Complet list of 1dt7 con file
Complete list of 1dt7.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 367
C A 0000 MET C 2.423 C A 0001 SER CA
C A 0000 MET C 2.867 C A 0001 SER C
C A 0000 MET C 3.051 C A 0001 SER CB
C A 0001 SER C 2.428 H A 0002 GLU CA
C A 0001 SER C 3.098 H A 0002 GLU C
C A 0001 SER C 3.672 H A 0002 GLU CB
H A 0002 GLU C 2.405 H A 0003 LEU CA
H A 0002 GLU C 2.972 H A 0003 LEU C
H A 0002 GLU C 3.692 H A 0003 LEU CB
H A 0002 GLU CD 3.538 H A 0005 LYS CE
H A 0003 LEU C 2.430 H A 0004 GLU CA
H A 0003 LEU C 3.040 H A 0004 GLU C
H A 0003 LEU C 3.693 H A 0004 GLU CB
H A 0003 LEU CD2 3.715 H A 0007 MET CG
H A 0004 GLU C 2.405 H A 0005 LYS CA
H A 0004 GLU C 3.045 H A 0005 LYS C
H A 0004 GLU C 3.697 H A 0005 LYS CB
H A 0005 LYS C 2.419 H A 0006 ALA CA
H A 0005 LYS C 3.057 H A 0006 ALA C
H A 0005 LYS C 3.684 H A 0006 ALA CB
H A 0006 ALA C 2.408 H A 0007 MET CA
H A 0006 ALA C 3.010 H A 0007 MET C
H A 0006 ALA C 3.694 H A 0007 MET CB
H A 0007 MET CA 3.794 H A 0008 VAL CA
H A 0007 MET C 2.410 H A 0008 VAL CA
H A 0007 MET C 3.021 H A 0008 VAL C
H A 0007 MET C 3.685 H A 0008 VAL CB
H A 0008 VAL C 2.429 H A 0009 ALA CA
H A 0008 VAL C 3.085 H A 0009 ALA C
H A 0008 VAL C 3.682 H A 0009 ALA CB
H A 0009 ALA CA 3.798 H A 0010 LEU CA
H A 0009 ALA C 2.414 H A 0010 LEU CA
H A 0009 ALA C 2.925 H A 0010 LEU C
H A 0009 ALA C 3.668 H A 0010 LEU CB
H A 0010 LEU C 2.423 H A 0011 ILE CA
H A 0010 LEU C 3.073 H A 0011 ILE C
H A 0010 LEU C 3.682 H A 0011 ILE CB
H A 0010 LEU CD1 3.790 H A 0074 MET CE
H A 0010 LEU CD2 3.645 H A 0077 VAL CG1
H A 0011 ILE C 2.431 H A 0012 ASP CA
H A 0011 ILE C 3.014 H A 0012 ASP C
H A 0011 ILE C 3.702 H A 0012 ASP CB
H A 0012 ASP C 2.422 H A 0013 VAL CA
H A 0012 ASP C 2.978 H A 0013 VAL C
H A 0012 ASP C 3.724 H A 0013 VAL CB
H A 0012 ASP C 3.635 H A 0016 GLN CD
H A 0013 VAL C 2.411 H A 0014 PHE CA
H A 0013 VAL C 2.939 H A 0014 PHE C
H A 0013 VAL C 3.698 H A 0014 PHE CB
H A 0013 VAL CG1 3.562 H A 0039 GLU CD
H A 0013 VAL CG2 3.406 H A 0039 GLU CD
H A 0014 PHE C 2.415 H A 0015 HIS CA
H A 0014 PHE C 3.038 H A 0015 HIS C
H A 0014 PHE C 3.688 H A 0015 HIS CB
H A 0014 PHE CE1 3.154 H A 0018 SER CB
H A 0014 PHE CZ 3.421 H A 0018 SER CB
H A 0014 PHE CE2 3.192 E A 0027 LEU CD2
H A 0014 PHE CZ 3.233 E A 0027 LEU CD2
H A 0014 PHE CE2 3.614 H A 0070 PHE CA
H A 0014 PHE CE2 3.479 H A 0070 PHE CB
H A 0014 PHE CZ 3.215 H A 0070 PHE CB
H A 0014 PHE CD2 3.625 H A 0073 PHE CD2
H A 0015 HIS C 2.412 H A 0016 GLN CA
H A 0015 HIS C 2.971 H A 0016 GLN C
H A 0015 HIS C 3.692 H A 0016 GLN CB
H A 0016 GLN C 2.432 H A 0017 TYR CA
H A 0016 GLN C 3.288 H A 0017 TYR C
H A 0016 GLN C 3.630 H A 0017 TYR CB
H A 0016 GLN C 3.759 H A 0017 TYR CD1
H A 0017 TYR C 2.406 H A 0018 SER CA
H A 0017 TYR C 2.964 H A 0018 SER C
H A 0017 TYR C 3.673 H A 0018 SER CB
H A 0017 TYR C 3.764 C A 0020 ARG CB
H A 0017 TYR CD2 3.623 H A 0034 GLU C
H A 0017 TYR CE2 3.209 H A 0034 GLU C
H A 0017 TYR CD1 3.638 H A 0035 LEU CD2
H A 0017 TYR CD2 3.478 H A 0035 LEU CA
H A 0017 TYR CE1 3.774 H A 0035 LEU CD2
H A 0017 TYR CE2 3.410 H A 0035 LEU CA
H A 0017 TYR CE1 3.600 H A 0039 GLU CB
H A 0017 TYR CE1 3.795 H A 0039 GLU CG
H A 0017 TYR CE1 3.760 H A 0039 GLU CD
H A 0017 TYR CZ 3.551 H A 0039 GLU CB
H A 0018 SER C 2.416 H A 0019 GLY CA
H A 0018 SER C 3.087 H A 0019 GLY C
H A 0019 GLY C 2.422 C A 0020 ARG CA
H A 0019 GLY C 2.962 C A 0020 ARG C
H A 0019 GLY C 3.687 C A 0020 ARG CB
C A 0020 ARG C 2.455 C A 0021 GLU CA
C A 0020 ARG C 3.467 C A 0021 GLU C
C A 0020 ARG C 3.530 C A 0021 GLU CB
C A 0020 ARG C 3.678 C A 0021 GLU CG
C A 0020 ARG CZ 3.557 H A 0034 GLU CD
C A 0021 GLU C 2.437 C A 0022 GLY CA
C A 0021 GLU C 2.995 C A 0022 GLY C
C A 0021 GLU CB 3.745 H A 0031 GLU CD
C A 0021 GLU CD 3.337 H A 0031 GLU CG
C A 0022 GLY C 2.413 C A 0023 ASP CA
C A 0022 GLY C 3.042 C A 0023 ASP C
C A 0022 GLY C 3.681 C A 0023 ASP CB
C A 0023 ASP C 2.428 C A 0024 LYS CA
C A 0023 ASP C 2.999 C A 0024 LYS C
C A 0023 ASP C 3.696 C A 0024 LYS CB
C A 0023 ASP CB 3.668 E A 0026 LYS C
C A 0023 ASP CB 3.767 H A 0031 GLU CD
C A 0024 LYS C 2.434 C A 0025 HIS CA
C A 0024 LYS C 3.302 C A 0025 HIS C
C A 0024 LYS C 3.620 C A 0025 HIS CB
C A 0025 HIS C 2.439 E A 0026 LYS CA
C A 0025 HIS C 3.618 E A 0026 LYS C
C A 0025 HIS C 3.317 E A 0026 LYS CB
C A 0025 HIS C 3.236 E A 0026 LYS CG
C A 0025 HIS CE1 3.613 E A 0026 LYS CE
E A 0026 LYS C 2.452 E A 0027 LEU CA
E A 0026 LYS C 3.477 E A 0027 LEU C
E A 0026 LYS C 3.519 E A 0027 LEU CB
E A 0026 LYS C 3.261 E A 0027 LEU CD2
E A 0027 LEU C 2.426 E A 0028 LYS CA
E A 0027 LEU C 3.277 E A 0028 LYS C
E A 0027 LEU C 3.597 E A 0028 LYS CB
E A 0027 LEU CD1 3.337 H A 0031 GLU CB
E A 0028 LYS C 2.435 H A 0029 LYS CA
E A 0028 LYS C 2.839 H A 0029 LYS C
E A 0028 LYS C 3.700 H A 0029 LYS CB
H A 0029 LYS C 2.420 H A 0030 SER CA
H A 0029 LYS C 3.094 H A 0030 SER C
H A 0029 LYS C 3.668 H A 0030 SER CB
H A 0029 LYS CA 3.675 H A 0057 MET CE
H A 0029 LYS CB 3.475 H A 0057 MET CG
H A 0029 LYS CB 3.700 H A 0057 MET CE
H A 0030 SER C 2.422 H A 0031 GLU CA
H A 0030 SER C 2.966 H A 0031 GLU C
H A 0030 SER C 3.694 H A 0031 GLU CB
H A 0031 GLU C 2.425 H A 0032 LEU CA
H A 0031 GLU C 2.959 H A 0032 LEU C
H A 0031 GLU C 3.699 H A 0032 LEU CB
H A 0032 LEU C 2.416 H A 0033 LYS CA
H A 0032 LEU C 2.963 H A 0033 LYS C
H A 0032 LEU C 3.691 H A 0033 LYS CB
H A 0032 LEU CD1 3.659 H A 0073 PHE CD1
H A 0033 LYS C 2.416 H A 0034 GLU CA
H A 0033 LYS C 2.979 H A 0034 GLU C
H A 0033 LYS C 3.685 H A 0034 GLU CB
H A 0034 GLU C 2.408 H A 0035 LEU CA
H A 0034 GLU C 2.925 H A 0035 LEU C
H A 0034 GLU C 3.683 H A 0035 LEU CB
H A 0035 LEU C 2.419 H A 0036 ILE CA
H A 0035 LEU C 3.109 H A 0036 ILE C
H A 0035 LEU C 3.669 H A 0036 ILE CB
H A 0035 LEU CD1 3.644 H A 0036 ILE CA
H A 0035 LEU CD1 3.785 H A 0036 ILE CG1
H A 0035 LEU CD2 3.665 H A 0039 GLU CB
H A 0035 LEU CD2 3.200 H A 0039 GLU CD
H A 0035 LEU CG 3.519 H A 0073 PHE CE1
H A 0035 LEU CG 3.572 H A 0073 PHE CZ
H A 0035 LEU CD1 3.607 H A 0073 PHE CE1
H A 0035 LEU CD1 3.726 H A 0073 PHE CZ
H A 0036 ILE C 2.409 H A 0037 ASN CA
H A 0036 ILE C 3.135 H A 0037 ASN C
H A 0036 ILE C 3.662 H A 0037 ASN CB
H A 0036 ILE CG2 3.363 C A 0047 ILE CG1
H A 0037 ASN C 2.415 H A 0038 ASN CA
H A 0037 ASN C 3.180 H A 0038 ASN C
H A 0037 ASN C 3.653 H A 0038 ASN CB
H A 0038 ASN C 2.410 H A 0039 GLU CA
H A 0038 ASN C 3.034 H A 0039 GLU C
H A 0038 ASN C 3.694 H A 0039 GLU CB
H A 0039 GLU C 2.426 H A 0040 LEU CA
H A 0039 GLU C 3.255 H A 0040 LEU C
H A 0039 GLU C 3.618 H A 0040 LEU CB
H A 0039 GLU C 3.679 H A 0040 LEU CG
H A 0039 GLU C 3.502 H A 0040 LEU CD2
H A 0040 LEU C 2.420 C A 0041 SER CA
H A 0040 LEU C 2.975 C A 0041 SER C
H A 0040 LEU C 3.687 C A 0041 SER CB
H A 0040 LEU CB 3.729 C A 0044 LEU CB
H A 0040 LEU CD1 3.612 C A 0044 LEU CB
H A 0040 LEU CD1 3.742 C A 0044 LEU CD2
C A 0041 SER C 2.441 C A 0042 HIS CA
C A 0041 SER C 3.608 C A 0042 HIS C
C A 0041 SER C 3.338 C A 0042 HIS CB
C A 0041 SER C 3.288 C A 0042 HIS CG
C A 0042 HIS C 2.419 C A 0043 PHE CA
C A 0042 HIS C 2.984 C A 0043 PHE C
C A 0042 HIS C 3.696 C A 0043 PHE CB
C A 0043 PHE C 2.443 C A 0044 LEU CA
C A 0043 PHE C 3.529 C A 0044 LEU C
C A 0043 PHE C 3.417 C A 0044 LEU CB
C A 0044 LEU C 2.407 C A 0045 GLU CA
C A 0044 LEU C 2.951 C A 0045 GLU C
C A 0044 LEU C 3.687 C A 0045 GLU CB
C A 0044 LEU CD1 3.480 H A 0080 VAL CG1
C A 0045 GLU C 2.426 C A 0046 GLU CA
C A 0045 GLU C 2.922 C A 0046 GLU C
C A 0045 GLU C 3.706 C A 0046 GLU CB
C A 0046 GLU C 2.429 C A 0047 ILE CA
C A 0046 GLU C 3.245 C A 0047 ILE C
C A 0046 GLU C 3.627 C A 0047 ILE CB
C A 0046 GLU C 3.761 C A 0048 LYS CE
C A 0046 GLU CB 3.781 C A 0048 LYS CE
C A 0047 ILE C 2.433 C A 0048 LYS CA
C A 0047 ILE C 3.325 C A 0048 LYS C
C A 0047 ILE C 3.591 C A 0048 LYS CB
C A 0047 ILE C 3.616 C A 0048 LYS CG
C A 0047 ILE C 3.500 C A 0048 LYS CD
C A 0047 ILE CD1 3.536 H A 0052 VAL CG1
C A 0048 LYS C 2.445 H A 0049 GLU CA
C A 0048 LYS C 3.517 H A 0049 GLU C
C A 0048 LYS C 3.454 H A 0049 GLU CB
C A 0048 LYS C 3.529 H A 0049 GLU CG
H A 0049 GLU C 2.412 H A 0050 GLN CA
H A 0049 GLU C 3.022 H A 0050 GLN C
H A 0049 GLU C 3.689 H A 0050 GLN CB
H A 0049 GLU CB 3.753 H A 0051 GLU CG
H A 0049 GLU CD 3.692 H A 0051 GLU CD
H A 0050 GLN C 2.421 H A 0051 GLU CA
H A 0050 GLN C 2.947 H A 0051 GLU C
H A 0050 GLN C 3.707 H A 0051 GLU CB
H A 0051 GLU C 2.411 H A 0052 VAL CA
H A 0051 GLU C 2.912 H A 0052 VAL C
H A 0051 GLU C 3.685 H A 0052 VAL CB
H A 0052 VAL CA 3.786 H A 0053 VAL CA
H A 0052 VAL C 2.410 H A 0053 VAL CA
H A 0052 VAL C 3.023 H A 0053 VAL C
H A 0052 VAL C 3.651 H A 0053 VAL CB
H A 0053 VAL C 2.431 H A 0054 ASP CA
H A 0053 VAL C 3.018 H A 0054 ASP C
H A 0053 VAL C 3.701 H A 0054 ASP CB
H A 0054 ASP C 2.423 H A 0055 LYS CA
H A 0054 ASP C 3.029 H A 0055 LYS C
H A 0054 ASP C 3.679 H A 0055 LYS CB
H A 0055 LYS CA 3.788 H A 0056 VAL CA
H A 0055 LYS C 2.413 H A 0056 VAL CA
H A 0055 LYS C 2.987 H A 0056 VAL C
H A 0055 LYS C 3.672 H A 0056 VAL CB
H A 0056 VAL C 2.429 H A 0057 MET CA
H A 0056 VAL C 2.964 H A 0057 MET C
H A 0056 VAL C 3.713 H A 0057 MET CB
H A 0056 VAL CG1 3.739 H A 0060 LEU CG
H A 0056 VAL CG1 3.503 H A 0060 LEU CD1
H A 0057 MET CA 3.796 H A 0058 GLU CA
H A 0057 MET C 2.389 H A 0058 GLU CA
H A 0057 MET C 2.849 H A 0058 GLU C
H A 0057 MET C 3.669 H A 0058 GLU CB
H A 0057 MET C 3.514 H A 0061 ASP CB
H A 0057 MET CE 3.222 C A 0066 GLY C
H A 0057 MET CE 3.463 E A 0067 GLU CA
H A 0057 MET CE 3.699 E A 0067 GLU C
H A 0058 GLU C 2.420 H A 0059 THR CA
H A 0058 GLU C 3.163 H A 0059 THR C
H A 0058 GLU C 3.659 H A 0059 THR CB
H A 0059 THR C 2.436 H A 0060 LEU CA
H A 0059 THR C 3.260 H A 0060 LEU C
H A 0059 THR C 3.648 H A 0060 LEU CB
H A 0059 THR C 3.783 H A 0060 LEU CD2
H A 0060 LEU C 2.401 H A 0061 ASP CA
H A 0060 LEU C 3.070 H A 0061 ASP C
H A 0060 LEU C 3.671 H A 0061 ASP CB
H A 0060 LEU CD1 3.551 H A 0076 PHE CB
H A 0060 LEU CD1 3.636 H A 0076 PHE CG
H A 0060 LEU CD1 3.666 H A 0076 PHE CD1
H A 0061 ASP CA 3.786 C A 0062 GLU CA
H A 0061 ASP C 2.417 C A 0062 GLU CA
H A 0061 ASP C 2.950 C A 0062 GLU C
H A 0061 ASP C 3.673 C A 0062 GLU CB
H A 0061 ASP CG 3.220 C A 0064 GLY CA
H A 0061 ASP CG 3.498 C A 0064 GLY C
H A 0061 ASP CG 3.761 C A 0066 GLY CA
C A 0062 GLU C 2.415 C A 0063 ASP CA
C A 0062 GLU C 3.061 C A 0063 ASP C
C A 0062 GLU C 3.671 C A 0063 ASP CB
C A 0062 GLU CB 3.739 H A 0072 GLU CD
C A 0062 GLU CD 3.646 H A 0072 GLU CG
C A 0063 ASP C 2.425 C A 0064 GLY CA
C A 0063 ASP C 3.025 C A 0064 GLY C
C A 0064 GLY C 2.444 C A 0065 ASP CA
C A 0064 GLY C 3.391 C A 0065 ASP C
C A 0064 GLY C 3.567 C A 0065 ASP CB
C A 0065 ASP C 2.420 C A 0066 GLY CA
C A 0065 ASP C 3.099 C A 0066 GLY C
C A 0065 ASP CG 3.677 E A 0067 GLU CB
C A 0066 GLY C 2.435 E A 0067 GLU CA
C A 0066 GLY C 3.571 E A 0067 GLU C
C A 0066 GLY C 3.357 E A 0067 GLU CB
C A 0066 GLY C 3.192 E A 0067 GLU CG
E A 0067 GLU C 2.436 E A 0068 CYS CA
E A 0067 GLU C 3.278 E A 0068 CYS C
E A 0067 GLU C 3.623 E A 0068 CYS CB
E A 0068 CYS C 2.424 E A 0069 ASP CA
E A 0068 CYS C 3.088 E A 0069 ASP C
E A 0068 CYS C 3.668 E A 0069 ASP CB
E A 0068 CYS CA 3.680 H A 0072 GLU CD
E A 0068 CYS CB 3.645 H A 0072 GLU CB
E A 0069 ASP C 2.420 H A 0070 PHE CA
E A 0069 ASP C 2.883 H A 0070 PHE C
E A 0069 ASP C 3.727 H A 0070 PHE CB
H A 0070 PHE C 2.405 H A 0071 GLN CA
H A 0070 PHE C 2.994 H A 0071 GLN C
H A 0070 PHE C 3.697 H A 0071 GLN CB
H A 0071 GLN C 2.423 H A 0072 GLU CA
H A 0071 GLN C 3.030 H A 0072 GLU C
H A 0071 GLN C 3.688 H A 0072 GLU CB
H A 0072 GLU C 2.428 H A 0073 PHE CA
H A 0072 GLU C 2.984 H A 0073 PHE C
H A 0072 GLU C 3.696 H A 0073 PHE CB
H A 0073 PHE C 2.425 H A 0074 MET CA
H A 0073 PHE C 2.991 H A 0074 MET C
H A 0073 PHE C 3.695 H A 0074 MET CB
H A 0073 PHE CE2 3.734 H A 0077 VAL CG2
H A 0074 MET C 2.399 H A 0075 ALA CA
H A 0074 MET C 3.044 H A 0075 ALA C
H A 0074 MET C 3.675 H A 0075 ALA CB
H A 0074 MET CA 3.743 H A 0077 VAL CG2
H A 0074 MET C 3.707 H A 0077 VAL CG2
H A 0075 ALA C 2.423 H A 0076 PHE CA
H A 0075 ALA C 3.060 H A 0076 PHE C
H A 0075 ALA C 3.685 H A 0076 PHE CB
