Complet list of 1mwn con file
Complete list of 1mwn.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 356
H A 0001 SER C 2.423 H A 0002 GLU CA
H A 0001 SER C 2.974 H A 0002 GLU C
H A 0001 SER C 3.695 H A 0002 GLU CB
H A 0002 GLU C 2.420 H A 0003 LEU CA
H A 0002 GLU C 2.838 H A 0003 LEU C
H A 0002 GLU C 3.695 H A 0003 LEU CB
H A 0003 LEU C 2.419 H A 0004 GLU CA
H A 0003 LEU C 3.030 H A 0004 GLU C
H A 0003 LEU C 3.680 H A 0004 GLU CB
H A 0004 GLU C 2.422 H A 0005 LYS CA
H A 0004 GLU C 3.046 H A 0005 LYS C
H A 0004 GLU C 3.707 H A 0005 LYS CB
H A 0005 LYS C 2.414 H A 0006 ALA CA
H A 0005 LYS C 3.009 H A 0006 ALA C
H A 0005 LYS C 3.685 H A 0006 ALA CB
H A 0006 ALA C 2.417 H A 0007 MET CA
H A 0006 ALA C 2.949 H A 0007 MET C
H A 0006 ALA C 3.709 H A 0007 MET CB
H A 0007 MET C 2.417 H A 0008 VAL CA
H A 0007 MET C 2.918 H A 0008 VAL C
H A 0007 MET C 3.692 H A 0008 VAL CB
H A 0008 VAL CA 3.793 H A 0009 ALA CA
H A 0008 VAL C 2.413 H A 0009 ALA CA
H A 0008 VAL C 2.972 H A 0009 ALA C
H A 0008 VAL C 3.694 H A 0009 ALA CB
H A 0009 ALA C 2.422 H A 0010 LEU CA
H A 0009 ALA C 2.972 H A 0010 LEU C
H A 0009 ALA C 3.713 H A 0010 LEU CB
H A 0010 LEU C 2.420 H A 0011 ILE CA
H A 0010 LEU C 2.966 H A 0011 ILE C
H A 0010 LEU C 3.697 H A 0011 ILE CB
H A 0011 ILE C 2.419 H A 0012 ASP CA
H A 0011 ILE C 3.035 H A 0012 ASP C
H A 0011 ILE C 3.690 H A 0012 ASP CB
H A 0012 ASP C 2.425 H A 0013 VAL CA
H A 0012 ASP C 2.919 H A 0013 VAL C
H A 0012 ASP C 3.714 H A 0013 VAL CB
H A 0013 VAL C 2.411 H A 0014 PHE CA
H A 0013 VAL C 2.941 H A 0014 PHE C
H A 0013 VAL C 3.670 H A 0014 PHE CB
H A 0014 PHE C 2.428 H A 0015 HIS CA
H A 0014 PHE C 3.179 H A 0015 HIS C
H A 0014 PHE C 3.667 H A 0015 HIS CB
H A 0014 PHE CD2 3.224 H A 0015 HIS CD2
H A 0014 PHE CE2 3.563 H A 0015 HIS CD2
H A 0014 PHE CE1 3.774 H A 0070 PHE CA
H A 0014 PHE CE1 3.388 H A 0070 PHE CB
H A 0014 PHE CZ 3.613 H A 0070 PHE CB
H A 0015 HIS C 2.419 H A 0016 GLN CA
H A 0015 HIS C 3.007 H A 0016 GLN C
H A 0015 HIS C 3.689 H A 0016 GLN CB
H A 0015 HIS CD2 3.586 C A 0024 LYS CE
H A 0016 GLN C 2.443 H A 0017 TYR CA
H A 0016 GLN C 3.440 H A 0017 TYR C
H A 0016 GLN C 3.548 H A 0017 TYR CB
H A 0017 TYR C 2.423 H A 0018 SER CA
H A 0017 TYR C 3.007 H A 0018 SER C
H A 0017 TYR C 3.688 H A 0018 SER CB
H A 0017 TYR CD1 3.692 H A 0018 SER CA
H A 0017 TYR CE1 3.621 E A 0027 LEU CD1
H A 0017 TYR CE1 3.404 E A 0027 LEU CD2
H A 0017 TYR CZ 3.730 E A 0027 LEU CD1
H A 0017 TYR CG 3.782 H A 0035 LEU CD2
H A 0017 TYR CD1 3.640 H A 0035 LEU CB
H A 0017 TYR CD2 3.355 H A 0035 LEU CD2
H A 0017 TYR CE1 3.698 H A 0035 LEU CB
H A 0017 TYR CE2 3.783 H A 0035 LEU CG
H A 0017 TYR CE2 3.436 H A 0035 LEU CD2
H A 0017 TYR CZ 3.703 H A 0035 LEU CG
H A 0017 TYR CE2 3.673 H A 0073 PHE CE2
H A 0017 TYR CE2 3.429 H A 0073 PHE CZ
H A 0017 TYR CZ 3.767 H A 0073 PHE CE1
H A 0017 TYR CZ 3.664 H A 0073 PHE CE2
H A 0017 TYR CZ 3.611 H A 0073 PHE CZ
H A 0018 SER C 2.423 H A 0019 GLY CA
H A 0018 SER C 3.230 H A 0019 GLY C
H A 0018 SER CA 3.467 E A 0027 LEU CD2
H A 0018 SER CB 3.385 E A 0027 LEU CD2
H A 0019 GLY C 2.403 C A 0020 ARG CA
H A 0019 GLY C 3.019 C A 0020 ARG C
H A 0019 GLY C 3.667 C A 0020 ARG CB
H A 0019 GLY CA 3.662 C A 0024 LYS CG
C A 0020 ARG C 2.420 C A 0021 GLU CA
C A 0020 ARG C 3.678 C A 0021 GLU C
C A 0020 ARG C 3.095 C A 0021 GLU CB
C A 0020 ARG CD 3.297 H A 0034 GLU CD
C A 0021 GLU C 2.427 C A 0022 GLY CA
C A 0021 GLU C 3.146 C A 0022 GLY C
C A 0022 GLY C 2.427 C A 0023 ASP CA
C A 0022 GLY C 3.166 C A 0023 ASP C
C A 0022 GLY C 3.668 C A 0023 ASP CB
C A 0023 ASP C 2.430 C A 0024 LYS CA
C A 0023 ASP C 3.046 C A 0024 LYS C
C A 0023 ASP C 3.685 C A 0024 LYS CB
C A 0023 ASP CB 3.685 C A 0026 LYS CG
C A 0023 ASP CG 3.616 C A 0026 LYS CG
C A 0024 LYS C 2.428 C A 0025 HIS CA
C A 0024 LYS C 3.105 C A 0025 HIS C
C A 0024 LYS C 3.683 C A 0025 HIS CB
C A 0025 HIS C 2.446 C A 0026 LYS CA
C A 0025 HIS C 3.551 C A 0026 LYS C
C A 0025 HIS C 3.412 C A 0026 LYS CB
C A 0026 LYS C 2.440 E A 0027 LEU CA
C A 0026 LYS C 3.379 E A 0027 LEU C
C A 0026 LYS C 3.584 E A 0027 LEU CB
C A 0026 LYS C 3.735 E A 0027 LEU CG
C A 0026 LYS CD 3.683 E A 0067 GLU CD
E A 0027 LEU C 2.430 E A 0028 LYS CA
E A 0027 LEU C 3.298 E A 0028 LYS C
E A 0027 LEU C 3.608 E A 0028 LYS CB
E A 0027 LEU CD1 3.479 H A 0073 PHE CB
E A 0028 LYS C 2.432 H A 0029 LYS CA
E A 0028 LYS C 2.866 H A 0029 LYS C
E A 0028 LYS C 3.667 H A 0029 LYS CB
E A 0028 LYS CG 3.770 H A 0029 LYS CG
H A 0029 LYS C 2.418 H A 0030 SER CA
H A 0029 LYS C 2.994 H A 0030 SER C
H A 0029 LYS C 3.696 H A 0030 SER CB
H A 0029 LYS CA 3.514 H A 0057 MET CE
H A 0029 LYS CB 3.615 H A 0057 MET CE
H A 0030 SER C 2.424 H A 0031 GLU CA
H A 0030 SER C 3.034 H A 0031 GLU C
H A 0030 SER C 3.698 H A 0031 GLU CB
H A 0031 GLU C 2.418 H A 0032 LEU CA
H A 0031 GLU C 2.982 H A 0032 LEU C
H A 0031 GLU C 3.710 H A 0032 LEU CB
H A 0032 LEU C 2.402 H A 0033 LYS CA
H A 0032 LEU C 2.859 H A 0033 LYS C
H A 0032 LEU C 3.680 H A 0033 LYS CB
H A 0032 LEU CD2 3.669 H A 0036 ILE CD1
H A 0032 LEU CD2 3.706 H A 0060 LEU CD1
H A 0033 LYS CA 3.789 H A 0034 GLU CA
H A 0033 LYS C 2.400 H A 0034 GLU CA
H A 0033 LYS C 2.971 H A 0034 GLU C
H A 0033 LYS C 3.678 H A 0034 GLU CB
H A 0033 LYS CB 3.743 H A 0053 VAL CG2
H A 0033 LYS CG 3.649 H A 0053 VAL CG2
H A 0034 GLU C 2.425 H A 0035 LEU CA
H A 0034 GLU C 2.962 H A 0035 LEU C
H A 0034 GLU C 3.682 H A 0035 LEU CB
H A 0034 GLU C 3.772 H A 0038 ASN CB
H A 0035 LEU C 2.415 H A 0036 ILE CA
H A 0035 LEU C 3.020 H A 0036 ILE C
H A 0035 LEU C 3.687 H A 0036 ILE CB
H A 0035 LEU CD1 3.666 H A 0036 ILE CA
H A 0035 LEU CD2 3.394 H A 0039 GLU CD
H A 0036 ILE C 2.427 H A 0037 ASN CA
H A 0036 ILE C 3.187 H A 0037 ASN C
H A 0036 ILE C 3.664 H A 0037 ASN CB
H A 0036 ILE CG2 3.636 C A 0047 ILE CG1
H A 0036 ILE CG2 3.320 C A 0047 ILE CD1
H A 0036 ILE CD1 3.726 H A 0056 VAL CG1
H A 0037 ASN C 2.431 H A 0038 ASN CA
H A 0037 ASN C 3.257 H A 0038 ASN C
H A 0037 ASN C 3.649 H A 0038 ASN CB
H A 0038 ASN C 2.440 H A 0039 GLU CA
H A 0038 ASN C 3.332 H A 0039 GLU C
H A 0038 ASN C 3.610 H A 0039 GLU CB
H A 0038 ASN C 3.494 H A 0039 GLU CD
H A 0039 GLU C 2.446 H A 0040 LEU CA
H A 0039 GLU C 3.492 H A 0040 LEU C
H A 0039 GLU C 3.483 H A 0040 LEU CB
H A 0039 GLU C 3.405 H A 0040 LEU CG
H A 0039 GLU C 3.517 H A 0040 LEU CD2
H A 0040 LEU C 2.430 C A 0041 SER CA
H A 0040 LEU C 2.872 C A 0041 SER C
H A 0040 LEU C 3.672 C A 0041 SER CB
C A 0041 SER C 2.449 C A 0042 HIS CA
C A 0041 SER C 3.516 C A 0042 HIS C
C A 0041 SER C 3.471 C A 0042 HIS CB
C A 0041 SER C 3.436 C A 0042 HIS CG
C A 0042 HIS C 2.418 C A 0043 PHE CA
C A 0042 HIS C 3.044 C A 0043 PHE C
C A 0042 HIS C 3.691 C A 0043 PHE CB
C A 0042 HIS CD2 3.491 C A 0046 GLU CD
C A 0043 PHE C 2.425 C A 0044 LEU CA
C A 0043 PHE C 3.673 C A 0044 LEU C
C A 0043 PHE C 3.188 C A 0044 LEU CB
C A 0043 PHE C 3.451 C A 0044 LEU CG
C A 0044 LEU C 2.448 C A 0045 GLU CA
C A 0044 LEU C 3.495 C A 0045 GLU C
C A 0044 LEU C 3.473 C A 0045 GLU CB
C A 0044 LEU C 3.611 C A 0045 GLU CG
C A 0044 LEU CD1 3.776 C A 0045 GLU CB
C A 0044 LEU CD1 3.453 C A 0045 GLU CG
C A 0044 LEU CD1 3.649 C A 0045 GLU CD
C A 0044 LEU CD1 3.626 H A 0080 VAL CG1
C A 0045 GLU C 2.441 C A 0046 GLU CA
C A 0045 GLU C 3.354 C A 0046 GLU C
C A 0045 GLU C 3.572 C A 0046 GLU CB
C A 0046 GLU C 2.437 C A 0047 ILE CA
C A 0046 GLU C 3.359 C A 0047 ILE C
C A 0046 GLU C 3.589 C A 0047 ILE CB
C A 0046 GLU C 3.584 C A 0047 ILE CG1
C A 0046 GLU C 3.385 C A 0047 ILE CD1
C A 0047 ILE C 2.429 C A 0048 LYS CA
C A 0047 ILE C 3.554 C A 0048 LYS C
C A 0047 ILE C 3.378 C A 0048 LYS CB
C A 0047 ILE C 3.357 C A 0048 LYS CG
C A 0047 ILE CG2 3.672 H A 0053 VAL CG2
C A 0048 LYS C 2.444 H A 0049 GLU CA
C A 0048 LYS C 3.523 H A 0049 GLU C
C A 0048 LYS C 3.450 H A 0049 GLU CB
C A 0048 LYS C 3.467 H A 0049 GLU CG
H A 0049 GLU CA 3.792 H A 0050 GLN CA
H A 0049 GLU C 2.408 H A 0050 GLN CA
H A 0049 GLU C 3.088 H A 0050 GLN C
H A 0049 GLU C 3.656 H A 0050 GLN CB
H A 0049 GLU CB 3.762 H A 0051 GLU CG
H A 0050 GLN C 2.436 H A 0051 GLU CA
H A 0050 GLN C 2.984 H A 0051 GLU C
H A 0050 GLN C 3.721 H A 0051 GLU CB
H A 0051 GLU C 2.409 H A 0052 VAL CA
H A 0051 GLU C 2.915 H A 0052 VAL C
H A 0051 GLU C 3.690 H A 0052 VAL CB
H A 0052 VAL CA 3.777 H A 0053 VAL CA
H A 0052 VAL C 2.415 H A 0053 VAL CA
H A 0052 VAL C 2.961 H A 0053 VAL C
H A 0052 VAL C 3.651 H A 0053 VAL CB
H A 0052 VAL C 3.766 H A 0056 VAL CG2
H A 0053 VAL C 2.405 H A 0054 ASP CA
H A 0053 VAL C 2.978 H A 0054 ASP C
H A 0053 VAL C 3.688 H A 0054 ASP CB
H A 0054 ASP C 2.414 H A 0055 LYS CA
H A 0054 ASP C 3.026 H A 0055 LYS C
H A 0054 ASP C 3.682 H A 0055 LYS CB
H A 0055 LYS C 2.423 H A 0056 VAL CA
H A 0055 LYS C 3.034 H A 0056 VAL C
H A 0055 LYS C 3.689 H A 0056 VAL CB
H A 0056 VAL C 2.420 H A 0057 MET CA
H A 0056 VAL C 3.053 H A 0057 MET C
H A 0056 VAL C 3.693 H A 0057 MET CB
H A 0056 VAL CG1 3.698 H A 0076 PHE CD1
H A 0056 VAL CG1 3.358 H A 0076 PHE CE1
H A 0057 MET C 2.393 H A 0058 GLU CA
H A 0057 MET C 2.877 H A 0058 GLU C
H A 0057 MET C 3.695 H A 0058 GLU CB
H A 0057 MET C 3.778 H A 0061 ASP CB
H A 0058 GLU C 2.422 H A 0059 THR CA
H A 0058 GLU C 3.081 H A 0059 THR C
H A 0058 GLU C 3.692 H A 0059 THR CB
H A 0059 THR C 2.446 H A 0060 LEU CA
H A 0059 THR C 3.335 H A 0060 LEU C
H A 0059 THR C 3.613 H A 0060 LEU CB
H A 0059 THR C 3.680 H A 0060 LEU CG
H A 0060 LEU CA 3.786 H A 0061 ASP CA
H A 0060 LEU C 2.413 H A 0061 ASP CA
H A 0060 LEU C 3.011 H A 0061 ASP C
H A 0060 LEU C 3.670 H A 0061 ASP CB
H A 0060 LEU CD1 3.679 H A 0076 PHE CB
H A 0060 LEU CD2 3.684 H A 0076 PHE CA
H A 0060 LEU CD2 3.659 H A 0076 PHE CB
H A 0061 ASP CA 3.787 C A 0062 GLU CA
H A 0061 ASP C 2.408 C A 0062 GLU CA
H A 0061 ASP C 2.999 C A 0062 GLU C
H A 0061 ASP C 3.684 C A 0062 GLU CB
H A 0061 ASP CG 3.781 E A 0067 GLU C
C A 0062 GLU CA 3.797 C A 0063 ASP CA
C A 0062 GLU C 2.414 C A 0063 ASP CA
C A 0062 GLU C 3.190 C A 0063 ASP C
C A 0062 GLU C 3.619 C A 0063 ASP CB
C A 0063 ASP C 2.421 C A 0064 GLY CA
C A 0063 ASP C 3.117 C A 0064 GLY C
C A 0063 ASP CB 3.741 C A 0065 ASP CG
C A 0064 GLY CA 3.792 C A 0065 ASP CA
C A 0064 GLY C 2.412 C A 0065 ASP CA
C A 0064 GLY C 3.099 C A 0065 ASP C
C A 0064 GLY C 3.664 C A 0065 ASP CB
C A 0065 ASP C 2.421 C A 0066 GLY CA
