Complet list of 1dip con file
Complete list of 1dip.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 351
C A 0001 MET C 2.423 C A 0002 ASP CA
C A 0001 MET C 3.576 C A 0002 ASP C
C A 0001 MET C 3.337 C A 0002 ASP CB
C A 0002 ASP C 2.424 C A 0003 LEU CA
C A 0002 ASP C 3.275 C A 0003 LEU C
C A 0002 ASP C 3.617 C A 0003 LEU CB
C A 0003 LEU C 2.419 C A 0004 VAL CA
C A 0003 LEU C 2.964 C A 0004 VAL C
C A 0003 LEU C 3.691 C A 0004 VAL CB
C A 0003 LEU CD1 3.759 C A 0004 VAL CG2
C A 0004 VAL C 2.428 C A 0005 LYS CA
C A 0004 VAL C 3.207 C A 0005 LYS C
C A 0004 VAL C 3.651 C A 0005 LYS CB
C A 0004 VAL CA 3.699 H A 0007 HIS CD2
C A 0004 VAL C 3.601 H A 0007 HIS CD2
C A 0004 VAL C 3.729 H A 0008 LEU CD1
C A 0004 VAL CG1 3.393 C A 0013 ARG CD
C A 0004 VAL CG1 3.495 C A 0013 ARG CZ
C A 0005 LYS C 2.434 C A 0006 ASN CA
C A 0005 LYS C 3.584 C A 0006 ASN C
C A 0005 LYS C 3.330 C A 0006 ASN CB
C A 0005 LYS CA 3.488 H A 0008 LEU CD1
C A 0005 LYS C 3.271 H A 0008 LEU CD1
C A 0006 ASN CA 3.794 H A 0007 HIS CA
C A 0006 ASN C 2.411 H A 0007 HIS CA
C A 0006 ASN C 3.126 H A 0007 HIS C
C A 0006 ASN C 3.649 H A 0007 HIS CB
C A 0006 ASN CA 3.741 H A 0008 LEU CD1
C A 0006 ASN C 3.507 H A 0008 LEU CD1
H A 0007 HIS C 2.415 H A 0008 LEU CA
H A 0007 HIS C 3.028 H A 0008 LEU C
H A 0007 HIS C 3.670 H A 0008 LEU CB
H A 0007 HIS C 3.426 H A 0008 LEU CD1
H A 0007 HIS CD2 3.778 H A 0008 LEU CD1
H A 0007 HIS C 3.566 H A 0010 TYR CD1
H A 0007 HIS CG 3.650 H A 0010 TYR CG
H A 0007 HIS CG 3.563 H A 0010 TYR CD1
H A 0007 HIS CG 3.732 H A 0010 TYR CE1
H A 0007 HIS CD2 3.618 H A 0010 TYR CD1
H A 0007 HIS CD2 3.441 H A 0010 TYR CE1
H A 0007 HIS CE1 3.698 H A 0010 TYR CD2
H A 0007 HIS CE1 3.250 H A 0010 TYR CE1
H A 0007 HIS CE1 3.072 H A 0010 TYR CE2
H A 0007 HIS CE1 2.809 H A 0010 TYR CZ
H A 0008 LEU CA 3.773 H A 0009 MET CA
H A 0008 LEU C 2.384 H A 0009 MET CA
H A 0008 LEU C 3.037 H A 0009 MET C
H A 0008 LEU C 3.653 H A 0009 MET CB
H A 0008 LEU CA 3.181 C A 0012 VAL CA
H A 0008 LEU C 3.421 C A 0012 VAL CA
H A 0008 LEU C 3.737 C A 0012 VAL CB
H A 0008 LEU CB 3.201 C A 0012 VAL CA
H A 0008 LEU CB 3.622 C A 0012 VAL CB
H A 0008 LEU CB 3.664 C A 0012 VAL CG2
H A 0008 LEU CG 3.533 C A 0012 VAL CA
