
C B 0061 ASP OD1 8.485 H B 0029 LYS NZ
C B 0061 ASP OD2 7.912 H B 0029 LYS NZ
C B 0065 ASP OD1 8.839 C B 0026 LYS NZ
C B 0065 ASP OD2 7.415 C B 0026 LYS NZ
C B 0065 ASP OD1 8.279 C B 0028 LYS NZ
C B 0065 ASP OD2 9.020 C B 0028 LYS NZ
C B 0065 ASP OD1 9.750 H B 0029 LYS NZ
C B 0065 ASP OD2 11.76 H B 0029 LYS NZ
C B 0067 GLU OE1 9.350 C B 0025 HIS ND1
C B 0067 GLU OE1 11.02 C B 0025 HIS NE2
C B 0067 GLU OE2 10.07 C B 0025 HIS ND1
C B 0067 GLU OE2 11.84 C B 0025 HIS NE2
C B 0067 GLU OE1 4.424 C B 0026 LYS NZ
C B 0067 GLU OE2 5.843 C B 0026 LYS NZ
C B 0067 GLU OE1 8.306 C B 0028 LYS NZ
C B 0067 GLU OE2 10.32 C B 0028 LYS NZ
C B 0069 ASP OD1 11.43 H B 0015 HIS ND1
C B 0069 ASP OD1 11.35 H B 0015 HIS NE2
C B 0069 ASP OD2 10.98 H B 0015 HIS ND1
C B 0069 ASP OD2 10.83 H B 0015 HIS NE2
C B 0069 ASP OD1 6.787 C B 0025 HIS ND1
C B 0069 ASP OD1 8.866 C B 0025 HIS NE2
C B 0069 ASP OD2 6.454 C B 0025 HIS ND1
C B 0069 ASP OD2 8.312 C B 0025 HIS NE2
C B 0069 ASP OD1 6.848 C B 0026 LYS NZ
C B 0069 ASP OD2 7.875 C B 0026 LYS NZ
H B 0072 GLU OE2 11.70 C B 0025 HIS ND1
H B 0072 GLU OE2 11.80 C B 0026 LYS NZ
H B 0086 GLU OE1 4.223 H B 0085 HIS ND1
H B 0086 GLU OE1 4.930 H B 0085 HIS NE2
H B 0086 GLU OE2 6.301 H B 0085 HIS ND1
H B 0086 GLU OE2 6.626 H B 0085 HIS NE2
C B 0089 GLU OE1 7.975 H B 0085 HIS ND1
C B 0089 GLU OE1 8.757 H B 0085 HIS NE2
C B 0089 GLU OE2 9.612 H B 0085 HIS ND1
C B 0089 GLU OE2 10.51 H B 0085 HIS NE2
C B 0089 GLU OE1 10.61 C B 0090 HIS ND1
C B 0089 GLU OE1 11.51 C B 0090 HIS NE2
C B 0089 GLU OE2 9.723 C B 0090 HIS ND1
C B 0089 GLU OE2 10.40 C B 0090 HIS NE2
C B 0091 GLU OE1 6.546 C B 0090 HIS ND1
C B 0091 GLU OE1 5.236 C B 0090 HIS NE2
C B 0091 GLU OE2 8.522 C B 0090 HIS ND1
C B 0091 GLU OE2 7.245 C B 0090 HIS NE2
CHARGE_REPU 2.00 12.00 185
H B 0002 GLU OE1 10.36 H B 0004 GLU OE1
H B 0002 GLU OE1 11.57 H B 0004 GLU OE2
H B 0002 GLU OE2 9.610 H B 0004 GLU OE1
H B 0002 GLU OE2 10.57 H B 0004 GLU OE2
H B 0004 GLU OE2 11.29 H B 0012 ASP OD1
H B 0004 GLU OE2 11.84 H B 0012 ASP OD2
H B 0012 ASP OD1 9.687 C B 0039 GLU OE1
H B 0012 ASP OD1 11.33 C B 0039 GLU OE2
H B 0012 ASP OD2 8.559 C B 0039 GLU OE1
H B 0012 ASP OD2 9.991 C B 0039 GLU OE2
H B 0015 HIS ND1 9.240 C B 0024 LYS NZ
H B 0015 HIS NE2 7.305 C B 0024 LYS NZ
H B 0015 HIS ND1 5.959 C B 0025 HIS ND1