C A 0065 ASP C 3.003 C A 0066 GLY C
C A 0065 ASP CG 3.592 E A 0067 GLU CB
C A 0066 GLY C 2.433 E A 0067 GLU CA
C A 0066 GLY C 3.622 E A 0067 GLU C
C A 0066 GLY C 3.290 E A 0067 GLU CB
C A 0066 GLY C 3.196 E A 0067 GLU CG
E A 0067 GLU C 2.446 E A 0068 CYS CA
E A 0067 GLU C 3.555 E A 0068 CYS C
E A 0067 GLU C 3.387 E A 0068 CYS CB
E A 0068 CYS C 2.413 H A 0069 ASP CA
E A 0068 CYS C 3.168 H A 0069 ASP C
E A 0068 CYS C 3.640 H A 0069 ASP CB
H A 0069 ASP CA 3.797 H A 0070 PHE CA
H A 0069 ASP C 2.406 H A 0070 PHE CA
H A 0069 ASP C 2.884 H A 0070 PHE C
H A 0069 ASP C 3.664 H A 0070 PHE CB
H A 0070 PHE C 2.424 H A 0071 GLN CA
H A 0070 PHE C 2.994 H A 0071 GLN C
H A 0070 PHE C 3.704 H A 0071 GLN CB
H A 0070 PHE CD1 3.646 H A 0071 GLN CA
H A 0071 GLN C 2.426 H A 0072 GLU CA
H A 0071 GLN C 3.064 H A 0072 GLU C
H A 0071 GLN C 3.690 H A 0072 GLU CB
H A 0072 GLU C 2.419 H A 0073 PHE CA
H A 0072 GLU C 3.023 H A 0073 PHE C
H A 0072 GLU C 3.682 H A 0073 PHE CB
H A 0073 PHE C 2.411 H A 0074 MET CA
H A 0073 PHE C 2.950 H A 0074 MET C
H A 0073 PHE C 3.688 H A 0074 MET CB
H A 0074 MET C 2.416 H A 0075 ALA CA
H A 0074 MET C 3.033 H A 0075 ALA C
H A 0074 MET C 3.687 H A 0075 ALA CB
H A 0075 ALA C 2.406 H A 0076 PHE CA
H A 0075 ALA C 2.918 H A 0076 PHE C
H A 0075 ALA C 3.680 H A 0076 PHE CB
H A 0076 PHE CA 3.795 H A 0077 VAL CA
H A 0076 PHE C 2.406 H A 0077 VAL CA
H A 0076 PHE C 2.935 H A 0077 VAL C
H A 0076 PHE C 3.687 H A 0077 VAL CB
H A 0076 PHE CE1 3.767 H A 0079 MET CE
H A 0076 PHE CE2 3.400 H A 0080 VAL CG2
H A 0076 PHE CZ 3.511 H A 0080 VAL CG2
H A 0077 VAL C 2.416 H A 0078 SER CA
H A 0077 VAL C 2.959 H A 0078 SER C
H A 0077 VAL C 3.689 H A 0078 SER CB
H A 0078 SER CA 3.798 H A 0079 MET CA
H A 0078 SER C 2.401 H A 0079 MET CA
H A 0078 SER C 2.940 H A 0079 MET C
H A 0078 SER C 3.686 H A 0079 MET CB
H A 0079 MET CA 3.796 H A 0080 VAL CA
H A 0079 MET C 2.407 H A 0080 VAL CA
H A 0079 MET C 3.000 H A 0080 VAL C
H A 0079 MET C 3.684 H A 0080 VAL CB
H A 0080 VAL C 2.419 H A 0081 THR CA
H A 0080 VAL C 2.945 H A 0081 THR C
H A 0080 VAL C 3.709 H A 0081 THR CB
H A 0081 THR C 2.415 H A 0082 THR CA
H A 0081 THR C 3.012 H A 0082 THR C
H A 0081 THR C 3.683 H A 0082 THR CB
H A 0082 THR C 2.418 H A 0083 ALA CA
H A 0082 THR C 3.046 H A 0083 ALA C
H A 0082 THR C 3.683 H A 0083 ALA CB
H A 0083 ALA C 2.416 H A 0084 CYS CA
H A 0083 ALA C 2.957 H A 0084 CYS C
H A 0083 ALA C 3.694 H A 0084 CYS CB
H A 0084 CYS C 2.423 H A 0085 HIS CA
H A 0084 CYS C 2.966 H A 0085 HIS C
H A 0084 CYS C 3.703 H A 0085 HIS CB
H A 0085 HIS C 2.421 H A 0086 GLU CA
H A 0085 HIS C 2.923 H A 0086 GLU C
H A 0085 HIS C 3.701 H A 0086 GLU CB
H A 0086 GLU C 2.422 H A 0087 PHE CA
H A 0086 GLU C 2.889 H A 0087 PHE C
H A 0086 GLU C 3.697 H A 0087 PHE CB
H A 0087 PHE C 2.420 H A 0088 PHE CA
H A 0087 PHE C 3.179 H A 0088 PHE C
H A 0087 PHE C 3.653 H A 0088 PHE CB
H A 0088 PHE C 2.425 C A 0089 GLU CA
H A 0088 PHE C 3.295 C A 0089 GLU C
H A 0088 PHE C 3.597 C A 0089 GLU CB
H A 0088 PHE C 3.790 C A 0089 GLU CG
C A 0089 GLU C 2.416 C A 0090 HIS CA
C A 0089 GLU C 2.961 C A 0090 HIS C
C A 0089 GLU C 3.684 C A 0090 HIS CB
C A 0090 HIS C 2.420 C A 0091 GLU CA
C A 0090 HIS C 3.093 C A 0091 GLU C
C A 0090 HIS C 3.687 C A 0091 GLU CB
CHARGE_ATTR 2.00 12.00 132
H A 0002 GLU OE1 6.010 H A 0005 LYS NZ
H A 0002 GLU OE2 6.465 H A 0005 LYS NZ
H A 0004 GLU OE1 10.96 H A 0005 LYS NZ
H A 0004 GLU OE2 11.51 H A 0005 LYS NZ
H A 0012 ASP OD2 10.73 H A 0005 LYS NZ
H A 0012 ASP OD1 5.699 H A 0015 HIS ND1
H A 0012 ASP OD1 7.704 H A 0015 HIS NE2
H A 0012 ASP OD2 7.792 H A 0015 HIS ND1
H A 0012 ASP OD2 9.762 H A 0015 HIS NE2
H A 0012 ASP OD1 10.65 C A 0024 LYS NZ
C A 0021 GLU OE1 5.283 C A 0020 ARG NH1
C A 0021 GLU OE1 7.116 C A 0020 ARG NH2
C A 0021 GLU OE2 7.001 C A 0020 ARG NH1
C A 0021 GLU OE2 8.891 C A 0020 ARG NH2
C A 0021 GLU OE1 10.87 E A 0028 LYS NZ
C A 0021 GLU OE2 9.722 E A 0028 LYS NZ
C A 0023 ASP OD1 10.58 H A 0015 HIS NE2
C A 0023 ASP OD1 7.876 C A 0024 LYS NZ
C A 0023 ASP OD2 9.855 C A 0024 LYS NZ
C A 0023 ASP OD1 3.252 C A 0025 HIS ND1
C A 0023 ASP OD1 5.440 C A 0025 HIS NE2
C A 0023 ASP OD2 4.591 C A 0025 HIS ND1
C A 0023 ASP OD2 6.600 C A 0025 HIS NE2
C A 0023 ASP OD1 6.383 C A 0026 LYS NZ
C A 0023 ASP OD2 4.372 C A 0026 LYS NZ
C A 0023 ASP OD1 10.70 E A 0028 LYS NZ
C A 0023 ASP OD2 9.993 E A 0028 LYS NZ
H A 0031 GLU OE1 11.47 H A 0015 HIS NE2
H A 0031 GLU OE1 9.327 C A 0020 ARG NH1
H A 0031 GLU OE1 11.34 C A 0020 ARG NH2
H A 0031 GLU OE2 9.060 C A 0020 ARG NH1
H A 0031 GLU OE2 11.24 C A 0020 ARG NH2
H A 0031 GLU OE1 10.33 C A 0024 LYS NZ
H A 0031 GLU OE2 11.26 C A 0024 LYS NZ
H A 0031 GLU OE1 9.696 C A 0025 HIS ND1
H A 0031 GLU OE1 11.54 C A 0025 HIS NE2
H A 0031 GLU OE2 9.782 C A 0025 HIS ND1
H A 0031 GLU OE2 11.82 C A 0025 HIS NE2
H A 0031 GLU OE1 9.226 C A 0026 LYS NZ
H A 0031 GLU OE2 8.537 C A 0026 LYS NZ
H A 0031 GLU OE1 7.922 E A 0028 LYS NZ
H A 0031 GLU OE2 6.308 E A 0028 LYS NZ
H A 0034 GLU OE1 4.233 C A 0020 ARG NH1
H A 0034 GLU OE1 5.329 C A 0020 ARG NH2
H A 0034 GLU OE2 4.130 C A 0020 ARG NH1
H A 0034 GLU OE2 4.323 C A 0020 ARG NH2
H A 0034 GLU OE1 11.40 E A 0028 LYS NZ
H A 0034 GLU OE1 8.521 H A 0033 LYS NZ
H A 0034 GLU OE2 9.373 H A 0033 LYS NZ
H A 0039 GLU OE1 10.97 C A 0020 ARG NH1
H A 0039 GLU OE1 10.93 C A 0020 ARG NH2
H A 0039 GLU OE2 10.68 C A 0020 ARG NH1
H A 0039 GLU OE2 10.51 C A 0020 ARG NH2
H A 0039 GLU OE1 10.88 H A 0033 LYS NZ
H A 0039 GLU OE1 11.60 C A 0042 HIS ND1
C A 0045 GLU OE1 11.70 H A 0033 LYS NZ
C A 0045 GLU OE1 11.67 C A 0042 HIS ND1
C A 0045 GLU OE1 11.62 C A 0048 LYS NZ
C A 0046 GLU OE1 11.00 H A 0033 LYS NZ
C A 0046 GLU OE2 9.698 H A 0033 LYS NZ
C A 0046 GLU OE1 5.714 C A 0042 HIS ND1
C A 0046 GLU OE1 4.246 C A 0042 HIS NE2
C A 0046 GLU OE2 5.687 C A 0042 HIS ND1
C A 0046 GLU OE2 3.662 C A 0042 HIS NE2
C A 0046 GLU OE1 5.179 C A 0048 LYS NZ
C A 0046 GLU OE2 5.232 C A 0048 LYS NZ
H A 0049 GLU OE1 11.38 H A 0029 LYS NZ
H A 0049 GLU OE1 8.993 H A 0033 LYS NZ
H A 0049 GLU OE2 9.280 H A 0033 LYS NZ
H A 0049 GLU OE1 7.924 C A 0048 LYS NZ
H A 0049 GLU OE2 6.587 C A 0048 LYS NZ
H A 0049 GLU OE1 11.73 H A 0055 LYS NZ
H A 0051 GLU OE2 11.65 H A 0033 LYS NZ
H A 0051 GLU OE1 8.924 C A 0048 LYS NZ
H A 0051 GLU OE2 6.799 C A 0048 LYS NZ
H A 0051 GLU OE1 6.521 H A 0055 LYS NZ
H A 0051 GLU OE2 7.671 H A 0055 LYS NZ
H A 0054 ASP OD1 11.66 E A 0028 LYS NZ
H A 0054 ASP OD1 3.329 H A 0029 LYS NZ
H A 0054 ASP OD2 4.645 H A 0029 LYS NZ
H A 0054 ASP OD1 10.85 H A 0033 LYS NZ
H A 0054 ASP OD2 11.29 H A 0033 LYS NZ
H A 0054 ASP OD1 9.352 H A 0055 LYS NZ
H A 0054 ASP OD2 8.313 H A 0055 LYS NZ
H A 0058 GLU OE1 10.90 H A 0029 LYS NZ
H A 0058 GLU OE2 9.406 H A 0029 LYS NZ
H A 0058 GLU OE1 6.091 H A 0055 LYS NZ
H A 0058 GLU OE2 6.776 H A 0055 LYS NZ
H A 0061 ASP OD1 10.79 C A 0026 LYS NZ
H A 0061 ASP OD2 10.06 C A 0026 LYS NZ
H A 0061 ASP OD2 10.97 E A 0028 LYS NZ
H A 0061 ASP OD1 10.39 H A 0029 LYS NZ
H A 0061 ASP OD2 8.366 H A 0029 LYS NZ
C A 0063 ASP OD2 11.13 C A 0026 LYS NZ
C A 0065 ASP OD1 8.588 C A 0026 LYS NZ
C A 0065 ASP OD2 7.486 C A 0026 LYS NZ
C A 0065 ASP OD1 11.52 E A 0028 LYS NZ
C A 0065 ASP OD1 10.51 H A 0029 LYS NZ
E A 0067 GLU OE1 10.96 C A 0025 HIS ND1
E A 0067 GLU OE2 11.19 C A 0025 HIS ND1
E A 0067 GLU OE1 3.913 C A 0026 LYS NZ
E A 0067 GLU OE2 2.890 C A 0026 LYS NZ
E A 0067 GLU OE1 9.548 E A 0028 LYS NZ
E A 0067 GLU OE2 7.771 E A 0028 LYS NZ
E A 0067 GLU OE2 11.44 H A 0029 LYS NZ
H A 0069 ASP OD1 10.18 C A 0025 HIS ND1
H A 0069 ASP OD1 10.99 C A 0025 HIS NE2
H A 0069 ASP OD2 11.69 C A 0025 HIS ND1
H A 0069 ASP OD1 8.000 C A 0026 LYS NZ
H A 0069 ASP OD2 9.619 C A 0026 LYS NZ
H A 0072 GLU OE1 11.58 C A 0026 LYS NZ
H A 0072 GLU OE2 11.80 C A 0026 LYS NZ
H A 0086 GLU OE1 5.209 H A 0085 HIS ND1
H A 0086 GLU OE1 7.204 H A 0085 HIS NE2
H A 0086 GLU OE2 6.788 H A 0085 HIS ND1
H A 0086 GLU OE2 8.520 H A 0085 HIS NE2
H A 0086 GLU OE1 9.374 C A 0090 HIS ND1
H A 0086 GLU OE1 9.715 C A 0090 HIS NE2
H A 0086 GLU OE2 8.107 C A 0090 HIS ND1
H A 0086 GLU OE2 8.788 C A 0090 HIS NE2
C A 0089 GLU OE1 11.21 H A 0085 HIS ND1
C A 0089 GLU OE1 11.75 H A 0085 HIS NE2
C A 0089 GLU OE2 10.64 H A 0085 HIS ND1
C A 0089 GLU OE2 11.56 H A 0085 HIS NE2
C A 0089 GLU OE1 6.192 C A 0090 HIS ND1
C A 0089 GLU OE1 8.321 C A 0090 HIS NE2
C A 0089 GLU OE2 7.320 C A 0090 HIS ND1
C A 0089 GLU OE2 9.265 C A 0090 HIS NE2
C A 0091 GLU OE1 8.874 C A 0090 HIS ND1
C A 0091 GLU OE1 10.84 C A 0090 HIS NE2
C A 0091 GLU OE2 8.344 C A 0090 HIS ND1
C A 0091 GLU OE2 10.45 C A 0090 HIS NE2
CHARGE_REPU 2.00 12.00 197
H A 0002 GLU OE1 10.66 H A 0004 GLU OE1
H A 0002 GLU OE2 10.67 H A 0004 GLU OE1
H A 0012 ASP OD1 11.91 H A 0039 GLU OE2
H A 0012 ASP OD2 11.79 H A 0039 GLU OE2
H A 0015 HIS ND1 5.014 C A 0024 LYS NZ
H A 0015 HIS NE2 3.685 C A 0024 LYS NZ
H A 0015 HIS ND1 11.03 C A 0025 HIS ND1
H A 0015 HIS ND1 10.54 C A 0025 HIS NE2
H A 0015 HIS NE2 9.210 C A 0025 HIS ND1
H A 0015 HIS NE2 8.670 C A 0025 HIS NE2
C A 0020 ARG NH1 11.87 H A 0033 LYS NZ
C A 0021 GLU OE1 11.19 C A 0023 ASP OD1
C A 0021 GLU OE2 10.92 C A 0023 ASP OD1
C A 0021 GLU OE2 11.87 C A 0023 ASP OD2
C A 0021 GLU OE1 8.623 H A 0031 GLU OE1
C A 0021 GLU OE1 7.459 H A 0031 GLU OE2
C A 0021 GLU OE2 9.028 H A 0031 GLU OE1
C A 0021 GLU OE2 7.432 H A 0031 GLU OE2
C A 0021 GLU OE1 8.077 H A 0034 GLU OE1
C A 0021 GLU OE1 8.857 H A 0034 GLU OE2
C A 0021 GLU OE2 9.363 H A 0034 GLU OE1
C A 0021 GLU OE2 10.46 H A 0034 GLU OE2
C A 0023 ASP OD1 7.127 H A 0031 GLU OE1
C A 0023 ASP OD1 6.885 H A 0031 GLU OE2
C A 0023 ASP OD2 7.905 H A 0031 GLU OE1
C A 0023 ASP OD2 7.454 H A 0031 GLU OE2
C A 0023 ASP OD2 11.74 C A 0065 ASP OD1
C A 0023 ASP OD2 10.50 C A 0065 ASP OD2
C A 0023 ASP OD1 8.780 E A 0067 GLU OE1
C A 0023 ASP OD1 8.626 E A 0067 GLU OE2
C A 0023 ASP OD2 7.105 E A 0067 GLU OE1
C A 0023 ASP OD2 6.846 E A 0067 GLU OE2
C A 0023 ASP OD1 9.155 H A 0069 ASP OD1
C A 0023 ASP OD1 11.02 H A 0069 ASP OD2
C A 0023 ASP OD2 8.423 H A 0069 ASP OD1
C A 0023 ASP OD2 10.23 H A 0069 ASP OD2
C A 0024 LYS NZ 6.215 C A 0025 HIS ND1
C A 0024 LYS NZ 5.839 C A 0025 HIS NE2
C A 0025 HIS ND1 8.844 C A 0026 LYS NZ
C A 0025 HIS NE2 10.65 C A 0026 LYS NZ
C A 0026 LYS NZ 8.234 E A 0028 LYS NZ