H A 0076 PHE C 2.417 H A 0077 VAL CA
H A 0076 PHE C 3.128 H A 0077 VAL C
H A 0076 PHE C 3.655 H A 0077 VAL CB
H A 0076 PHE C 3.729 H A 0077 VAL CG2
H A 0076 PHE CE1 3.755 H A 0080 VAL CG2
H A 0076 PHE CE2 3.557 H A 0080 VAL CG2
H A 0076 PHE CZ 3.439 H A 0080 VAL CG2
H A 0077 VAL C 2.413 H A 0078 SER CA
H A 0077 VAL C 3.071 H A 0078 SER C
H A 0077 VAL C 3.682 H A 0078 SER CB
H A 0078 SER C 2.406 H A 0079 MET CA
H A 0078 SER C 3.061 H A 0079 MET C
H A 0078 SER C 3.673 H A 0079 MET CB
H A 0079 MET C 2.410 H A 0080 VAL CA
H A 0079 MET C 2.982 H A 0080 VAL C
H A 0079 MET C 3.710 H A 0080 VAL CB
H A 0080 VAL C 2.418 H A 0081 THR CA
H A 0080 VAL C 2.932 H A 0081 THR C
H A 0080 VAL C 3.698 H A 0081 THR CB
H A 0081 THR CA 3.790 H A 0082 THR CA
H A 0081 THR C 2.407 H A 0082 THR CA
H A 0081 THR C 2.845 H A 0082 THR C
H A 0081 THR C 3.667 H A 0082 THR CB
H A 0081 THR C 3.755 H A 0084 CYS CB
H A 0082 THR C 2.426 H A 0083 ALA CA
H A 0082 THR C 2.934 H A 0083 ALA C
H A 0082 THR C 3.706 H A 0083 ALA CB
H A 0083 ALA C 2.431 H A 0084 CYS CA
H A 0083 ALA C 2.976 H A 0084 CYS C
H A 0083 ALA C 3.703 H A 0084 CYS CB
H A 0084 CYS C 2.416 H A 0085 HIS CA
H A 0084 CYS C 2.935 H A 0085 HIS C
H A 0084 CYS C 3.695 H A 0085 HIS CB
H A 0085 HIS C 2.410 H A 0086 GLU CA
H A 0085 HIS C 2.948 H A 0086 GLU C
H A 0085 HIS C 3.708 H A 0086 GLU CB
H A 0086 GLU C 2.424 H A 0087 PHE CA
H A 0086 GLU C 3.157 H A 0087 PHE C
H A 0086 GLU C 3.664 H A 0087 PHE CB
H A 0087 PHE C 2.423 H A 0088 PHE CA
H A 0087 PHE C 3.251 H A 0088 PHE C
H A 0087 PHE C 3.612 H A 0088 PHE CB
H A 0088 PHE C 2.419 C A 0089 GLU CA
H A 0088 PHE C 3.134 C A 0089 GLU C
H A 0088 PHE C 3.663 C A 0089 GLU CB
C A 0089 GLU C 2.425 C A 0090 HIS CA
C A 0089 GLU C 3.047 C A 0090 HIS C
C A 0089 GLU C 3.683 C A 0090 HIS CB
C A 0090 HIS C 2.432 C A 0091 GLU CA
C A 0090 HIS C 3.688 C A 0091 GLU CB
CHARGE_ATTR 2.00 12.00 148
H A 0002 GLU OE1 2.422 H A 0005 LYS NZ
H A 0002 GLU OE2 4.224 H A 0005 LYS NZ
H A 0002 GLU OE1 11.88 C A 0090 HIS ND1
H A 0002 GLU OE2 9.806 C A 0090 HIS ND1
H A 0002 GLU OE2 11.78 C A 0090 HIS NE2
H A 0004 GLU OE1 11.09 H A 0005 LYS NZ
H A 0004 GLU OE2 11.44 H A 0005 LYS NZ
H A 0012 ASP OD2 11.83 H A 0005 LYS NZ
H A 0012 ASP OD1 7.437 H A 0015 HIS ND1
H A 0012 ASP OD1 8.545 H A 0015 HIS NE2
H A 0012 ASP OD2 9.009 H A 0015 HIS ND1
H A 0012 ASP OD2 10.36 H A 0015 HIS NE2
C A 0021 GLU OE1 7.907 C A 0020 ARG NH1
C A 0021 GLU OE1 8.271 C A 0020 ARG NH2
C A 0021 GLU OE2 6.228 C A 0020 ARG NH1
C A 0021 GLU OE2 6.289 C A 0020 ARG NH2
C A 0021 GLU OE1 11.37 C A 0025 HIS NE2
C A 0021 GLU OE1 11.68 E A 0026 LYS NZ
C A 0021 GLU OE1 8.320 E A 0028 LYS NZ
C A 0021 GLU OE2 9.654 E A 0028 LYS NZ
C A 0021 GLU OE2 11.10 H A 0033 LYS NZ
C A 0023 ASP OD2 11.88 C A 0020 ARG NH1
C A 0023 ASP OD1 11.34 C A 0024 LYS NZ
C A 0023 ASP OD1 7.428 C A 0025 HIS ND1
C A 0023 ASP OD1 6.163 C A 0025 HIS NE2
C A 0023 ASP OD2 8.489 C A 0025 HIS ND1
C A 0023 ASP OD2 7.674 C A 0025 HIS NE2
C A 0023 ASP OD1 6.378 E A 0026 LYS NZ
C A 0023 ASP OD2 7.127 E A 0026 LYS NZ
C A 0023 ASP OD1 8.077 E A 0028 LYS NZ
C A 0023 ASP OD2 6.642 E A 0028 LYS NZ
C A 0023 ASP OD2 11.87 H A 0029 LYS NZ
H A 0031 GLU OE1 11.88 H A 0015 HIS ND1
H A 0031 GLU OE1 11.81 H A 0015 HIS NE2
H A 0031 GLU OE1 9.213 C A 0020 ARG NH1
H A 0031 GLU OE1 10.48 C A 0020 ARG NH2
H A 0031 GLU OE2 9.244 C A 0020 ARG NH1
H A 0031 GLU OE2 10.07 C A 0020 ARG NH2
H A 0031 GLU OE1 9.452 C A 0025 HIS ND1
H A 0031 GLU OE1 9.118 C A 0025 HIS NE2
H A 0031 GLU OE2 9.951 C A 0025 HIS ND1
H A 0031 GLU OE2 9.158 C A 0025 HIS NE2
H A 0031 GLU OE1 9.504 E A 0026 LYS NZ
H A 0031 GLU OE2 9.530 E A 0026 LYS NZ
H A 0031 GLU OE1 8.752 E A 0028 LYS NZ
H A 0031 GLU OE2 8.051 E A 0028 LYS NZ
H A 0034 GLU OE1 2.808 C A 0020 ARG NH1
H A 0034 GLU OE1 4.054 C A 0020 ARG NH2
H A 0034 GLU OE2 3.802 C A 0020 ARG NH1
H A 0034 GLU OE2 3.958 C A 0020 ARG NH2
H A 0034 GLU OE2 11.68 E A 0028 LYS NZ
H A 0034 GLU OE1 8.821 H A 0033 LYS NZ
H A 0034 GLU OE2 7.880 H A 0033 LYS NZ
H A 0039 GLU OE1 10.18 H A 0015 HIS ND1
H A 0039 GLU OE2 11.80 H A 0015 HIS ND1
H A 0039 GLU OE1 9.113 C A 0020 ARG NH1
H A 0039 GLU OE1 11.25 C A 0020 ARG NH2
H A 0039 GLU OE2 10.93 C A 0020 ARG NH1
C A 0045 GLU OE1 7.100 C A 0048 LYS NZ
C A 0045 GLU OE2 5.321 C A 0048 LYS NZ
C A 0046 GLU OE2 11.48 C A 0020 ARG NH1
C A 0046 GLU OE1 8.457 H A 0033 LYS NZ
C A 0046 GLU OE2 8.408 H A 0033 LYS NZ
C A 0046 GLU OE1 6.474 C A 0042 HIS ND1
C A 0046 GLU OE1 6.234 C A 0042 HIS NE2
C A 0046 GLU OE2 5.711 C A 0042 HIS ND1
C A 0046 GLU OE2 6.128 C A 0042 HIS NE2
C A 0046 GLU OE1 5.421 C A 0048 LYS NZ
C A 0046 GLU OE2 7.508 C A 0048 LYS NZ
H A 0049 GLU OE1 10.35 H A 0033 LYS NZ
H A 0049 GLU OE2 10.76 H A 0033 LYS NZ
H A 0049 GLU OE1 9.805 C A 0048 LYS NZ
H A 0049 GLU OE2 9.273 C A 0048 LYS NZ
H A 0051 GLU OE1 11.71 H A 0029 LYS NZ
H A 0051 GLU OE1 10.84 H A 0033 LYS NZ
H A 0051 GLU OE1 12.00 C A 0048 LYS NZ
H A 0051 GLU OE2 10.32 H A 0055 LYS NZ
H A 0054 ASP OD1 11.01 E A 0028 LYS NZ
H A 0054 ASP OD2 11.17 E A 0028 LYS NZ
H A 0054 ASP OD1 6.176 H A 0029 LYS NZ
H A 0054 ASP OD2 5.599 H A 0029 LYS NZ
H A 0054 ASP OD1 9.441 H A 0055 LYS NZ
H A 0054 ASP OD2 10.55 H A 0055 LYS NZ
H A 0058 GLU OE1 5.860 H A 0055 LYS NZ
H A 0058 GLU OE2 7.313 H A 0055 LYS NZ
H A 0061 ASP OD1 10.88 E A 0026 LYS NZ
H A 0061 ASP OD2 11.82 E A 0026 LYS NZ
H A 0061 ASP OD1 9.921 E A 0028 LYS NZ
H A 0061 ASP OD2 8.920 E A 0028 LYS NZ
H A 0061 ASP OD1 10.48 H A 0029 LYS NZ
H A 0061 ASP OD2 8.612 H A 0029 LYS NZ
C A 0063 ASP OD1 11.52 C A 0025 HIS ND1
C A 0063 ASP OD2 10.07 C A 0025 HIS ND1
C A 0063 ASP OD2 11.76 C A 0025 HIS NE2
C A 0063 ASP OD1 9.962 E A 0026 LYS NZ
C A 0063 ASP OD2 8.586 E A 0026 LYS NZ
C A 0065 ASP OD1 11.11 C A 0025 HIS ND1
C A 0065 ASP OD2 9.251 C A 0025 HIS ND1
C A 0065 ASP OD2 10.19 C A 0025 HIS NE2
C A 0065 ASP OD1 7.948 E A 0026 LYS NZ
C A 0065 ASP OD2 5.878 E A 0026 LYS NZ
C A 0065 ASP OD1 8.457 E A 0028 LYS NZ
C A 0065 ASP OD2 8.565 E A 0028 LYS NZ
C A 0065 ASP OD1 10.72 H A 0029 LYS NZ
C A 0065 ASP OD2 11.93 H A 0029 LYS NZ
E A 0067 GLU OE1 8.920 C A 0025 HIS ND1
E A 0067 GLU OE1 8.996 C A 0025 HIS NE2
E A 0067 GLU OE2 8.572 C A 0025 HIS ND1
E A 0067 GLU OE2 8.407 C A 0025 HIS NE2
E A 0067 GLU OE1 4.780 E A 0026 LYS NZ
E A 0067 GLU OE2 5.259 E A 0026 LYS NZ
E A 0067 GLU OE1 5.635 E A 0028 LYS NZ
E A 0067 GLU OE2 4.943 E A 0028 LYS NZ
E A 0067 GLU OE1 10.54 H A 0029 LYS NZ
E A 0067 GLU OE2 10.21 H A 0029 LYS NZ
E A 0069 ASP OD1 6.281 C A 0025 HIS ND1
E A 0069 ASP OD1 7.915 C A 0025 HIS NE2
E A 0069 ASP OD2 7.264 C A 0025 HIS ND1
E A 0069 ASP OD2 9.147 C A 0025 HIS NE2
E A 0069 ASP OD1 5.774 E A 0026 LYS NZ
E A 0069 ASP OD2 6.911 E A 0026 LYS NZ
E A 0069 ASP OD1 11.31 E A 0028 LYS NZ
H A 0072 GLU OE2 10.45 C A 0025 HIS ND1
H A 0072 GLU OE1 11.37 E A 0026 LYS NZ
H A 0072 GLU OE2 9.529 E A 0026 LYS NZ
H A 0086 GLU OE1 4.679 H A 0085 HIS ND1
H A 0086 GLU OE1 6.819 H A 0085 HIS NE2
H A 0086 GLU OE2 4.451 H A 0085 HIS ND1
H A 0086 GLU OE2 6.580 H A 0085 HIS NE2
H A 0086 GLU OE1 10.53 C A 0090 HIS ND1
H A 0086 GLU OE1 9.946 C A 0090 HIS NE2
H A 0086 GLU OE2 10.96 C A 0090 HIS ND1
H A 0086 GLU OE2 9.992 C A 0090 HIS NE2
C A 0089 GLU OE1 6.987 H A 0085 HIS ND1
C A 0089 GLU OE1 7.333 H A 0085 HIS NE2
C A 0089 GLU OE2 7.335 H A 0085 HIS ND1
C A 0089 GLU OE2 7.130 H A 0085 HIS NE2
C A 0089 GLU OE1 8.900 C A 0090 HIS ND1
C A 0089 GLU OE1 7.809 C A 0090 HIS NE2
C A 0089 GLU OE2 8.434 C A 0090 HIS ND1
C A 0089 GLU OE2 7.036 C A 0090 HIS NE2
C A 0091 GLU OE1 11.92 H A 0085 HIS NE2
C A 0091 GLU OE2 11.40 H A 0085 HIS ND1
C A 0091 GLU OE2 11.15 H A 0085 HIS NE2
C A 0091 GLU OE1 10.51 C A 0090 HIS ND1
C A 0091 GLU OE1 10.25 C A 0090 HIS NE2
C A 0091 GLU OE2 10.61 C A 0090 HIS ND1
C A 0091 GLU OE2 10.10 C A 0090 HIS NE2
CHARGE_REPU 2.00 12.00 202
H A 0002 GLU OE1 10.91 H A 0004 GLU OE1
H A 0002 GLU OE1 11.69 H A 0004 GLU OE2
H A 0004 GLU OE2 11.74 H A 0012 ASP OD1
H A 0004 GLU OE2 11.27 H A 0012 ASP OD2
H A 0012 ASP OD1 10.84 H A 0039 GLU OE1
H A 0012 ASP OD1 11.19 H A 0039 GLU OE2
H A 0012 ASP OD2 10.98 H A 0039 GLU OE1
H A 0012 ASP OD2 11.04 H A 0039 GLU OE2
H A 0015 HIS ND1 8.340 C A 0024 LYS NZ
H A 0015 HIS NE2 6.182 C A 0024 LYS NZ
C A 0020 ARG NH1 9.445 H A 0033 LYS NZ
C A 0020 ARG NH2 9.951 H A 0033 LYS NZ
C A 0021 GLU OE1 5.751 C A 0023 ASP OD1
C A 0021 GLU OE1 4.574 C A 0023 ASP OD2
C A 0021 GLU OE2 7.869 C A 0023 ASP OD1
C A 0021 GLU OE2 6.714 C A 0023 ASP OD2
C A 0021 GLU OE1 4.254 H A 0031 GLU OE1
C A 0021 GLU OE1 2.546 H A 0031 GLU OE2
C A 0021 GLU OE2 5.789 H A 0031 GLU OE1
C A 0021 GLU OE2 4.515 H A 0031 GLU OE2
C A 0021 GLU OE1 5.510 H A 0034 GLU OE1
C A 0021 GLU OE1 5.671 H A 0034 GLU OE2
C A 0021 GLU OE2 4.040 H A 0034 GLU OE1
C A 0021 GLU OE2 3.787 H A 0034 GLU OE2
C A 0021 GLU OE1 10.28 E A 0067 GLU OE1
C A 0021 GLU OE1 8.156 E A 0067 GLU OE2
C A 0021 GLU OE2 10.14 E A 0067 GLU OE2
C A 0023 ASP OD1 5.166 H A 0031 GLU OE1
C A 0023 ASP OD1 4.022 H A 0031 GLU OE2
C A 0023 ASP OD2 3.687 H A 0031 GLU OE1
C A 0023 ASP OD2 2.672 H A 0031 GLU OE2
C A 0023 ASP OD1 10.78 H A 0034 GLU OE1
C A 0023 ASP OD1 11.34 H A 0034 GLU OE2
C A 0023 ASP OD2 9.363 H A 0034 GLU OE1
C A 0023 ASP OD2 9.876 H A 0034 GLU OE2
C A 0023 ASP OD1 11.02 C A 0065 ASP OD1
C A 0023 ASP OD1 9.730 C A 0065 ASP OD2
C A 0023 ASP OD2 10.00 C A 0065 ASP OD1
C A 0023 ASP OD2 9.072 C A 0065 ASP OD2
C A 0023 ASP OD1 6.758 E A 0067 GLU OE1
C A 0023 ASP OD1 5.033 E A 0067 GLU OE2
C A 0023 ASP OD2 6.189 E A 0067 GLU OE1
C A 0023 ASP OD2 4.111 E A 0067 GLU OE2
C A 0023 ASP OD1 9.297 E A 0069 ASP OD1
C A 0023 ASP OD1 11.29 E A 0069 ASP OD2
C A 0023 ASP OD2 8.909 E A 0069 ASP OD1
C A 0023 ASP OD2 11.01 E A 0069 ASP OD2
C A 0023 ASP OD2 11.81 H A 0072 GLU OE2
C A 0024 LYS NZ 8.614 C A 0025 HIS ND1
C A 0024 LYS NZ 7.959 C A 0025 HIS NE2
C A 0025 HIS ND1 4.834 E A 0026 LYS NZ
C A 0025 HIS NE2 4.966 E A 0026 LYS NZ
E A 0026 LYS NZ 9.906 E A 0028 LYS NZ
E A 0028 LYS NZ 6.028 H A 0029 LYS NZ
H A 0031 GLU OE1 6.839 H A 0034 GLU OE1
H A 0031 GLU OE1 7.996 H A 0034 GLU OE2
H A 0031 GLU OE2 6.821 H A 0034 GLU OE1
H A 0031 GLU OE2 7.550 H A 0034 GLU OE2
H A 0031 GLU OE1 11.84 H A 0039 GLU OE1
H A 0031 GLU OE1 11.03 C A 0065 ASP OD1
H A 0031 GLU OE1 10.51 C A 0065 ASP OD2
H A 0031 GLU OE2 11.81 C A 0065 ASP OD1
H A 0031 GLU OE2 11.15 C A 0065 ASP OD2
H A 0031 GLU OE1 8.671 E A 0067 GLU OE1
H A 0031 GLU OE1 6.621 E A 0067 GLU OE2
H A 0031 GLU OE2 8.611 E A 0067 GLU OE1
H A 0031 GLU OE2 6.466 E A 0067 GLU OE2
H A 0031 GLU OE1 9.197 E A 0069 ASP OD1
H A 0031 GLU OE1 11.33 E A 0069 ASP OD2
H A 0031 GLU OE2 10.42 E A 0069 ASP OD1
H A 0031 GLU OE1 11.51 H A 0072 GLU OE2
H A 0033 LYS NZ 9.933 C A 0048 LYS NZ
H A 0034 GLU OE1 9.801 H A 0039 GLU OE1
H A 0034 GLU OE1 11.56 H A 0039 GLU OE2
H A 0034 GLU OE2 11.67 H A 0039 GLU OE1
H A 0039 GLU OE1 11.75 C A 0046 GLU OE2
H A 0039 GLU OE2 11.55 C A 0046 GLU OE2
C A 0042 HIS ND1 10.64 C A 0048 LYS NZ
C A 0042 HIS NE2 9.728 C A 0048 LYS NZ
C A 0045 GLU OE1 9.923 C A 0046 GLU OE1
C A 0045 GLU OE1 11.23 C A 0046 GLU OE2
C A 0045 GLU OE2 9.066 C A 0046 GLU OE1
C A 0045 GLU OE2 10.67 C A 0046 GLU OE2
C A 0045 GLU OE1 11.48 H A 0049 GLU OE1
C A 0045 GLU OE2 9.988 H A 0049 GLU OE1
C A 0045 GLU OE2 10.32 H A 0049 GLU OE2
C A 0045 GLU OE2 11.69 H A 0051 GLU OE2
H A 0049 GLU OE1 2.380 H A 0051 GLU OE1
H A 0049 GLU OE1 3.085 H A 0051 GLU OE2
H A 0049 GLU OE2 3.881 H A 0051 GLU OE1
H A 0049 GLU OE2 4.887 H A 0051 GLU OE2
H A 0049 GLU OE1 11.82 H A 0054 ASP OD1
H A 0049 GLU OE1 10.87 H A 0054 ASP OD2
H A 0051 GLU OE1 10.18 H A 0054 ASP OD1
H A 0051 GLU OE1 8.954 H A 0054 ASP OD2
H A 0051 GLU OE2 9.878 H A 0054 ASP OD1
H A 0051 GLU OE2 8.874 H A 0054 ASP OD2
H A 0054 ASP OD1 6.598 H A 0058 GLU OE1
H A 0054 ASP OD1 8.273 H A 0058 GLU OE2
H A 0054 ASP OD2 8.051 H A 0058 GLU OE1
H A 0054 ASP OD2 9.749 H A 0058 GLU OE2
H A 0054 ASP OD1 9.260 H A 0061 ASP OD1
H A 0054 ASP OD1 7.384 H A 0061 ASP OD2
H A 0054 ASP OD2 11.01 H A 0061 ASP OD1