H B 0015 HIS ND1 5.646 C B 0025 HIS NE2
H B 0015 HIS NE2 5.010 C B 0025 HIS ND1
H B 0015 HIS NE2 3.975 C B 0025 HIS NE2
H B 0015 HIS ND1 11.29 C B 0026 LYS NZ
H B 0015 HIS NE2 10.29 C B 0026 LYS NZ
C B 0020 ARG NH2 10.92 C B 0028 LYS NZ
C B 0021 GLU OE1 9.312 C B 0023 ASP OD1
C B 0021 GLU OE1 8.229 C B 0023 ASP OD2
C B 0021 GLU OE2 11.09 C B 0023 ASP OD1
C B 0021 GLU OE2 10.18 C B 0023 ASP OD2
C B 0021 GLU OE1 8.106 H B 0031 GLU OE1
C B 0021 GLU OE1 7.270 H B 0031 GLU OE2
C B 0021 GLU OE2 9.190 H B 0031 GLU OE1
C B 0021 GLU OE2 8.761 H B 0031 GLU OE2
C B 0021 GLU OE1 10.85 H B 0034 GLU OE1
C B 0021 GLU OE1 9.706 H B 0034 GLU OE2
C B 0021 GLU OE2 10.82 H B 0034 GLU OE1
C B 0021 GLU OE2 9.324 H B 0034 GLU OE2
C B 0023 ASP OD1 8.340 H B 0031 GLU OE1
C B 0023 ASP OD1 7.274 H B 0031 GLU OE2
C B 0023 ASP OD2 7.145 H B 0031 GLU OE1
C B 0023 ASP OD2 5.677 H B 0031 GLU OE2
C B 0023 ASP OD2 11.01 C B 0061 ASP OD1
C B 0023 ASP OD1 9.032 C B 0065 ASP OD1
C B 0023 ASP OD1 8.638 C B 0065 ASP OD2
C B 0023 ASP OD2 7.589 C B 0065 ASP OD1
C B 0023 ASP OD2 7.555 C B 0065 ASP OD2
C B 0023 ASP OD1 6.970 C B 0067 GLU OE1
C B 0023 ASP OD1 9.087 C B 0067 GLU OE2
C B 0023 ASP OD2 6.123 C B 0067 GLU OE1
C B 0023 ASP OD2 8.272 C B 0067 GLU OE2
C B 0023 ASP OD1 11.36 C B 0069 ASP OD1
C B 0023 ASP OD2 10.73 C B 0069 ASP OD1
C B 0024 LYS NZ 7.080 C B 0025 HIS ND1
C B 0024 LYS NZ 5.704 C B 0025 HIS NE2
C B 0024 LYS NZ 7.819 C B 0026 LYS NZ
C B 0025 HIS ND1 6.019 C B 0026 LYS NZ
C B 0025 HIS NE2 7.166 C B 0026 LYS NZ
C B 0026 LYS NZ 8.676 C B 0028 LYS NZ
C B 0028 LYS NZ 11.07 H B 0029 LYS NZ
H B 0029 LYS NZ 9.255 H B 0033 LYS NZ
H B 0031 GLU OE1 9.139 H B 0034 GLU OE1
H B 0031 GLU OE1 9.085 H B 0034 GLU OE2
H B 0031 GLU OE2 9.476 H B 0034 GLU OE1
H B 0031 GLU OE2 9.541 H B 0034 GLU OE2
H B 0031 GLU OE1 11.58 C B 0039 GLU OE1
H B 0031 GLU OE1 11.27 C B 0061 ASP OD1
H B 0031 GLU OE2 9.744 C B 0061 ASP OD1
H B 0031 GLU OE2 11.56 C B 0061 ASP OD2
H B 0031 GLU OE2 10.14 C B 0065 ASP OD1
H B 0031 GLU OE2 10.64 C B 0065 ASP OD2
H B 0031 GLU OE1 10.55 C B 0067 GLU OE1
H B 0031 GLU OE2 9.008 C B 0067 GLU OE1
H B 0031 GLU OE2 10.69 C B 0067 GLU OE2
H B 0031 GLU OE1 11.62 C B 0069 ASP OD1
H B 0031 GLU OE2 11.01 C B 0069 ASP OD1
H B 0034 GLU OE1 10.65 C B 0039 GLU OE1