E A 0028 LYS NZ 8.700 H A 0029 LYS NZ
H A 0029 LYS NZ 11.16 H A 0033 LYS NZ
H A 0031 GLU OE1 7.578 H A 0034 GLU OE1
H A 0031 GLU OE1 9.134 H A 0034 GLU OE2
H A 0031 GLU OE2 7.915 H A 0034 GLU OE1
H A 0031 GLU OE2 9.663 H A 0034 GLU OE2
H A 0031 GLU OE1 11.45 H A 0039 GLU OE1
H A 0031 GLU OE1 11.61 H A 0039 GLU OE2
H A 0031 GLU OE1 11.85 H A 0061 ASP OD2
H A 0031 GLU OE1 9.901 E A 0067 GLU OE1
H A 0031 GLU OE1 9.552 E A 0067 GLU OE2
H A 0031 GLU OE2 9.890 E A 0067 GLU OE1
H A 0031 GLU OE2 9.094 E A 0067 GLU OE2
H A 0031 GLU OE1 10.16 H A 0069 ASP OD1
H A 0031 GLU OE2 11.18 H A 0069 ASP OD1
H A 0033 LYS NZ 11.33 C A 0042 HIS ND1
H A 0033 LYS NZ 10.35 C A 0042 HIS NE2
H A 0033 LYS NZ 10.36 C A 0048 LYS NZ
H A 0034 GLU OE1 7.895 H A 0039 GLU OE1
H A 0034 GLU OE1 8.297 H A 0039 GLU OE2
H A 0034 GLU OE2 7.042 H A 0039 GLU OE1
H A 0034 GLU OE2 7.125 H A 0039 GLU OE2
H A 0039 GLU OE1 9.478 C A 0045 GLU OE1
H A 0039 GLU OE1 11.40 C A 0045 GLU OE2
H A 0039 GLU OE2 11.37 C A 0045 GLU OE1
C A 0042 HIS ND1 10.46 C A 0048 LYS NZ
C A 0042 HIS NE2 8.721 C A 0048 LYS NZ
C A 0045 GLU OE1 10.94 C A 0046 GLU OE1
C A 0045 GLU OE1 11.92 C A 0046 GLU OE2
C A 0045 GLU OE2 11.82 C A 0046 GLU OE1
C A 0046 GLU OE1 10.80 H A 0049 GLU OE2
C A 0046 GLU OE2 11.17 H A 0049 GLU OE1
C A 0046 GLU OE2 9.673 H A 0049 GLU OE2
C A 0046 GLU OE1 11.75 H A 0051 GLU OE2
C A 0046 GLU OE2 11.65 H A 0051 GLU OE2
H A 0049 GLU OE1 5.693 H A 0051 GLU OE1
H A 0049 GLU OE1 5.300 H A 0051 GLU OE2
H A 0049 GLU OE2 6.737 H A 0051 GLU OE1
H A 0049 GLU OE2 5.791 H A 0051 GLU OE2
H A 0049 GLU OE1 9.874 H A 0054 ASP OD1
H A 0049 GLU OE1 8.501 H A 0054 ASP OD2
H A 0049 GLU OE2 11.85 H A 0054 ASP OD1
H A 0049 GLU OE2 10.56 H A 0054 ASP OD2
H A 0051 GLU OE1 9.309 H A 0054 ASP OD1
H A 0051 GLU OE1 7.609 H A 0054 ASP OD2
H A 0051 GLU OE2 10.16 H A 0054 ASP OD1
H A 0051 GLU OE2 8.741 H A 0054 ASP OD2
H A 0051 GLU OE1 11.44 H A 0058 GLU OE1
H A 0051 GLU OE1 11.32 H A 0058 GLU OE2
H A 0054 ASP OD1 8.323 H A 0058 GLU OE1
H A 0054 ASP OD1 7.146 H A 0058 GLU OE2
H A 0054 ASP OD2 8.502 H A 0058 GLU OE1
H A 0054 ASP OD2 7.274 H A 0058 GLU OE2
H A 0054 ASP OD1 10.41 H A 0061 ASP OD1
H A 0054 ASP OD1 8.704 H A 0061 ASP OD2
H A 0054 ASP OD2 10.63 H A 0061 ASP OD2
H A 0054 ASP OD1 11.26 C A 0065 ASP OD1
H A 0058 GLU OE1 9.844 H A 0061 ASP OD1
H A 0058 GLU OE1 9.783 H A 0061 ASP OD2
H A 0058 GLU OE2 9.386 H A 0061 ASP OD1
H A 0058 GLU OE2 9.046 H A 0061 ASP OD2
H A 0058 GLU OE1 10.47 C A 0062 GLU OE1
H A 0058 GLU OE1 9.547 C A 0062 GLU OE2
H A 0058 GLU OE2 11.54 C A 0062 GLU OE1
H A 0058 GLU OE2 10.91 C A 0062 GLU OE2
H A 0058 GLU OE1 11.85 C A 0065 ASP OD1
H A 0058 GLU OE2 11.11 C A 0065 ASP OD1
H A 0061 ASP OD1 8.399 C A 0062 GLU OE1
H A 0061 ASP OD1 8.942 C A 0062 GLU OE2
H A 0061 ASP OD2 10.21 C A 0062 GLU OE1
H A 0061 ASP OD2 10.45 C A 0062 GLU OE2
H A 0061 ASP OD1 5.358 C A 0063 ASP OD1
H A 0061 ASP OD1 4.718 C A 0063 ASP OD2
H A 0061 ASP OD2 7.460 C A 0063 ASP OD1
H A 0061 ASP OD2 6.609 C A 0063 ASP OD2
H A 0061 ASP OD1 2.368 C A 0065 ASP OD1
H A 0061 ASP OD1 4.149 C A 0065 ASP OD2
H A 0061 ASP OD2 2.715 C A 0065 ASP OD1
H A 0061 ASP OD2 4.790 C A 0065 ASP OD2
H A 0061 ASP OD1 7.040 E A 0067 GLU OE1
H A 0061 ASP OD1 8.180 E A 0067 GLU OE2
H A 0061 ASP OD2 6.691 E A 0067 GLU OE1
H A 0061 ASP OD2 7.336 E A 0067 GLU OE2
H A 0061 ASP OD1 7.905 H A 0069 ASP OD1
H A 0061 ASP OD1 8.045 H A 0069 ASP OD2
H A 0061 ASP OD2 8.457 H A 0069 ASP OD1
H A 0061 ASP OD2 9.102 H A 0069 ASP OD2
H A 0061 ASP OD1 4.563 H A 0072 GLU OE1
H A 0061 ASP OD1 5.269 H A 0072 GLU OE2
H A 0061 ASP OD2 5.686 H A 0072 GLU OE1
H A 0061 ASP OD2 6.864 H A 0072 GLU OE2
C A 0062 GLU OE1 6.556 C A 0063 ASP OD1
C A 0062 GLU OE1 7.763 C A 0063 ASP OD2
C A 0062 GLU OE2 8.253 C A 0063 ASP OD1
C A 0062 GLU OE2 9.178 C A 0063 ASP OD2
C A 0062 GLU OE1 10.36 C A 0065 ASP OD1
C A 0062 GLU OE1 11.07 C A 0065 ASP OD2
C A 0062 GLU OE2 11.11 C A 0065 ASP OD1
C A 0062 GLU OE1 11.10 H A 0069 ASP OD2
C A 0062 GLU OE1 7.519 H A 0072 GLU OE1
C A 0062 GLU OE1 7.094 H A 0072 GLU OE2
C A 0062 GLU OE2 7.875 H A 0072 GLU OE1
C A 0062 GLU OE2 7.992 H A 0072 GLU OE2
C A 0063 ASP OD1 5.922 C A 0065 ASP OD1
C A 0063 ASP OD1 5.699 C A 0065 ASP OD2
C A 0063 ASP OD2 4.738 C A 0065 ASP OD1
C A 0063 ASP OD2 4.073 C A 0065 ASP OD2
C A 0063 ASP OD1 9.193 E A 0067 GLU OE1
C A 0063 ASP OD1 10.96 E A 0067 GLU OE2
C A 0063 ASP OD2 7.341 E A 0067 GLU OE1
C A 0063 ASP OD2 9.244 E A 0067 GLU OE2
C A 0063 ASP OD1 8.367 H A 0069 ASP OD1
C A 0063 ASP OD1 7.136 H A 0069 ASP OD2
C A 0063 ASP OD2 6.249 H A 0069 ASP OD1
C A 0063 ASP OD2 5.183 H A 0069 ASP OD2
C A 0063 ASP OD1 5.956 H A 0072 GLU OE1
C A 0063 ASP OD1 4.519 H A 0072 GLU OE2
C A 0063 ASP OD2 4.664 H A 0072 GLU OE1
C A 0063 ASP OD2 3.179 H A 0072 GLU OE2
C A 0065 ASP OD1 4.842 E A 0067 GLU OE1
C A 0065 ASP OD1 5.962 E A 0067 GLU OE2
C A 0065 ASP OD2 3.619 E A 0067 GLU OE1
C A 0065 ASP OD2 5.265 E A 0067 GLU OE2
C A 0065 ASP OD1 6.943 H A 0069 ASP OD1
C A 0065 ASP OD1 7.376 H A 0069 ASP OD2
C A 0065 ASP OD2 5.643 H A 0069 ASP OD1
C A 0065 ASP OD2 5.963 H A 0069 ASP OD2
C A 0065 ASP OD1 5.513 H A 0072 GLU OE1
C A 0065 ASP OD1 5.895 H A 0072 GLU OE2
C A 0065 ASP OD2 5.854 H A 0072 GLU OE1
C A 0065 ASP OD2 5.634 H A 0072 GLU OE2
E A 0067 GLU OE1 5.504 H A 0069 ASP OD1
E A 0067 GLU OE1 6.816 H A 0069 ASP OD2
E A 0067 GLU OE2 7.453 H A 0069 ASP OD1
E A 0067 GLU OE2 8.924 H A 0069 ASP OD2
E A 0067 GLU OE1 8.016 H A 0072 GLU OE1
E A 0067 GLU OE1 8.158 H A 0072 GLU OE2
E A 0067 GLU OE2 9.729 H A 0072 GLU OE1
E A 0067 GLU OE2 10.11 H A 0072 GLU OE2
H A 0069 ASP OD1 5.501 H A 0072 GLU OE1
H A 0069 ASP OD1 5.204 H A 0072 GLU OE2
H A 0069 ASP OD2 5.339 H A 0072 GLU OE1
H A 0069 ASP OD2 4.238 H A 0072 GLU OE2
H A 0085 HIS ND1 10.47 C A 0090 HIS ND1
H A 0085 HIS ND1 10.38 C A 0090 HIS NE2
H A 0085 HIS NE2 10.55 C A 0090 HIS ND1
H A 0085 HIS NE2 10.32 C A 0090 HIS NE2
H A 0086 GLU OE1 9.250 C A 0089 GLU OE1
H A 0086 GLU OE1 7.966 C A 0089 GLU OE2
H A 0086 GLU OE2 7.553 C A 0089 GLU OE1
H A 0086 GLU OE2 6.192 C A 0089 GLU OE2
H A 0086 GLU OE2 11.16 C A 0091 GLU OE2
C A 0089 GLU OE1 5.723 C A 0091 GLU OE1
C A 0089 GLU OE1 3.895 C A 0091 GLU OE2
C A 0089 GLU OE2 7.647 C A 0091 GLU OE1
C A 0089 GLU OE2 5.627 C A 0091 GLU OE2
HB_MM 2.00 3.20 164
H A 0002 GLU N 2.195 H A 0001 SER O
H A 0003 LEU N 2.195 H A 0002 GLU O
H A 0004 GLU N 2.937 H A 0001 SER O
H A 0004 GLU N 2.561 H A 0002 GLU O
H A 0004 GLU N 2.201 H A 0003 LEU O
H A 0005 LYS N 2.884 H A 0002 GLU O
H A 0005 LYS N 2.194 H A 0004 GLU O
H A 0006 ALA N 2.791 H A 0002 GLU O
H A 0006 ALA N 2.193 H A 0005 LYS O
H A 0007 MET N 2.856 H A 0003 LEU O
H A 0007 MET N 2.195 H A 0006 ALA O
H A 0008 VAL N 2.198 H A 0007 MET O
H A 0009 ALA N 3.158 H A 0005 LYS O
H A 0009 ALA N 2.980 H A 0006 ALA O
H A 0009 ALA N 3.200 H A 0007 MET O
H A 0009 ALA N 2.199 H A 0008 VAL O
H A 0010 LEU N 2.957 H A 0006 ALA O
H A 0010 LEU N 3.096 H A 0007 MET O
H A 0010 LEU N 2.194 H A 0009 ALA O
H A 0011 ILE N 2.922 H A 0007 MET O
H A 0011 ILE N 2.196 H A 0010 LEU O
H A 0012 ASP N 2.981 H A 0008 VAL O
H A 0012 ASP N 3.106 H A 0009 ALA O
H A 0012 ASP N 2.192 H A 0011 ILE O
H A 0013 VAL N 2.741 H A 0009 ALA O
H A 0013 VAL N 3.173 H A 0010 LEU O
H A 0013 VAL N 2.199 H A 0012 ASP O
H A 0014 PHE N 2.965 H A 0010 LEU O
H A 0014 PHE N 3.098 H A 0012 ASP O
H A 0014 PHE N 2.187 H A 0013 VAL O
H A 0015 HIS N 3.093 H A 0012 ASP O
H A 0015 HIS N 2.188 H A 0014 PHE O
H A 0016 GLN N 2.763 H A 0012 ASP O
H A 0016 GLN N 3.188 H A 0013 VAL O
H A 0016 GLN N 2.189 H A 0015 HIS O
H A 0017 TYR N 2.200 H A 0016 GLN O
H A 0018 SER N 2.193 H A 0017 TYR O
H A 0019 GLY N 2.192 H A 0018 SER O
C A 0020 ARG N 3.069 H A 0017 TYR O
C A 0020 ARG N 2.189 H A 0019 GLY O
C A 0021 GLU N 2.197 C A 0020 ARG O
C A 0022 GLY N 2.199 C A 0021 GLU O
C A 0023 ASP N 2.200 C A 0022 GLY O
C A 0024 LYS N 2.197 C A 0023 ASP O
C A 0025 HIS N 2.191 C A 0024 LYS O
C A 0026 LYS N 2.200 C A 0025 HIS O
E A 0027 LEU N 2.205 C A 0026 LYS O
E A 0027 LEU N 2.895 E A 0068 CYS O
E A 0028 LYS N 2.199 E A 0027 LEU O
H A 0029 LYS N 2.199 E A 0028 LYS O
H A 0030 SER N 2.760 E A 0028 LYS O
H A 0030 SER N 2.189 H A 0029 LYS O
H A 0031 GLU N 2.662 E A 0028 LYS O
H A 0031 GLU N 2.196 H A 0030 SER O
H A 0032 LEU N 2.935 E A 0028 LYS O
H A 0032 LEU N 2.199 H A 0031 GLU O
H A 0033 LYS N 2.827 H A 0029 LYS O
H A 0033 LYS N 2.187 H A 0032 LEU O
H A 0034 GLU N 3.054 H A 0031 GLU O
H A 0034 GLU N 3.051 H A 0032 LEU O
H A 0034 GLU N 2.193 H A 0033 LYS O
H A 0035 LEU N 3.080 H A 0031 GLU O
H A 0035 LEU N 2.811 H A 0032 LEU O
H A 0035 LEU N 2.196 H A 0034 GLU O
H A 0036 ILE N 2.820 H A 0032 LEU O
H A 0036 ILE N 2.192 H A 0035 LEU O
H A 0037 ASN N 2.858 H A 0033 LYS O
H A 0037 ASN N 2.189 H A 0036 ILE O
H A 0038 ASN N 2.487 H A 0034 GLU O
H A 0038 ASN N 2.196 H A 0037 ASN O
H A 0039 GLU N 2.982 H A 0035 LEU O
H A 0039 GLU N 2.201 H A 0038 ASN O
H A 0040 LEU N 3.008 H A 0036 ILE O
H A 0040 LEU N 2.206 H A 0039 GLU O
C A 0041 SER N 2.195 H A 0040 LEU O
C A 0042 HIS N 2.205 C A 0041 SER O
C A 0043 PHE N 2.192 C A 0042 HIS O
C A 0044 LEU N 2.195 C A 0043 PHE O
C A 0045 GLU N 2.201 C A 0044 LEU O
C A 0046 GLU N 2.198 C A 0045 GLU O
C A 0047 ILE N 2.200 C A 0046 GLU O
C A 0048 LYS N 2.195 C A 0047 ILE O
H A 0049 GLU N 2.207 C A 0048 LYS O
H A 0050 GLN N 2.194 H A 0049 GLU O
H A 0051 GLU N 2.207 H A 0050 GLN O
H A 0052 VAL N 2.197 H A 0051 GLU O
H A 0053 VAL N 3.051 H A 0050 GLN O
H A 0053 VAL N 2.194 H A 0052 VAL O
H A 0054 ASP N 2.444 H A 0050 GLN O
H A 0054 ASP N 2.187 H A 0053 VAL O
H A 0055 LYS N 2.760 H A 0051 GLU O
H A 0055 LYS N 2.192 H A 0054 ASP O
H A 0056 VAL N 2.642 H A 0052 VAL O
H A 0056 VAL N 2.197 H A 0055 LYS O
H A 0057 MET N 2.733 H A 0053 VAL O
H A 0057 MET N 2.184 H A 0056 VAL O
H A 0058 GLU N 3.129 H A 0054 ASP O
H A 0058 GLU N 2.176 H A 0057 MET O
H A 0059 THR N 3.130 H A 0056 VAL O
H A 0059 THR N 2.934 H A 0057 MET O
H A 0059 THR N 2.199 H A 0058 GLU O
H A 0060 LEU N 2.864 H A 0057 MET O
H A 0060 LEU N 2.202 H A 0059 THR O
H A 0061 ASP N 2.357 H A 0057 MET O
H A 0061 ASP N 2.199 H A 0060 LEU O
C A 0062 GLU N 2.429 H A 0060 LEU O
C A 0062 GLU N 2.192 H A 0061 ASP O
C A 0063 ASP N 2.680 H A 0061 ASP O