H A 0054 ASP OD2 8.999 H A 0061 ASP OD2
H A 0054 ASP OD1 11.13 C A 0065 ASP OD1
H A 0058 GLU OE1 10.67 H A 0061 ASP OD1
H A 0058 GLU OE1 9.624 H A 0061 ASP OD2
H A 0058 GLU OE2 10.73 H A 0061 ASP OD1
H A 0058 GLU OE2 9.934 H A 0061 ASP OD2
H A 0061 ASP OD1 8.160 C A 0062 GLU OE1
H A 0061 ASP OD1 8.689 C A 0062 GLU OE2
H A 0061 ASP OD2 10.07 C A 0062 GLU OE1
H A 0061 ASP OD2 10.34 C A 0062 GLU OE2
H A 0061 ASP OD1 6.380 C A 0063 ASP OD1
H A 0061 ASP OD1 5.591 C A 0063 ASP OD2
H A 0061 ASP OD2 8.468 C A 0063 ASP OD1
H A 0061 ASP OD2 7.672 C A 0063 ASP OD2
H A 0061 ASP OD1 2.955 C A 0065 ASP OD1
H A 0061 ASP OD1 5.055 C A 0065 ASP OD2
H A 0061 ASP OD2 4.095 C A 0065 ASP OD1
H A 0061 ASP OD2 6.190 C A 0065 ASP OD2
H A 0061 ASP OD1 7.784 E A 0067 GLU OE1
H A 0061 ASP OD1 8.813 E A 0067 GLU OE2
H A 0061 ASP OD2 8.009 E A 0067 GLU OE1
H A 0061 ASP OD2 8.943 E A 0067 GLU OE2
H A 0061 ASP OD1 7.906 E A 0069 ASP OD1
H A 0061 ASP OD1 8.075 E A 0069 ASP OD2
H A 0061 ASP OD2 9.536 E A 0069 ASP OD1
H A 0061 ASP OD2 9.979 E A 0069 ASP OD2
H A 0061 ASP OD1 4.724 H A 0072 GLU OE1
H A 0061 ASP OD1 5.516 H A 0072 GLU OE2
H A 0061 ASP OD2 6.650 H A 0072 GLU OE1
H A 0061 ASP OD2 7.511 H A 0072 GLU OE2
C A 0062 GLU OE1 5.757 C A 0063 ASP OD1
C A 0062 GLU OE1 5.995 C A 0063 ASP OD2
C A 0062 GLU OE2 7.662 C A 0063 ASP OD1
C A 0062 GLU OE2 7.582 C A 0063 ASP OD2
C A 0062 GLU OE1 9.265 C A 0065 ASP OD1
C A 0062 GLU OE1 10.11 C A 0065 ASP OD2
C A 0062 GLU OE2 10.17 C A 0065 ASP OD1
C A 0062 GLU OE2 11.27 C A 0065 ASP OD2
C A 0062 GLU OE1 8.957 E A 0069 ASP OD1
C A 0062 GLU OE1 7.778 E A 0069 ASP OD2
C A 0062 GLU OE2 10.14 E A 0069 ASP OD1
C A 0062 GLU OE2 9.300 E A 0069 ASP OD2
C A 0062 GLU OE1 4.051 H A 0072 GLU OE1
C A 0062 GLU OE1 5.078 H A 0072 GLU OE2
C A 0062 GLU OE2 4.679 H A 0072 GLU OE1
C A 0062 GLU OE2 6.138 H A 0072 GLU OE2
C A 0063 ASP OD1 5.982 C A 0065 ASP OD1
C A 0063 ASP OD1 5.974 C A 0065 ASP OD2
C A 0063 ASP OD2 4.681 C A 0065 ASP OD1
C A 0063 ASP OD2 4.564 C A 0065 ASP OD2
C A 0063 ASP OD1 9.792 E A 0067 GLU OE1
C A 0063 ASP OD1 11.07 E A 0067 GLU OE2
C A 0063 ASP OD2 8.252 E A 0067 GLU OE1
C A 0063 ASP OD2 9.274 E A 0067 GLU OE2
C A 0063 ASP OD1 6.127 E A 0069 ASP OD1
C A 0063 ASP OD1 4.525 E A 0069 ASP OD2
C A 0063 ASP OD2 4.199 E A 0069 ASP OD1
C A 0063 ASP OD2 3.051 E A 0069 ASP OD2
C A 0063 ASP OD1 4.823 H A 0072 GLU OE1
C A 0063 ASP OD1 4.141 H A 0072 GLU OE2
C A 0063 ASP OD2 3.797 H A 0072 GLU OE1
C A 0063 ASP OD2 2.420 H A 0072 GLU OE2
C A 0065 ASP OD1 5.060 E A 0067 GLU OE1
C A 0065 ASP OD1 6.302 E A 0067 GLU OE2
C A 0065 ASP OD2 3.865 E A 0067 GLU OE1
C A 0065 ASP OD2 5.346 E A 0067 GLU OE2
C A 0065 ASP OD1 5.831 E A 0069 ASP OD1
C A 0065 ASP OD1 6.356 E A 0069 ASP OD2
C A 0065 ASP OD2 4.660 E A 0069 ASP OD1
C A 0065 ASP OD2 5.309 E A 0069 ASP OD2
C A 0065 ASP OD1 5.567 H A 0072 GLU OE1
C A 0065 ASP OD1 5.157 H A 0072 GLU OE2
C A 0065 ASP OD2 6.652 H A 0072 GLU OE1
C A 0065 ASP OD2 5.540 H A 0072 GLU OE2
E A 0067 GLU OE1 6.664 E A 0069 ASP OD1
E A 0067 GLU OE1 8.103 E A 0069 ASP OD2
E A 0067 GLU OE2 6.921 E A 0069 ASP OD1
E A 0067 GLU OE2 8.747 E A 0069 ASP OD2
E A 0067 GLU OE1 9.931 H A 0072 GLU OE1
E A 0067 GLU OE1 8.788 H A 0072 GLU OE2
E A 0067 GLU OE2 10.49 H A 0072 GLU OE1
E A 0067 GLU OE2 9.318 H A 0072 GLU OE2
E A 0069 ASP OD1 6.304 H A 0072 GLU OE1
E A 0069 ASP OD1 4.227 H A 0072 GLU OE2
E A 0069 ASP OD2 5.915 H A 0072 GLU OE1
E A 0069 ASP OD2 3.817 H A 0072 GLU OE2
H A 0085 HIS ND1 6.660 C A 0090 HIS ND1
H A 0085 HIS ND1 5.543 C A 0090 HIS NE2
H A 0085 HIS NE2 4.869 C A 0090 HIS ND1
H A 0085 HIS NE2 3.499 C A 0090 HIS NE2
H A 0086 GLU OE1 9.014 C A 0089 GLU OE1
H A 0086 GLU OE1 10.26 C A 0089 GLU OE2
H A 0086 GLU OE2 9.278 C A 0089 GLU OE1
H A 0086 GLU OE2 10.21 C A 0089 GLU OE2
C A 0089 GLU OE1 6.769 C A 0091 GLU OE1
C A 0089 GLU OE1 5.033 C A 0091 GLU OE2
C A 0089 GLU OE2 6.403 C A 0091 GLU OE1
C A 0089 GLU OE2 5.059 C A 0091 GLU OE2
HB_MM 2.00 3.20 163
C A 0001 SER N 2.195 C A 0000 MET O
H A 0002 GLU N 2.557 C A 0000 MET O
H A 0002 GLU N 2.197 C A 0001 SER O
H A 0003 LEU N 2.776 C A 0001 SER O
H A 0003 LEU N 2.179 H A 0002 GLU O
H A 0004 GLU N 3.164 H A 0002 GLU O
H A 0004 GLU N 2.190 H A 0003 LEU O
H A 0005 LYS N 2.186 H A 0004 GLU O
H A 0006 ALA N 3.178 H A 0003 LEU O
H A 0006 ALA N 2.194 H A 0005 LYS O
H A 0007 MET N 3.136 H A 0003 LEU O
H A 0007 MET N 2.185 H A 0006 ALA O
H A 0008 VAL N 2.191 H A 0007 MET O
H A 0009 ALA N 3.082 H A 0005 LYS O
H A 0009 ALA N 2.192 H A 0008 VAL O
H A 0010 LEU N 3.132 H A 0006 ALA O
H A 0010 LEU N 2.193 H A 0009 ALA O
H A 0011 ILE N 2.198 H A 0010 LEU O
H A 0012 ASP N 3.062 H A 0008 VAL O
H A 0012 ASP N 3.039 H A 0009 ALA O
H A 0012 ASP N 2.196 H A 0011 ILE O
H A 0013 VAL N 2.189 H A 0012 ASP O
H A 0014 PHE N 2.200 H A 0013 VAL O
H A 0015 HIS N 3.172 H A 0012 ASP O
H A 0015 HIS N 3.148 H A 0013 VAL O
H A 0015 HIS N 2.178 H A 0014 PHE O
H A 0016 GLN N 2.982 H A 0013 VAL O
H A 0016 GLN N 2.189 H A 0015 HIS O
H A 0017 TYR N 2.195 H A 0016 GLN O
H A 0018 SER N 3.049 H A 0014 PHE O
H A 0018 SER N 2.179 H A 0017 TYR O
H A 0019 GLY N 2.192 H A 0018 SER O
C A 0020 ARG N 2.889 H A 0017 TYR O
C A 0020 ARG N 3.183 H A 0018 SER O
C A 0020 ARG N 2.197 H A 0019 GLY O
C A 0021 GLU N 2.207 C A 0020 ARG O
C A 0022 GLY N 2.201 C A 0021 GLU O
C A 0023 ASP N 3.081 C A 0021 GLU O
C A 0023 ASP N 2.190 C A 0022 GLY O
C A 0024 LYS N 2.474 C A 0022 GLY O
C A 0024 LYS N 2.194 C A 0023 ASP O
C A 0025 HIS N 2.198 C A 0024 LYS O
E A 0026 LYS N 3.190 C A 0023 ASP O
E A 0026 LYS N 2.199 C A 0025 HIS O
E A 0027 LEU N 2.202 E A 0026 LYS O
E A 0027 LEU N 3.092 E A 0068 CYS O
E A 0028 LYS N 2.196 E A 0027 LEU O
H A 0029 LYS N 2.201 E A 0028 LYS O
H A 0030 SER N 2.486 E A 0028 LYS O
H A 0030 SER N 2.198 H A 0029 LYS O
H A 0031 GLU N 2.602 E A 0028 LYS O
H A 0031 GLU N 2.199 H A 0030 SER O
H A 0032 LEU N 2.693 E A 0028 LYS O
H A 0032 LEU N 2.199 H A 0031 GLU O
H A 0033 LYS N 3.199 H A 0029 LYS O
H A 0033 LYS N 3.150 H A 0030 SER O
H A 0033 LYS N 2.181 H A 0032 LEU O
H A 0034 GLU N 3.068 H A 0031 GLU O
H A 0034 GLU N 2.192 H A 0033 LYS O
H A 0035 LEU N 3.131 H A 0032 LEU O
H A 0035 LEU N 2.177 H A 0034 GLU O
H A 0036 ILE N 3.093 H A 0032 LEU O
H A 0036 ILE N 2.184 H A 0035 LEU O
H A 0037 ASN N 2.668 H A 0033 LYS O
H A 0037 ASN N 2.183 H A 0036 ILE O
H A 0038 ASN N 2.905 H A 0034 GLU O
H A 0038 ASN N 2.184 H A 0037 ASN O
H A 0039 GLU N 3.182 H A 0035 LEU O
H A 0039 GLU N 2.186 H A 0038 ASN O
H A 0040 LEU N 2.196 H A 0039 GLU O
C A 0041 SER N 3.151 H A 0039 GLU O
C A 0041 SER N 2.197 H A 0040 LEU O
C A 0042 HIS N 2.201 C A 0041 SER O
C A 0043 PHE N 2.192 C A 0042 HIS O
C A 0044 LEU N 2.205 C A 0043 PHE O
C A 0045 GLU N 2.191 C A 0044 LEU O
C A 0046 GLU N 2.874 C A 0044 LEU O
C A 0046 GLU N 2.196 C A 0045 GLU O
C A 0047 ILE N 2.199 C A 0046 GLU O
C A 0048 LYS N 2.198 C A 0047 ILE O
H A 0049 GLU N 2.205 C A 0048 LYS O
H A 0050 GLN N 2.194 H A 0049 GLU O
H A 0051 GLU N 3.170 H A 0049 GLU O
H A 0051 GLU N 2.190 H A 0050 GLN O
H A 0052 VAL N 3.145 H A 0050 GLN O
H A 0052 VAL N 2.187 H A 0051 GLU O
H A 0053 VAL N 2.858 H A 0050 GLN O
H A 0053 VAL N 3.155 H A 0051 GLU O
H A 0053 VAL N 2.191 H A 0052 VAL O
H A 0054 ASP N 3.048 H A 0050 GLN O
H A 0054 ASP N 2.935 H A 0051 GLU O
H A 0054 ASP N 2.192 H A 0053 VAL O
H A 0055 LYS N 3.093 H A 0051 GLU O
H A 0055 LYS N 2.189 H A 0054 ASP O
H A 0056 VAL N 3.088 H A 0052 VAL O
H A 0056 VAL N 2.199 H A 0055 LYS O
H A 0057 MET N 2.816 H A 0053 VAL O
H A 0057 MET N 3.197 H A 0054 ASP O
H A 0057 MET N 2.203 H A 0056 VAL O
H A 0058 GLU N 3.116 H A 0055 LYS O
H A 0058 GLU N 2.166 H A 0057 MET O
H A 0059 THR N 2.964 H A 0056 VAL O
H A 0059 THR N 3.027 H A 0057 MET O
H A 0059 THR N 2.198 H A 0058 GLU O
H A 0060 LEU N 2.713 H A 0056 VAL O
H A 0060 LEU N 3.197 H A 0057 MET O
H A 0060 LEU N 2.197 H A 0059 THR O
H A 0061 ASP N 2.341 H A 0057 MET O
H A 0061 ASP N 2.183 H A 0060 LEU O
C A 0062 GLU N 2.657 H A 0060 LEU O
C A 0062 GLU N 2.200 H A 0061 ASP O
C A 0063 ASP N 2.195 C A 0062 GLU O
C A 0064 GLY N 2.788 H A 0061 ASP O
C A 0064 GLY N 2.199 C A 0063 ASP O
C A 0065 ASP N 2.205 C A 0064 GLY O
C A 0066 GLY N 2.196 C A 0065 ASP O
E A 0067 GLU N 3.166 C A 0065 ASP O
E A 0067 GLU N 2.203 C A 0066 GLY O
E A 0068 CYS N 2.872 E A 0027 LEU O
E A 0068 CYS N 2.198 E A 0067 GLU O
E A 0069 ASP N 2.186 E A 0068 CYS O
H A 0070 PHE N 2.201 E A 0069 ASP O
H A 0071 GLN N 2.871 E A 0069 ASP O
H A 0071 GLN N 2.185 H A 0070 PHE O
H A 0072 GLU N 2.642 E A 0069 ASP O
H A 0072 GLU N 2.201 H A 0071 GLN O
H A 0073 PHE N 2.862 E A 0069 ASP O
H A 0073 PHE N 2.200 H A 0072 GLU O
H A 0074 MET N 3.067 H A 0070 PHE O
H A 0074 MET N 2.197 H A 0073 PHE O
H A 0075 ALA N 3.177 H A 0072 GLU O
H A 0075 ALA N 2.187 H A 0074 MET O
H A 0076 PHE N 3.145 H A 0073 PHE O
H A 0076 PHE N 2.189 H A 0075 ALA O
H A 0077 VAL N 2.177 H A 0076 PHE O
H A 0078 SER N 2.193 H A 0077 VAL O
H A 0079 MET N 2.193 H A 0078 SER O
H A 0080 VAL N 2.186 H A 0079 MET O
H A 0081 THR N 2.196 H A 0080 VAL O
H A 0082 THR N 3.142 H A 0079 MET O
H A 0082 THR N 2.193 H A 0081 THR O
H A 0083 ALA N 2.933 H A 0080 VAL O
H A 0083 ALA N 3.006 H A 0081 THR O
H A 0083 ALA N 2.204 H A 0082 THR O
H A 0084 CYS N 2.574 H A 0081 THR O
H A 0084 CYS N 3.183 H A 0082 THR O
H A 0084 CYS N 2.203 H A 0083 ALA O
H A 0085 HIS N 3.062 H A 0081 THR O
H A 0085 HIS N 2.950 H A 0082 THR O
H A 0085 HIS N 3.153 H A 0083 ALA O
H A 0085 HIS N 2.194 H A 0084 CYS O
H A 0086 GLU N 3.026 H A 0083 ALA O
H A 0086 GLU N 2.193 H A 0085 HIS O
H A 0087 PHE N 2.946 H A 0084 CYS O
H A 0087 PHE N 2.197 H A 0086 GLU O
H A 0088 PHE N 2.395 H A 0084 CYS O
H A 0088 PHE N 2.196 H A 0087 PHE O
C A 0089 GLU N 3.175 H A 0087 PHE O
C A 0089 GLU N 2.199 H A 0088 PHE O
C A 0090 HIS N 3.132 H A 0088 PHE O
C A 0090 HIS N 2.197 C A 0089 GLU O
C A 0091 GLU N 2.574 C A 0089 GLU O
C A 0091 GLU N 2.197 C A 0090 HIS O
HB_MS 2.00 3.20 16
H A 0012 ASP O 2.428 H A 0016 GLN NE2
H A 0019 GLY N 2.750 H A 0018 SER OG
H A 0039 GLU N 2.732 H A 0017 TYR OH
C A 0042 HIS N 2.851 C A 0041 SER OG
C A 0047 ILE O 2.728 H A 0037 ASN ND2
C A 0062 GLU N 2.628 H A 0072 GLU OE1
C A 0064 GLY N 2.523 H A 0061 ASP OD1
C A 0065 ASP N 2.685 H A 0061 ASP OD1
C A 0065 ASP N 3.194 H A 0061 ASP OD2
C A 0066 GLY N 2.426 H A 0061 ASP OD2
C A 0066 GLY N 3.024 C A 0065 ASP OD1
E A 0067 GLU N 2.731 C A 0065 ASP OD1
E A 0069 ASP N 2.752 H A 0072 GLU OE2
H A 0077 VAL O 2.718 H A 0081 THR OG1
H A 0078 SER O 2.727 H A 0082 THR OG1
H A 0079 MET O 2.994 H A 0082 THR OG1
HB_SS 2.00 3.20 2
H A 0038 ASN ND2 2.745 H A 0017 TYR OH
C A 0042 HIS ND1 2.953 C A 0041 SER OG
AROMATIC 0.00 8.00 5
H A 0085 HIS 5.264 C A 0090 HIS
C A 0024 LYS 7.287 H A 0015 HIS
C A 0024 LYS 7.670 C A 0025 HIS
E A 0026 LYS 5.315 C A 0025 HIS
C A 0020 ARG 5.231 H A 0017 TYR
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 50
C A 0001 SER CA 3.668 H B 0013 VAL CG2
C A 0001 SER CA 3.517 H B 0039 GLU CG
C A 0001 SER CB 3.666 H B 0039 GLU CG
H A 0003 LEU CD2 3.756 H B 0077 VAL CG1
H A 0004 GLU CG 3.615 C B 0043 PHE CD1
H A 0004 GLU CG 3.542 C B 0043 PHE CE1
H A 0004 GLU CD 3.703 C B 0043 PHE CD1
H A 0008 VAL CG1 3.696 H B 0088 PHE CE2
H A 0008 VAL CG1 3.762 H B 0088 PHE CZ
H A 0011 ILE CG1 3.793 H B 0081 THR CG2
H A 0011 ILE CD1 3.623 H B 0085 HIS CA
H A 0013 VAL CG2 3.663 C B 0001 SER CA
H A 0015 HIS CB 3.608 C B 0090 HIS CE1
H A 0015 HIS CG 3.792 C B 0090 HIS CE1
H A 0015 HIS CD2 3.584 C B 0090 HIS CD2
H A 0015 HIS CD2 3.470 C B 0090 HIS CE1
H A 0039 GLU CG 3.484 C B 0001 SER CA
H A 0039 GLU CG 3.625 C B 0001 SER CB
C A 0043 PHE CD1 3.782 H B 0004 GLU CB
C A 0043 PHE CD1 3.601 H B 0004 GLU CG
C A 0043 PHE CD1 3.673 H B 0004 GLU CD
C A 0043 PHE CE1 3.515 H B 0004 GLU CG
H A 0070 PHE CE2 3.381 H B 0082 THR CG2
H A 0070 PHE CZ 3.203 H B 0082 THR CG2
H A 0070 PHE CE2 3.317 H B 0085 HIS CB
H A 0070 PHE CE2 3.552 H B 0085 HIS CG
H A 0070 PHE CZ 3.601 H B 0085 HIS CB
H A 0070 PHE CZ 3.771 H B 0085 HIS CG
H A 0071 GLN CA 3.601 H B 0082 THR CG2