H B 0034 GLU OE1 9.624 C B 0039 GLU OE2
H B 0034 GLU OE2 11.19 C B 0039 GLU OE1
H B 0034 GLU OE2 10.03 C B 0039 GLU OE2
H B 0034 GLU OE1 8.665 C B 0046 GLU OE1
H B 0034 GLU OE1 10.50 C B 0046 GLU OE2
H B 0034 GLU OE2 9.468 C B 0046 GLU OE1
H B 0034 GLU OE2 11.29 C B 0046 GLU OE2
C B 0039 GLU OE2 10.74 C B 0046 GLU OE1
C B 0039 GLU OE2 10.84 C B 0046 GLU OE2
C B 0042 HIS ND1 10.73 H B 0085 HIS ND1
C B 0042 HIS ND1 10.29 H B 0085 HIS NE2
C B 0045 GLU OE1 7.477 C B 0046 GLU OE1
C B 0045 GLU OE1 6.614 C B 0046 GLU OE2
C B 0045 GLU OE2 6.159 C B 0046 GLU OE1
C B 0045 GLU OE2 5.207 C B 0046 GLU OE2
C B 0045 GLU OE1 10.30 C B 0049 GLU OE1
C B 0045 GLU OE1 10.94 C B 0049 GLU OE2
C B 0045 GLU OE2 10.91 C B 0049 GLU OE1
C B 0045 GLU OE2 11.26 C B 0049 GLU OE2
C B 0045 GLU OE1 9.670 C B 0051 GLU OE1
C B 0045 GLU OE1 10.64 C B 0051 GLU OE2
C B 0045 GLU OE2 11.46 C B 0051 GLU OE1
C B 0048 LYS NZ 10.73 H B 0085 HIS ND1
C B 0048 LYS NZ 9.323 C B 0090 HIS ND1
C B 0048 LYS NZ 10.48 C B 0090 HIS NE2
C B 0049 GLU OE1 8.838 C B 0051 GLU OE1
C B 0049 GLU OE1 10.99 C B 0051 GLU OE2
C B 0049 GLU OE2 9.734 C B 0051 GLU OE1
C B 0049 GLU OE2 11.82 C B 0051 GLU OE2
C B 0049 GLU OE1 10.99 H B 0054 ASP OD2
C B 0049 GLU OE2 11.58 H B 0054 ASP OD1
C B 0049 GLU OE2 9.858 H B 0054 ASP OD2
C B 0051 GLU OE1 10.86 H B 0054 ASP OD1
C B 0051 GLU OE1 10.65 H B 0054 ASP OD2
C B 0051 GLU OE2 11.44 H B 0054 ASP OD1
C B 0051 GLU OE2 11.57 H B 0054 ASP OD2
C B 0051 GLU OE2 11.82 H B 0086 GLU OE1
H B 0054 ASP OD1 4.644 H B 0058 GLU OE1
H B 0054 ASP OD1 3.756 H B 0058 GLU OE2
H B 0054 ASP OD2 6.712 H B 0058 GLU OE1
H B 0054 ASP OD2 5.706 H B 0058 GLU OE2
H B 0054 ASP OD1 10.54 C B 0061 ASP OD1
H B 0054 ASP OD1 8.915 C B 0061 ASP OD2
H B 0054 ASP OD2 11.09 C B 0061 ASP OD1
H B 0054 ASP OD2 9.689 C B 0061 ASP OD2
H B 0058 GLU OE1 9.562 C B 0061 ASP OD1
H B 0058 GLU OE1 7.834 C B 0061 ASP OD2
H B 0058 GLU OE2 8.792 C B 0061 ASP OD1
H B 0058 GLU OE2 6.857 C B 0061 ASP OD2
H B 0058 GLU OE1 11.13 H B 0072 GLU OE1
H B 0058 GLU OE2 11.83 H B 0072 GLU OE1
C B 0061 ASP OD1 9.181 C B 0063 ASP OD1
C B 0061 ASP OD1 9.744 C B 0063 ASP OD2
C B 0061 ASP OD2 8.932 C B 0063 ASP OD1
C B 0061 ASP OD2 9.750 C B 0063 ASP OD2
C B 0061 ASP OD1 7.032 C B 0065 ASP OD1
C B 0061 ASP OD1 7.663 C B 0065 ASP OD2