C A 0063 ASP N 2.194 C A 0062 GLU O
C A 0064 GLY N 2.822 H A 0061 ASP O
C A 0064 GLY N 2.205 C A 0063 ASP O
C A 0065 ASP N 2.197 C A 0064 GLY O
C A 0066 GLY N 3.110 C A 0064 GLY O
C A 0066 GLY N 2.203 C A 0065 ASP O
E A 0067 GLU N 2.202 C A 0066 GLY O
E A 0068 CYS N 2.567 E A 0027 LEU O
E A 0068 CYS N 2.206 E A 0067 GLU O
H A 0069 ASP N 2.189 E A 0068 CYS O
H A 0070 PHE N 2.192 H A 0069 ASP O
H A 0071 GLN N 3.122 H A 0069 ASP O
H A 0071 GLN N 2.199 H A 0070 PHE O
H A 0072 GLU N 2.910 H A 0069 ASP O
H A 0072 GLU N 2.199 H A 0071 GLN O
H A 0073 PHE N 2.775 H A 0069 ASP O
H A 0073 PHE N 2.189 H A 0072 GLU O
H A 0074 MET N 2.900 H A 0070 PHE O
H A 0074 MET N 2.195 H A 0073 PHE O
H A 0075 ALA N 3.153 H A 0073 PHE O
H A 0075 ALA N 2.193 H A 0074 MET O
H A 0076 PHE N 2.978 H A 0073 PHE O
H A 0076 PHE N 2.188 H A 0075 ALA O
H A 0077 VAL N 3.197 H A 0075 ALA O
H A 0077 VAL N 2.185 H A 0076 PHE O
H A 0078 SER N 3.014 H A 0075 ALA O
H A 0078 SER N 2.200 H A 0077 VAL O
H A 0079 MET N 3.046 H A 0075 ALA O
H A 0079 MET N 3.149 H A 0076 PHE O
H A 0079 MET N 2.193 H A 0078 SER O
H A 0080 VAL N 3.044 H A 0076 PHE O
H A 0080 VAL N 3.198 H A 0077 VAL O
H A 0080 VAL N 2.197 H A 0079 MET O
H A 0081 THR N 2.590 H A 0077 VAL O
H A 0081 THR N 3.138 H A 0078 SER O
H A 0081 THR N 2.199 H A 0080 VAL O
H A 0082 THR N 2.728 H A 0078 SER O
H A 0082 THR N 2.195 H A 0081 THR O
H A 0083 ALA N 2.973 H A 0079 MET O
H A 0083 ALA N 3.136 H A 0080 VAL O
H A 0083 ALA N 2.198 H A 0082 THR O
H A 0084 CYS N 2.697 H A 0080 VAL O
H A 0084 CYS N 2.195 H A 0083 ALA O
H A 0085 HIS N 3.018 H A 0081 THR O
H A 0085 HIS N 2.195 H A 0084 CYS O
H A 0086 GLU N 3.068 H A 0083 ALA O
H A 0086 GLU N 2.196 H A 0085 HIS O
H A 0087 PHE N 2.934 H A 0084 CYS O
H A 0087 PHE N 3.006 H A 0085 HIS O
H A 0087 PHE N 2.194 H A 0086 GLU O
H A 0088 PHE N 2.872 H A 0085 HIS O
H A 0088 PHE N 2.869 H A 0086 GLU O
H A 0088 PHE N 2.196 H A 0087 PHE O
C A 0089 GLU N 2.195 H A 0088 PHE O
C A 0090 HIS N 2.191 C A 0089 GLU O
C A 0091 GLU N 2.196 C A 0090 HIS O
HB_MS 2.00 3.20 14
H A 0014 PHE O 2.429 H A 0018 SER OG
H A 0019 GLY N 2.746 H A 0018 SER OG
C A 0024 LYS N 2.812 C A 0023 ASP OD1
C A 0025 HIS N 2.622 C A 0023 ASP OD1
C A 0042 HIS N 3.169 C A 0041 SER OG
H A 0055 LYS O 3.071 H A 0059 THR OG1
C A 0063 ASP N 3.195 H A 0061 ASP OD1
C A 0064 GLY N 2.716 H A 0061 ASP OD1
C A 0066 GLY N 2.399 H A 0061 ASP OD2
C A 0066 GLY N 2.905 C A 0065 ASP OD1
E A 0067 GLU N 2.392 H A 0061 ASP OD2
E A 0067 GLU N 2.860 C A 0065 ASP OD1
H A 0077 VAL O 2.632 H A 0081 THR OG1
H A 0078 SER O 2.636 H A 0082 THR OG1
HB_SS 2.00 3.20 2
H A 0039 GLU OE2 2.963 H A 0038 ASN ND2
C A 0042 HIS ND1 2.634 C A 0041 SER OG
AROMATIC 0.00 8.00 4
H A 0017 TYR 4.813 H A 0073 PHE
C A 0024 LYS 6.595 H A 0014 PHE
C A 0024 LYS 4.125 H A 0015 HIS
H A 0087 PHE 5.659 H A 0088 PHE
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 24
H A 0003 LEU CB 3.669 H B 0039 GLU CG
H A 0004 GLU CD 3.214 C B 0043 PHE CE1
H A 0004 GLU CD 3.157 C B 0043 PHE CZ
H A 0005 LYS CE 3.741 H B 0009 ALA CB
H A 0006 ALA CB 3.676 H B 0009 ALA CB
H A 0006 ALA CB 3.481 H B 0010 LEU CD1
H A 0009 ALA CB 3.736 H B 0005 LYS CE
H A 0009 ALA CB 3.657 H B 0006 ALA CB
H A 0010 LEU CD1 3.476 H B 0006 ALA CB
H A 0015 HIS CE1 3.358 H B 0085 HIS CD2
H A 0039 GLU CG 3.660 H B 0003 LEU CB
C A 0043 PHE CE1 3.221 H B 0004 GLU CD
C A 0043 PHE CZ 3.154 H B 0004 GLU CD
H A 0070 PHE CD1 3.644 H B 0082 THR CG2
H A 0070 PHE CE1 3.340 H B 0082 THR CG2
H A 0074 MET CG 3.627 H B 0078 SER CB
H A 0074 MET CE 3.434 H B 0078 SER CA
H A 0074 MET CE 3.705 H B 0078 SER CB
H A 0078 SER CA 3.456 H B 0074 MET CE
H A 0078 SER CB 3.636 H B 0074 MET CG
H A 0078 SER CB 3.730 H B 0074 MET CE
H A 0082 THR CG2 3.646 H B 0070 PHE CD1
H A 0082 THR CG2 3.340 H B 0070 PHE CE1
H A 0085 HIS CD2 3.349 H B 0015 HIS CE1
CHARGE_ATTR 2.00 12.00 48
H A 0002 GLU OE1 8.770 H B 0005 LYS NZ
H A 0002 GLU OE2 9.244 H B 0005 LYS NZ
H A 0002 GLU OE1 10.35 H B 0015 HIS ND1
H A 0002 GLU OE2 11.54 H B 0015 HIS ND1
H A 0004 GLU OE1 11.45 H B 0005 LYS NZ
H A 0004 GLU OE2 11.47 H B 0005 LYS NZ
H A 0004 GLU OE1 10.15 C B 0042 HIS ND1
H A 0004 GLU OE2 10.55 C B 0042 HIS ND1
H A 0005 LYS NZ 8.772 H B 0002 GLU OE1
H A 0005 LYS NZ 9.256 H B 0002 GLU OE2
H A 0005 LYS NZ 11.44 H B 0004 GLU OE1
H A 0005 LYS NZ 11.49 H B 0004 GLU OE2
H A 0005 LYS NZ 9.959 H B 0012 ASP OD1
H A 0005 LYS NZ 7.997 H B 0012 ASP OD2
H A 0012 ASP OD1 9.958 H B 0005 LYS NZ
H A 0012 ASP OD2 8.001 H B 0005 LYS NZ
H A 0012 ASP OD1 10.29 H B 0085 HIS ND1
H A 0012 ASP OD1 8.677 H B 0085 HIS NE2
H A 0012 ASP OD2 10.67 H B 0085 HIS NE2
H A 0015 HIS ND1 10.35 H B 0002 GLU OE1
H A 0015 HIS ND1 11.54 H B 0002 GLU OE2
H A 0015 HIS ND1 11.30 H B 0086 GLU OE1
H A 0015 HIS NE2 9.652 H B 0086 GLU OE1
H A 0015 HIS NE2 10.87 H B 0086 GLU OE2
C A 0023 ASP OD1 11.54 H B 0085 HIS NE2
C A 0023 ASP OD1 11.18 C B 0090 HIS NE2
C A 0024 LYS NZ 10.62 H B 0086 GLU OE1
C A 0024 LYS NZ 11.41 H B 0086 GLU OE2
C A 0025 HIS ND1 11.73 H B 0086 GLU OE1
C A 0025 HIS NE2 10.05 H B 0086 GLU OE1
C A 0025 HIS NE2 10.30 H B 0086 GLU OE2
C A 0042 HIS ND1 10.17 H B 0004 GLU OE1
C A 0042 HIS ND1 10.54 H B 0004 GLU OE2
H A 0069 ASP OD1 12.00 H B 0085 HIS ND1
H A 0085 HIS ND1 10.28 H B 0012 ASP OD1
H A 0085 HIS NE2 8.668 H B 0012 ASP OD1
H A 0085 HIS NE2 10.66 H B 0012 ASP OD2
H A 0085 HIS NE2 11.52 C B 0023 ASP OD1
H A 0085 HIS ND1 11.97 H B 0069 ASP OD1
H A 0086 GLU OE1 11.30 H B 0015 HIS ND1
H A 0086 GLU OE1 9.640 H B 0015 HIS NE2
H A 0086 GLU OE2 10.86 H B 0015 HIS NE2
H A 0086 GLU OE1 10.56 C B 0024 LYS NZ
H A 0086 GLU OE2 11.34 C B 0024 LYS NZ
H A 0086 GLU OE1 11.67 C B 0025 HIS ND1
H A 0086 GLU OE1 9.977 C B 0025 HIS NE2
H A 0086 GLU OE2 10.24 C B 0025 HIS NE2
C A 0090 HIS NE2 11.13 C B 0023 ASP OD1
CHARGE_REPU 2.00 12.00 64
H A 0002 GLU OE1 5.959 H B 0012 ASP OD1
H A 0002 GLU OE1 4.490 H B 0012 ASP OD2
H A 0002 GLU OE2 6.903 H B 0012 ASP OD1
H A 0002 GLU OE2 5.266 H B 0012 ASP OD2
H A 0002 GLU OE1 10.44 H B 0039 GLU OE1
H A 0002 GLU OE1 8.551 H B 0039 GLU OE2
H A 0002 GLU OE2 11.46 H B 0039 GLU OE1
H A 0002 GLU OE2 9.498 H B 0039 GLU OE2
H A 0004 GLU OE1 9.378 H B 0039 GLU OE1
H A 0004 GLU OE1 9.237 H B 0039 GLU OE2
H A 0004 GLU OE2 11.25 H B 0039 GLU OE1
H A 0004 GLU OE2 11.25 H B 0039 GLU OE2
H A 0005 LYS NZ 2.887 H B 0005 LYS NZ
H A 0012 ASP OD1 5.935 H B 0002 GLU OE1
H A 0012 ASP OD1 6.888 H B 0002 GLU OE2
H A 0012 ASP OD2 4.464 H B 0002 GLU OE1
H A 0012 ASP OD2 5.249 H B 0002 GLU OE2
H A 0015 HIS ND1 6.330 H B 0085 HIS ND1
H A 0015 HIS ND1 4.164 H B 0085 HIS NE2
H A 0015 HIS NE2 4.768 H B 0085 HIS ND1
H A 0015 HIS NE2 2.623 H B 0085 HIS NE2
H A 0015 HIS NE2 11.48 C B 0090 HIS ND1
H A 0015 HIS NE2 10.91 C B 0090 HIS NE2
C A 0024 LYS NZ 6.925 H B 0085 HIS ND1
C A 0024 LYS NZ 5.255 H B 0085 HIS NE2
C A 0024 LYS NZ 9.789 C B 0090 HIS ND1
C A 0024 LYS NZ 8.677 C B 0090 HIS NE2
C A 0025 HIS ND1 10.29 H B 0085 HIS ND1
C A 0025 HIS ND1 9.766 H B 0085 HIS NE2
C A 0025 HIS NE2 9.111 H B 0085 HIS ND1
C A 0025 HIS NE2 8.780 H B 0085 HIS NE2
C A 0025 HIS ND1 9.985 C B 0090 HIS ND1
C A 0025 HIS ND1 7.948 C B 0090 HIS NE2
C A 0025 HIS NE2 7.857 C B 0090 HIS ND1
C A 0025 HIS NE2 5.889 C B 0090 HIS NE2
H A 0039 GLU OE1 10.48 H B 0002 GLU OE1
H A 0039 GLU OE1 11.49 H B 0002 GLU OE2
H A 0039 GLU OE2 8.579 H B 0002 GLU OE1
H A 0039 GLU OE2 9.520 H B 0002 GLU OE2
H A 0039 GLU OE1 9.380 H B 0004 GLU OE1
H A 0039 GLU OE1 11.23 H B 0004 GLU OE2
H A 0039 GLU OE2 9.213 H B 0004 GLU OE1
H A 0039 GLU OE2 11.22 H B 0004 GLU OE2
C A 0062 GLU OE1 11.18 C B 0062 GLU OE1
C A 0062 GLU OE1 11.73 C B 0062 GLU OE2
C A 0062 GLU OE2 11.72 C B 0062 GLU OE1
H A 0085 HIS ND1 6.321 H B 0015 HIS ND1
H A 0085 HIS ND1 4.743 H B 0015 HIS NE2
H A 0085 HIS NE2 4.155 H B 0015 HIS ND1
H A 0085 HIS NE2 2.603 H B 0015 HIS NE2
H A 0085 HIS ND1 6.877 C B 0024 LYS NZ
H A 0085 HIS NE2 5.227 C B 0024 LYS NZ
H A 0085 HIS ND1 10.25 C B 0025 HIS ND1
H A 0085 HIS ND1 9.072 C B 0025 HIS NE2
H A 0085 HIS NE2 9.747 C B 0025 HIS ND1
H A 0085 HIS NE2 8.757 C B 0025 HIS NE2
C A 0090 HIS ND1 11.44 H B 0015 HIS NE2
C A 0090 HIS NE2 10.91 H B 0015 HIS NE2
C A 0090 HIS ND1 9.697 C B 0024 LYS NZ
C A 0090 HIS NE2 8.615 C B 0024 LYS NZ
C A 0090 HIS ND1 9.906 C B 0025 HIS ND1
C A 0090 HIS ND1 7.780 C B 0025 HIS NE2
C A 0090 HIS NE2 7.883 C B 0025 HIS ND1
C A 0090 HIS NE2 5.831 C B 0025 HIS NE2
AROMATIC 0.00 8.00 4
H A 0085 HIS 6.443 C B 0024 LYS
H A 0085 HIS 5.328 H B 0014 PHE
H A 0014 PHE 5.358 H B 0085 HIS
C A 0024 LYS 6.477 H B 0085 HIS
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "X"
HYDROPHOBIC 2.00 3.80 18
C A 0045 GLU CB 3.348 H X 0007 TRP CE2
C A 0045 GLU CB 3.403 H X 0007 TRP CZ2
C A 0045 GLU CG 3.749 H X 0007 TRP CD2
C A 0045 GLU CG 3.269 H X 0007 TRP CE2
C A 0045 GLU CG 3.342 H X 0007 TRP CZ2
C A 0045 GLU CD 3.780 H X 0007 TRP CE2
C A 0045 GLU CD 3.287 H X 0007 TRP CZ2
C A 0045 GLU CD 3.345 H X 0007 TRP CH2
C A 0047 ILE CD1 3.520 H X 0007 TRP CZ2
H A 0052 VAL CG1 3.773 H X 0007 TRP CD2
H A 0052 VAL CG1 3.443 H X 0007 TRP CE2
H A 0052 VAL CG1 3.582 H X 0007 TRP CZ2
H A 0055 LYS CB 3.735 H X 0011 LEU CD2
H A 0056 VAL CG2 3.653 H X 0007 TRP CZ3
H A 0056 VAL CG2 3.350 H X 0007 TRP CH2
H A 0056 VAL CG2 3.725 H X 0011 LEU CD2
H A 0079 MET CE 3.292 H X 0010 ILE CG2
H A 0083 ALA CB 3.591 H X 0010 ILE CG1
CHARGE_ATTR 2.00 12.00 11
C A 0045 GLU OE1 9.714 C X 0004 LYS NZ
C A 0045 GLU OE2 10.07 C X 0004 LYS NZ
C A 0045 GLU OE2 12.00 H X 0009 LYS NZ
C A 0046 GLU OE1 11.16 C X 0002 ARG NH2
C A 0046 GLU OE1 3.608 C X 0004 LYS NZ
C A 0046 GLU OE2 5.736 C X 0004 LYS NZ
C A 0048 LYS NZ 10.29 H X 0006 ASP OD1
H A 0086 GLU OE1 4.817 H X 0009 LYS NZ
H A 0086 GLU OE2 4.358 H X 0009 LYS NZ
C A 0089 GLU OE1 9.977 H X 0009 LYS NZ
C A 0089 GLU OE2 7.989 H X 0009 LYS NZ
CHARGE_REPU 2.00 12.00 14
C A 0042 HIS ND1 11.54 C X 0002 ARG NH1
C A 0042 HIS ND1 9.471 C X 0002 ARG NH2
C A 0042 HIS NE2 10.98 C X 0002 ARG NH2
C A 0042 HIS ND1 6.829 C X 0004 LYS NZ
C A 0042 HIS NE2 6.463 C X 0004 LYS NZ
C A 0045 GLU OE1 10.80 H X 0006 ASP OD1
C A 0045 GLU OE2 9.472 H X 0006 ASP OD1
C A 0045 GLU OE2 11.12 H X 0006 ASP OD2
C A 0046 GLU OE1 11.85 H X 0006 ASP OD1
C A 0048 LYS NZ 7.157 C X 0004 LYS NZ