H A 0071 GLN CB 3.468 H B 0082 THR CG2
H A 0074 MET CE 3.552 H B 0081 THR CB
H A 0074 MET CE 3.358 H B 0081 THR CG2
H A 0077 VAL CG1 3.708 H B 0003 LEU CD2
H A 0078 SER CB 3.546 H B 0078 SER CB
H A 0081 THR CG2 3.786 H B 0011 ILE CG1
H A 0081 THR CB 3.550 H B 0074 MET CE
H A 0081 THR CG2 3.386 H B 0074 MET CE
H A 0082 THR CG2 3.356 H B 0070 PHE CE2
H A 0082 THR CG2 3.201 H B 0070 PHE CZ
H A 0082 THR CG2 3.612 H B 0071 GLN CA
H A 0082 THR CG2 3.497 H B 0071 GLN CB
H A 0085 HIS CA 3.593 H B 0011 ILE CD1
H A 0085 HIS CB 3.359 H B 0070 PHE CE2
H A 0085 HIS CB 3.644 H B 0070 PHE CZ
H A 0085 HIS CG 3.584 H B 0070 PHE CE2
H A 0088 PHE CE2 3.675 H B 0008 VAL CG1
H A 0088 PHE CZ 3.755 H B 0008 VAL CG1
C A 0090 HIS CD2 3.621 H B 0015 HIS CD2
C A 0090 HIS CE1 3.623 H B 0015 HIS CB
C A 0090 HIS CE1 3.496 H B 0015 HIS CD2
CHARGE_ATTR 2.00 12.00 65
H A 0002 GLU OE1 10.13 H B 0005 LYS NZ
H A 0002 GLU OE2 11.23 H B 0005 LYS NZ
H A 0002 GLU OE2 10.16 H B 0015 HIS ND1
H A 0004 GLU OE1 8.731 C B 0042 HIS ND1
H A 0004 GLU OE1 10.54 C B 0042 HIS NE2
H A 0004 GLU OE2 10.28 C B 0042 HIS ND1
H A 0004 GLU OE2 11.87 C B 0042 HIS NE2
H A 0005 LYS NZ 10.16 H B 0002 GLU OE1
H A 0005 LYS NZ 11.26 H B 0002 GLU OE2
H A 0005 LYS NZ 8.702 H B 0012 ASP OD1
H A 0005 LYS NZ 6.630 H B 0012 ASP OD2
H A 0005 LYS NZ 11.91 H B 0039 GLU OE1
H A 0005 LYS NZ 11.11 H B 0039 GLU OE2
H A 0012 ASP OD1 8.687 H B 0005 LYS NZ
H A 0012 ASP OD2 6.618 H B 0005 LYS NZ
H A 0012 ASP OD1 10.23 H B 0085 HIS ND1
H A 0012 ASP OD1 8.947 H B 0085 HIS NE2
H A 0012 ASP OD2 11.03 H B 0085 HIS NE2
H A 0012 ASP OD1 4.956 C B 0090 HIS ND1
H A 0012 ASP OD1 7.130 C B 0090 HIS NE2
H A 0012 ASP OD2 7.096 C B 0090 HIS ND1
H A 0012 ASP OD2 9.273 C B 0090 HIS NE2
H A 0015 HIS ND1 10.15 H B 0002 GLU OE2
H A 0015 HIS ND1 11.07 C B 0089 GLU OE2
H A 0015 HIS NE2 10.60 C B 0089 GLU OE1
H A 0015 HIS NE2 9.160 C B 0089 GLU OE2
H A 0015 HIS NE2 10.92 C B 0091 GLU OE1
H A 0015 HIS NE2 11.47 C B 0091 GLU OE2
C A 0024 LYS NZ 8.606 C B 0089 GLU OE1
C A 0024 LYS NZ 6.553 C B 0089 GLU OE2
C A 0024 LYS NZ 10.26 C B 0091 GLU OE1
C A 0024 LYS NZ 10.09 C B 0091 GLU OE2
C A 0025 HIS ND1 11.03 H B 0086 GLU OE2
C A 0025 HIS ND1 11.54 C B 0089 GLU OE2
C A 0025 HIS NE2 11.95 C B 0089 GLU OE2
H A 0039 GLU OE1 11.89 H B 0005 LYS NZ
H A 0039 GLU OE2 11.09 H B 0005 LYS NZ
C A 0042 HIS ND1 8.745 H B 0004 GLU OE1
C A 0042 HIS ND1 10.30 H B 0004 GLU OE2
C A 0042 HIS NE2 10.55 H B 0004 GLU OE1
C A 0042 HIS NE2 11.88 H B 0004 GLU OE2
E A 0069 ASP OD1 11.51 H B 0085 HIS ND1
E A 0069 ASP OD1 11.57 H B 0085 HIS NE2
E A 0069 ASP OD2 11.57 H B 0085 HIS ND1
H A 0085 HIS ND1 10.20 H B 0012 ASP OD1
H A 0085 HIS NE2 8.898 H B 0012 ASP OD1
H A 0085 HIS NE2 10.98 H B 0012 ASP OD2
H A 0085 HIS ND1 11.57 E B 0069 ASP OD1
H A 0085 HIS ND1 11.62 E B 0069 ASP OD2
H A 0085 HIS NE2 11.64 E B 0069 ASP OD1
H A 0086 GLU OE2 11.07 C B 0025 HIS ND1
C A 0089 GLU OE1 10.64 H B 0015 HIS NE2
C A 0089 GLU OE2 11.10 H B 0015 HIS ND1
C A 0089 GLU OE2 9.196 H B 0015 HIS NE2
C A 0089 GLU OE1 8.678 C B 0024 LYS NZ
C A 0089 GLU OE2 6.629 C B 0024 LYS NZ
C A 0089 GLU OE2 11.62 C B 0025 HIS ND1
C A 0090 HIS ND1 4.927 H B 0012 ASP OD1
C A 0090 HIS ND1 7.066 H B 0012 ASP OD2
C A 0090 HIS NE2 7.099 H B 0012 ASP OD1
C A 0090 HIS NE2 9.242 H B 0012 ASP OD2
C A 0091 GLU OE1 10.99 H B 0015 HIS NE2
C A 0091 GLU OE2 11.52 H B 0015 HIS NE2
C A 0091 GLU OE1 10.35 C B 0024 LYS NZ
C A 0091 GLU OE2 10.18 C B 0024 LYS NZ
CHARGE_REPU 2.00 12.00 64
H A 0002 GLU OE1 7.357 H B 0012 ASP OD1
H A 0002 GLU OE1 5.529 H B 0012 ASP OD2
H A 0002 GLU OE2 5.437 H B 0012 ASP OD1
H A 0002 GLU OE2 3.898 H B 0012 ASP OD2
H A 0002 GLU OE1 9.757 H B 0039 GLU OE1
H A 0002 GLU OE1 9.207 H B 0039 GLU OE2
H A 0002 GLU OE2 8.680 H B 0039 GLU OE1
H A 0002 GLU OE2 8.394 H B 0039 GLU OE2
H A 0004 GLU OE1 11.43 H B 0039 GLU OE1
H A 0004 GLU OE1 9.673 H B 0039 GLU OE2
H A 0004 GLU OE2 11.48 H B 0039 GLU OE2
H A 0005 LYS NZ 7.955 H B 0005 LYS NZ
H A 0012 ASP OD1 7.343 H B 0002 GLU OE1
H A 0012 ASP OD1 5.432 H B 0002 GLU OE2
H A 0012 ASP OD2 5.526 H B 0002 GLU OE1
H A 0012 ASP OD2 3.912 H B 0002 GLU OE2
H A 0015 HIS ND1 10.59 H B 0085 HIS ND1
H A 0015 HIS ND1 8.404 H B 0085 HIS NE2
H A 0015 HIS NE2 9.598 H B 0085 HIS ND1
H A 0015 HIS NE2 7.452 H B 0085 HIS NE2
H A 0015 HIS ND1 5.015 C B 0090 HIS ND1
H A 0015 HIS ND1 5.241 C B 0090 HIS NE2
H A 0015 HIS NE2 4.857 C B 0090 HIS ND1
H A 0015 HIS NE2 4.264 C B 0090 HIS NE2
C A 0024 LYS NZ 9.618 H B 0085 HIS ND1
C A 0024 LYS NZ 8.202 H B 0085 HIS NE2
C A 0024 LYS NZ 8.901 C B 0090 HIS ND1
C A 0024 LYS NZ 6.971 C B 0090 HIS NE2
C A 0025 HIS ND1 9.967 H B 0085 HIS ND1
C A 0025 HIS ND1 9.641 H B 0085 HIS NE2
C A 0025 HIS NE2 11.44 H B 0085 HIS ND1
C A 0025 HIS NE2 10.81 H B 0085 HIS NE2
C A 0025 HIS ND1 11.23 C B 0090 HIS NE2
C A 0025 HIS NE2 11.79 C B 0090 HIS NE2
H A 0039 GLU OE1 9.710 H B 0002 GLU OE1
H A 0039 GLU OE1 8.633 H B 0002 GLU OE2
H A 0039 GLU OE2 9.166 H B 0002 GLU OE1
H A 0039 GLU OE2 8.355 H B 0002 GLU OE2
H A 0039 GLU OE1 11.44 H B 0004 GLU OE1
H A 0039 GLU OE2 9.675 H B 0004 GLU OE1
H A 0039 GLU OE2 11.49 H B 0004 GLU OE2
C A 0062 GLU OE2 11.38 C B 0062 GLU OE2
E A 0069 ASP OD1 11.21 H B 0086 GLU OE2
E A 0069 ASP OD2 10.44 H B 0086 GLU OE2
H A 0085 HIS ND1 10.58 H B 0015 HIS ND1
H A 0085 HIS ND1 9.602 H B 0015 HIS NE2
H A 0085 HIS NE2 8.389 H B 0015 HIS ND1
H A 0085 HIS NE2 7.449 H B 0015 HIS NE2
H A 0085 HIS ND1 9.643 C B 0024 LYS NZ
H A 0085 HIS NE2 8.225 C B 0024 LYS NZ
H A 0085 HIS ND1 10.01 C B 0025 HIS ND1
H A 0085 HIS ND1 11.48 C B 0025 HIS NE2
H A 0085 HIS NE2 9.703 C B 0025 HIS ND1
H A 0085 HIS NE2 10.87 C B 0025 HIS NE2
H A 0086 GLU OE2 11.27 E B 0069 ASP OD1
H A 0086 GLU OE2 10.50 E B 0069 ASP OD2
C A 0090 HIS ND1 5.045 H B 0015 HIS ND1
C A 0090 HIS ND1 4.894 H B 0015 HIS NE2
C A 0090 HIS NE2 5.251 H B 0015 HIS ND1
C A 0090 HIS NE2 4.283 H B 0015 HIS NE2
C A 0090 HIS ND1 8.940 C B 0024 LYS NZ
C A 0090 HIS NE2 7.002 C B 0024 LYS NZ
C A 0090 HIS NE2 11.28 C B 0025 HIS ND1
C A 0090 HIS NE2 11.85 C B 0025 HIS NE2
HB_MS 2.00 3.20 6
C A 0001 SER OG 2.985 H B 0039 GLU O
H A 0039 GLU O 2.930 C B 0001 SER OG
H A 0074 MET O 2.830 H B 0078 SER OG
H A 0075 ALA N 3.165 H B 0078 SER OG
H A 0078 SER OG 2.807 H B 0074 MET O
H A 0078 SER OG 3.182 H B 0075 ALA N
AROMATIC 0.00 8.00 2
C A 0024 LYS 7.729 C B 0090 HIS
C A 0090 HIS 7.770 C B 0024 LYS
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "X"
HYDROPHOBIC 2.00 3.80 8
C A 0045 GLU CD 3.565 H X 0104 ARG CB
C A 0045 GLU CD 3.774 H X 0104 ARG CD
C A 0047 ILE CD1 3.625 H X 0104 ARG CZ
H A 0051 GLU CD 3.683 H X 0102 THR CG2
H A 0055 LYS CD 3.649 H X 0105 HIS CD2
H A 0055 LYS CE 3.754 H X 0105 HIS CD2
H A 0079 MET CB 3.724 H X 0111 LYS CG
H A 0079 MET CE 3.541 H X 0111 LYS CG
CHARGE_ATTR 2.00 12.00 43
C A 0045 GLU OE1 4.473 H X 0104 ARG NH1
C A 0045 GLU OE1 4.650 H X 0104 ARG NH2
C A 0045 GLU OE2 4.013 H X 0104 ARG NH1
C A 0045 GLU OE2 5.092 H X 0104 ARG NH2
C A 0045 GLU OE1 9.064 H X 0105 HIS ND1
C A 0045 GLU OE1 10.57 H X 0105 HIS NE2
C A 0045 GLU OE2 8.783 H X 0105 HIS ND1
C A 0045 GLU OE2 10.57 H X 0105 HIS NE2
C A 0045 GLU OE1 2.895 H X 0107 LYS NZ
C A 0045 GLU OE2 4.350 H X 0107 LYS NZ
C A 0046 GLU OE1 8.070 H X 0104 ARG NH1
C A 0046 GLU OE1 9.878 H X 0104 ARG NH2
C A 0046 GLU OE2 9.214 H X 0104 ARG NH1
C A 0046 GLU OE2 10.74 H X 0104 ARG NH2
H A 0049 GLU OE1 9.604 C X 0097 LYS NZ
H A 0049 GLU OE2 10.50 C X 0097 LYS NZ
H A 0049 GLU OE1 8.575 H X 0104 ARG NH1
H A 0049 GLU OE1 9.495 H X 0104 ARG NH2
H A 0049 GLU OE2 9.413 H X 0104 ARG NH1
H A 0049 GLU OE2 10.71 H X 0104 ARG NH2
H A 0049 GLU OE1 7.201 H X 0105 HIS ND1
H A 0049 GLU OE1 9.071 H X 0105 HIS NE2
H A 0049 GLU OE2 8.859 H X 0105 HIS ND1
H A 0049 GLU OE2 10.76 H X 0105 HIS NE2
H A 0051 GLU OE1 8.669 C X 0097 LYS NZ
H A 0051 GLU OE2 7.124 C X 0097 LYS NZ
H A 0051 GLU OE1 10.26 H X 0104 ARG NH1
H A 0051 GLU OE1 10.88 H X 0104 ARG NH2
H A 0051 GLU OE2 10.15 H X 0104 ARG NH1
H A 0051 GLU OE2 10.44 H X 0104 ARG NH2
H A 0051 GLU OE1 7.902 H X 0105 HIS ND1
H A 0051 GLU OE1 9.420 H X 0105 HIS NE2
H A 0051 GLU OE2 6.127 H X 0105 HIS ND1
H A 0051 GLU OE2 7.441 H X 0105 HIS NE2
H A 0054 ASP OD1 11.43 H X 0105 HIS ND1
H A 0054 ASP OD1 11.53 H X 0105 HIS NE2
H A 0054 ASP OD2 11.56 H X 0105 HIS ND1
H A 0054 ASP OD2 11.82 H X 0105 HIS NE2
H A 0058 GLU OE1 11.00 H X 0105 HIS ND1
H A 0058 GLU OE1 9.872 H X 0105 HIS NE2
H A 0058 GLU OE2 11.56 H X 0105 HIS NE2
H A 0086 GLU OE1 4.486 H X 0111 LYS NZ
H A 0086 GLU OE2 4.593 H X 0111 LYS NZ
CHARGE_REPU 2.00 12.00 17
H A 0033 LYS NZ 9.041 H X 0104 ARG NH1
H A 0033 LYS NZ 10.17 H X 0104 ARG NH2
C A 0048 LYS NZ 5.940 H X 0104 ARG NH1
C A 0048 LYS NZ 8.141 H X 0104 ARG NH2
C A 0048 LYS NZ 9.634 H X 0107 LYS NZ
H A 0055 LYS NZ 11.95 C X 0097 LYS NZ
H A 0055 LYS NZ 11.99 H X 0104 ARG NH1
H A 0055 LYS NZ 10.27 H X 0104 ARG NH2
H A 0055 LYS NZ 6.303 H X 0105 HIS ND1
H A 0055 LYS NZ 4.943 H X 0105 HIS NE2
H A 0055 LYS NZ 9.810 H X 0106 LYS NZ
H A 0085 HIS ND1 8.502 H X 0111 LYS NZ
H A 0085 HIS NE2 10.49 H X 0111 LYS NZ
H A 0086 GLU OE1 10.50 H X 0113 GLU OE1
H A 0086 GLU OE1 10.71 H X 0113 GLU OE2
H A 0086 GLU OE2 9.163 H X 0113 GLU OE1
H A 0086 GLU OE2 9.167 H X 0113 GLU OE2
HB_MS 2.00 3.20 1
C A 0046 GLU O 2.456 H X 0104 ARG NH1
HB_SS 2.00 3.20 1
H A 0049 GLU OE1 2.827 H X 0102 THR OG1
AROMATIC 0.00 8.00 1
H A 0055 LYS 5.163 H X 0105 HIS
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "Y"
CHARGE_ATTR 2.00 12.00 2
C A 0062 GLU OE1 11.49 H Y 0111 LYS NZ
E A 0069 ASP OD2 11.79 H Y 0111 LYS NZ
CHARGE_REPU 2.00 12.00 16
C A 0062 GLU OE1 6.517 H Y 0113 GLU OE1
C A 0062 GLU OE1 8.029 H Y 0113 GLU OE2
C A 0062 GLU OE2 8.218 H Y 0113 GLU OE1
C A 0062 GLU OE2 9.931 H Y 0113 GLU OE2
C A 0063 ASP OD1 7.372 H Y 0113 GLU OE1
C A 0063 ASP OD1 7.301 H Y 0113 GLU OE2
C A 0063 ASP OD2 8.300 H Y 0113 GLU OE1
C A 0063 ASP OD2 8.389 H Y 0113 GLU OE2
E A 0069 ASP OD1 10.34 H Y 0113 GLU OE1
E A 0069 ASP OD1 10.25 H Y 0113 GLU OE2
E A 0069 ASP OD2 8.388 H Y 0113 GLU OE1
E A 0069 ASP OD2 8.173 H Y 0113 GLU OE2
H A 0072 GLU OE1 9.208 H Y 0113 GLU OE1
H A 0072 GLU OE1 10.12 H Y 0113 GLU OE2
H A 0072 GLU OE2 8.668 H Y 0113 GLU OE1
H A 0072 GLU OE2 9.270 H Y 0113 GLU OE2
AROMATIC 0.00 8.00 1
H A 0070 PHE 7.390 H Y 0111 LYS
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 366
C B 0000 MET C 2.422 C B 0001 SER CA
C B 0000 MET C 2.869 C B 0001 SER C
C B 0000 MET C 3.055 C B 0001 SER CB
C B 0001 SER C 2.426 H B 0002 GLU CA
C B 0001 SER C 3.096 H B 0002 GLU C
C B 0001 SER C 3.669 H B 0002 GLU CB
H B 0002 GLU C 2.404 H B 0003 LEU CA
H B 0002 GLU C 2.964 H B 0003 LEU C
H B 0002 GLU C 3.692 H B 0003 LEU CB
H B 0002 GLU CD 3.541 H B 0005 LYS CE
H B 0003 LEU C 2.432 H B 0004 GLU CA
H B 0003 LEU C 3.039 H B 0004 GLU C
H B 0003 LEU C 3.696 H B 0004 GLU CB
H B 0003 LEU CD2 3.713 H B 0007 MET CG
H B 0004 GLU C 2.404 H B 0005 LYS CA
H B 0004 GLU C 3.044 H B 0005 LYS C
H B 0004 GLU C 3.697 H B 0005 LYS CB
H B 0005 LYS C 2.416 H B 0006 ALA CA
H B 0005 LYS C 3.059 H B 0006 ALA C
H B 0005 LYS C 3.679 H B 0006 ALA CB
H B 0006 ALA C 2.408 H B 0007 MET CA
H B 0006 ALA C 3.008 H B 0007 MET C
H B 0006 ALA C 3.695 H B 0007 MET CB
H B 0007 MET CA 3.797 H B 0008 VAL CA
H B 0007 MET C 2.411 H B 0008 VAL CA
H B 0007 MET C 3.022 H B 0008 VAL C
H B 0007 MET C 3.683 H B 0008 VAL CB
H B 0008 VAL C 2.427 H B 0009 ALA CA
H B 0008 VAL C 3.089 H B 0009 ALA C
H B 0008 VAL C 3.682 H B 0009 ALA CB
H B 0009 ALA CA 3.797 H B 0010 LEU CA
H B 0009 ALA C 2.412 H B 0010 LEU CA
H B 0009 ALA C 2.926 H B 0010 LEU C
H B 0009 ALA C 3.665 H B 0010 LEU CB
H B 0010 LEU C 2.424 H B 0011 ILE CA
H B 0010 LEU C 3.075 H B 0011 ILE C
H B 0010 LEU C 3.682 H B 0011 ILE CB
H B 0010 LEU CD2 3.672 H B 0077 VAL CG1
H B 0011 ILE C 2.431 H B 0012 ASP CA
H B 0011 ILE C 3.015 H B 0012 ASP C
H B 0011 ILE C 3.701 H B 0012 ASP CB
H B 0012 ASP C 2.421 H B 0013 VAL CA
H B 0012 ASP C 2.976 H B 0013 VAL C
H B 0012 ASP C 3.725 H B 0013 VAL CB