C B 0061 ASP OD2 7.906 C B 0065 ASP OD1
C B 0061 ASP OD2 8.773 C B 0065 ASP OD2
C B 0061 ASP OD1 7.918 C B 0067 GLU OE1
C B 0061 ASP OD1 7.545 C B 0067 GLU OE2
C B 0061 ASP OD2 9.618 C B 0067 GLU OE1
C B 0061 ASP OD2 9.039 C B 0067 GLU OE2
C B 0061 ASP OD1 8.804 C B 0069 ASP OD1
C B 0061 ASP OD1 10.81 C B 0069 ASP OD2
C B 0061 ASP OD2 10.60 C B 0069 ASP OD1
C B 0061 ASP OD1 7.547 H B 0072 GLU OE1
C B 0061 ASP OD1 7.554 H B 0072 GLU OE2
C B 0061 ASP OD2 8.293 H B 0072 GLU OE1
C B 0061 ASP OD2 8.544 H B 0072 GLU OE2
C B 0063 ASP OD1 9.745 C B 0065 ASP OD1
C B 0063 ASP OD1 8.947 C B 0065 ASP OD2
C B 0063 ASP OD2 10.97 C B 0065 ASP OD1
C B 0063 ASP OD2 9.921 C B 0065 ASP OD2
C B 0063 ASP OD1 10.14 C B 0067 GLU OE1
C B 0063 ASP OD1 8.133 C B 0067 GLU OE2
C B 0063 ASP OD2 10.46 C B 0067 GLU OE1
C B 0063 ASP OD2 8.351 C B 0067 GLU OE2
C B 0063 ASP OD1 10.42 C B 0069 ASP OD1
C B 0063 ASP OD1 11.51 C B 0069 ASP OD2
C B 0063 ASP OD2 9.469 C B 0069 ASP OD1
C B 0063 ASP OD2 10.24 C B 0069 ASP OD2
C B 0063 ASP OD1 9.834 H B 0072 GLU OE1
C B 0063 ASP OD1 8.604 H B 0072 GLU OE2
C B 0063 ASP OD2 8.739 H B 0072 GLU OE1
C B 0063 ASP OD2 7.358 H B 0072 GLU OE2
C B 0065 ASP OD1 4.797 C B 0067 GLU OE1
C B 0065 ASP OD1 5.251 C B 0067 GLU OE2
C B 0065 ASP OD2 3.270 C B 0067 GLU OE1
C B 0065 ASP OD2 3.434 C B 0067 GLU OE2
C B 0065 ASP OD1 10.33 C B 0069 ASP OD1
C B 0065 ASP OD2 8.958 C B 0069 ASP OD1
C B 0065 ASP OD2 10.82 C B 0069 ASP OD2
C B 0065 ASP OD1 11.93 H B 0072 GLU OE2
C B 0065 ASP OD2 11.09 H B 0072 GLU OE2
C B 0067 GLU OE1 6.408 C B 0069 ASP OD1
C B 0067 GLU OE1 8.212 C B 0069 ASP OD2
C B 0067 GLU OE2 5.719 C B 0069 ASP OD1
C B 0067 GLU OE2 7.458 C B 0069 ASP OD2
C B 0067 GLU OE1 11.31 H B 0072 GLU OE1
C B 0067 GLU OE1 9.811 H B 0072 GLU OE2
C B 0067 GLU OE2 10.15 H B 0072 GLU OE1
C B 0067 GLU OE2 8.477 H B 0072 GLU OE2
C B 0069 ASP OD1 7.044 H B 0072 GLU OE1
C B 0069 ASP OD1 5.339 H B 0072 GLU OE2
C B 0069 ASP OD2 7.729 H B 0072 GLU OE1
C B 0069 ASP OD2 6.014 H B 0072 GLU OE2
H B 0085 HIS ND1 11.95 C B 0090 HIS ND1
H B 0086 GLU OE1 5.456 C B 0089 GLU OE1
H B 0086 GLU OE1 7.512 C B 0089 GLU OE2
H B 0086 GLU OE2 5.462 C B 0089 GLU OE1
H B 0086 GLU OE2 7.579 C B 0089 GLU OE2
C B 0089 GLU OE1 11.52 C B 0091 GLU OE1
C B 0089 GLU OE2 9.681 C B 0091 GLU OE1