H A 0051 GLU OE2 11.10 H X 0006 ASP OD1
H A 0085 HIS ND1 9.580 H X 0009 LYS NZ
H A 0085 HIS NE2 11.63 H X 0009 LYS NZ
H A 0086 GLU OE2 11.91 H X 0006 ASP OD2
AROMATIC 0.00 8.00 1
C A 0043 PHE 5.888 C X 0002 ARG
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "Y"
CHARGE_ATTR 2.00 12.00 4
H A 0004 GLU OE1 10.77 C Y 0002 ARG NH1
H A 0004 GLU OE1 8.952 C Y 0002 ARG NH2
H A 0004 GLU OE2 9.016 C Y 0002 ARG NH1
H A 0004 GLU OE2 7.388 C Y 0002 ARG NH2
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 354
H B 0001 SER C 2.424 H B 0002 GLU CA
H B 0001 SER C 2.973 H B 0002 GLU C
H B 0001 SER C 3.698 H B 0002 GLU CB
H B 0002 GLU C 2.413 H B 0003 LEU CA
H B 0002 GLU C 2.845 H B 0003 LEU C
H B 0002 GLU C 3.689 H B 0003 LEU CB
H B 0003 LEU C 2.418 H B 0004 GLU CA
H B 0003 LEU C 3.034 H B 0004 GLU C
H B 0003 LEU C 3.678 H B 0004 GLU CB
H B 0004 GLU C 2.422 H B 0005 LYS CA
H B 0004 GLU C 3.049 H B 0005 LYS C
H B 0004 GLU C 3.701 H B 0005 LYS CB
H B 0005 LYS C 2.413 H B 0006 ALA CA
H B 0005 LYS C 3.000 H B 0006 ALA C
H B 0005 LYS C 3.689 H B 0006 ALA CB
H B 0006 ALA C 2.416 H B 0007 MET CA
H B 0006 ALA C 2.951 H B 0007 MET C
H B 0006 ALA C 3.708 H B 0007 MET CB
H B 0007 MET C 2.415 H B 0008 VAL CA
H B 0007 MET C 2.915 H B 0008 VAL C
H B 0007 MET C 3.687 H B 0008 VAL CB
H B 0008 VAL CA 3.789 H B 0009 ALA CA
H B 0008 VAL C 2.411 H B 0009 ALA CA
H B 0008 VAL C 2.974 H B 0009 ALA C
H B 0008 VAL C 3.686 H B 0009 ALA CB
H B 0009 ALA C 2.423 H B 0010 LEU CA
H B 0009 ALA C 2.981 H B 0010 LEU C
H B 0009 ALA C 3.713 H B 0010 LEU CB
H B 0010 LEU C 2.415 H B 0011 ILE CA
H B 0010 LEU C 2.960 H B 0011 ILE C
H B 0010 LEU C 3.693 H B 0011 ILE CB
H B 0011 ILE C 2.413 H B 0012 ASP CA
H B 0011 ILE C 3.032 H B 0012 ASP C
H B 0011 ILE C 3.685 H B 0012 ASP CB
H B 0012 ASP C 2.424 H B 0013 VAL CA
H B 0012 ASP C 2.916 H B 0013 VAL C
H B 0012 ASP C 3.715 H B 0013 VAL CB
H B 0013 VAL C 2.413 H B 0014 PHE CA
H B 0013 VAL C 2.936 H B 0014 PHE C
H B 0013 VAL C 3.673 H B 0014 PHE CB
H B 0014 PHE C 2.426 H B 0015 HIS CA
H B 0014 PHE C 3.182 H B 0015 HIS C
H B 0014 PHE C 3.661 H B 0015 HIS CB
H B 0014 PHE CD2 3.227 H B 0015 HIS CD2
H B 0014 PHE CE2 3.558 H B 0015 HIS CD2
H B 0014 PHE CE1 3.792 H B 0070 PHE CA
H B 0014 PHE CE1 3.403 H B 0070 PHE CB
H B 0014 PHE CZ 3.624 H B 0070 PHE CB
H B 0015 HIS C 2.418 H B 0016 GLN CA
H B 0015 HIS C 3.004 H B 0016 GLN C
H B 0015 HIS C 3.690 H B 0016 GLN CB
H B 0015 HIS CD2 3.577 C B 0024 LYS CE
H B 0016 GLN C 2.440 H B 0017 TYR CA
H B 0016 GLN C 3.437 H B 0017 TYR C
H B 0016 GLN C 3.544 H B 0017 TYR CB
H B 0017 TYR C 2.426 H B 0018 SER CA
H B 0017 TYR C 3.007 H B 0018 SER C
H B 0017 TYR C 3.694 H B 0018 SER CB
H B 0017 TYR CD1 3.695 H B 0018 SER CA
H B 0017 TYR CE1 3.650 E B 0027 LEU CD1
H B 0017 TYR CE1 3.415 E B 0027 LEU CD2
H B 0017 TYR CZ 3.761 E B 0027 LEU CD1
H B 0017 TYR CD1 3.637 H B 0035 LEU CB
H B 0017 TYR CD2 3.376 H B 0035 LEU CD2
H B 0017 TYR CE1 3.692 H B 0035 LEU CB
H B 0017 TYR CE2 3.789 H B 0035 LEU CG
H B 0017 TYR CE2 3.448 H B 0035 LEU CD2
H B 0017 TYR CZ 3.711 H B 0035 LEU CG
H B 0017 TYR CE2 3.672 H B 0073 PHE CE2
H B 0017 TYR CE2 3.427 H B 0073 PHE CZ
H B 0017 TYR CZ 3.764 H B 0073 PHE CE1
H B 0017 TYR CZ 3.660 H B 0073 PHE CE2
H B 0017 TYR CZ 3.606 H B 0073 PHE CZ
H B 0018 SER C 2.427 H B 0019 GLY CA
H B 0018 SER C 3.236 H B 0019 GLY C
H B 0018 SER CA 3.475 E B 0027 LEU CD2
H B 0018 SER CB 3.395 E B 0027 LEU CD2
H B 0019 GLY C 2.407 C B 0020 ARG CA
H B 0019 GLY C 3.024 C B 0020 ARG C
H B 0019 GLY C 3.672 C B 0020 ARG CB
H B 0019 GLY CA 3.682 C B 0024 LYS CG
C B 0020 ARG C 2.417 C B 0021 GLU CA
C B 0020 ARG C 3.675 C B 0021 GLU C
C B 0020 ARG C 3.105 C B 0021 GLU CB
C B 0020 ARG CD 3.297 H B 0034 GLU CD
C B 0021 GLU C 2.426 C B 0022 GLY CA
C B 0021 GLU C 3.143 C B 0022 GLY C
C B 0022 GLY C 2.426 C B 0023 ASP CA
C B 0022 GLY C 3.174 C B 0023 ASP C
C B 0022 GLY C 3.661 C B 0023 ASP CB
C B 0023 ASP C 2.427 C B 0024 LYS CA
C B 0023 ASP C 3.043 C B 0024 LYS C
C B 0023 ASP C 3.681 C B 0024 LYS CB
C B 0023 ASP CB 3.702 C B 0026 LYS CG
C B 0023 ASP CG 3.626 C B 0026 LYS CG
C B 0024 LYS C 2.431 C B 0025 HIS CA
C B 0024 LYS C 3.102 C B 0025 HIS C
C B 0024 LYS C 3.690 C B 0025 HIS CB
C B 0025 HIS C 2.445 C B 0026 LYS CA
C B 0025 HIS C 3.549 C B 0026 LYS C
C B 0025 HIS C 3.412 C B 0026 LYS CB
C B 0026 LYS C 2.445 E B 0027 LEU CA
C B 0026 LYS C 3.387 E B 0027 LEU C
C B 0026 LYS C 3.588 E B 0027 LEU CB
C B 0026 LYS C 3.742 E B 0027 LEU CG
C B 0026 LYS CD 3.660 E B 0067 GLU CD
E B 0027 LEU C 2.429 E B 0028 LYS CA
E B 0027 LEU C 3.289 E B 0028 LYS C
E B 0027 LEU C 3.613 E B 0028 LYS CB
E B 0027 LEU CD1 3.461 H B 0073 PHE CB
E B 0028 LYS C 2.430 H B 0029 LYS CA
E B 0028 LYS C 2.868 H B 0029 LYS C
E B 0028 LYS C 3.671 H B 0029 LYS CB
E B 0028 LYS CG 3.761 H B 0029 LYS CG
H B 0029 LYS C 2.418 H B 0030 SER CA
H B 0029 LYS C 2.992 H B 0030 SER C
H B 0029 LYS C 3.700 H B 0030 SER CB
H B 0029 LYS CA 3.503 H B 0057 MET CE
H B 0029 LYS CB 3.618 H B 0057 MET CE
H B 0030 SER C 2.422 H B 0031 GLU CA
H B 0030 SER C 3.032 H B 0031 GLU C
H B 0030 SER C 3.701 H B 0031 GLU CB
H B 0031 GLU C 2.416 H B 0032 LEU CA
H B 0031 GLU C 2.978 H B 0032 LEU C
H B 0031 GLU C 3.709 H B 0032 LEU CB
H B 0032 LEU C 2.403 H B 0033 LYS CA
H B 0032 LEU C 2.863 H B 0033 LYS C
H B 0032 LEU C 3.687 H B 0033 LYS CB
H B 0032 LEU CD2 3.678 H B 0036 ILE CD1
H B 0032 LEU CD2 3.683 H B 0060 LEU CD1
H B 0033 LYS CA 3.793 H B 0034 GLU CA
H B 0033 LYS C 2.404 H B 0034 GLU CA
H B 0033 LYS C 2.979 H B 0034 GLU C
H B 0033 LYS C 3.682 H B 0034 GLU CB
H B 0033 LYS CB 3.736 H B 0053 VAL CG2
H B 0033 LYS CG 3.645 H B 0053 VAL CG2
H B 0034 GLU C 2.423 H B 0035 LEU CA
H B 0034 GLU C 2.954 H B 0035 LEU C
H B 0034 GLU C 3.683 H B 0035 LEU CB
H B 0034 GLU C 3.766 H B 0038 ASN CB
H B 0035 LEU C 2.417 H B 0036 ILE CA
H B 0035 LEU C 3.017 H B 0036 ILE C
H B 0035 LEU C 3.689 H B 0036 ILE CB
H B 0035 LEU CD1 3.647 H B 0036 ILE CA
H B 0035 LEU CD2 3.390 H B 0039 GLU CD
H B 0036 ILE C 2.434 H B 0037 ASN CA
H B 0036 ILE C 3.192 H B 0037 ASN C
H B 0036 ILE C 3.670 H B 0037 ASN CB
H B 0036 ILE CG2 3.638 C B 0047 ILE CG1
H B 0036 ILE CG2 3.324 C B 0047 ILE CD1
H B 0036 ILE CD1 3.734 H B 0056 VAL CG1
H B 0037 ASN C 2.433 H B 0038 ASN CA
H B 0037 ASN C 3.259 H B 0038 ASN C
H B 0037 ASN C 3.650 H B 0038 ASN CB
H B 0038 ASN C 2.439 H B 0039 GLU CA
H B 0038 ASN C 3.333 H B 0039 GLU C
H B 0038 ASN C 3.601 H B 0039 GLU CB
H B 0038 ASN C 3.488 H B 0039 GLU CD
H B 0039 GLU C 2.442 H B 0040 LEU CA
H B 0039 GLU C 3.492 H B 0040 LEU C
H B 0039 GLU C 3.473 H B 0040 LEU CB
H B 0039 GLU C 3.401 H B 0040 LEU CG
H B 0039 GLU C 3.528 H B 0040 LEU CD2
H B 0040 LEU C 2.430 C B 0041 SER CA
H B 0040 LEU C 2.877 C B 0041 SER C
H B 0040 LEU C 3.673 C B 0041 SER CB
C B 0041 SER C 2.447 C B 0042 HIS CA
C B 0041 SER C 3.517 C B 0042 HIS C
C B 0041 SER C 3.465 C B 0042 HIS CB
C B 0041 SER C 3.430 C B 0042 HIS CG
C B 0042 HIS C 2.418 C B 0043 PHE CA
C B 0042 HIS C 3.046 C B 0043 PHE C
C B 0042 HIS C 3.690 C B 0043 PHE CB
C B 0042 HIS CD2 3.510 C B 0046 GLU CD
C B 0043 PHE C 2.427 C B 0044 LEU CA
C B 0043 PHE C 3.675 C B 0044 LEU C
C B 0043 PHE C 3.201 C B 0044 LEU CB
C B 0043 PHE C 3.460 C B 0044 LEU CG
C B 0044 LEU C 2.443 C B 0045 GLU CA
C B 0044 LEU C 3.492 C B 0045 GLU C
C B 0044 LEU C 3.468 C B 0045 GLU CB
C B 0044 LEU C 3.601 C B 0045 GLU CG
C B 0044 LEU CD1 3.798 C B 0045 GLU CB
C B 0044 LEU CD1 3.459 C B 0045 GLU CG
C B 0044 LEU CD1 3.648 C B 0045 GLU CD
C B 0044 LEU CD1 3.584 H B 0080 VAL CG1
C B 0045 GLU C 2.443 C B 0046 GLU CA
C B 0045 GLU C 3.358 C B 0046 GLU C
C B 0045 GLU C 3.578 C B 0046 GLU CB
C B 0046 GLU C 2.440 C B 0047 ILE CA
C B 0046 GLU C 3.367 C B 0047 ILE C
C B 0046 GLU C 3.583 C B 0047 ILE CB
C B 0046 GLU C 3.571 C B 0047 ILE CG1
C B 0046 GLU C 3.372 C B 0047 ILE CD1
C B 0047 ILE CA 3.797 C B 0048 LYS CA
C B 0047 ILE C 2.427 C B 0048 LYS CA
C B 0047 ILE C 3.555 C B 0048 LYS C
C B 0047 ILE C 3.381 C B 0048 LYS CB
C B 0047 ILE C 3.362 C B 0048 LYS CG
C B 0047 ILE CG2 3.682 H B 0053 VAL CG2
C B 0048 LYS C 2.449 H B 0049 GLU CA
C B 0048 LYS C 3.531 H B 0049 GLU C
C B 0048 LYS C 3.452 H B 0049 GLU CB
C B 0048 LYS C 3.478 H B 0049 GLU CG
H B 0049 GLU C 2.411 H B 0050 GLN CA
H B 0049 GLU C 3.092 H B 0050 GLN C
H B 0049 GLU C 3.660 H B 0050 GLN CB
H B 0049 GLU CB 3.722 H B 0051 GLU CG
H B 0050 GLN C 2.434 H B 0051 GLU CA
H B 0050 GLN C 2.980 H B 0051 GLU C
H B 0050 GLN C 3.719 H B 0051 GLU CB
H B 0051 GLU C 2.408 H B 0052 VAL CA
H B 0051 GLU C 2.908 H B 0052 VAL C
H B 0051 GLU C 3.693 H B 0052 VAL CB
H B 0052 VAL CA 3.773 H B 0053 VAL CA
H B 0052 VAL C 2.411 H B 0053 VAL CA
H B 0052 VAL C 2.955 H B 0053 VAL C
H B 0052 VAL C 3.650 H B 0053 VAL CB
H B 0052 VAL C 3.785 H B 0056 VAL CG2
H B 0053 VAL C 2.404 H B 0054 ASP CA
H B 0053 VAL C 2.976 H B 0054 ASP C
H B 0053 VAL C 3.687 H B 0054 ASP CB
H B 0054 ASP C 2.412 H B 0055 LYS CA
H B 0054 ASP C 3.024 H B 0055 LYS C
H B 0054 ASP C 3.684 H B 0055 LYS CB
H B 0055 LYS C 2.424 H B 0056 VAL CA
H B 0055 LYS C 3.036 H B 0056 VAL C
H B 0055 LYS C 3.689 H B 0056 VAL CB
H B 0056 VAL C 2.425 H B 0057 MET CA
H B 0056 VAL C 3.057 H B 0057 MET C
H B 0056 VAL C 3.700 H B 0057 MET CB
H B 0056 VAL CG1 3.707 H B 0076 PHE CD1
H B 0056 VAL CG1 3.373 H B 0076 PHE CE1
H B 0057 MET C 2.395 H B 0058 GLU CA
H B 0057 MET C 2.877 H B 0058 GLU C
H B 0057 MET C 3.697 H B 0058 GLU CB
H B 0057 MET C 3.765 H B 0061 ASP CB
H B 0058 GLU C 2.421 H B 0059 THR CA
H B 0058 GLU C 3.081 H B 0059 THR C
H B 0058 GLU C 3.691 H B 0059 THR CB
H B 0059 THR C 2.449 H B 0060 LEU CA
H B 0059 THR C 3.335 H B 0060 LEU C
H B 0059 THR C 3.620 H B 0060 LEU CB
H B 0059 THR C 3.681 H B 0060 LEU CG
H B 0060 LEU CA 3.785 H B 0061 ASP CA
H B 0060 LEU C 2.415 H B 0061 ASP CA
H B 0060 LEU C 3.014 H B 0061 ASP C
H B 0060 LEU C 3.673 H B 0061 ASP CB
H B 0060 LEU CD1 3.686 H B 0076 PHE CB
H B 0060 LEU CD2 3.685 H B 0076 PHE CA
H B 0060 LEU CD2 3.657 H B 0076 PHE CB
H B 0061 ASP CA 3.789 C B 0062 GLU CA
H B 0061 ASP C 2.408 C B 0062 GLU CA
H B 0061 ASP C 2.999 C B 0062 GLU C
H B 0061 ASP C 3.690 C B 0062 GLU CB
H B 0061 ASP CG 3.786 E B 0067 GLU C
C B 0062 GLU C 2.416 C B 0063 ASP CA
C B 0062 GLU C 3.190 C B 0063 ASP C