H B 0012 ASP C 3.635 H B 0016 GLN CD
H B 0013 VAL C 2.408 H B 0014 PHE CA
H B 0013 VAL C 2.938 H B 0014 PHE C
H B 0013 VAL C 3.694 H B 0014 PHE CB
H B 0013 VAL CG1 3.561 H B 0039 GLU CD
H B 0013 VAL CG2 3.373 H B 0039 GLU CD
H B 0014 PHE C 2.411 H B 0015 HIS CA
H B 0014 PHE C 3.034 H B 0015 HIS C
H B 0014 PHE C 3.686 H B 0015 HIS CB
H B 0014 PHE CE1 3.171 H B 0018 SER CB
H B 0014 PHE CZ 3.430 H B 0018 SER CB
H B 0014 PHE CE2 3.180 E B 0027 LEU CD2
H B 0014 PHE CZ 3.232 E B 0027 LEU CD2
H B 0014 PHE CE2 3.617 H B 0070 PHE CA
H B 0014 PHE CE2 3.475 H B 0070 PHE CB
H B 0014 PHE CZ 3.209 H B 0070 PHE CB
H B 0014 PHE CD2 3.622 H B 0073 PHE CD2
H B 0015 HIS C 2.413 H B 0016 GLN CA
H B 0015 HIS C 2.972 H B 0016 GLN C
H B 0015 HIS C 3.695 H B 0016 GLN CB
H B 0016 GLN C 2.432 H B 0017 TYR CA
H B 0016 GLN C 3.286 H B 0017 TYR C
H B 0016 GLN C 3.630 H B 0017 TYR CB
H B 0016 GLN C 3.760 H B 0017 TYR CD1
H B 0017 TYR C 2.406 H B 0018 SER CA
H B 0017 TYR C 2.964 H B 0018 SER C
H B 0017 TYR C 3.677 H B 0018 SER CB
H B 0017 TYR C 3.768 C B 0020 ARG CB
H B 0017 TYR CD2 3.621 H B 0034 GLU C
H B 0017 TYR CE2 3.208 H B 0034 GLU C
H B 0017 TYR CD1 3.635 H B 0035 LEU CD2
H B 0017 TYR CD2 3.476 H B 0035 LEU CA
H B 0017 TYR CE1 3.777 H B 0035 LEU CD2
H B 0017 TYR CE2 3.407 H B 0035 LEU CA
H B 0017 TYR CE1 3.596 H B 0039 GLU CB
H B 0017 TYR CE1 3.794 H B 0039 GLU CG
H B 0017 TYR CE1 3.760 H B 0039 GLU CD
H B 0017 TYR CZ 3.550 H B 0039 GLU CB
H B 0018 SER C 2.415 H B 0019 GLY CA
H B 0018 SER C 3.083 H B 0019 GLY C
H B 0019 GLY C 2.418 C B 0020 ARG CA
H B 0019 GLY C 2.962 C B 0020 ARG C
H B 0019 GLY C 3.685 C B 0020 ARG CB
C B 0020 ARG C 2.451 C B 0021 GLU CA
C B 0020 ARG C 3.465 C B 0021 GLU C
C B 0020 ARG C 3.527 C B 0021 GLU CB
C B 0020 ARG C 3.656 C B 0021 GLU CG
C B 0020 ARG CZ 3.552 H B 0034 GLU CD
C B 0021 GLU C 2.435 C B 0022 GLY CA
C B 0021 GLU C 2.991 C B 0022 GLY C
C B 0021 GLU CB 3.748 H B 0031 GLU CD
C B 0021 GLU CD 3.329 H B 0031 GLU CG
C B 0022 GLY C 2.411 C B 0023 ASP CA
C B 0022 GLY C 3.041 C B 0023 ASP C
C B 0022 GLY C 3.681 C B 0023 ASP CB
C B 0023 ASP C 2.429 C B 0024 LYS CA
C B 0023 ASP C 3.000 C B 0024 LYS C
C B 0023 ASP C 3.696 C B 0024 LYS CB
C B 0023 ASP CB 3.668 E B 0026 LYS C
C B 0023 ASP CB 3.763 H B 0031 GLU CD
C B 0024 LYS C 2.436 C B 0025 HIS CA
C B 0024 LYS C 3.303 C B 0025 HIS C
C B 0024 LYS C 3.621 C B 0025 HIS CB
C B 0025 HIS C 2.439 E B 0026 LYS CA
C B 0025 HIS C 3.620 E B 0026 LYS C
C B 0025 HIS C 3.317 E B 0026 LYS CB
C B 0025 HIS C 3.229 E B 0026 LYS CG
C B 0025 HIS CE1 3.605 E B 0026 LYS CE
E B 0026 LYS C 2.452 E B 0027 LEU CA
E B 0026 LYS C 3.477 E B 0027 LEU C
E B 0026 LYS C 3.517 E B 0027 LEU CB
E B 0026 LYS C 3.265 E B 0027 LEU CD2
E B 0027 LEU C 2.428 E B 0028 LYS CA
E B 0027 LEU C 3.277 E B 0028 LYS C
E B 0027 LEU C 3.600 E B 0028 LYS CB
E B 0027 LEU CD1 3.338 H B 0031 GLU CB
E B 0028 LYS C 2.435 H B 0029 LYS CA
E B 0028 LYS C 2.837 H B 0029 LYS C
E B 0028 LYS C 3.698 H B 0029 LYS CB
H B 0029 LYS C 2.418 H B 0030 SER CA
H B 0029 LYS C 3.092 H B 0030 SER C
H B 0029 LYS C 3.667 H B 0030 SER CB
H B 0029 LYS CA 3.704 H B 0057 MET CE
H B 0029 LYS CB 3.481 H B 0057 MET CG
H B 0029 LYS CB 3.727 H B 0057 MET CE
H B 0030 SER C 2.422 H B 0031 GLU CA
H B 0030 SER C 2.966 H B 0031 GLU C
H B 0030 SER C 3.694 H B 0031 GLU CB
H B 0031 GLU C 2.426 H B 0032 LEU CA
H B 0031 GLU C 2.961 H B 0032 LEU C
H B 0031 GLU C 3.700 H B 0032 LEU CB
H B 0032 LEU C 2.417 H B 0033 LYS CA
H B 0032 LEU C 2.963 H B 0033 LYS C
H B 0032 LEU C 3.693 H B 0033 LYS CB
H B 0032 LEU CD1 3.659 H B 0073 PHE CD1
H B 0033 LYS C 2.416 H B 0034 GLU CA
H B 0033 LYS C 2.979 H B 0034 GLU C
H B 0033 LYS C 3.680 H B 0034 GLU CB
H B 0034 GLU C 2.408 H B 0035 LEU CA
H B 0034 GLU C 2.927 H B 0035 LEU C
H B 0034 GLU C 3.680 H B 0035 LEU CB
H B 0035 LEU CA 3.799 H B 0036 ILE CA
H B 0035 LEU C 2.418 H B 0036 ILE CA
H B 0035 LEU C 3.110 H B 0036 ILE C
H B 0035 LEU C 3.667 H B 0036 ILE CB
H B 0035 LEU CD1 3.642 H B 0036 ILE CA
H B 0035 LEU CD1 3.786 H B 0036 ILE CG1
H B 0035 LEU CD2 3.680 H B 0039 GLU CB
H B 0035 LEU CD2 3.218 H B 0039 GLU CD
H B 0035 LEU CG 3.520 H B 0073 PHE CE1
H B 0035 LEU CG 3.566 H B 0073 PHE CZ
H B 0035 LEU CD1 3.613 H B 0073 PHE CE1
H B 0035 LEU CD1 3.722 H B 0073 PHE CZ
H B 0036 ILE C 2.409 H B 0037 ASN CA
H B 0036 ILE C 3.136 H B 0037 ASN C
H B 0036 ILE C 3.661 H B 0037 ASN CB
H B 0036 ILE CG2 3.361 C B 0047 ILE CG1
H B 0037 ASN C 2.416 H B 0038 ASN CA
H B 0037 ASN C 3.183 H B 0038 ASN C
H B 0037 ASN C 3.652 H B 0038 ASN CB
H B 0038 ASN C 2.414 H B 0039 GLU CA
H B 0038 ASN C 3.038 H B 0039 GLU C
H B 0038 ASN C 3.699 H B 0039 GLU CB
H B 0039 GLU C 2.427 H B 0040 LEU CA
H B 0039 GLU C 3.252 H B 0040 LEU C
H B 0039 GLU C 3.620 H B 0040 LEU CB
H B 0039 GLU C 3.682 H B 0040 LEU CG
H B 0039 GLU C 3.485 H B 0040 LEU CD2
H B 0040 LEU C 2.418 C B 0041 SER CA
H B 0040 LEU C 2.974 C B 0041 SER C
H B 0040 LEU C 3.683 C B 0041 SER CB
H B 0040 LEU CB 3.731 C B 0044 LEU CB
H B 0040 LEU CD1 3.595 C B 0044 LEU CB
H B 0040 LEU CD1 3.748 C B 0044 LEU CD2
C B 0041 SER C 2.442 C B 0042 HIS CA
C B 0041 SER C 3.608 C B 0042 HIS C
C B 0041 SER C 3.343 C B 0042 HIS CB
C B 0041 SER C 3.292 C B 0042 HIS CG
C B 0042 HIS C 2.422 C B 0043 PHE CA
C B 0042 HIS C 2.986 C B 0043 PHE C
C B 0042 HIS C 3.698 C B 0043 PHE CB
C B 0043 PHE C 2.446 C B 0044 LEU CA
C B 0043 PHE C 3.534 C B 0044 LEU C
C B 0043 PHE C 3.422 C B 0044 LEU CB
C B 0044 LEU C 2.407 C B 0045 GLU CA
C B 0044 LEU C 2.951 C B 0045 GLU C
C B 0044 LEU C 3.685 C B 0045 GLU CB
C B 0044 LEU CD1 3.474 H B 0080 VAL CG1
C B 0045 GLU C 2.425 C B 0046 GLU CA
C B 0045 GLU C 2.923 C B 0046 GLU C
C B 0045 GLU C 3.704 C B 0046 GLU CB
C B 0046 GLU C 2.427 C B 0047 ILE CA
C B 0046 GLU C 3.244 C B 0047 ILE C
C B 0046 GLU C 3.626 C B 0047 ILE CB
C B 0046 GLU C 3.772 C B 0048 LYS CE
C B 0046 GLU CB 3.776 C B 0048 LYS CE
C B 0047 ILE C 2.432 C B 0048 LYS CA
C B 0047 ILE C 3.329 C B 0048 LYS C
C B 0047 ILE C 3.587 C B 0048 LYS CB
C B 0047 ILE C 3.611 C B 0048 LYS CG
C B 0047 ILE C 3.514 C B 0048 LYS CD
C B 0047 ILE CD1 3.532 H B 0052 VAL CG1
C B 0048 LYS C 2.441 H B 0049 GLU CA
C B 0048 LYS C 3.513 H B 0049 GLU C
C B 0048 LYS C 3.449 H B 0049 GLU CB
C B 0048 LYS C 3.522 H B 0049 GLU CG
H B 0049 GLU C 2.412 H B 0050 GLN CA
H B 0049 GLU C 3.022 H B 0050 GLN C
H B 0049 GLU C 3.689 H B 0050 GLN CB
H B 0049 GLU CB 3.750 H B 0051 GLU CG
H B 0049 GLU CD 3.695 H B 0051 GLU CD
H B 0050 GLN C 2.419 H B 0051 GLU CA
H B 0050 GLN C 2.944 H B 0051 GLU C
H B 0050 GLN C 3.710 H B 0051 GLU CB
H B 0051 GLU C 2.412 H B 0052 VAL CA
H B 0051 GLU C 2.915 H B 0052 VAL C
H B 0051 GLU C 3.686 H B 0052 VAL CB
H B 0052 VAL CA 3.786 H B 0053 VAL CA
H B 0052 VAL C 2.412 H B 0053 VAL CA
H B 0052 VAL C 3.021 H B 0053 VAL C
H B 0052 VAL C 3.653 H B 0053 VAL CB
H B 0053 VAL C 2.431 H B 0054 ASP CA
H B 0053 VAL C 3.018 H B 0054 ASP C
H B 0053 VAL C 3.698 H B 0054 ASP CB
H B 0054 ASP C 2.422 H B 0055 LYS CA
H B 0054 ASP C 3.026 H B 0055 LYS C
H B 0054 ASP C 3.677 H B 0055 LYS CB
H B 0055 LYS CA 3.790 H B 0056 VAL CA
H B 0055 LYS C 2.414 H B 0056 VAL CA
H B 0055 LYS C 2.989 H B 0056 VAL C
H B 0055 LYS C 3.672 H B 0056 VAL CB
H B 0056 VAL C 2.428 H B 0057 MET CA
H B 0056 VAL C 2.963 H B 0057 MET C
H B 0056 VAL C 3.710 H B 0057 MET CB
H B 0056 VAL CG1 3.739 H B 0060 LEU CG
H B 0056 VAL CG1 3.478 H B 0060 LEU CD1
H B 0057 MET CA 3.797 H B 0058 GLU CA
H B 0057 MET C 2.390 H B 0058 GLU CA
H B 0057 MET C 2.848 H B 0058 GLU C
H B 0057 MET C 3.672 H B 0058 GLU CB
H B 0057 MET C 3.516 H B 0061 ASP CB
H B 0057 MET CE 3.229 C B 0066 GLY C
H B 0057 MET CE 3.479 E B 0067 GLU CA
H B 0057 MET CE 3.702 E B 0067 GLU C
H B 0058 GLU C 2.421 H B 0059 THR CA
H B 0058 GLU C 3.165 H B 0059 THR C
H B 0058 GLU C 3.658 H B 0059 THR CB
H B 0059 THR C 2.435 H B 0060 LEU CA
H B 0059 THR C 3.257 H B 0060 LEU C
H B 0059 THR C 3.643 H B 0060 LEU CB
H B 0060 LEU C 2.404 H B 0061 ASP CA
H B 0060 LEU C 3.073 H B 0061 ASP C
H B 0060 LEU C 3.677 H B 0061 ASP CB
H B 0060 LEU CD1 3.590 H B 0076 PHE CB
H B 0060 LEU CD1 3.658 H B 0076 PHE CG
H B 0060 LEU CD1 3.689 H B 0076 PHE CD1
H B 0061 ASP CA 3.787 C B 0062 GLU CA
H B 0061 ASP C 2.417 C B 0062 GLU CA
H B 0061 ASP C 2.951 C B 0062 GLU C
H B 0061 ASP C 3.676 C B 0062 GLU CB
H B 0061 ASP CG 3.219 C B 0064 GLY CA
H B 0061 ASP CG 3.495 C B 0064 GLY C
H B 0061 ASP CG 3.748 C B 0066 GLY CA
C B 0062 GLU C 2.413 C B 0063 ASP CA
C B 0062 GLU C 3.060 C B 0063 ASP C
C B 0062 GLU C 3.674 C B 0063 ASP CB
C B 0062 GLU CB 3.738 H B 0072 GLU CD
C B 0062 GLU CD 3.640 H B 0072 GLU CG
C B 0063 ASP C 2.424 C B 0064 GLY CA
C B 0063 ASP C 3.023 C B 0064 GLY C
C B 0064 GLY C 2.447 C B 0065 ASP CA
C B 0064 GLY C 3.393 C B 0065 ASP C
C B 0064 GLY C 3.571 C B 0065 ASP CB
C B 0065 ASP C 2.420 C B 0066 GLY CA
C B 0065 ASP C 3.096 C B 0066 GLY C
C B 0065 ASP CG 3.670 E B 0067 GLU CB
C B 0066 GLY C 2.436 E B 0067 GLU CA
C B 0066 GLY C 3.571 E B 0067 GLU C
C B 0066 GLY C 3.359 E B 0067 GLU CB
C B 0066 GLY C 3.199 E B 0067 GLU CG
E B 0067 GLU C 2.436 E B 0068 CYS CA
E B 0067 GLU C 3.275 E B 0068 CYS C
E B 0067 GLU C 3.624 E B 0068 CYS CB
E B 0068 CYS C 2.427 E B 0069 ASP CA
E B 0068 CYS C 3.090 E B 0069 ASP C
E B 0068 CYS C 3.672 E B 0069 ASP CB
E B 0068 CYS CA 3.682 H B 0072 GLU CD
E B 0068 CYS CB 3.647 H B 0072 GLU CB
E B 0069 ASP C 2.418 H B 0070 PHE CA
E B 0069 ASP C 2.882 H B 0070 PHE C
E B 0069 ASP C 3.729 H B 0070 PHE CB
H B 0070 PHE C 2.406 H B 0071 GLN CA
H B 0070 PHE C 2.998 H B 0071 GLN C
H B 0070 PHE C 3.696 H B 0071 GLN CB
H B 0071 GLN C 2.425 H B 0072 GLU CA
H B 0071 GLN C 3.033 H B 0072 GLU C
H B 0071 GLN C 3.692 H B 0072 GLU CB
H B 0072 GLU C 2.430 H B 0073 PHE CA
H B 0072 GLU C 2.983 H B 0073 PHE C
H B 0072 GLU C 3.696 H B 0073 PHE CB
H B 0073 PHE C 2.427 H B 0074 MET CA
H B 0073 PHE C 2.993 H B 0074 MET C
H B 0073 PHE C 3.695 H B 0074 MET CB
H B 0073 PHE CE2 3.738 H B 0077 VAL CG2
H B 0074 MET C 2.398 H B 0075 ALA CA
H B 0074 MET C 3.042 H B 0075 ALA C
H B 0074 MET C 3.677 H B 0075 ALA CB
H B 0074 MET CA 3.739 H B 0077 VAL CG2
H B 0074 MET C 3.707 H B 0077 VAL CG2
H B 0075 ALA C 2.421 H B 0076 PHE CA
H B 0075 ALA C 3.058 H B 0076 PHE C
H B 0075 ALA C 3.683 H B 0076 PHE CB
H B 0076 PHE C 2.415 H B 0077 VAL CA
H B 0076 PHE C 3.122 H B 0077 VAL C
H B 0076 PHE C 3.655 H B 0077 VAL CB
H B 0076 PHE C 3.731 H B 0077 VAL CG2
H B 0076 PHE CE1 3.740 H B 0080 VAL CG2
H B 0076 PHE CE2 3.582 H B 0080 VAL CG2
H B 0076 PHE CZ 3.449 H B 0080 VAL CG2
H B 0077 VAL C 2.412 H B 0078 SER CA
H B 0077 VAL C 3.070 H B 0078 SER C
H B 0077 VAL C 3.682 H B 0078 SER CB
H B 0078 SER C 2.407 H B 0079 MET CA
H B 0078 SER C 3.068 H B 0079 MET C
H B 0078 SER C 3.670 H B 0079 MET CB
H B 0079 MET C 2.412 H B 0080 VAL CA
H B 0079 MET C 2.987 H B 0080 VAL C
H B 0079 MET C 3.707 H B 0080 VAL CB
H B 0080 VAL C 2.418 H B 0081 THR CA
H B 0080 VAL C 2.930 H B 0081 THR C
H B 0080 VAL C 3.698 H B 0081 THR CB
H B 0081 THR CA 3.789 H B 0082 THR CA
H B 0081 THR C 2.406 H B 0082 THR CA
H B 0081 THR C 2.848 H B 0082 THR C
H B 0081 THR C 3.661 H B 0082 THR CB
H B 0081 THR C 3.754 H B 0084 CYS CB
H B 0082 THR C 2.423 H B 0083 ALA CA
H B 0082 THR C 2.932 H B 0083 ALA C
H B 0082 THR C 3.702 H B 0083 ALA CB
H B 0083 ALA C 2.430 H B 0084 CYS CA
H B 0083 ALA C 2.978 H B 0084 CYS C
H B 0083 ALA C 3.700 H B 0084 CYS CB
H B 0084 CYS C 2.417 H B 0085 HIS CA
H B 0084 CYS C 2.937 H B 0085 HIS C
H B 0084 CYS C 3.696 H B 0085 HIS CB
H B 0085 HIS C 2.409 H B 0086 GLU CA
H B 0085 HIS C 2.948 H B 0086 GLU C
H B 0085 HIS C 3.708 H B 0086 GLU CB
H B 0086 GLU C 2.423 H B 0087 PHE CA
H B 0086 GLU C 3.157 H B 0087 PHE C
H B 0086 GLU C 3.664 H B 0087 PHE CB
H B 0087 PHE C 2.425 H B 0088 PHE CA
H B 0087 PHE C 3.253 H B 0088 PHE C
H B 0087 PHE C 3.615 H B 0088 PHE CB
H B 0088 PHE C 2.418 C B 0089 GLU CA
H B 0088 PHE C 3.132 C B 0089 GLU C
H B 0088 PHE C 3.662 C B 0089 GLU CB
C B 0089 GLU C 2.424 C B 0090 HIS CA
C B 0089 GLU C 3.048 C B 0090 HIS C
C B 0089 GLU C 3.682 C B 0090 HIS CB