C B 0089 GLU OE2 10.87 C B 0091 GLU OE2
HB_MM 2.00 3.20 169
H B 0002 GLU N 2.196 C B 0001 SER O
H B 0003 LEU N 2.197 H B 0002 GLU O
H B 0004 GLU N 2.197 H B 0003 LEU O
H B 0005 LYS N 3.015 C B 0001 SER O
H B 0005 LYS N 2.195 H B 0004 GLU O
H B 0006 ALA N 2.197 H B 0005 LYS O
H B 0007 MET N 2.712 H B 0003 LEU O
H B 0007 MET N 2.787 H B 0004 GLU O
H B 0007 MET N 3.097 H B 0005 LYS O
H B 0007 MET N 2.197 H B 0006 ALA O
H B 0008 VAL N 3.137 H B 0004 GLU O
H B 0008 VAL N 3.187 H B 0005 LYS O
H B 0008 VAL N 2.196 H B 0007 MET O
H B 0009 ALA N 2.197 H B 0008 VAL O
H B 0010 LEU N 3.062 H B 0006 ALA O
H B 0010 LEU N 2.196 H B 0009 ALA O
H B 0011 ILE N 3.060 H B 0007 MET O
H B 0011 ILE N 3.112 H B 0009 ALA O
H B 0011 ILE N 2.196 H B 0010 LEU O
H B 0012 ASP N 2.916 H B 0008 VAL O
H B 0012 ASP N 2.737 H B 0009 ALA O
H B 0012 ASP N 3.069 H B 0010 LEU O
H B 0012 ASP N 2.196 H B 0011 ILE O
H B 0013 VAL N 3.055 H B 0009 ALA O
H B 0013 VAL N 2.806 H B 0010 LEU O
H B 0013 VAL N 2.196 H B 0012 ASP O
H B 0014 PHE N 3.117 H B 0010 LEU O
H B 0014 PHE N 3.149 H B 0011 ILE O
H B 0014 PHE N 2.194 H B 0013 VAL O
H B 0015 HIS N 2.197 H B 0014 PHE O
H B 0016 GLN N 2.828 H B 0012 ASP O
H B 0016 GLN N 2.195 H B 0015 HIS O
H B 0017 TYR N 2.935 H B 0013 VAL O
H B 0017 TYR N 2.196 H B 0016 GLN O
H B 0018 SER N 3.074 H B 0014 PHE O
H B 0018 SER N 3.144 H B 0016 GLN O
H B 0018 SER N 2.196 H B 0017 TYR O
H B 0019 GLY N 2.951 H B 0016 GLN O
H B 0019 GLY N 2.196 H B 0018 SER O
C B 0020 ARG N 2.196 H B 0019 GLY O
C B 0021 GLU N 2.196 C B 0020 ARG O
C B 0022 GLY N 2.197 C B 0021 GLU O
C B 0023 ASP N 2.196 C B 0022 GLY O
C B 0024 LYS N 2.196 C B 0023 ASP O
C B 0025 HIS N 2.196 C B 0024 LYS O
C B 0026 LYS N 2.197 C B 0025 HIS O
C B 0027 LEU N 2.197 C B 0026 LYS O
C B 0028 LYS N 2.195 C B 0027 LEU O
H B 0029 LYS N 2.186 C B 0028 LYS O
H B 0030 SER N 2.545 C B 0028 LYS O
H B 0030 SER N 2.199 H B 0029 LYS O
H B 0031 GLU N 2.847 C B 0028 LYS O
H B 0031 GLU N 2.194 H B 0030 SER O
H B 0032 LEU N 3.030 C B 0028 LYS O
H B 0032 LEU N 3.103 H B 0030 SER O
H B 0032 LEU N 2.194 H B 0031 GLU O
H B 0033 LYS N 2.201 H B 0032 LEU O
H B 0034 GLU N 3.144 H B 0030 SER O
H B 0034 GLU N 2.918 H B 0032 LEU O
H B 0034 GLU N 2.197 H B 0033 LYS O
H B 0035 LEU N 2.853 H B 0032 LEU O
H B 0035 LEU N 2.196 H B 0034 GLU O