C B 0062 GLU C 3.620 C B 0063 ASP CB
C B 0063 ASP C 2.420 C B 0064 GLY CA
C B 0063 ASP C 3.119 C B 0064 GLY C
C B 0063 ASP CB 3.737 C B 0065 ASP CG
C B 0064 GLY CA 3.789 C B 0065 ASP CA
C B 0064 GLY C 2.409 C B 0065 ASP CA
C B 0064 GLY C 3.100 C B 0065 ASP C
C B 0064 GLY C 3.655 C B 0065 ASP CB
C B 0065 ASP C 2.425 C B 0066 GLY CA
C B 0065 ASP C 3.006 C B 0066 GLY C
C B 0065 ASP CG 3.599 E B 0067 GLU CB
C B 0066 GLY C 2.434 E B 0067 GLU CA
C B 0066 GLY C 3.622 E B 0067 GLU C
C B 0066 GLY C 3.298 E B 0067 GLU CB
C B 0066 GLY C 3.215 E B 0067 GLU CG
E B 0067 GLU C 2.443 E B 0068 CYS CA
E B 0067 GLU C 3.549 E B 0068 CYS C
E B 0067 GLU C 3.386 E B 0068 CYS CB
E B 0068 CYS C 2.418 H B 0069 ASP CA
E B 0068 CYS C 3.174 H B 0069 ASP C
E B 0068 CYS C 3.644 H B 0069 ASP CB
H B 0069 ASP CA 3.795 H B 0070 PHE CA
H B 0069 ASP C 2.406 H B 0070 PHE CA
H B 0069 ASP C 2.887 H B 0070 PHE C
H B 0069 ASP C 3.665 H B 0070 PHE CB
H B 0070 PHE C 2.427 H B 0071 GLN CA
H B 0070 PHE C 3.002 H B 0071 GLN C
H B 0070 PHE C 3.707 H B 0071 GLN CB
H B 0070 PHE CD1 3.651 H B 0071 GLN CA
H B 0071 GLN C 2.424 H B 0072 GLU CA
H B 0071 GLN C 3.062 H B 0072 GLU C
H B 0071 GLN C 3.687 H B 0072 GLU CB
H B 0072 GLU C 2.421 H B 0073 PHE CA
H B 0072 GLU C 3.025 H B 0073 PHE C
H B 0072 GLU C 3.686 H B 0073 PHE CB
H B 0073 PHE C 2.408 H B 0074 MET CA
H B 0073 PHE C 2.949 H B 0074 MET C
H B 0073 PHE C 3.683 H B 0074 MET CB
H B 0074 MET C 2.409 H B 0075 ALA CA
H B 0074 MET C 3.031 H B 0075 ALA C
H B 0074 MET C 3.676 H B 0075 ALA CB
H B 0075 ALA C 2.408 H B 0076 PHE CA
H B 0075 ALA C 2.920 H B 0076 PHE C
H B 0075 ALA C 3.684 H B 0076 PHE CB
H B 0076 PHE CA 3.795 H B 0077 VAL CA
H B 0076 PHE C 2.409 H B 0077 VAL CA
H B 0076 PHE C 2.933 H B 0077 VAL C
H B 0076 PHE C 3.689 H B 0077 VAL CB
H B 0076 PHE CE1 3.753 H B 0079 MET CE
H B 0076 PHE CE2 3.394 H B 0080 VAL CG2
H B 0076 PHE CZ 3.506 H B 0080 VAL CG2
H B 0077 VAL C 2.419 H B 0078 SER CA
H B 0077 VAL C 2.963 H B 0078 SER C
H B 0077 VAL C 3.692 H B 0078 SER CB
H B 0078 SER CA 3.796 H B 0079 MET CA
H B 0078 SER C 2.401 H B 0079 MET CA
H B 0078 SER C 2.943 H B 0079 MET C
H B 0078 SER C 3.684 H B 0079 MET CB
H B 0079 MET C 2.408 H B 0080 VAL CA
H B 0079 MET C 3.005 H B 0080 VAL C
H B 0079 MET C 3.687 H B 0080 VAL CB
H B 0080 VAL C 2.423 H B 0081 THR CA
H B 0080 VAL C 2.951 H B 0081 THR C
H B 0080 VAL C 3.709 H B 0081 THR CB
H B 0081 THR CA 3.798 H B 0082 THR CA
H B 0081 THR C 2.414 H B 0082 THR CA
H B 0081 THR C 3.015 H B 0082 THR C
H B 0081 THR C 3.684 H B 0082 THR CB
H B 0082 THR C 2.420 H B 0083 ALA CA
H B 0082 THR C 3.049 H B 0083 ALA C
H B 0082 THR C 3.680 H B 0083 ALA CB
H B 0083 ALA C 2.417 H B 0084 CYS CA
H B 0083 ALA C 2.958 H B 0084 CYS C
H B 0083 ALA C 3.696 H B 0084 CYS CB
H B 0084 CYS C 2.424 H B 0085 HIS CA
H B 0084 CYS C 2.963 H B 0085 HIS C
H B 0084 CYS C 3.702 H B 0085 HIS CB
H B 0085 HIS C 2.424 H B 0086 GLU CA
H B 0085 HIS C 2.922 H B 0086 GLU C
H B 0085 HIS C 3.713 H B 0086 GLU CB
H B 0086 GLU C 2.428 H B 0087 PHE CA
H B 0086 GLU C 2.887 H B 0087 PHE C
H B 0086 GLU C 3.698 H B 0087 PHE CB
H B 0087 PHE C 2.419 H B 0088 PHE CA
H B 0087 PHE C 3.172 H B 0088 PHE C
H B 0087 PHE C 3.657 H B 0088 PHE CB
H B 0088 PHE C 2.427 C B 0089 GLU CA
H B 0088 PHE C 3.294 C B 0089 GLU C
H B 0088 PHE C 3.598 C B 0089 GLU CB
H B 0088 PHE C 3.790 C B 0089 GLU CG
C B 0089 GLU C 2.419 C B 0090 HIS CA
C B 0089 GLU C 2.968 C B 0090 HIS C
C B 0089 GLU C 3.688 C B 0090 HIS CB
C B 0090 HIS C 2.420 C B 0091 GLU CA
C B 0090 HIS C 3.094 C B 0091 GLU C
C B 0090 HIS C 3.681 C B 0091 GLU CB
CHARGE_ATTR 2.00 12.00 132
H B 0002 GLU OE1 6.009 H B 0005 LYS NZ
H B 0002 GLU OE2 6.476 H B 0005 LYS NZ
H B 0004 GLU OE1 10.94 H B 0005 LYS NZ
H B 0004 GLU OE2 11.52 H B 0005 LYS NZ
H B 0012 ASP OD2 10.72 H B 0005 LYS NZ
H B 0012 ASP OD1 5.698 H B 0015 HIS ND1
H B 0012 ASP OD1 7.702 H B 0015 HIS NE2
H B 0012 ASP OD2 7.790 H B 0015 HIS ND1
H B 0012 ASP OD2 9.757 H B 0015 HIS NE2
H B 0012 ASP OD1 10.69 C B 0024 LYS NZ
C B 0021 GLU OE1 5.289 C B 0020 ARG NH1
C B 0021 GLU OE1 7.115 C B 0020 ARG NH2
C B 0021 GLU OE2 7.014 C B 0020 ARG NH1
C B 0021 GLU OE2 8.900 C B 0020 ARG NH2
C B 0021 GLU OE1 10.85 E B 0028 LYS NZ
C B 0021 GLU OE2 9.711 E B 0028 LYS NZ
C B 0023 ASP OD1 10.58 H B 0015 HIS NE2
C B 0023 ASP OD1 7.843 C B 0024 LYS NZ
C B 0023 ASP OD2 9.817 C B 0024 LYS NZ
C B 0023 ASP OD1 3.263 C B 0025 HIS ND1
C B 0023 ASP OD1 5.453 C B 0025 HIS NE2
C B 0023 ASP OD2 4.594 C B 0025 HIS ND1
C B 0023 ASP OD2 6.608 C B 0025 HIS NE2
C B 0023 ASP OD1 6.421 C B 0026 LYS NZ
C B 0023 ASP OD2 4.415 C B 0026 LYS NZ
C B 0023 ASP OD1 10.72 E B 0028 LYS NZ
C B 0023 ASP OD2 10.01 E B 0028 LYS NZ
H B 0031 GLU OE1 11.48 H B 0015 HIS NE2
H B 0031 GLU OE1 9.351 C B 0020 ARG NH1
H B 0031 GLU OE1 11.36 C B 0020 ARG NH2
H B 0031 GLU OE2 9.075 C B 0020 ARG NH1
H B 0031 GLU OE2 11.25 C B 0020 ARG NH2
H B 0031 GLU OE1 10.34 C B 0024 LYS NZ
H B 0031 GLU OE2 11.27 C B 0024 LYS NZ
H B 0031 GLU OE1 9.703 C B 0025 HIS ND1
H B 0031 GLU OE1 11.55 C B 0025 HIS NE2
H B 0031 GLU OE2 9.802 C B 0025 HIS ND1
H B 0031 GLU OE2 11.84 C B 0025 HIS NE2
H B 0031 GLU OE1 9.215 C B 0026 LYS NZ
H B 0031 GLU OE2 8.536 C B 0026 LYS NZ
H B 0031 GLU OE1 7.923 E B 0028 LYS NZ
H B 0031 GLU OE2 6.307 E B 0028 LYS NZ
H B 0034 GLU OE1 4.225 C B 0020 ARG NH1
H B 0034 GLU OE1 5.334 C B 0020 ARG NH2
H B 0034 GLU OE2 4.120 C B 0020 ARG NH1
H B 0034 GLU OE2 4.324 C B 0020 ARG NH2
H B 0034 GLU OE1 11.40 E B 0028 LYS NZ
H B 0034 GLU OE1 8.487 H B 0033 LYS NZ
H B 0034 GLU OE2 9.343 H B 0033 LYS NZ
H B 0039 GLU OE1 10.97 C B 0020 ARG NH1
H B 0039 GLU OE1 10.93 C B 0020 ARG NH2
H B 0039 GLU OE2 10.66 C B 0020 ARG NH1
H B 0039 GLU OE2 10.49 C B 0020 ARG NH2
H B 0039 GLU OE1 10.87 H B 0033 LYS NZ
H B 0039 GLU OE1 11.59 C B 0042 HIS ND1
C B 0045 GLU OE1 11.72 H B 0033 LYS NZ
C B 0045 GLU OE1 11.67 C B 0042 HIS ND1
C B 0045 GLU OE1 11.57 C B 0048 LYS NZ
C B 0046 GLU OE1 11.05 H B 0033 LYS NZ
C B 0046 GLU OE2 9.746 H B 0033 LYS NZ
C B 0046 GLU OE1 5.714 C B 0042 HIS ND1
C B 0046 GLU OE1 4.239 C B 0042 HIS NE2
C B 0046 GLU OE2 5.712 C B 0042 HIS ND1
C B 0046 GLU OE2 3.683 C B 0042 HIS NE2
C B 0046 GLU OE1 5.118 C B 0048 LYS NZ
C B 0046 GLU OE2 5.155 C B 0048 LYS NZ
H B 0049 GLU OE1 11.35 H B 0029 LYS NZ
H B 0049 GLU OE1 9.011 H B 0033 LYS NZ
H B 0049 GLU OE2 9.316 H B 0033 LYS NZ
H B 0049 GLU OE1 7.972 C B 0048 LYS NZ
H B 0049 GLU OE2 6.647 C B 0048 LYS NZ
H B 0049 GLU OE1 11.74 H B 0055 LYS NZ
H B 0051 GLU OE2 11.70 H B 0033 LYS NZ
H B 0051 GLU OE1 8.980 C B 0048 LYS NZ
H B 0051 GLU OE2 6.853 C B 0048 LYS NZ
H B 0051 GLU OE1 6.527 H B 0055 LYS NZ
H B 0051 GLU OE2 7.687 H B 0055 LYS NZ
H B 0054 ASP OD1 11.64 E B 0028 LYS NZ
H B 0054 ASP OD1 3.321 H B 0029 LYS NZ
H B 0054 ASP OD2 4.626 H B 0029 LYS NZ
H B 0054 ASP OD1 10.84 H B 0033 LYS NZ
H B 0054 ASP OD2 11.30 H B 0033 LYS NZ
H B 0054 ASP OD1 9.385 H B 0055 LYS NZ
H B 0054 ASP OD2 8.352 H B 0055 LYS NZ
H B 0058 GLU OE1 10.92 H B 0029 LYS NZ
H B 0058 GLU OE2 9.426 H B 0029 LYS NZ
H B 0058 GLU OE1 6.097 H B 0055 LYS NZ
H B 0058 GLU OE2 6.784 H B 0055 LYS NZ
H B 0061 ASP OD1 10.76 C B 0026 LYS NZ
H B 0061 ASP OD2 10.03 C B 0026 LYS NZ
H B 0061 ASP OD2 10.98 E B 0028 LYS NZ
H B 0061 ASP OD1 10.41 H B 0029 LYS NZ
H B 0061 ASP OD2 8.390 H B 0029 LYS NZ
C B 0063 ASP OD2 11.12 C B 0026 LYS NZ
C B 0065 ASP OD1 8.556 C B 0026 LYS NZ
C B 0065 ASP OD2 7.455 C B 0026 LYS NZ
C B 0065 ASP OD1 11.53 E B 0028 LYS NZ
C B 0065 ASP OD1 10.53 H B 0029 LYS NZ
E B 0067 GLU OE1 10.96 C B 0025 HIS ND1
E B 0067 GLU OE2 11.19 C B 0025 HIS ND1
E B 0067 GLU OE1 3.894 C B 0026 LYS NZ
E B 0067 GLU OE2 2.851 C B 0026 LYS NZ
E B 0067 GLU OE1 9.567 E B 0028 LYS NZ
E B 0067 GLU OE2 7.794 E B 0028 LYS NZ
E B 0067 GLU OE2 11.46 H B 0029 LYS NZ
H B 0069 ASP OD1 10.18 C B 0025 HIS ND1
H B 0069 ASP OD1 10.99 C B 0025 HIS NE2
H B 0069 ASP OD2 11.68 C B 0025 HIS ND1
H B 0069 ASP OD1 8.003 C B 0026 LYS NZ
H B 0069 ASP OD2 9.620 C B 0026 LYS NZ
H B 0072 GLU OE1 11.57 C B 0026 LYS NZ
H B 0072 GLU OE2 11.80 C B 0026 LYS NZ
H B 0086 GLU OE1 5.192 H B 0085 HIS ND1
H B 0086 GLU OE1 7.194 H B 0085 HIS NE2
H B 0086 GLU OE2 6.771 H B 0085 HIS ND1
H B 0086 GLU OE2 8.513 H B 0085 HIS NE2
H B 0086 GLU OE1 9.418 C B 0090 HIS ND1
H B 0086 GLU OE1 9.730 C B 0090 HIS NE2
H B 0086 GLU OE2 8.138 C B 0090 HIS ND1
H B 0086 GLU OE2 8.789 C B 0090 HIS NE2
C B 0089 GLU OE1 11.20 H B 0085 HIS ND1
C B 0089 GLU OE1 11.77 H B 0085 HIS NE2
C B 0089 GLU OE2 10.64 H B 0085 HIS ND1
C B 0089 GLU OE2 11.58 H B 0085 HIS NE2
C B 0089 GLU OE1 6.202 C B 0090 HIS ND1
C B 0089 GLU OE1 8.318 C B 0090 HIS NE2
C B 0089 GLU OE2 7.342 C B 0090 HIS ND1
C B 0089 GLU OE2 9.271 C B 0090 HIS NE2
C B 0091 GLU OE1 8.875 C B 0090 HIS ND1
C B 0091 GLU OE1 10.84 C B 0090 HIS NE2
C B 0091 GLU OE2 8.344 C B 0090 HIS ND1
C B 0091 GLU OE2 10.44 C B 0090 HIS NE2
CHARGE_REPU 2.00 12.00 197
H B 0002 GLU OE1 10.66 H B 0004 GLU OE1
H B 0002 GLU OE2 10.66 H B 0004 GLU OE1
H B 0012 ASP OD1 11.91 H B 0039 GLU OE2
H B 0012 ASP OD2 11.79 H B 0039 GLU OE2
H B 0015 HIS ND1 5.047 C B 0024 LYS NZ
H B 0015 HIS NE2 3.703 C B 0024 LYS NZ
H B 0015 HIS ND1 11.02 C B 0025 HIS ND1
H B 0015 HIS ND1 10.53 C B 0025 HIS NE2
H B 0015 HIS NE2 9.209 C B 0025 HIS ND1
H B 0015 HIS NE2 8.664 C B 0025 HIS NE2
C B 0020 ARG NH1 11.83 H B 0033 LYS NZ
C B 0021 GLU OE1 11.18 C B 0023 ASP OD1
C B 0021 GLU OE2 10.92 C B 0023 ASP OD1
C B 0021 GLU OE2 11.87 C B 0023 ASP OD2
C B 0021 GLU OE1 8.628 H B 0031 GLU OE1
C B 0021 GLU OE1 7.456 H B 0031 GLU OE2
C B 0021 GLU OE2 9.035 H B 0031 GLU OE1
C B 0021 GLU OE2 7.434 H B 0031 GLU OE2
C B 0021 GLU OE1 8.063 H B 0034 GLU OE1
C B 0021 GLU OE1 8.848 H B 0034 GLU OE2
C B 0021 GLU OE2 9.359 H B 0034 GLU OE1
C B 0021 GLU OE2 10.46 H B 0034 GLU OE2
C B 0023 ASP OD1 7.117 H B 0031 GLU OE1
C B 0023 ASP OD1 6.887 H B 0031 GLU OE2
C B 0023 ASP OD2 7.892 H B 0031 GLU OE1
C B 0023 ASP OD2 7.453 H B 0031 GLU OE2
C B 0023 ASP OD2 11.73 C B 0065 ASP OD1
C B 0023 ASP OD2 10.50 C B 0065 ASP OD2
C B 0023 ASP OD1 8.782 E B 0067 GLU OE1
C B 0023 ASP OD1 8.628 E B 0067 GLU OE2
C B 0023 ASP OD2 7.109 E B 0067 GLU OE1
C B 0023 ASP OD2 6.848 E B 0067 GLU OE2
C B 0023 ASP OD1 9.155 H B 0069 ASP OD1