C B 0090 HIS C 2.429 C B 0091 GLU CA
C B 0090 HIS C 3.689 C B 0091 GLU CB
CHARGE_ATTR 2.00 12.00 148
H B 0002 GLU OE1 2.443 H B 0005 LYS NZ
H B 0002 GLU OE2 4.241 H B 0005 LYS NZ
H B 0002 GLU OE1 11.87 C B 0090 HIS ND1
H B 0002 GLU OE2 9.801 C B 0090 HIS ND1
H B 0002 GLU OE2 11.77 C B 0090 HIS NE2
H B 0004 GLU OE1 11.10 H B 0005 LYS NZ
H B 0004 GLU OE2 11.44 H B 0005 LYS NZ
H B 0012 ASP OD2 11.83 H B 0005 LYS NZ
H B 0012 ASP OD1 7.437 H B 0015 HIS ND1
H B 0012 ASP OD1 8.549 H B 0015 HIS NE2
H B 0012 ASP OD2 9.002 H B 0015 HIS ND1
H B 0012 ASP OD2 10.36 H B 0015 HIS NE2
C B 0021 GLU OE1 7.923 C B 0020 ARG NH1
C B 0021 GLU OE1 8.279 C B 0020 ARG NH2
C B 0021 GLU OE2 6.236 C B 0020 ARG NH1
C B 0021 GLU OE2 6.293 C B 0020 ARG NH2
C B 0021 GLU OE1 11.37 C B 0025 HIS NE2
C B 0021 GLU OE1 11.69 E B 0026 LYS NZ
C B 0021 GLU OE1 8.323 E B 0028 LYS NZ
C B 0021 GLU OE2 9.654 E B 0028 LYS NZ
C B 0021 GLU OE2 11.07 H B 0033 LYS NZ
C B 0023 ASP OD2 11.89 C B 0020 ARG NH1
C B 0023 ASP OD1 11.34 C B 0024 LYS NZ
C B 0023 ASP OD1 7.435 C B 0025 HIS ND1
C B 0023 ASP OD1 6.166 C B 0025 HIS NE2
C B 0023 ASP OD2 8.497 C B 0025 HIS ND1
C B 0023 ASP OD2 7.677 C B 0025 HIS NE2
C B 0023 ASP OD1 6.383 E B 0026 LYS NZ
C B 0023 ASP OD2 7.133 E B 0026 LYS NZ
C B 0023 ASP OD1 8.073 E B 0028 LYS NZ
C B 0023 ASP OD2 6.639 E B 0028 LYS NZ
C B 0023 ASP OD2 11.87 H B 0029 LYS NZ
H B 0031 GLU OE1 11.88 H B 0015 HIS ND1
H B 0031 GLU OE1 11.81 H B 0015 HIS NE2
H B 0031 GLU OE1 9.223 C B 0020 ARG NH1
H B 0031 GLU OE1 10.48 C B 0020 ARG NH2
H B 0031 GLU OE2 9.262 C B 0020 ARG NH1
H B 0031 GLU OE2 10.08 C B 0020 ARG NH2
H B 0031 GLU OE1 9.457 C B 0025 HIS ND1
H B 0031 GLU OE1 9.117 C B 0025 HIS NE2
H B 0031 GLU OE2 9.958 C B 0025 HIS ND1
H B 0031 GLU OE2 9.159 C B 0025 HIS NE2
H B 0031 GLU OE1 9.507 E B 0026 LYS NZ
H B 0031 GLU OE2 9.530 E B 0026 LYS NZ
H B 0031 GLU OE1 8.744 E B 0028 LYS NZ
H B 0031 GLU OE2 8.038 E B 0028 LYS NZ
H B 0034 GLU OE1 2.823 C B 0020 ARG NH1
H B 0034 GLU OE1 4.056 C B 0020 ARG NH2
H B 0034 GLU OE2 3.813 C B 0020 ARG NH1
H B 0034 GLU OE2 3.952 C B 0020 ARG NH2
H B 0034 GLU OE2 11.69 E B 0028 LYS NZ
H B 0034 GLU OE1 8.805 H B 0033 LYS NZ
H B 0034 GLU OE2 7.859 H B 0033 LYS NZ
H B 0039 GLU OE1 10.17 H B 0015 HIS ND1
H B 0039 GLU OE2 11.78 H B 0015 HIS ND1
H B 0039 GLU OE1 9.103 C B 0020 ARG NH1
H B 0039 GLU OE1 11.24 C B 0020 ARG NH2
H B 0039 GLU OE2 10.92 C B 0020 ARG NH1
C B 0045 GLU OE1 7.065 C B 0048 LYS NZ
C B 0045 GLU OE2 5.285 C B 0048 LYS NZ
C B 0046 GLU OE2 11.49 C B 0020 ARG NH1
C B 0046 GLU OE1 8.471 H B 0033 LYS NZ
C B 0046 GLU OE2 8.420 H B 0033 LYS NZ
C B 0046 GLU OE1 6.475 C B 0042 HIS ND1
C B 0046 GLU OE1 6.228 C B 0042 HIS NE2
C B 0046 GLU OE2 5.709 C B 0042 HIS ND1
C B 0046 GLU OE2 6.120 C B 0042 HIS NE2
C B 0046 GLU OE1 5.441 C B 0048 LYS NZ
C B 0046 GLU OE2 7.526 C B 0048 LYS NZ
H B 0049 GLU OE1 10.36 H B 0033 LYS NZ
H B 0049 GLU OE2 10.77 H B 0033 LYS NZ
H B 0049 GLU OE1 9.790 C B 0048 LYS NZ
H B 0049 GLU OE2 9.263 C B 0048 LYS NZ
H B 0051 GLU OE1 11.71 H B 0029 LYS NZ
H B 0051 GLU OE1 10.85 H B 0033 LYS NZ
H B 0051 GLU OE1 11.98 C B 0048 LYS NZ
H B 0051 GLU OE2 10.33 H B 0055 LYS NZ
H B 0054 ASP OD1 11.01 E B 0028 LYS NZ
H B 0054 ASP OD2 11.18 E B 0028 LYS NZ
H B 0054 ASP OD1 6.175 H B 0029 LYS NZ
H B 0054 ASP OD2 5.601 H B 0029 LYS NZ
H B 0054 ASP OD1 9.425 H B 0055 LYS NZ
H B 0054 ASP OD2 10.53 H B 0055 LYS NZ
H B 0058 GLU OE1 5.850 H B 0055 LYS NZ
H B 0058 GLU OE2 7.289 H B 0055 LYS NZ
H B 0061 ASP OD1 10.87 E B 0026 LYS NZ
H B 0061 ASP OD2 11.81 E B 0026 LYS NZ
H B 0061 ASP OD1 9.912 E B 0028 LYS NZ
H B 0061 ASP OD2 8.911 E B 0028 LYS NZ
H B 0061 ASP OD1 10.47 H B 0029 LYS NZ
H B 0061 ASP OD2 8.609 H B 0029 LYS NZ
C B 0063 ASP OD1 11.53 C B 0025 HIS ND1
C B 0063 ASP OD2 10.07 C B 0025 HIS ND1
C B 0063 ASP OD2 11.76 C B 0025 HIS NE2
C B 0063 ASP OD1 9.964 E B 0026 LYS NZ
C B 0063 ASP OD2 8.580 E B 0026 LYS NZ
C B 0065 ASP OD1 11.12 C B 0025 HIS ND1
C B 0065 ASP OD2 9.259 C B 0025 HIS ND1
C B 0065 ASP OD2 10.19 C B 0025 HIS NE2
C B 0065 ASP OD1 7.951 E B 0026 LYS NZ
C B 0065 ASP OD2 5.876 E B 0026 LYS NZ
C B 0065 ASP OD1 8.458 E B 0028 LYS NZ
C B 0065 ASP OD2 8.551 E B 0028 LYS NZ
C B 0065 ASP OD1 10.73 H B 0029 LYS NZ
C B 0065 ASP OD2 11.93 H B 0029 LYS NZ
E B 0067 GLU OE1 8.923 C B 0025 HIS ND1
E B 0067 GLU OE1 8.992 C B 0025 HIS NE2
E B 0067 GLU OE2 8.579 C B 0025 HIS ND1
E B 0067 GLU OE2 8.406 C B 0025 HIS NE2
E B 0067 GLU OE1 4.772 E B 0026 LYS NZ
E B 0067 GLU OE2 5.258 E B 0026 LYS NZ
E B 0067 GLU OE1 5.633 E B 0028 LYS NZ
E B 0067 GLU OE2 4.938 E B 0028 LYS NZ
E B 0067 GLU OE1 10.54 H B 0029 LYS NZ
E B 0067 GLU OE2 10.22 H B 0029 LYS NZ
E B 0069 ASP OD1 6.288 C B 0025 HIS ND1
E B 0069 ASP OD1 7.918 C B 0025 HIS NE2
E B 0069 ASP OD2 7.264 C B 0025 HIS ND1
E B 0069 ASP OD2 9.146 C B 0025 HIS NE2
E B 0069 ASP OD1 5.779 E B 0026 LYS NZ
E B 0069 ASP OD2 6.913 E B 0026 LYS NZ
E B 0069 ASP OD1 11.31 E B 0028 LYS NZ
H B 0072 GLU OE2 10.46 C B 0025 HIS ND1
H B 0072 GLU OE1 11.37 E B 0026 LYS NZ
H B 0072 GLU OE2 9.531 E B 0026 LYS NZ
H B 0086 GLU OE1 4.677 H B 0085 HIS ND1
H B 0086 GLU OE1 6.818 H B 0085 HIS NE2
H B 0086 GLU OE2 4.450 H B 0085 HIS ND1
H B 0086 GLU OE2 6.573 H B 0085 HIS NE2
H B 0086 GLU OE1 10.54 C B 0090 HIS ND1
H B 0086 GLU OE1 9.948 C B 0090 HIS NE2
H B 0086 GLU OE2 10.97 C B 0090 HIS ND1
H B 0086 GLU OE2 9.990 C B 0090 HIS NE2
C B 0089 GLU OE1 6.975 H B 0085 HIS ND1
C B 0089 GLU OE1 7.336 H B 0085 HIS NE2
C B 0089 GLU OE2 7.326 H B 0085 HIS ND1
C B 0089 GLU OE2 7.132 H B 0085 HIS NE2
C B 0089 GLU OE1 8.904 C B 0090 HIS ND1
C B 0089 GLU OE1 7.811 C B 0090 HIS NE2
C B 0089 GLU OE2 8.436 C B 0090 HIS ND1
C B 0089 GLU OE2 7.037 C B 0090 HIS NE2
C B 0091 GLU OE1 11.93 H B 0085 HIS NE2
C B 0091 GLU OE2 11.39 H B 0085 HIS ND1
C B 0091 GLU OE2 11.16 H B 0085 HIS NE2
C B 0091 GLU OE1 10.51 C B 0090 HIS ND1
C B 0091 GLU OE1 10.25 C B 0090 HIS NE2
C B 0091 GLU OE2 10.61 C B 0090 HIS ND1
C B 0091 GLU OE2 10.11 C B 0090 HIS NE2
CHARGE_REPU 2.00 12.00 203
H B 0002 GLU OE1 10.91 H B 0004 GLU OE1
H B 0002 GLU OE1 11.69 H B 0004 GLU OE2
H B 0004 GLU OE2 11.74 H B 0012 ASP OD1
H B 0004 GLU OE2 11.28 H B 0012 ASP OD2
H B 0012 ASP OD1 10.84 H B 0039 GLU OE1
H B 0012 ASP OD1 11.18 H B 0039 GLU OE2
H B 0012 ASP OD2 10.97 H B 0039 GLU OE1
H B 0012 ASP OD2 11.03 H B 0039 GLU OE2
H B 0015 HIS ND1 8.347 C B 0024 LYS NZ
H B 0015 HIS NE2 6.189 C B 0024 LYS NZ
C B 0020 ARG NH1 9.442 H B 0033 LYS NZ
C B 0020 ARG NH2 9.935 H B 0033 LYS NZ
C B 0021 GLU OE1 5.747 C B 0023 ASP OD1
C B 0021 GLU OE1 4.574 C B 0023 ASP OD2
C B 0021 GLU OE2 7.868 C B 0023 ASP OD1
C B 0021 GLU OE2 6.712 C B 0023 ASP OD2
C B 0021 GLU OE1 4.258 H B 0031 GLU OE1
C B 0021 GLU OE1 2.549 H B 0031 GLU OE2
C B 0021 GLU OE2 5.783 H B 0031 GLU OE1
C B 0021 GLU OE2 4.515 H B 0031 GLU OE2
C B 0021 GLU OE1 5.514 H B 0034 GLU OE1
C B 0021 GLU OE1 5.688 H B 0034 GLU OE2
C B 0021 GLU OE2 4.030 H B 0034 GLU OE1
C B 0021 GLU OE2 3.793 H B 0034 GLU OE2
C B 0021 GLU OE1 10.28 E B 0067 GLU OE1
C B 0021 GLU OE1 8.156 E B 0067 GLU OE2
C B 0021 GLU OE2 10.14 E B 0067 GLU OE2
C B 0023 ASP OD1 5.160 H B 0031 GLU OE1
C B 0023 ASP OD1 4.014 H B 0031 GLU OE2
C B 0023 ASP OD2 3.680 H B 0031 GLU OE1
C B 0023 ASP OD2 2.661 H B 0031 GLU OE2
C B 0023 ASP OD1 10.77 H B 0034 GLU OE1
C B 0023 ASP OD1 11.35 H B 0034 GLU OE2
C B 0023 ASP OD2 9.360 H B 0034 GLU OE1
C B 0023 ASP OD2 9.888 H B 0034 GLU OE2
C B 0023 ASP OD1 11.03 C B 0065 ASP OD1
C B 0023 ASP OD1 9.725 C B 0065 ASP OD2
C B 0023 ASP OD2 10.01 C B 0065 ASP OD1
C B 0023 ASP OD2 9.066 C B 0065 ASP OD2
C B 0023 ASP OD1 6.752 E B 0067 GLU OE1
C B 0023 ASP OD1 5.026 E B 0067 GLU OE2
C B 0023 ASP OD2 6.186 E B 0067 GLU OE1
C B 0023 ASP OD2 4.108 E B 0067 GLU OE2
C B 0023 ASP OD1 9.299 E B 0069 ASP OD1
C B 0023 ASP OD1 11.29 E B 0069 ASP OD2
C B 0023 ASP OD2 8.910 E B 0069 ASP OD1
C B 0023 ASP OD2 11.01 E B 0069 ASP OD2
C B 0023 ASP OD2 11.81 H B 0072 GLU OE2
C B 0024 LYS NZ 8.616 C B 0025 HIS ND1
C B 0024 LYS NZ 7.960 C B 0025 HIS NE2
C B 0025 HIS ND1 4.848 E B 0026 LYS NZ
C B 0025 HIS NE2 4.976 E B 0026 LYS NZ
E B 0026 LYS NZ 9.900 E B 0028 LYS NZ
E B 0028 LYS NZ 6.030 H B 0029 LYS NZ
H B 0029 LYS NZ 12.00 H B 0033 LYS NZ
H B 0031 GLU OE1 6.842 H B 0034 GLU OE1
H B 0031 GLU OE1 8.010 H B 0034 GLU OE2
H B 0031 GLU OE2 6.826 H B 0034 GLU OE1
H B 0031 GLU OE2 7.566 H B 0034 GLU OE2
H B 0031 GLU OE1 11.84 H B 0039 GLU OE1
H B 0031 GLU OE1 11.04 C B 0065 ASP OD1
H B 0031 GLU OE1 10.50 C B 0065 ASP OD2
H B 0031 GLU OE2 11.81 C B 0065 ASP OD1
H B 0031 GLU OE2 11.14 C B 0065 ASP OD2
H B 0031 GLU OE1 8.666 E B 0067 GLU OE1
H B 0031 GLU OE1 6.617 E B 0067 GLU OE2
H B 0031 GLU OE2 8.599 E B 0067 GLU OE1
H B 0031 GLU OE2 6.455 E B 0067 GLU OE2
H B 0031 GLU OE1 9.199 E B 0069 ASP OD1
H B 0031 GLU OE1 11.33 E B 0069 ASP OD2
H B 0031 GLU OE2 10.42 E B 0069 ASP OD1
H B 0031 GLU OE1 11.52 H B 0072 GLU OE2
H B 0033 LYS NZ 9.958 C B 0048 LYS NZ
H B 0034 GLU OE1 9.803 H B 0039 GLU OE1
H B 0034 GLU OE1 11.57 H B 0039 GLU OE2
H B 0034 GLU OE2 11.67 H B 0039 GLU OE1
H B 0039 GLU OE1 11.76 C B 0046 GLU OE2
H B 0039 GLU OE2 11.57 C B 0046 GLU OE2
C B 0042 HIS ND1 10.66 C B 0048 LYS NZ
C B 0042 HIS NE2 9.745 C B 0048 LYS NZ
C B 0045 GLU OE1 9.917 C B 0046 GLU OE1
C B 0045 GLU OE1 11.23 C B 0046 GLU OE2
C B 0045 GLU OE2 9.062 C B 0046 GLU OE1
C B 0045 GLU OE2 10.67 C B 0046 GLU OE2
C B 0045 GLU OE1 11.48 H B 0049 GLU OE1
C B 0045 GLU OE2 9.982 H B 0049 GLU OE1
C B 0045 GLU OE2 10.31 H B 0049 GLU OE2
C B 0045 GLU OE2 11.69 H B 0051 GLU OE2
H B 0049 GLU OE1 2.374 H B 0051 GLU OE1
H B 0049 GLU OE1 3.095 H B 0051 GLU OE2
H B 0049 GLU OE2 3.875 H B 0051 GLU OE1
H B 0049 GLU OE2 4.896 H B 0051 GLU OE2
H B 0049 GLU OE1 11.81 H B 0054 ASP OD1
H B 0049 GLU OE1 10.86 H B 0054 ASP OD2
H B 0051 GLU OE1 10.19 H B 0054 ASP OD1
H B 0051 GLU OE1 8.958 H B 0054 ASP OD2
H B 0051 GLU OE2 9.870 H B 0054 ASP OD1
H B 0051 GLU OE2 8.861 H B 0054 ASP OD2
H B 0054 ASP OD1 6.586 H B 0058 GLU OE1
H B 0054 ASP OD1 8.270 H B 0058 GLU OE2
H B 0054 ASP OD2 8.035 H B 0058 GLU OE1
H B 0054 ASP OD2 9.744 H B 0058 GLU OE2
H B 0054 ASP OD1 9.261 H B 0061 ASP OD1
H B 0054 ASP OD1 7.387 H B 0061 ASP OD2
H B 0054 ASP OD2 11.01 H B 0061 ASP OD1
H B 0054 ASP OD2 9.001 H B 0061 ASP OD2
H B 0054 ASP OD1 11.13 C B 0065 ASP OD1
H B 0058 GLU OE1 10.66 H B 0061 ASP OD1
H B 0058 GLU OE1 9.621 H B 0061 ASP OD2
H B 0058 GLU OE2 10.73 H B 0061 ASP OD1
H B 0058 GLU OE2 9.936 H B 0061 ASP OD2
H B 0061 ASP OD1 8.162 C B 0062 GLU OE1
H B 0061 ASP OD1 8.690 C B 0062 GLU OE2
H B 0061 ASP OD2 10.07 C B 0062 GLU OE1
H B 0061 ASP OD2 10.34 C B 0062 GLU OE2
H B 0061 ASP OD1 6.381 C B 0063 ASP OD1
H B 0061 ASP OD1 5.590 C B 0063 ASP OD2
H B 0061 ASP OD2 8.469 C B 0063 ASP OD1
H B 0061 ASP OD2 7.671 C B 0063 ASP OD2
H B 0061 ASP OD1 2.946 C B 0065 ASP OD1
H B 0061 ASP OD1 5.049 C B 0065 ASP OD2
H B 0061 ASP OD2 4.091 C B 0065 ASP OD1
H B 0061 ASP OD2 6.184 C B 0065 ASP OD2
H B 0061 ASP OD1 7.786 E B 0067 GLU OE1
H B 0061 ASP OD1 8.816 E B 0067 GLU OE2
H B 0061 ASP OD2 8.012 E B 0067 GLU OE1
H B 0061 ASP OD2 8.946 E B 0067 GLU OE2
H B 0061 ASP OD1 7.904 E B 0069 ASP OD1
H B 0061 ASP OD1 8.081 E B 0069 ASP OD2
H B 0061 ASP OD2 9.535 E B 0069 ASP OD1
H B 0061 ASP OD2 9.986 E B 0069 ASP OD2
H B 0061 ASP OD1 4.728 H B 0072 GLU OE1
H B 0061 ASP OD1 5.517 H B 0072 GLU OE2
H B 0061 ASP OD2 6.654 H B 0072 GLU OE1
H B 0061 ASP OD2 7.513 H B 0072 GLU OE2
C B 0062 GLU OE1 5.742 C B 0063 ASP OD1
C B 0062 GLU OE1 5.997 C B 0063 ASP OD2
C B 0062 GLU OE2 7.645 C B 0063 ASP OD1
C B 0062 GLU OE2 7.580 C B 0063 ASP OD2
C B 0062 GLU OE1 9.257 C B 0065 ASP OD1
C B 0062 GLU OE1 10.10 C B 0065 ASP OD2
C B 0062 GLU OE2 10.16 C B 0065 ASP OD1
C B 0062 GLU OE2 11.26 C B 0065 ASP OD2
C B 0062 GLU OE1 8.952 E B 0069 ASP OD1
C B 0062 GLU OE1 7.776 E B 0069 ASP OD2
C B 0062 GLU OE2 10.12 E B 0069 ASP OD1
C B 0062 GLU OE2 9.292 E B 0069 ASP OD2
C B 0062 GLU OE1 4.051 H B 0072 GLU OE1