H B 0036 ILE N 3.022 H B 0032 LEU O
H B 0036 ILE N 2.835 H B 0033 LYS O
H B 0036 ILE N 2.731 H B 0034 GLU O
H B 0036 ILE N 2.196 H B 0035 LEU O
H B 0037 ASN N 2.679 H B 0034 GLU O
H B 0037 ASN N 2.195 H B 0036 ILE O
H B 0038 ASN N 2.636 H B 0034 GLU O
H B 0038 ASN N 2.198 H B 0037 ASN O
C B 0039 GLU N 3.034 H B 0035 LEU O
C B 0039 GLU N 2.494 H B 0037 ASN O
C B 0039 GLU N 2.194 H B 0038 ASN O
C B 0040 LEU N 2.912 H B 0035 LEU O
C B 0040 LEU N 2.730 H B 0036 ILE O
C B 0040 LEU N 3.115 H B 0037 ASN O
C B 0040 LEU N 2.194 C B 0039 GLU O
C B 0041 SER N 3.144 H B 0037 ASN O
C B 0041 SER N 2.197 C B 0040 LEU O
C B 0042 HIS N 2.196 C B 0041 SER O
C B 0043 PHE N 2.197 C B 0042 HIS O
C B 0044 LEU N 2.197 C B 0043 PHE O
C B 0045 GLU N 2.196 C B 0044 LEU O
C B 0046 GLU N 2.197 C B 0045 GLU O
C B 0047 ILE N 3.138 C B 0044 LEU O
C B 0047 ILE N 2.934 C B 0045 GLU O
C B 0047 ILE N 2.197 C B 0046 GLU O
C B 0048 LYS N 2.196 C B 0047 ILE O
C B 0049 GLU N 2.196 C B 0048 LYS O
C B 0050 GLN N 2.198 C B 0049 GLU O
C B 0051 GLU N 2.197 C B 0050 GLN O
H B 0052 VAL N 2.196 C B 0051 GLU O
H B 0053 VAL N 2.195 H B 0052 VAL O
H B 0054 ASP N 2.197 H B 0053 VAL O
H B 0055 LYS N 2.196 H B 0054 ASP O
H B 0056 VAL N 3.004 H B 0052 VAL O
H B 0056 VAL N 2.195 H B 0055 LYS O
H B 0057 MET N 2.189 H B 0056 VAL O
H B 0058 GLU N 2.927 H B 0055 LYS O
H B 0058 GLU N 2.536 H B 0056 VAL O
H B 0058 GLU N 2.196 H B 0057 MET O
H B 0059 THR N 2.599 H B 0056 VAL O
H B 0059 THR N 2.198 H B 0058 GLU O
C B 0060 LEU N 2.643 H B 0056 VAL O
C B 0060 LEU N 2.200 H B 0059 THR O
C B 0061 ASP N 2.509 H B 0059 THR O
C B 0061 ASP N 2.196 C B 0060 LEU O
C B 0062 ASN N 2.998 C B 0060 LEU O
C B 0062 ASN N 2.198 C B 0061 ASP O
C B 0062 ASN N 3.142 C B 0067 GLU O
C B 0063 ASP N 2.829 C B 0061 ASP O
C B 0063 ASP N 2.197 C B 0062 ASN O
C B 0064 GLY N 2.196 C B 0063 ASP O
C B 0065 ASP N 2.196 C B 0064 GLY O
C B 0066 GLY N 2.198 C B 0065 ASP O
C B 0067 GLU N 2.196 C B 0066 GLY O
C B 0068 CYS N 3.142 C B 0027 LEU O
C B 0068 CYS N 2.196 C B 0067 GLU O
C B 0069 ASP N 2.196 C B 0068 CYS O
H B 0070 PHE N 2.191 C B 0069 ASP O
H B 0071 GLN N 2.193 H B 0070 PHE O
H B 0072 GLU N 3.145 C B 0069 ASP O
H B 0072 GLU N 3.088 H B 0070 PHE O
H B 0072 GLU N 2.200 H B 0071 GLN O
H B 0073 PHE N 2.709 C B 0069 ASP O