C B 0023 ASP OD1 11.02 H B 0069 ASP OD2
C B 0023 ASP OD2 8.424 H B 0069 ASP OD1
C B 0023 ASP OD2 10.23 H B 0069 ASP OD2
C B 0024 LYS NZ 6.173 C B 0025 HIS ND1
C B 0024 LYS NZ 5.788 C B 0025 HIS NE2
C B 0025 HIS ND1 8.887 C B 0026 LYS NZ
C B 0025 HIS NE2 10.70 C B 0026 LYS NZ
C B 0026 LYS NZ 8.235 E B 0028 LYS NZ
E B 0028 LYS NZ 8.686 H B 0029 LYS NZ
H B 0029 LYS NZ 11.13 H B 0033 LYS NZ
H B 0031 GLU OE1 7.593 H B 0034 GLU OE1
H B 0031 GLU OE1 9.152 H B 0034 GLU OE2
H B 0031 GLU OE2 7.918 H B 0034 GLU OE1
H B 0031 GLU OE2 9.669 H B 0034 GLU OE2
H B 0031 GLU OE1 11.46 H B 0039 GLU OE1
H B 0031 GLU OE1 11.61 H B 0039 GLU OE2
H B 0031 GLU OE1 11.83 H B 0061 ASP OD2
H B 0031 GLU OE1 9.880 E B 0067 GLU OE1
H B 0031 GLU OE1 9.535 E B 0067 GLU OE2
H B 0031 GLU OE2 9.881 E B 0067 GLU OE1
H B 0031 GLU OE2 9.087 E B 0067 GLU OE2
H B 0031 GLU OE1 10.14 H B 0069 ASP OD1
H B 0031 GLU OE2 11.17 H B 0069 ASP OD1
H B 0033 LYS NZ 11.36 C B 0042 HIS ND1
H B 0033 LYS NZ 10.39 C B 0042 HIS NE2
H B 0033 LYS NZ 10.38 C B 0048 LYS NZ
H B 0034 GLU OE1 7.895 H B 0039 GLU OE1
H B 0034 GLU OE1 8.282 H B 0039 GLU OE2
H B 0034 GLU OE2 7.042 H B 0039 GLU OE1
H B 0034 GLU OE2 7.112 H B 0039 GLU OE2
H B 0039 GLU OE1 9.474 C B 0045 GLU OE1
H B 0039 GLU OE1 11.40 C B 0045 GLU OE2
H B 0039 GLU OE2 11.37 C B 0045 GLU OE1
C B 0042 HIS ND1 10.39 C B 0048 LYS NZ
C B 0042 HIS NE2 8.655 C B 0048 LYS NZ
C B 0045 GLU OE1 10.94 C B 0046 GLU OE1
C B 0045 GLU OE1 11.93 C B 0046 GLU OE2
C B 0045 GLU OE2 11.82 C B 0046 GLU OE1
C B 0046 GLU OE1 10.82 H B 0049 GLU OE2
C B 0046 GLU OE2 11.17 H B 0049 GLU OE1
C B 0046 GLU OE2 9.673 H B 0049 GLU OE2
C B 0046 GLU OE1 11.76 H B 0051 GLU OE2
C B 0046 GLU OE2 11.64 H B 0051 GLU OE2
H B 0049 GLU OE1 5.703 H B 0051 GLU OE1
H B 0049 GLU OE1 5.309 H B 0051 GLU OE2
H B 0049 GLU OE2 6.742 H B 0051 GLU OE1
H B 0049 GLU OE2 5.796 H B 0051 GLU OE2
H B 0049 GLU OE1 9.871 H B 0054 ASP OD1
H B 0049 GLU OE1 8.502 H B 0054 ASP OD2
H B 0049 GLU OE2 11.85 H B 0054 ASP OD1
H B 0049 GLU OE2 10.57 H B 0054 ASP OD2
H B 0051 GLU OE1 9.325 H B 0054 ASP OD1
H B 0051 GLU OE1 7.632 H B 0054 ASP OD2
H B 0051 GLU OE2 10.19 H B 0054 ASP OD1
H B 0051 GLU OE2 8.775 H B 0054 ASP OD2
H B 0051 GLU OE1 11.44 H B 0058 GLU OE1
H B 0051 GLU OE1 11.31 H B 0058 GLU OE2
H B 0054 ASP OD1 8.332 H B 0058 GLU OE1
H B 0054 ASP OD1 7.151 H B 0058 GLU OE2
H B 0054 ASP OD2 8.512 H B 0058 GLU OE1
H B 0054 ASP OD2 7.279 H B 0058 GLU OE2
H B 0054 ASP OD1 10.41 H B 0061 ASP OD1
H B 0054 ASP OD1 8.700 H B 0061 ASP OD2
H B 0054 ASP OD2 10.63 H B 0061 ASP OD2
H B 0054 ASP OD1 11.25 C B 0065 ASP OD1
H B 0058 GLU OE1 9.858 H B 0061 ASP OD1
H B 0058 GLU OE1 9.788 H B 0061 ASP OD2
H B 0058 GLU OE2 9.400 H B 0061 ASP OD1
H B 0058 GLU OE2 9.051 H B 0061 ASP OD2
H B 0058 GLU OE1 10.47 C B 0062 GLU OE1
H B 0058 GLU OE1 9.551 C B 0062 GLU OE2
H B 0058 GLU OE2 11.55 C B 0062 GLU OE1
H B 0058 GLU OE2 10.91 C B 0062 GLU OE2
H B 0058 GLU OE1 11.86 C B 0065 ASP OD1
H B 0058 GLU OE2 11.11 C B 0065 ASP OD1
H B 0061 ASP OD1 8.412 C B 0062 GLU OE1
H B 0061 ASP OD1 8.949 C B 0062 GLU OE2
H B 0061 ASP OD2 10.22 C B 0062 GLU OE1
H B 0061 ASP OD2 10.45 C B 0062 GLU OE2
H B 0061 ASP OD1 5.348 C B 0063 ASP OD1
H B 0061 ASP OD1 4.702 C B 0063 ASP OD2
H B 0061 ASP OD2 7.451 C B 0063 ASP OD1
H B 0061 ASP OD2 6.600 C B 0063 ASP OD2
H B 0061 ASP OD1 2.361 C B 0065 ASP OD1
H B 0061 ASP OD1 4.142 C B 0065 ASP OD2
H B 0061 ASP OD2 2.708 C B 0065 ASP OD1
H B 0061 ASP OD2 4.786 C B 0065 ASP OD2
H B 0061 ASP OD1 7.029 E B 0067 GLU OE1
H B 0061 ASP OD1 8.174 E B 0067 GLU OE2
H B 0061 ASP OD2 6.687 E B 0067 GLU OE1
H B 0061 ASP OD2 7.336 E B 0067 GLU OE2
H B 0061 ASP OD1 7.889 H B 0069 ASP OD1
H B 0061 ASP OD1 8.029 H B 0069 ASP OD2
H B 0061 ASP OD2 8.450 H B 0069 ASP OD1
H B 0061 ASP OD2 9.095 H B 0069 ASP OD2
H B 0061 ASP OD1 4.550 H B 0072 GLU OE1
H B 0061 ASP OD1 5.261 H B 0072 GLU OE2
H B 0061 ASP OD2 5.683 H B 0072 GLU OE1
H B 0061 ASP OD2 6.867 H B 0072 GLU OE2
C B 0062 GLU OE1 6.564 C B 0063 ASP OD1
C B 0062 GLU OE1 7.765 C B 0063 ASP OD2
C B 0062 GLU OE2 8.256 C B 0063 ASP OD1
C B 0062 GLU OE2 9.174 C B 0063 ASP OD2
C B 0062 GLU OE1 10.37 C B 0065 ASP OD1
C B 0062 GLU OE1 11.09 C B 0065 ASP OD2
C B 0062 GLU OE2 11.11 C B 0065 ASP OD1
C B 0062 GLU OE1 11.10 H B 0069 ASP OD2
C B 0062 GLU OE1 7.525 H B 0072 GLU OE1
C B 0062 GLU OE1 7.092 H B 0072 GLU OE2
C B 0062 GLU OE2 7.875 H B 0072 GLU OE1
C B 0062 GLU OE2 7.985 H B 0072 GLU OE2
C B 0063 ASP OD1 5.921 C B 0065 ASP OD1
C B 0063 ASP OD1 5.702 C B 0065 ASP OD2
C B 0063 ASP OD2 4.737 C B 0065 ASP OD1
C B 0063 ASP OD2 4.080 C B 0065 ASP OD2
C B 0063 ASP OD1 9.187 E B 0067 GLU OE1
C B 0063 ASP OD1 10.95 E B 0067 GLU OE2
C B 0063 ASP OD2 7.339 E B 0067 GLU OE1
C B 0063 ASP OD2 9.242 E B 0067 GLU OE2
C B 0063 ASP OD1 8.372 H B 0069 ASP OD1
C B 0063 ASP OD1 7.142 H B 0069 ASP OD2
C B 0063 ASP OD2 6.252 H B 0069 ASP OD1
C B 0063 ASP OD2 5.187 H B 0069 ASP OD2
C B 0063 ASP OD1 5.953 H B 0072 GLU OE1
C B 0063 ASP OD1 4.520 H B 0072 GLU OE2
C B 0063 ASP OD2 4.656 H B 0072 GLU OE1
C B 0063 ASP OD2 3.178 H B 0072 GLU OE2
C B 0065 ASP OD1 4.838 E B 0067 GLU OE1
C B 0065 ASP OD1 5.959 E B 0067 GLU OE2
C B 0065 ASP OD2 3.610 E B 0067 GLU OE1
C B 0065 ASP OD2 5.256 E B 0067 GLU OE2
C B 0065 ASP OD1 6.937 H B 0069 ASP OD1
C B 0065 ASP OD1 7.371 H B 0069 ASP OD2
C B 0065 ASP OD2 5.644 H B 0069 ASP OD1
C B 0065 ASP OD2 5.965 H B 0069 ASP OD2
C B 0065 ASP OD1 5.508 H B 0072 GLU OE1
C B 0065 ASP OD1 5.900 H B 0072 GLU OE2
C B 0065 ASP OD2 5.858 H B 0072 GLU OE1
C B 0065 ASP OD2 5.649 H B 0072 GLU OE2
E B 0067 GLU OE1 5.499 H B 0069 ASP OD1
E B 0067 GLU OE1 6.810 H B 0069 ASP OD2
E B 0067 GLU OE2 7.449 H B 0069 ASP OD1
E B 0067 GLU OE2 8.919 H B 0069 ASP OD2
E B 0067 GLU OE1 8.014 H B 0072 GLU OE1
E B 0067 GLU OE1 8.165 H B 0072 GLU OE2
E B 0067 GLU OE2 9.731 H B 0072 GLU OE1
E B 0067 GLU OE2 10.12 H B 0072 GLU OE2
H B 0069 ASP OD1 5.502 H B 0072 GLU OE1
H B 0069 ASP OD1 5.213 H B 0072 GLU OE2
H B 0069 ASP OD2 5.337 H B 0072 GLU OE1
H B 0069 ASP OD2 4.243 H B 0072 GLU OE2
H B 0085 HIS ND1 10.50 C B 0090 HIS ND1
H B 0085 HIS ND1 10.38 C B 0090 HIS NE2
H B 0085 HIS NE2 10.59 C B 0090 HIS ND1
H B 0085 HIS NE2 10.32 C B 0090 HIS NE2
H B 0086 GLU OE1 9.247 C B 0089 GLU OE1
H B 0086 GLU OE1 7.969 C B 0089 GLU OE2
H B 0086 GLU OE2 7.553 C B 0089 GLU OE1
H B 0086 GLU OE2 6.201 C B 0089 GLU OE2
H B 0086 GLU OE2 11.17 C B 0091 GLU OE2
C B 0089 GLU OE1 5.738 C B 0091 GLU OE1
C B 0089 GLU OE1 3.906 C B 0091 GLU OE2
C B 0089 GLU OE2 7.661 C B 0091 GLU OE1
C B 0089 GLU OE2 5.639 C B 0091 GLU OE2
HB_MM 2.00 3.20 165
H B 0002 GLU N 2.196 H B 0001 SER O
H B 0003 LEU N 3.196 H B 0001 SER O
H B 0003 LEU N 2.190 H B 0002 GLU O
H B 0004 GLU N 2.924 H B 0001 SER O
H B 0004 GLU N 2.569 H B 0002 GLU O
H B 0004 GLU N 2.199 H B 0003 LEU O
H B 0005 LYS N 2.904 H B 0002 GLU O
H B 0005 LYS N 2.189 H B 0004 GLU O
H B 0006 ALA N 2.790 H B 0002 GLU O
H B 0006 ALA N 2.192 H B 0005 LYS O
H B 0007 MET N 2.886 H B 0003 LEU O
H B 0007 MET N 2.194 H B 0006 ALA O
H B 0008 VAL N 2.196 H B 0007 MET O
H B 0009 ALA N 3.159 H B 0005 LYS O
H B 0009 ALA N 2.976 H B 0006 ALA O
H B 0009 ALA N 2.196 H B 0008 VAL O
H B 0010 LEU N 2.952 H B 0006 ALA O
H B 0010 LEU N 3.092 H B 0007 MET O
H B 0010 LEU N 2.194 H B 0009 ALA O
H B 0011 ILE N 2.919 H B 0007 MET O
H B 0011 ILE N 2.193 H B 0010 LEU O
H B 0012 ASP N 2.979 H B 0008 VAL O
H B 0012 ASP N 3.128 H B 0009 ALA O
H B 0012 ASP N 2.188 H B 0011 ILE O
H B 0013 VAL N 2.747 H B 0009 ALA O
H B 0013 VAL N 3.176 H B 0010 LEU O
H B 0013 VAL N 2.200 H B 0012 ASP O
H B 0014 PHE N 2.967 H B 0010 LEU O
H B 0014 PHE N 3.107 H B 0012 ASP O
H B 0014 PHE N 2.188 H B 0013 VAL O
H B 0015 HIS N 3.087 H B 0012 ASP O
H B 0015 HIS N 2.186 H B 0014 PHE O
H B 0016 GLN N 2.766 H B 0012 ASP O
H B 0016 GLN N 3.175 H B 0013 VAL O
H B 0016 GLN N 2.192 H B 0015 HIS O
H B 0017 TYR N 2.199 H B 0016 GLN O
H B 0018 SER N 2.193 H B 0017 TYR O
H B 0019 GLY N 2.194 H B 0018 SER O
C B 0020 ARG N 3.067 H B 0017 TYR O
C B 0020 ARG N 2.192 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 2.198 C B 0022 GLY O
C B 0024 LYS N 2.194 C B 0023 ASP O
C B 0025 HIS N 2.195 C B 0024 LYS O
C B 0026 LYS N 2.201 C B 0025 HIS O
E B 0027 LEU N 2.207 C B 0026 LYS O
E B 0027 LEU N 2.895 E B 0068 CYS O
E B 0028 LYS N 2.201 E B 0027 LEU O
H B 0029 LYS N 2.197 E B 0028 LYS O
H B 0030 SER N 2.766 E B 0028 LYS O
H B 0030 SER N 2.188 H B 0029 LYS O
H B 0031 GLU N 2.669 E B 0028 LYS O
H B 0031 GLU N 2.192 H B 0030 SER O
H B 0032 LEU N 2.942 E B 0028 LYS O
H B 0032 LEU N 2.199 H B 0031 GLU O
H B 0033 LYS N 2.834 H B 0029 LYS O
H B 0033 LYS N 2.191 H B 0032 LEU O
H B 0034 GLU N 3.049 H B 0031 GLU O
H B 0034 GLU N 3.055 H B 0032 LEU O
H B 0034 GLU N 2.196 H B 0033 LYS O
H B 0035 LEU N 3.081 H B 0031 GLU O
H B 0035 LEU N 2.815 H B 0032 LEU O
H B 0035 LEU N 2.196 H B 0034 GLU O
H B 0036 ILE N 2.810 H B 0032 LEU O
H B 0036 ILE N 2.192 H B 0035 LEU O
H B 0037 ASN N 2.864 H B 0033 LYS O
H B 0037 ASN N 2.191 H B 0036 ILE O
H B 0038 ASN N 2.478 H B 0034 GLU O
H B 0038 ASN N 2.194 H B 0037 ASN O
H B 0039 GLU N 2.980 H B 0035 LEU O
H B 0039 GLU N 2.197 H B 0038 ASN O
H B 0040 LEU N 2.996 H B 0036 ILE O
H B 0040 LEU N 2.203 H B 0039 GLU O
C B 0041 SER N 2.191 H B 0040 LEU O
C B 0042 HIS N 2.205 C B 0041 SER O
C B 0043 PHE N 2.193 C B 0042 HIS O
C B 0044 LEU N 2.195 C B 0043 PHE O
C B 0045 GLU N 2.201 C B 0044 LEU O
C B 0046 GLU N 2.198 C B 0045 GLU O
C B 0047 ILE N 2.198 C B 0046 GLU O
C B 0048 LYS N 2.195 C B 0047 ILE O
H B 0049 GLU N 2.210 C B 0048 LYS O
H B 0050 GLN N 2.194 H B 0049 GLU O
H B 0051 GLU N 2.207 H B 0050 GLN O
H B 0052 VAL N 2.196 H B 0051 GLU O
H B 0053 VAL N 3.055 H B 0050 GLN O
H B 0053 VAL N 2.194 H B 0052 VAL O
H B 0054 ASP N 2.443 H B 0050 GLN O
H B 0054 ASP N 3.199 H B 0051 GLU O
H B 0054 ASP N 2.189 H B 0053 VAL O
H B 0055 LYS N 2.744 H B 0051 GLU O
H B 0055 LYS N 2.190 H B 0054 ASP O
H B 0056 VAL N 2.637 H B 0052 VAL O
H B 0056 VAL N 2.198 H B 0055 LYS O
H B 0057 MET N 2.730 H B 0053 VAL O
H B 0057 MET N 2.187 H B 0056 VAL O
H B 0058 GLU N 3.130 H B 0054 ASP O
H B 0058 GLU N 2.176 H B 0057 MET O
H B 0059 THR N 3.137 H B 0056 VAL O