C B 0062 GLU OE1 5.072 H B 0072 GLU OE2
C B 0062 GLU OE2 4.670 H B 0072 GLU OE1
C B 0062 GLU OE2 6.126 H B 0072 GLU OE2
C B 0063 ASP OD1 5.978 C B 0065 ASP OD1
C B 0063 ASP OD1 5.984 C B 0065 ASP OD2
C B 0063 ASP OD2 4.673 C B 0065 ASP OD1
C B 0063 ASP OD2 4.561 C B 0065 ASP OD2
C B 0063 ASP OD1 9.798 E B 0067 GLU OE1
C B 0063 ASP OD1 11.08 E B 0067 GLU OE2
C B 0063 ASP OD2 8.248 E B 0067 GLU OE1
C B 0063 ASP OD2 9.274 E B 0067 GLU OE2
C B 0063 ASP OD1 6.123 E B 0069 ASP OD1
C B 0063 ASP OD1 4.527 E B 0069 ASP OD2
C B 0063 ASP OD2 4.194 E B 0069 ASP OD1
C B 0063 ASP OD2 3.054 E B 0069 ASP OD2
C B 0063 ASP OD1 4.819 H B 0072 GLU OE1
C B 0063 ASP OD1 4.128 H B 0072 GLU OE2
C B 0063 ASP OD2 3.805 H B 0072 GLU OE1
C B 0063 ASP OD2 2.419 H B 0072 GLU OE2
C B 0065 ASP OD1 5.072 E B 0067 GLU OE1
C B 0065 ASP OD1 6.317 E B 0067 GLU OE2
C B 0065 ASP OD2 3.864 E B 0067 GLU OE1
C B 0065 ASP OD2 5.345 E B 0067 GLU OE2
C B 0065 ASP OD1 5.833 E B 0069 ASP OD1
C B 0065 ASP OD1 6.362 E B 0069 ASP OD2
C B 0065 ASP OD2 4.659 E B 0069 ASP OD1
C B 0065 ASP OD2 5.318 E B 0069 ASP OD2
C B 0065 ASP OD1 5.564 H B 0072 GLU OE1
C B 0065 ASP OD1 5.155 H B 0072 GLU OE2
C B 0065 ASP OD2 6.652 H B 0072 GLU OE1
C B 0065 ASP OD2 5.539 H B 0072 GLU OE2
E B 0067 GLU OE1 6.664 E B 0069 ASP OD1
E B 0067 GLU OE1 8.107 E B 0069 ASP OD2
E B 0067 GLU OE2 6.926 E B 0069 ASP OD1
E B 0067 GLU OE2 8.754 E B 0069 ASP OD2
E B 0067 GLU OE1 9.935 H B 0072 GLU OE1
E B 0067 GLU OE1 8.792 H B 0072 GLU OE2
E B 0067 GLU OE2 10.50 H B 0072 GLU OE1
E B 0067 GLU OE2 9.326 H B 0072 GLU OE2
E B 0069 ASP OD1 6.303 H B 0072 GLU OE1
E B 0069 ASP OD1 4.228 H B 0072 GLU OE2
E B 0069 ASP OD2 5.922 H B 0072 GLU OE1
E B 0069 ASP OD2 3.821 H B 0072 GLU OE2
H B 0085 HIS ND1 6.664 C B 0090 HIS ND1
H B 0085 HIS ND1 5.543 C B 0090 HIS NE2
H B 0085 HIS NE2 4.883 C B 0090 HIS ND1
H B 0085 HIS NE2 3.507 C B 0090 HIS NE2
H B 0086 GLU OE1 9.013 C B 0089 GLU OE1
H B 0086 GLU OE1 10.26 C B 0089 GLU OE2
H B 0086 GLU OE2 9.277 C B 0089 GLU OE1
H B 0086 GLU OE2 10.21 C B 0089 GLU OE2
C B 0089 GLU OE1 6.774 C B 0091 GLU OE1
C B 0089 GLU OE1 5.039 C B 0091 GLU OE2
C B 0089 GLU OE2 6.406 C B 0091 GLU OE1
C B 0089 GLU OE2 5.062 C B 0091 GLU OE2
HB_MM 2.00 3.20 161
C B 0001 SER N 2.195 C B 0000 MET O
H B 0002 GLU N 2.565 C B 0000 MET O
H B 0002 GLU N 2.196 C B 0001 SER O
H B 0003 LEU N 2.776 C B 0001 SER O
H B 0003 LEU N 2.178 H B 0002 GLU O
H B 0004 GLU N 3.150 H B 0002 GLU O
H B 0004 GLU N 2.190 H B 0003 LEU O
H B 0005 LYS N 2.185 H B 0004 GLU O
H B 0006 ALA N 3.175 H B 0003 LEU O
H B 0006 ALA N 2.194 H B 0005 LYS O
H B 0007 MET N 3.133 H B 0003 LEU O
H B 0007 MET N 2.185 H B 0006 ALA O
H B 0008 VAL N 2.192 H B 0007 MET O
H B 0009 ALA N 3.082 H B 0005 LYS O
H B 0009 ALA N 2.192 H B 0008 VAL O
H B 0010 LEU N 3.133 H B 0006 ALA O
H B 0010 LEU N 2.192 H B 0009 ALA O
H B 0011 ILE N 2.199 H B 0010 LEU O
H B 0012 ASP N 3.066 H B 0008 VAL O
H B 0012 ASP N 3.048 H B 0009 ALA O
H B 0012 ASP N 2.197 H B 0011 ILE O
H B 0013 VAL N 2.187 H B 0012 ASP O
H B 0014 PHE N 2.200 H B 0013 VAL O
H B 0015 HIS N 3.168 H B 0012 ASP O
H B 0015 HIS N 3.149 H B 0013 VAL O
H B 0015 HIS N 2.177 H B 0014 PHE O
H B 0016 GLN N 2.977 H B 0013 VAL O
H B 0016 GLN N 2.190 H B 0015 HIS O
H B 0017 TYR N 2.195 H B 0016 GLN O
H B 0018 SER N 3.051 H B 0014 PHE O
H B 0018 SER N 2.179 H B 0017 TYR O
H B 0019 GLY N 2.192 H B 0018 SER O
C B 0020 ARG N 2.889 H B 0017 TYR O
C B 0020 ARG N 3.178 H B 0018 SER O
C B 0020 ARG N 2.196 H B 0019 GLY O
C B 0021 GLU N 2.208 C B 0020 ARG O
C B 0022 GLY N 2.200 C B 0021 GLU O
C B 0023 ASP N 3.072 C B 0021 GLU O
C B 0023 ASP N 2.190 C B 0022 GLY O
C B 0024 LYS N 2.472 C B 0022 GLY O
C B 0024 LYS N 2.194 C B 0023 ASP O
C B 0025 HIS N 2.198 C B 0024 LYS O
E B 0026 LYS N 3.193 C B 0023 ASP O
E B 0026 LYS N 2.199 C B 0025 HIS O
E B 0027 LEU N 2.201 E B 0026 LYS O
E B 0027 LEU N 3.090 E B 0068 CYS O
E B 0028 LYS N 2.195 E B 0027 LEU O
H B 0029 LYS N 2.202 E B 0028 LYS O
H B 0030 SER N 2.481 E B 0028 LYS O
H B 0030 SER N 2.198 H B 0029 LYS O
H B 0031 GLU N 2.599 E B 0028 LYS O
H B 0031 GLU N 2.198 H B 0030 SER O
H B 0032 LEU N 2.689 E B 0028 LYS O
H B 0032 LEU N 2.202 H B 0031 GLU O
H B 0033 LYS N 3.153 H B 0030 SER O
H B 0033 LYS N 2.183 H B 0032 LEU O
H B 0034 GLU N 3.064 H B 0031 GLU O
H B 0034 GLU N 2.192 H B 0033 LYS O
H B 0035 LEU N 3.131 H B 0032 LEU O
H B 0035 LEU N 2.175 H B 0034 GLU O
H B 0036 ILE N 3.093 H B 0032 LEU O
H B 0036 ILE N 2.185 H B 0035 LEU O
H B 0037 ASN N 2.670 H B 0033 LYS O
H B 0037 ASN N 2.183 H B 0036 ILE O
H B 0038 ASN N 2.909 H B 0034 GLU O
H B 0038 ASN N 2.183 H B 0037 ASN O
H B 0039 GLU N 3.185 H B 0035 LEU O
H B 0039 GLU N 2.188 H B 0038 ASN O
H B 0040 LEU N 2.197 H B 0039 GLU O
C B 0041 SER N 3.143 H B 0039 GLU O
C B 0041 SER N 2.197 H B 0040 LEU O
C B 0042 HIS N 2.202 C B 0041 SER O
C B 0043 PHE N 2.193 C B 0042 HIS O
C B 0044 LEU N 2.204 C B 0043 PHE O
C B 0045 GLU N 2.191 C B 0044 LEU O
C B 0046 GLU N 2.873 C B 0044 LEU O
C B 0046 GLU N 2.197 C B 0045 GLU O
C B 0047 ILE N 2.198 C B 0046 GLU O
C B 0048 LYS N 2.198 C B 0047 ILE O
H B 0049 GLU N 2.203 C B 0048 LYS O
H B 0050 GLN N 2.194 H B 0049 GLU O
H B 0051 GLU N 3.173 H B 0049 GLU O
H B 0051 GLU N 2.191 H B 0050 GLN O
H B 0052 VAL N 3.141 H B 0050 GLN O
H B 0052 VAL N 2.187 H B 0051 GLU O
H B 0053 VAL N 2.856 H B 0050 GLN O
H B 0053 VAL N 3.157 H B 0051 GLU O
H B 0053 VAL N 2.192 H B 0052 VAL O
H B 0054 ASP N 3.049 H B 0050 GLN O
H B 0054 ASP N 2.935 H B 0051 GLU O
H B 0054 ASP N 2.191 H B 0053 VAL O
H B 0055 LYS N 3.094 H B 0051 GLU O
H B 0055 LYS N 2.190 H B 0054 ASP O
H B 0056 VAL N 3.085 H B 0052 VAL O
H B 0056 VAL N 2.199 H B 0055 LYS O
H B 0057 MET N 2.817 H B 0053 VAL O
H B 0057 MET N 2.201 H B 0056 VAL O
H B 0058 GLU N 3.114 H B 0055 LYS O
H B 0058 GLU N 2.166 H B 0057 MET O
H B 0059 THR N 2.960 H B 0056 VAL O
H B 0059 THR N 3.024 H B 0057 MET O
H B 0059 THR N 2.199 H B 0058 GLU O
H B 0060 LEU N 2.716 H B 0056 VAL O
H B 0060 LEU N 2.196 H B 0059 THR O
H B 0061 ASP N 2.340 H B 0057 MET O
H B 0061 ASP N 2.185 H B 0060 LEU O
C B 0062 GLU N 2.659 H B 0060 LEU O
C B 0062 GLU N 2.200 H B 0061 ASP O
C B 0063 ASP N 2.194 C B 0062 GLU O
C B 0064 GLY N 2.791 H B 0061 ASP O
C B 0064 GLY N 2.198 C B 0063 ASP O
C B 0065 ASP N 2.205 C B 0064 GLY O
C B 0066 GLY N 2.196 C B 0065 ASP O
E B 0067 GLU N 3.163 C B 0065 ASP O
E B 0067 GLU N 2.202 C B 0066 GLY O
E B 0068 CYS N 2.870 E B 0027 LEU O
E B 0068 CYS N 2.198 E B 0067 GLU O
E B 0069 ASP N 2.188 E B 0068 CYS O
H B 0070 PHE N 2.199 E B 0069 ASP O
H B 0071 GLN N 2.872 E B 0069 ASP O
H B 0071 GLN N 2.185 H B 0070 PHE O
H B 0072 GLU N 2.646 E B 0069 ASP O
H B 0072 GLU N 2.201 H B 0071 GLN O
H B 0073 PHE N 2.865 E B 0069 ASP O
H B 0073 PHE N 2.201 H B 0072 GLU O
H B 0074 MET N 3.066 H B 0070 PHE O
H B 0074 MET N 2.198 H B 0073 PHE O
H B 0075 ALA N 3.176 H B 0072 GLU O
H B 0075 ALA N 2.187 H B 0074 MET O
H B 0076 PHE N 3.139 H B 0073 PHE O
H B 0076 PHE N 2.189 H B 0075 ALA O
H B 0077 VAL N 2.178 H B 0076 PHE O
H B 0078 SER N 2.192 H B 0077 VAL O
H B 0079 MET N 2.191 H B 0078 SER O
H B 0080 VAL N 2.189 H B 0079 MET O
H B 0081 THR N 2.196 H B 0080 VAL O
H B 0082 THR N 3.161 H B 0079 MET O
H B 0082 THR N 3.194 H B 0080 VAL O
H B 0082 THR N 2.190 H B 0081 THR O
H B 0083 ALA N 2.926 H B 0080 VAL O
H B 0083 ALA N 3.010 H B 0081 THR O
H B 0083 ALA N 2.204 H B 0082 THR O
H B 0084 CYS N 2.580 H B 0081 THR O
H B 0084 CYS N 3.179 H B 0082 THR O
H B 0084 CYS N 2.202 H B 0083 ALA O
H B 0085 HIS N 3.065 H B 0081 THR O
H B 0085 HIS N 2.946 H B 0082 THR O
H B 0085 HIS N 3.153 H B 0083 ALA O
H B 0085 HIS N 2.190 H B 0084 CYS O
H B 0086 GLU N 3.027 H B 0083 ALA O
H B 0086 GLU N 2.192 H B 0085 HIS O
H B 0087 PHE N 2.942 H B 0084 CYS O
H B 0087 PHE N 2.199 H B 0086 GLU O
H B 0088 PHE N 2.394 H B 0084 CYS O
H B 0088 PHE N 2.197 H B 0087 PHE O
C B 0089 GLU N 3.180 H B 0087 PHE O
C B 0089 GLU N 2.198 H B 0088 PHE O
C B 0090 HIS N 3.132 H B 0088 PHE O
C B 0090 HIS N 2.196 C B 0089 GLU O
C B 0091 GLU N 2.575 C B 0089 GLU O
C B 0091 GLU N 2.198 C B 0090 HIS O
HB_MS 2.00 3.20 16
H B 0012 ASP O 2.435 H B 0016 GLN NE2
H B 0019 GLY N 2.748 H B 0018 SER OG
H B 0039 GLU N 2.734 H B 0017 TYR OH
C B 0042 HIS N 2.834 C B 0041 SER OG
C B 0047 ILE O 2.744 H B 0037 ASN ND2
C B 0062 GLU N 2.628 H B 0072 GLU OE1
C B 0064 GLY N 2.524 H B 0061 ASP OD1
C B 0065 ASP N 2.683 H B 0061 ASP OD1
C B 0065 ASP N 3.193 H B 0061 ASP OD2
C B 0066 GLY N 2.421 H B 0061 ASP OD2
C B 0066 GLY N 3.022 C B 0065 ASP OD1
E B 0067 GLU N 2.734 C B 0065 ASP OD1
E B 0069 ASP N 2.760 H B 0072 GLU OE2
H B 0077 VAL O 2.722 H B 0081 THR OG1
H B 0078 SER O 2.729 H B 0082 THR OG1
H B 0079 MET O 3.005 H B 0082 THR OG1
HB_SS 2.00 3.20 2
H B 0038 ASN ND2 2.742 H B 0017 TYR OH
C B 0042 HIS ND1 2.922 C B 0041 SER OG
AROMATIC 0.00 8.00 5
H B 0085 HIS 5.267 C B 0090 HIS
C B 0024 LYS 7.292 H B 0015 HIS
C B 0024 LYS 7.672 C B 0025 HIS
E B 0026 LYS 5.325 C B 0025 HIS
C B 0020 ARG 5.224 H B 0017 TYR
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "X"
CHARGE_ATTR 2.00 12.00 2
C B 0062 GLU OE1 11.68 H X 0111 LYS NZ
E B 0069 ASP OD2 11.97 H X 0111 LYS NZ
CHARGE_REPU 2.00 12.00 16
C B 0062 GLU OE1 6.499 H X 0113 GLU OE1
C B 0062 GLU OE1 7.942 H X 0113 GLU OE2
C B 0062 GLU OE2 8.159 H X 0113 GLU OE1
C B 0062 GLU OE2 9.821 H X 0113 GLU OE2
C B 0063 ASP OD1 7.470 H X 0113 GLU OE1
C B 0063 ASP OD1 7.313 H X 0113 GLU OE2
C B 0063 ASP OD2 8.345 H X 0113 GLU OE1
C B 0063 ASP OD2 8.353 H X 0113 GLU OE2
E B 0069 ASP OD1 10.30 H X 0113 GLU OE1
E B 0069 ASP OD1 10.15 H X 0113 GLU OE2
E B 0069 ASP OD2 8.370 H X 0113 GLU OE1
E B 0069 ASP OD2 8.084 H X 0113 GLU OE2
H B 0072 GLU OE1 9.198 H X 0113 GLU OE1
H B 0072 GLU OE1 10.04 H X 0113 GLU OE2
H B 0072 GLU OE2 8.640 H X 0113 GLU OE1
H B 0072 GLU OE2 9.172 H X 0113 GLU OE2
AROMATIC 0.00 8.00 1
H B 0070 PHE 7.464 H X 0111 LYS
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "Y"
HYDROPHOBIC 2.00 3.80 12
C B 0045 GLU CD 3.339 H Y 0104 ARG CB
C B 0045 GLU CD 3.677 H Y 0104 ARG CD
C B 0047 ILE CD1 3.435 H Y 0104 ARG CZ
H B 0051 GLU CD 3.613 H Y 0102 THR CG2
H B 0052 VAL CG2 3.569 H Y 0102 THR CG2
H B 0052 VAL CG1 3.724 H Y 0105 HIS CB
H B 0055 LYS CD 3.604 H Y 0105 HIS CD2
H B 0055 LYS CE 3.763 H Y 0105 HIS CD2
H B 0076 PHE CE1 3.707 H Y 0108 LEU CD2
H B 0076 PHE CZ 3.700 H Y 0108 LEU CD2
H B 0079 MET CB 3.734 H Y 0111 LYS CG
H B 0079 MET CE 3.537 H Y 0111 LYS CG
CHARGE_ATTR 2.00 12.00 44
C B 0045 GLU OE1 4.545 H Y 0104 ARG NH1
C B 0045 GLU OE1 4.768 H Y 0104 ARG NH2
C B 0045 GLU OE2 4.200 H Y 0104 ARG NH1
C B 0045 GLU OE2 5.272 H Y 0104 ARG NH2
C B 0045 GLU OE1 8.941 H Y 0105 HIS ND1
C B 0045 GLU OE1 10.44 H Y 0105 HIS NE2
C B 0045 GLU OE2 8.651 H Y 0105 HIS ND1
C B 0045 GLU OE2 10.43 H Y 0105 HIS NE2
C B 0045 GLU OE1 2.787 H Y 0107 LYS NZ
C B 0045 GLU OE2 4.334 H Y 0107 LYS NZ
C B 0046 GLU OE1 7.977 H Y 0104 ARG NH1
C B 0046 GLU OE1 9.861 H Y 0104 ARG NH2
C B 0046 GLU OE2 9.059 H Y 0104 ARG NH1
C B 0046 GLU OE2 10.67 H Y 0104 ARG NH2
H B 0049 GLU OE1 9.256 C Y 0097 LYS NZ
H B 0049 GLU OE2 10.14 C Y 0097 LYS NZ
H B 0049 GLU OE1 8.823 H Y 0104 ARG NH1
H B 0049 GLU OE1 9.703 H Y 0104 ARG NH2
H B 0049 GLU OE2 9.680 H Y 0104 ARG NH1
H B 0049 GLU OE2 10.93 H Y 0104 ARG NH2
H B 0049 GLU OE1 7.081 H Y 0105 HIS ND1
H B 0049 GLU OE1 8.915 H Y 0105 HIS NE2
H B 0049 GLU OE2 8.758 H Y 0105 HIS ND1
H B 0049 GLU OE2 10.62 H Y 0105 HIS NE2
H B 0051 GLU OE1 8.303 C Y 0097 LYS NZ
H B 0051 GLU OE2 6.785 C Y 0097 LYS NZ
H B 0051 GLU OE1 10.47 H Y 0104 ARG NH1
H B 0051 GLU OE1 11.06 H Y 0104 ARG NH2
H B 0051 GLU OE2 10.39 H Y 0104 ARG NH1
H B 0051 GLU OE2 10.65 H Y 0104 ARG NH2
H B 0051 GLU OE1 7.795 H Y 0105 HIS ND1
H B 0051 GLU OE1 9.274 H Y 0105 HIS NE2
H B 0051 GLU OE2 6.067 H Y 0105 HIS ND1
H B 0051 GLU OE2 7.316 H Y 0105 HIS NE2
H B 0054 ASP OD2 11.93 C Y 0097 LYS NZ
H B 0054 ASP OD1 11.32 H Y 0105 HIS ND1
H B 0054 ASP OD1 11.41 H Y 0105 HIS NE2
H B 0054 ASP OD2 11.45 H Y 0105 HIS ND1
H B 0054 ASP OD2 11.70 H Y 0105 HIS NE2