H B 0073 PHE N 2.752 H B 0070 PHE O
H B 0073 PHE N 2.196 H B 0072 GLU O
H B 0074 MET N 2.196 H B 0073 PHE O
H B 0075 ALA N 2.197 H B 0074 MET O
H B 0076 PHE N 2.862 H B 0072 GLU O
H B 0076 PHE N 3.079 H B 0073 PHE O
H B 0076 PHE N 2.913 H B 0074 MET O
H B 0076 PHE N 2.200 H B 0075 ALA O
H B 0077 VAL N 2.999 H B 0074 MET O
H B 0077 VAL N 2.201 H B 0076 PHE O
H B 0078 ALA N 2.955 H B 0074 MET O
H B 0078 ALA N 2.920 H B 0075 ALA O
H B 0078 ALA N 2.719 H B 0076 PHE O
H B 0078 ALA N 2.197 H B 0077 VAL O
H B 0079 MET N 2.834 H B 0076 PHE O
H B 0079 MET N 2.196 H B 0078 ALA O
H B 0080 VAL N 3.079 H B 0076 PHE O
H B 0080 VAL N 2.175 H B 0079 MET O
H B 0081 THR N 2.808 H B 0077 VAL O
H B 0081 THR N 2.431 H B 0079 MET O
H B 0081 THR N 2.196 H B 0080 VAL O
H B 0082 THR N 3.142 H B 0078 ALA O
H B 0082 THR N 2.931 H B 0079 MET O
H B 0082 THR N 2.198 H B 0081 THR O
H B 0083 ALA N 2.399 H B 0079 MET O
H B 0083 ALA N 2.202 H B 0082 THR O
H B 0084 CYS N 2.717 H B 0082 THR O
H B 0084 CYS N 2.197 H B 0083 ALA O
H B 0085 HIS N 2.961 H B 0081 THR O
H B 0085 HIS N 2.558 H B 0082 THR O
H B 0085 HIS N 2.196 H B 0084 CYS O
H B 0086 GLU N 2.828 H B 0082 THR O
H B 0086 GLU N 2.197 H B 0085 HIS O
H B 0087 PHE N 2.571 H B 0085 HIS O
H B 0087 PHE N 2.196 H B 0086 GLU O
H B 0088 PHE N 2.855 H B 0085 HIS O
H B 0088 PHE N 3.050 H B 0086 GLU O
H B 0088 PHE N 2.196 H B 0087 PHE O
C B 0089 GLU N 2.704 H B 0086 GLU O
C B 0089 GLU N 2.883 H B 0087 PHE O
C B 0089 GLU N 2.197 H B 0088 PHE O
C B 0090 HIS N 2.447 H B 0088 PHE O
C B 0090 HIS N 2.196 C B 0089 GLU O
C B 0091 GLU N 2.196 C B 0090 HIS O
HB_MS 2.00 3.20 6
H B 0014 PHE O 2.334 H B 0018 SER OG
H B 0015 HIS O 3.025 H B 0018 SER OG
H B 0019 GLY N 3.154 H B 0018 SER OG
C B 0028 LYS N 2.984 H B 0031 GLU OE2
C B 0047 ILE N 3.046 H B 0037 ASN OD1
H B 0077 VAL O 2.326 H B 0081 THR OG1
HB_SS 2.00 3.20 7
H B 0033 LYS NZ 2.835 C B 0050 GLN OE1
C B 0039 GLU OE1 3.163 H B 0017 TYR OH
C B 0039 GLU OE2 2.336 H B 0017 TYR OH
C B 0046 GLU OE2 3.073 C B 0041 SER OG
H B 0054 ASP OD2 3.167 C B 0050 GLN NE2
C B 0069 ASP OD1 2.517 C B 0062 ASN ND2
H B 0086 GLU OE2 3.180 H B 0082 THR OG1
AROMATIC 0.00 8.00 4
H B 0070 PHE 5.642 H B 0073 PHE
C B 0024 LYS 5.881 C B 0025 HIS
C B 0043 PHE 5.473 H B 0085 HIS
C B 0048 LYS 5.156 H B 0087 PHE