H B 0059 THR N 2.933 H B 0057 MET O
H B 0059 THR N 2.200 H B 0058 GLU O
H B 0060 LEU N 2.864 H B 0057 MET O
H B 0060 LEU N 2.203 H B 0059 THR O
H B 0061 ASP N 2.356 H B 0057 MET O
H B 0061 ASP N 2.203 H B 0060 LEU O
C B 0062 GLU N 2.435 H B 0060 LEU O
C B 0062 GLU N 2.191 H B 0061 ASP O
C B 0063 ASP N 2.674 H B 0061 ASP O
C B 0063 ASP N 2.194 C B 0062 GLU O
C B 0064 GLY N 2.824 H B 0061 ASP O
C B 0064 GLY N 2.206 C B 0063 ASP O
C B 0065 ASP N 2.193 C B 0064 GLY O
C B 0066 GLY N 3.110 C B 0064 GLY O
C B 0066 GLY N 2.203 C B 0065 ASP O
E B 0067 GLU N 2.205 C B 0066 GLY O
E B 0068 CYS N 2.567 E B 0027 LEU O
E B 0068 CYS N 2.203 E B 0067 GLU O
H B 0069 ASP N 2.190 E B 0068 CYS O
H B 0070 PHE N 2.195 H B 0069 ASP O
H B 0071 GLN N 3.121 H B 0069 ASP O
H B 0071 GLN N 2.200 H B 0070 PHE O
H B 0072 GLU N 2.899 H B 0069 ASP O
H B 0072 GLU N 2.195 H B 0071 GLN O
H B 0073 PHE N 2.777 H B 0069 ASP O
H B 0073 PHE N 2.192 H B 0072 GLU O
H B 0074 MET N 2.897 H B 0070 PHE O
H B 0074 MET N 2.194 H B 0073 PHE O
H B 0075 ALA N 3.144 H B 0073 PHE O
H B 0075 ALA N 2.191 H B 0074 MET O
H B 0076 PHE N 2.973 H B 0073 PHE O
H B 0076 PHE N 2.190 H B 0075 ALA O
H B 0077 VAL N 3.199 H B 0075 ALA O
H B 0077 VAL N 2.186 H B 0076 PHE O
H B 0078 SER N 3.009 H B 0075 ALA O
H B 0078 SER N 2.200 H B 0077 VAL O
H B 0079 MET N 3.050 H B 0075 ALA O
H B 0079 MET N 3.153 H B 0076 PHE O
H B 0079 MET N 2.191 H B 0078 SER O
H B 0080 VAL N 3.041 H B 0076 PHE O
H B 0080 VAL N 3.199 H B 0077 VAL O
H B 0080 VAL N 2.195 H B 0079 MET O
H B 0081 THR N 2.596 H B 0077 VAL O
H B 0081 THR N 3.139 H B 0078 SER O
H B 0081 THR N 2.201 H B 0080 VAL O
H B 0082 THR N 2.739 H B 0078 SER O
H B 0082 THR N 2.197 H B 0081 THR O
H B 0083 ALA N 2.982 H B 0079 MET O
H B 0083 ALA N 3.137 H B 0080 VAL O
H B 0083 ALA N 2.198 H B 0082 THR O
H B 0084 CYS N 2.696 H B 0080 VAL O
H B 0084 CYS N 2.197 H B 0083 ALA O
H B 0085 HIS N 3.028 H B 0081 THR O
H B 0085 HIS N 2.195 H B 0084 CYS O
H B 0086 GLU N 3.081 H B 0083 ALA O
H B 0086 GLU N 2.199 H B 0085 HIS O
H B 0087 PHE N 2.929 H B 0084 CYS O
H B 0087 PHE N 3.005 H B 0085 HIS O
H B 0087 PHE N 2.197 H B 0086 GLU O
H B 0088 PHE N 2.864 H B 0085 HIS O
H B 0088 PHE N 2.885 H B 0086 GLU O
H B 0088 PHE N 2.196 H B 0087 PHE O
C B 0089 GLU N 2.194 H B 0088 PHE O
C B 0090 HIS N 2.191 C B 0089 GLU O
C B 0091 GLU N 2.194 C B 0090 HIS O
HB_MS 2.00 3.20 14
H B 0014 PHE O 2.407 H B 0018 SER OG
H B 0019 GLY N 2.752 H B 0018 SER OG
C B 0024 LYS N 2.811 C B 0023 ASP OD1
C B 0025 HIS N 2.628 C B 0023 ASP OD1
C B 0042 HIS N 3.143 C B 0041 SER OG
H B 0055 LYS O 3.082 H B 0059 THR OG1
C B 0063 ASP N 3.197 H B 0061 ASP OD1
C B 0064 GLY N 2.726 H B 0061 ASP OD1
C B 0066 GLY N 2.402 H B 0061 ASP OD2
C B 0066 GLY N 2.909 C B 0065 ASP OD1
E B 0067 GLU N 2.397 H B 0061 ASP OD2
E B 0067 GLU N 2.853 C B 0065 ASP OD1
H B 0077 VAL O 2.613 H B 0081 THR OG1
H B 0078 SER O 2.641 H B 0082 THR OG1
HB_SS 2.00 3.20 2
H B 0039 GLU OE2 2.962 H B 0038 ASN ND2
C B 0042 HIS ND1 2.602 C B 0041 SER OG
AROMATIC 0.00 8.00 4
H B 0017 TYR 4.811 H B 0073 PHE
C B 0024 LYS 6.589 H B 0014 PHE
C B 0024 LYS 4.159 H B 0015 HIS
H B 0087 PHE 5.657 H B 0088 PHE
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "X"
CHARGE_ATTR 2.00 12.00 4
H B 0004 GLU OE1 10.76 C X 0002 ARG NH1
H B 0004 GLU OE1 8.957 C X 0002 ARG NH2
H B 0004 GLU OE2 8.993 C X 0002 ARG NH1
H B 0004 GLU OE2 7.377 C X 0002 ARG NH2
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "Y"
HYDROPHOBIC 2.00 3.80 19
C B 0045 GLU CB 3.331 H Y 0007 TRP CE2
C B 0045 GLU CB 3.397 H Y 0007 TRP CZ2
C B 0045 GLU CG 3.733 H Y 0007 TRP CD2
C B 0045 GLU CG 3.259 H Y 0007 TRP CE2
C B 0045 GLU CG 3.345 H Y 0007 TRP CZ2
C B 0045 GLU CD 3.758 H Y 0007 TRP CE2
C B 0045 GLU CD 3.277 H Y 0007 TRP CZ2
C B 0045 GLU CD 3.337 H Y 0007 TRP CH2
C B 0047 ILE CD1 3.798 H Y 0007 TRP CE2
C B 0047 ILE CD1 3.515 H Y 0007 TRP CZ2
H B 0052 VAL CG1 3.783 H Y 0007 TRP CD2
H B 0052 VAL CG1 3.445 H Y 0007 TRP CE2
H B 0052 VAL CG1 3.582 H Y 0007 TRP CZ2
H B 0055 LYS CB 3.740 H Y 0011 LEU CD2
H B 0056 VAL CG2 3.623 H Y 0007 TRP CZ3
H B 0056 VAL CG2 3.342 H Y 0007 TRP CH2
H B 0056 VAL CG2 3.652 H Y 0011 LEU CD2
H B 0079 MET CE 3.224 H Y 0010 ILE CG2
H B 0083 ALA CB 3.587 H Y 0010 ILE CG1
CHARGE_ATTR 2.00 12.00 11
C B 0045 GLU OE1 9.693 C Y 0004 LYS NZ
C B 0045 GLU OE2 10.04 C Y 0004 LYS NZ
C B 0045 GLU OE2 11.99 H Y 0009 LYS NZ
C B 0046 GLU OE1 11.21 C Y 0002 ARG NH2
C B 0046 GLU OE1 3.659 C Y 0004 LYS NZ
C B 0046 GLU OE2 5.789 C Y 0004 LYS NZ
C B 0048 LYS NZ 10.31 H Y 0006 ASP OD1
H B 0086 GLU OE1 4.808 H Y 0009 LYS NZ
H B 0086 GLU OE2 4.380 H Y 0009 LYS NZ
C B 0089 GLU OE1 10.03 H Y 0009 LYS NZ
C B 0089 GLU OE2 8.049 H Y 0009 LYS NZ
CHARGE_REPU 2.00 12.00 14
C B 0042 HIS ND1 11.61 C Y 0002 ARG NH1
C B 0042 HIS ND1 9.547 C Y 0002 ARG NH2
C B 0042 HIS NE2 11.05 C Y 0002 ARG NH2
C B 0042 HIS ND1 6.862 C Y 0004 LYS NZ
C B 0042 HIS NE2 6.502 C Y 0004 LYS NZ
C B 0045 GLU OE1 10.77 H Y 0006 ASP OD1
C B 0045 GLU OE2 9.437 H Y 0006 ASP OD1
C B 0045 GLU OE2 11.08 H Y 0006 ASP OD2
C B 0046 GLU OE1 11.88 H Y 0006 ASP OD1
C B 0048 LYS NZ 7.128 C Y 0004 LYS NZ
H B 0051 GLU OE2 11.09 H Y 0006 ASP OD1
H B 0085 HIS ND1 9.569 H Y 0009 LYS NZ
H B 0085 HIS NE2 11.63 H Y 0009 LYS NZ
H B 0086 GLU OE2 11.89 H Y 0006 ASP OD2
AROMATIC 0.00 8.00 1
C B 0043 PHE 5.938 C Y 0002 ARG
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "X"
AND
CHAIN(S) "X"
HYDROPHOBIC 2.00 3.80 37
C X 0001 THR C 2.446 C X 0002 ARG CA
C X 0001 THR C 3.589 C X 0002 ARG C
C X 0001 THR C 3.362 C X 0002 ARG CB
C X 0002 ARG C 2.438 C X 0003 THR CA
C X 0002 ARG C 3.597 C X 0003 THR C
C X 0002 ARG C 3.331 C X 0003 THR CB
C X 0002 ARG C 3.277 C X 0003 THR CG2
C X 0003 THR C 2.447 C X 0004 LYS CA
C X 0003 THR C 3.439 C X 0004 LYS C
C X 0003 THR C 3.529 C X 0004 LYS CB
C X 0004 LYS C 2.429 C X 0005 ILE CA
C X 0004 LYS C 2.967 C X 0005 ILE C
C X 0004 LYS C 3.694 C X 0005 ILE CB
C X 0005 ILE C 2.433 H X 0006 ASP CA
C X 0005 ILE C 3.640 H X 0006 ASP C
C X 0005 ILE C 3.287 H X 0006 ASP CB
C X 0005 ILE CD1 3.225 H X 0010 ILE CD1
H X 0006 ASP C 2.439 H X 0007 TRP CA
H X 0006 ASP C 2.999 H X 0007 TRP C
H X 0006 ASP C 3.720 H X 0007 TRP CB
H X 0007 TRP C 2.422 H X 0008 ASN CA
H X 0007 TRP C 2.986 H X 0008 ASN C
H X 0007 TRP C 3.691 H X 0008 ASN CB
H X 0007 TRP CZ3 3.742 H X 0010 ILE CG2
H X 0007 TRP CZ3 3.796 H X 0011 LEU CD2
H X 0008 ASN C 2.405 H X 0009 LYS CA
H X 0008 ASN C 2.930 H X 0009 LYS C
H X 0008 ASN C 3.683 H X 0009 LYS CB
H X 0009 LYS C 2.424 H X 0010 ILE CA
H X 0009 LYS C 3.077 H X 0010 ILE C
H X 0009 LYS C 3.678 H X 0010 ILE CB
H X 0010 ILE C 2.422 H X 0011 LEU CA
H X 0010 ILE C 2.957 H X 0011 LEU C
H X 0010 ILE C 3.704 H X 0011 LEU CB
H X 0011 LEU C 2.425 H X 0012 SER CA
H X 0011 LEU C 3.676 H X 0012 SER C
H X 0011 LEU C 3.117 H X 0012 SER CB
CHARGE_ATTR 2.00 12.00 4
H X 0006 ASP OD1 9.797 C X 0004 LYS NZ
H X 0006 ASP OD2 11.41 C X 0004 LYS NZ
H X 0006 ASP OD1 8.918 H X 0009 LYS NZ
H X 0006 ASP OD2 7.859 H X 0009 LYS NZ
CHARGE_REPU 2.00 12.00 2
C X 0002 ARG NH1 9.515 C X 0004 LYS NZ
C X 0002 ARG NH2 8.450 C X 0004 LYS NZ
HB_MM 2.00 3.20 14
C X 0002 ARG N 2.204 C X 0001 THR O
C X 0003 THR N 2.202 C X 0002 ARG O
C X 0004 LYS N 2.206 C X 0003 THR O
C X 0005 ILE N 2.199 C X 0004 LYS O
H X 0006 ASP N 2.199 C X 0005 ILE O
H X 0007 TRP N 2.206 H X 0006 ASP O
H X 0008 ASN N 2.193 H X 0007 TRP O
H X 0009 LYS N 2.185 H X 0008 ASN O
H X 0010 ILE N 3.046 H X 0007 TRP O
H X 0010 ILE N 2.198 H X 0009 LYS O
H X 0011 LEU N 2.906 H X 0007 TRP O
H X 0011 LEU N 2.194 H X 0010 ILE O
H X 0012 SER N 3.137 H X 0008 ASN O
H X 0012 SER N 2.196 H X 0011 LEU O
HB_MS 2.00 3.20 2
H X 0007 TRP N 2.719 H X 0006 ASP OD1
H X 0008 ASN N 2.646 H X 0006 ASP OD1
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "X"
AND
CHAIN(S) "Y"
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "Y"
AND
CHAIN(S) "Y"
HYDROPHOBIC 2.00 3.80 37
C Y 0001 THR C 2.444 C Y 0002 ARG CA
C Y 0001 THR C 3.584 C Y 0002 ARG C
C Y 0001 THR C 3.369 C Y 0002 ARG CB
C Y 0002 ARG C 2.436 C Y 0003 THR CA
C Y 0002 ARG C 3.602 C Y 0003 THR C
C Y 0002 ARG C 3.329 C Y 0003 THR CB
C Y 0002 ARG C 3.264 C Y 0003 THR CG2
C Y 0003 THR C 2.447 C Y 0004 LYS CA
C Y 0003 THR C 3.439 C Y 0004 LYS C
C Y 0003 THR C 3.531 C Y 0004 LYS CB
C Y 0004 LYS C 2.428 C Y 0005 ILE CA
C Y 0004 LYS C 2.966 C Y 0005 ILE C
C Y 0004 LYS C 3.695 C Y 0005 ILE CB
C Y 0005 ILE C 2.432 H Y 0006 ASP CA
C Y 0005 ILE C 3.635 H Y 0006 ASP C
C Y 0005 ILE C 3.288 H Y 0006 ASP CB
C Y 0005 ILE CD1 3.200 H Y 0010 ILE CD1
H Y 0006 ASP C 2.436 H Y 0007 TRP CA
H Y 0006 ASP C 3.004 H Y 0007 TRP C
H Y 0006 ASP C 3.715 H Y 0007 TRP CB
H Y 0007 TRP C 2.424 H Y 0008 ASN CA
H Y 0007 TRP C 2.981 H Y 0008 ASN C
H Y 0007 TRP C 3.690 H Y 0008 ASN CB
H Y 0007 TRP CZ3 3.732 H Y 0010 ILE CG2
H Y 0007 TRP CZ3 3.787 H Y 0011 LEU CD2
H Y 0008 ASN C 2.403 H Y 0009 LYS CA
H Y 0008 ASN C 2.929 H Y 0009 LYS C
H Y 0008 ASN C 3.681 H Y 0009 LYS CB
H Y 0009 LYS C 2.421 H Y 0010 ILE CA
H Y 0009 LYS C 3.075 H Y 0010 ILE C
H Y 0009 LYS C 3.673 H Y 0010 ILE CB
H Y 0010 ILE C 2.426 H Y 0011 LEU CA
H Y 0010 ILE C 2.958 H Y 0011 LEU C
H Y 0010 ILE C 3.717 H Y 0011 LEU CB
H Y 0011 LEU C 2.426 H Y 0012 SER CA
H Y 0011 LEU C 3.684 H Y 0012 SER C
H Y 0011 LEU C 3.097 H Y 0012 SER CB
CHARGE_ATTR 2.00 12.00 4
H Y 0006 ASP OD1 9.800 C Y 0004 LYS NZ
H Y 0006 ASP OD2 11.41 C Y 0004 LYS NZ
H Y 0006 ASP OD1 8.899 H Y 0009 LYS NZ
H Y 0006 ASP OD2 7.833 H Y 0009 LYS NZ
CHARGE_REPU 2.00 12.00 2
C Y 0002 ARG NH1 9.521 C Y 0004 LYS NZ
C Y 0002 ARG NH2 8.444 C Y 0004 LYS NZ
HB_MM 2.00 3.20 14
C Y 0002 ARG N 2.204 C Y 0001 THR O
C Y 0003 THR N 2.201 C Y 0002 ARG O
C Y 0004 LYS N 2.203 C Y 0003 THR O
C Y 0005 ILE N 2.198 C Y 0004 LYS O
H Y 0006 ASP N 2.199 C Y 0005 ILE O
H Y 0007 TRP N 2.202 H Y 0006 ASP O
H Y 0008 ASN N 2.190 H Y 0007 TRP O
H Y 0009 LYS N 2.184 H Y 0008 ASN O
H Y 0010 ILE N 3.039 H Y 0007 TRP O
H Y 0010 ILE N 2.200 H Y 0009 LYS O
H Y 0011 LEU N 2.898 H Y 0007 TRP O
H Y 0011 LEU N 2.197 H Y 0010 ILE O
H Y 0012 SER N 3.135 H Y 0008 ASN O
H Y 0012 SER N 2.199 H Y 0011 LEU O
HB_MS 2.00 3.20 2
H Y 0007 TRP N 2.720 H Y 0006 ASP OD1
H Y 0008 ASN N 2.657 H Y 0006 ASP OD1