H B 0058 GLU OE1 10.99 H Y 0105 HIS ND1
H B 0058 GLU OE1 9.866 H Y 0105 HIS NE2
H B 0058 GLU OE2 11.57 H Y 0105 HIS NE2
H B 0086 GLU OE1 4.548 H Y 0111 LYS NZ
H B 0086 GLU OE2 4.585 H Y 0111 LYS NZ
CHARGE_REPU 2.00 12.00 17
H B 0033 LYS NZ 8.966 H Y 0104 ARG NH1
H B 0033 LYS NZ 10.15 H Y 0104 ARG NH2
C B 0048 LYS NZ 6.058 H Y 0104 ARG NH1
C B 0048 LYS NZ 8.249 H Y 0104 ARG NH2
C B 0048 LYS NZ 11.97 H Y 0105 HIS ND1
C B 0048 LYS NZ 9.574 H Y 0107 LYS NZ
H B 0055 LYS NZ 11.96 C Y 0097 LYS NZ
H B 0055 LYS NZ 10.33 H Y 0104 ARG NH2
H B 0055 LYS NZ 6.344 H Y 0105 HIS ND1
H B 0055 LYS NZ 4.963 H Y 0105 HIS NE2
H B 0055 LYS NZ 9.751 H Y 0106 LYS NZ
H B 0085 HIS ND1 8.514 H Y 0111 LYS NZ
H B 0085 HIS NE2 10.49 H Y 0111 LYS NZ
H B 0086 GLU OE1 10.67 H Y 0113 GLU OE1
H B 0086 GLU OE1 10.87 H Y 0113 GLU OE2
H B 0086 GLU OE2 9.324 H Y 0113 GLU OE1
H B 0086 GLU OE2 9.330 H Y 0113 GLU OE2
HB_MS 2.00 3.20 2
C B 0045 GLU O 2.992 H Y 0104 ARG NH1
C B 0046 GLU O 2.390 H Y 0104 ARG NH1
HB_SS 2.00 3.20 1
H B 0049 GLU OE1 2.543 H Y 0102 THR OG1
AROMATIC 0.00 8.00 1
H B 0055 LYS 5.202 H Y 0105 HIS
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "X"
AND
CHAIN(S) "X"
HYDROPHOBIC 2.00 3.80 75
C X 0092 SER C 2.433 C X 0093 HIS CA
C X 0092 SER C 3.238 C X 0093 HIS C
C X 0092 SER C 3.650 C X 0093 HIS CB
C X 0093 HIS C 2.422 C X 0094 LEU CA
C X 0093 HIS C 3.044 C X 0094 LEU C
C X 0093 HIS C 3.693 C X 0094 LEU CB
C X 0093 HIS CD2 3.661 C X 0094 LEU CD1
C X 0094 LEU C 2.442 C X 0095 LYS CA
C X 0094 LEU C 3.364 C X 0095 LYS C
C X 0094 LEU C 3.575 C X 0095 LYS CB
C X 0094 LEU C 3.685 C X 0095 LYS CG
C X 0095 LYS C 2.426 C X 0096 SER CA
C X 0095 LYS C 2.999 C X 0096 SER C
C X 0095 LYS C 3.694 C X 0096 SER CB
C X 0096 SER C 2.441 C X 0097 LYS CA
C X 0096 SER C 2.959 C X 0097 LYS C
C X 0096 SER C 3.040 C X 0097 LYS CB
C X 0096 SER C 3.713 C X 0097 LYS CG
C X 0097 LYS C 2.429 C X 0098 LYS CA
C X 0097 LYS C 3.064 C X 0098 LYS C
C X 0097 LYS C 3.692 C X 0098 LYS CB
C X 0098 LYS C 2.431 C X 0099 GLY CA
C X 0098 LYS C 3.226 C X 0099 GLY C
C X 0099 GLY C 2.439 H X 0100 GLN CA
C X 0099 GLY C 2.970 H X 0100 GLN C
C X 0099 GLY C 3.020 H X 0100 GLN CB
C X 0099 GLY C 3.607 H X 0100 GLN CG
H X 0100 GLN C 2.427 H X 0101 SER CA
H X 0100 GLN C 2.934 H X 0101 SER C
H X 0100 GLN C 3.697 H X 0101 SER CB
H X 0101 SER C 2.441 H X 0102 THR CA
H X 0101 SER C 2.854 H X 0102 THR C
H X 0101 SER C 3.684 H X 0102 THR CB
H X 0102 THR C 2.426 H X 0103 SER CA
H X 0102 THR C 2.872 H X 0103 SER C
H X 0102 THR C 3.675 H X 0103 SER CB
H X 0102 THR C 3.575 H X 0104 ARG CG
H X 0103 SER C 2.425 H X 0104 ARG CA
H X 0103 SER C 2.862 H X 0104 ARG C
H X 0103 SER C 3.683 H X 0104 ARG CB
H X 0103 SER CA 3.754 H X 0105 HIS CE1
H X 0104 ARG C 2.421 H X 0105 HIS CA
H X 0104 ARG C 2.946 H X 0105 HIS C
H X 0104 ARG C 3.705 H X 0105 HIS CB
H X 0105 HIS C 2.421 H X 0106 LYS CA
H X 0105 HIS C 2.958 H X 0106 LYS C
H X 0105 HIS C 3.701 H X 0106 LYS CB
H X 0105 HIS CD2 3.441 H X 0106 LYS CA
H X 0106 LYS C 2.412 H X 0107 LYS CA
H X 0106 LYS C 2.931 H X 0107 LYS C
H X 0106 LYS C 3.695 H X 0107 LYS CB
H X 0106 LYS CA 3.682 H X 0109 MET CG
H X 0107 LYS C 2.427 H X 0108 LEU CA
H X 0107 LYS C 3.099 H X 0108 LEU C
H X 0107 LYS C 3.692 H X 0108 LEU CB
H X 0108 LEU C 2.420 H X 0109 MET CA
H X 0108 LEU C 2.976 H X 0109 MET C
H X 0108 LEU C 3.708 H X 0109 MET CB
H X 0108 LEU C 3.565 H X 0110 PHE CD1
H X 0109 MET C 2.412 H X 0110 PHE CA
H X 0109 MET C 2.852 H X 0110 PHE C
H X 0109 MET C 3.712 H X 0110 PHE CB
H X 0110 PHE C 2.425 H X 0111 LYS CA
H X 0110 PHE C 3.074 H X 0111 LYS C
H X 0110 PHE C 3.672 H X 0111 LYS CB
H X 0110 PHE CD1 3.758 H X 0111 LYS CA
H X 0110 PHE CE1 3.109 H X 0111 LYS CE
H X 0110 PHE CE2 3.704 H X 0111 LYS CE
H X 0110 PHE CZ 2.980 H X 0111 LYS CE
H X 0111 LYS C 2.428 H X 0112 THR CA
H X 0111 LYS C 2.971 H X 0112 THR C
H X 0111 LYS C 3.704 H X 0112 THR CB
H X 0112 THR C 2.422 H X 0113 GLU CA
H X 0112 THR C 3.056 H X 0113 GLU CB
H X 0112 THR C 3.643 H X 0113 GLU CG
CHARGE_ATTR 2.00 12.00 2
H X 0113 GLU OE1 7.125 H X 0111 LYS NZ
H X 0113 GLU OE2 7.815 H X 0111 LYS NZ
CHARGE_REPU 2.00 12.00 18
C X 0093 HIS ND1 10.20 C X 0095 LYS NZ
C X 0093 HIS NE2 9.856 C X 0095 LYS NZ
C X 0095 LYS NZ 6.383 C X 0097 LYS NZ
C X 0097 LYS NZ 9.306 H X 0105 HIS ND1
C X 0097 LYS NZ 9.000 H X 0105 HIS NE2
C X 0098 LYS NZ 11.68 H X 0106 LYS NZ
H X 0104 ARG NH1 8.152 H X 0105 HIS ND1
H X 0104 ARG NH1 10.08 H X 0105 HIS NE2
H X 0104 ARG NH2 7.436 H X 0105 HIS ND1
H X 0104 ARG NH2 9.053 H X 0105 HIS NE2
H X 0104 ARG NH1 6.788 H X 0107 LYS NZ
H X 0104 ARG NH2 6.285 H X 0107 LYS NZ
H X 0105 HIS ND1 9.192 H X 0106 LYS NZ
H X 0105 HIS NE2 7.661 H X 0106 LYS NZ
H X 0105 HIS ND1 8.587 H X 0107 LYS NZ
H X 0105 HIS NE2 9.594 H X 0107 LYS NZ
H X 0106 LYS NZ 11.16 H X 0107 LYS NZ
H X 0107 LYS NZ 11.55 H X 0111 LYS NZ
HB_MM 2.00 3.20 40
C X 0093 HIS N 2.197 C X 0092 SER O
C X 0094 LEU N 2.195 C X 0093 HIS O
C X 0095 LYS N 2.204 C X 0094 LEU O
C X 0096 SER N 2.197 C X 0095 LYS O
C X 0097 LYS N 2.202 C X 0096 SER O
C X 0098 LYS N 2.197 C X 0097 LYS O
C X 0099 GLY N 2.200 C X 0098 LYS O
H X 0100 GLN N 2.205 C X 0099 GLY O
H X 0101 SER N 2.198 H X 0100 GLN O
H X 0102 THR N 2.975 H X 0100 GLN O
H X 0102 THR N 2.203 H X 0101 SER O
H X 0103 SER N 3.040 H X 0100 GLN O
H X 0103 SER N 2.467 H X 0101 SER O
H X 0103 SER N 2.194 H X 0102 THR O
H X 0104 ARG N 2.725 H X 0101 SER O
H X 0104 ARG N 2.657 H X 0102 THR O
H X 0104 ARG N 2.197 H X 0103 SER O
H X 0105 HIS N 2.805 H X 0102 THR O
H X 0105 HIS N 2.725 H X 0103 SER O
H X 0105 HIS N 2.202 H X 0104 ARG O
H X 0106 LYS N 2.600 H X 0103 SER O
H X 0106 LYS N 2.197 H X 0105 HIS O
H X 0107 LYS N 2.937 H X 0104 ARG O
H X 0107 LYS N 3.105 H X 0105 HIS O
H X 0107 LYS N 2.192 H X 0106 LYS O
H X 0108 LEU N 2.989 H X 0105 HIS O
H X 0108 LEU N 2.197 H X 0107 LYS O
H X 0109 MET N 3.106 H X 0105 HIS O
H X 0109 MET N 2.936 H X 0106 LYS O
H X 0109 MET N 2.195 H X 0108 LEU O
H X 0110 PHE N 3.019 H X 0108 LEU O
H X 0110 PHE N 2.193 H X 0109 MET O
H X 0111 LYS N 2.879 H X 0108 LEU O
H X 0111 LYS N 2.756 H X 0109 MET O
H X 0111 LYS N 2.201 H X 0110 PHE O
H X 0112 THR N 2.677 H X 0109 MET O
H X 0112 THR N 2.200 H X 0111 LYS O
H X 0113 GLU N 3.114 H X 0109 MET O
H X 0113 GLU N 3.179 H X 0111 LYS O
H X 0113 GLU N 2.196 H X 0112 THR O
HB_MS 2.00 3.20 4
C X 0093 HIS N 3.093 C X 0092 SER OG
H X 0102 THR O 2.395 H X 0105 HIS ND1
H X 0109 MET O 2.417 H X 0112 THR OG1
H X 0113 GLU N 2.957 H X 0112 THR OG1
AROMATIC 0.00 8.00 2
H X 0111 LYS 3.986 H X 0110 PHE
H X 0104 ARG 7.796 H X 0105 HIS
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 75
C Y 0092 SER C 2.433 C Y 0093 HIS CA
C Y 0092 SER C 3.239 C Y 0093 HIS C
C Y 0092 SER C 3.651 C Y 0093 HIS CB
C Y 0093 HIS C 2.423 C Y 0094 LEU CA
C Y 0093 HIS C 3.045 C Y 0094 LEU C
C Y 0093 HIS C 3.690 C Y 0094 LEU CB
C Y 0093 HIS CD2 3.655 C Y 0094 LEU CD1
C Y 0094 LEU C 2.442 C Y 0095 LYS CA
C Y 0094 LEU C 3.365 C Y 0095 LYS C
C Y 0094 LEU C 3.576 C Y 0095 LYS CB
C Y 0094 LEU C 3.687 C Y 0095 LYS CG
C Y 0095 LYS C 2.426 C Y 0096 SER CA
C Y 0095 LYS C 2.996 C Y 0096 SER C
C Y 0095 LYS C 3.694 C Y 0096 SER CB
C Y 0096 SER C 2.440 C Y 0097 LYS CA
C Y 0096 SER C 2.958 C Y 0097 LYS C
C Y 0096 SER C 3.042 C Y 0097 LYS CB
C Y 0096 SER C 3.700 C Y 0097 LYS CG
C Y 0097 LYS C 2.427 C Y 0098 LYS CA
C Y 0097 LYS C 3.063 C Y 0098 LYS C
C Y 0097 LYS C 3.691 C Y 0098 LYS CB
C Y 0098 LYS C 2.432 C Y 0099 GLY CA
C Y 0098 LYS C 3.225 C Y 0099 GLY C
C Y 0099 GLY C 2.438 H Y 0100 GLN CA
C Y 0099 GLY C 2.971 H Y 0100 GLN C
C Y 0099 GLY C 3.017 H Y 0100 GLN CB
C Y 0099 GLY C 3.613 H Y 0100 GLN CG
H Y 0100 GLN C 2.428 H Y 0101 SER CA
H Y 0100 GLN C 2.934 H Y 0101 SER C
H Y 0100 GLN C 3.698 H Y 0101 SER CB
H Y 0101 SER C 2.441 H Y 0102 THR CA
H Y 0101 SER C 2.856 H Y 0102 THR C
H Y 0101 SER C 3.685 H Y 0102 THR CB
H Y 0102 THR C 2.423 H Y 0103 SER CA
H Y 0102 THR C 2.869 H Y 0103 SER C
H Y 0102 THR C 3.671 H Y 0103 SER CB
H Y 0102 THR C 3.575 H Y 0104 ARG CG
H Y 0103 SER C 2.426 H Y 0104 ARG CA
H Y 0103 SER C 2.861 H Y 0104 ARG C
H Y 0103 SER C 3.686 H Y 0104 ARG CB
H Y 0103 SER CA 3.758 H Y 0105 HIS CE1
H Y 0104 ARG C 2.417 H Y 0105 HIS CA
H Y 0104 ARG C 2.942 H Y 0105 HIS C
H Y 0104 ARG C 3.701 H Y 0105 HIS CB
H Y 0105 HIS C 2.421 H Y 0106 LYS CA
H Y 0105 HIS C 2.958 H Y 0106 LYS C
H Y 0105 HIS C 3.700 H Y 0106 LYS CB
H Y 0105 HIS CD2 3.433 H Y 0106 LYS CA
H Y 0106 LYS C 2.407 H Y 0107 LYS CA
H Y 0106 LYS C 2.929 H Y 0107 LYS C
H Y 0106 LYS C 3.691 H Y 0107 LYS CB
H Y 0106 LYS CA 3.681 H Y 0109 MET CG
H Y 0107 LYS C 2.425 H Y 0108 LEU CA
H Y 0107 LYS C 3.098 H Y 0108 LEU C
H Y 0107 LYS C 3.687 H Y 0108 LEU CB
H Y 0108 LEU C 2.420 H Y 0109 MET CA
H Y 0108 LEU C 2.975 H Y 0109 MET C
H Y 0108 LEU C 3.708 H Y 0109 MET CB
H Y 0108 LEU C 3.561 H Y 0110 PHE CD1
H Y 0109 MET C 2.411 H Y 0110 PHE CA
H Y 0109 MET C 2.853 H Y 0110 PHE C
H Y 0109 MET C 3.710 H Y 0110 PHE CB
H Y 0110 PHE C 2.427 H Y 0111 LYS CA
H Y 0110 PHE C 3.072 H Y 0111 LYS C
H Y 0110 PHE C 3.668 H Y 0111 LYS CB
H Y 0110 PHE CD1 3.759 H Y 0111 LYS CA
H Y 0110 PHE CE1 3.098 H Y 0111 LYS CE
H Y 0110 PHE CE2 3.709 H Y 0111 LYS CE
H Y 0110 PHE CZ 2.975 H Y 0111 LYS CE
H Y 0111 LYS C 2.428 H Y 0112 THR CA
H Y 0111 LYS C 2.972 H Y 0112 THR C
H Y 0111 LYS C 3.704 H Y 0112 THR CB
H Y 0112 THR C 2.423 H Y 0113 GLU CA
H Y 0112 THR C 3.059 H Y 0113 GLU CB
H Y 0112 THR C 3.640 H Y 0113 GLU CG
CHARGE_ATTR 2.00 12.00 2
H Y 0113 GLU OE1 7.152 H Y 0111 LYS NZ
H Y 0113 GLU OE2 7.827 H Y 0111 LYS NZ
CHARGE_REPU 2.00 12.00 18
C Y 0093 HIS ND1 10.20 C Y 0095 LYS NZ
C Y 0093 HIS NE2 9.853 C Y 0095 LYS NZ
C Y 0095 LYS NZ 6.376 C Y 0097 LYS NZ
C Y 0097 LYS NZ 9.303 H Y 0105 HIS ND1
C Y 0097 LYS NZ 8.996 H Y 0105 HIS NE2
C Y 0098 LYS NZ 11.68 H Y 0106 LYS NZ
H Y 0104 ARG NH1 8.147 H Y 0105 HIS ND1
H Y 0104 ARG NH1 10.07 H Y 0105 HIS NE2
H Y 0104 ARG NH2 7.430 H Y 0105 HIS ND1
H Y 0104 ARG NH2 9.045 H Y 0105 HIS NE2
H Y 0104 ARG NH1 6.785 H Y 0107 LYS NZ
H Y 0104 ARG NH2 6.286 H Y 0107 LYS NZ
H Y 0105 HIS ND1 9.199 H Y 0106 LYS NZ
H Y 0105 HIS NE2 7.659 H Y 0106 LYS NZ
H Y 0105 HIS ND1 8.598 H Y 0107 LYS NZ
H Y 0105 HIS NE2 9.592 H Y 0107 LYS NZ
H Y 0106 LYS NZ 11.15 H Y 0107 LYS NZ
H Y 0107 LYS NZ 11.53 H Y 0111 LYS NZ
HB_MM 2.00 3.20 40
C Y 0093 HIS N 2.197 C Y 0092 SER O
C Y 0094 LEU N 2.194 C Y 0093 HIS O
C Y 0095 LYS N 2.203 C Y 0094 LEU O
C Y 0096 SER N 2.197 C Y 0095 LYS O
C Y 0097 LYS N 2.201 C Y 0096 SER O
C Y 0098 LYS N 2.197 C Y 0097 LYS O
C Y 0099 GLY N 2.199 C Y 0098 LYS O
H Y 0100 GLN N 2.205 C Y 0099 GLY O
H Y 0101 SER N 2.198 H Y 0100 GLN O
H Y 0102 THR N 2.976 H Y 0100 GLN O
H Y 0102 THR N 2.204 H Y 0101 SER O
H Y 0103 SER N 3.042 H Y 0100 GLN O
H Y 0103 SER N 2.467 H Y 0101 SER O
H Y 0103 SER N 2.192 H Y 0102 THR O
H Y 0104 ARG N 2.724 H Y 0101 SER O
H Y 0104 ARG N 2.653 H Y 0102 THR O
H Y 0104 ARG N 2.198 H Y 0103 SER O
H Y 0105 HIS N 2.803 H Y 0102 THR O
H Y 0105 HIS N 2.725 H Y 0103 SER O
H Y 0105 HIS N 2.201 H Y 0104 ARG O
H Y 0106 LYS N 2.598 H Y 0103 SER O
H Y 0106 LYS N 2.196 H Y 0105 HIS O
H Y 0107 LYS N 2.943 H Y 0104 ARG O
H Y 0107 LYS N 3.105 H Y 0105 HIS O
H Y 0107 LYS N 2.190 H Y 0106 LYS O
H Y 0108 LEU N 2.987 H Y 0105 HIS O
H Y 0108 LEU N 2.195 H Y 0107 LYS O
H Y 0109 MET N 3.111 H Y 0105 HIS O
H Y 0109 MET N 2.936 H Y 0106 LYS O
H Y 0109 MET N 2.194 H Y 0108 LEU O
H Y 0110 PHE N 3.012 H Y 0108 LEU O
H Y 0110 PHE N 2.193 H Y 0109 MET O
H Y 0111 LYS N 2.879 H Y 0108 LEU O
H Y 0111 LYS N 2.760 H Y 0109 MET O
H Y 0111 LYS N 2.201 H Y 0110 PHE O
H Y 0112 THR N 2.682 H Y 0109 MET O
H Y 0112 THR N 2.201 H Y 0111 LYS O
H Y 0113 GLU N 3.115 H Y 0109 MET O
H Y 0113 GLU N 3.168 H Y 0111 LYS O
H Y 0113 GLU N 2.196 H Y 0112 THR O
HB_MS 2.00 3.20 4
C Y 0093 HIS N 3.096 C Y 0092 SER OG
H Y 0102 THR O 2.396 H Y 0105 HIS ND1
H Y 0109 MET O 2.419 H Y 0112 THR OG1
H Y 0113 GLU N 2.962 H Y 0112 THR OG1
AROMATIC 0.00 8.00 2
H Y 0111 LYS 3.987 H Y 0110 PHE
H Y 0104 ARG 7.787 H Y 0105 HIS