H A 0009 MET C 2.445 H A 0010 TYR CA
H A 0009 MET C 3.242 H A 0010 TYR C
H A 0009 MET C 3.641 H A 0010 TYR CB
H A 0010 TYR CA 3.796 C A 0011 ALA CA
H A 0010 TYR C 2.409 C A 0011 ALA CA
H A 0010 TYR C 3.690 C A 0011 ALA C
H A 0010 TYR C 2.895 C A 0011 ALA CB
H A 0010 TYR CG 3.753 C A 0011 ALA CB
H A 0010 TYR CD1 3.380 C A 0011 ALA CA
H A 0010 TYR CD1 2.887 C A 0011 ALA CB
H A 0010 TYR CE1 2.823 C A 0011 ALA CB
H A 0010 TYR CZ 3.639 C A 0011 ALA CB
H A 0010 TYR CE1 3.654 C A 0013 ARG CD
H A 0010 TYR CZ 3.720 C A 0013 ARG CD
C A 0011 ALA CA 3.796 C A 0012 VAL CA
C A 0011 ALA C 2.408 C A 0012 VAL CA
C A 0011 ALA C 2.810 C A 0012 VAL C
C A 0011 ALA C 3.113 C A 0012 VAL CB
C A 0011 ALA C 3.037 C A 0012 VAL CG1
C A 0012 VAL C 2.432 C A 0013 ARG CA
C A 0012 VAL C 2.878 C A 0013 ARG C
C A 0012 VAL C 3.678 C A 0013 ARG CB
C A 0012 VAL CG1 3.765 H A 0020 LYS CG
C A 0013 ARG C 2.422 C A 0014 GLU CA
C A 0013 ARG C 3.675 C A 0014 GLU C
C A 0013 ARG C 2.936 C A 0014 GLU CB
C A 0014 GLU C 2.423 C A 0015 GLU CA
C A 0014 GLU C 3.336 C A 0015 GLU C
C A 0014 GLU C 3.569 C A 0015 GLU CB
C A 0014 GLU C 3.772 C A 0015 GLU CG
C A 0015 GLU C 2.421 C A 0016 VAL CA
C A 0015 GLU C 3.622 C A 0016 VAL C
C A 0015 GLU C 3.237 C A 0016 VAL CB
C A 0015 GLU C 2.929 C A 0016 VAL CG2
C A 0016 VAL C 2.420 H A 0017 GLU CA
C A 0016 VAL C 2.988 H A 0017 GLU C
C A 0016 VAL C 3.692 H A 0017 GLU CB
H A 0017 GLU C 2.422 H A 0018 ILE CA
H A 0017 GLU C 3.047 H A 0018 ILE C
H A 0017 GLU C 3.690 H A 0018 ILE CB
H A 0018 ILE C 2.421 H A 0019 LEU CA
H A 0018 ILE C 3.038 H A 0019 LEU C
H A 0018 ILE C 3.691 H A 0019 LEU CB
H A 0019 LEU C 2.421 H A 0020 LYS CA
H A 0019 LEU C 3.052 H A 0020 LYS C
H A 0019 LEU C 3.687 H A 0020 LYS CB
H A 0019 LEU CA 3.781 H A 0022 GLN CB
H A 0020 LYS C 2.416 H A 0021 GLU CA
H A 0020 LYS C 3.062 H A 0021 GLU C
H A 0020 LYS C 3.679 H A 0021 GLU CB
H A 0020 LYS CE 3.448 H A 0021 GLU CA
H A 0021 GLU C 2.422 H A 0022 GLN CA
H A 0021 GLU C 3.093 H A 0022 GLN C
H A 0021 GLU C 3.676 H A 0022 GLN CB
H A 0022 GLN C 2.423 H A 0023 ILE CA
H A 0022 GLN C 3.054 H A 0023 ILE C
H A 0022 GLN C 3.690 H A 0023 ILE CB
H A 0022 GLN C 3.668 H A 0023 ILE CD1
H A 0023 ILE C 2.421 H A 0024 ARG CA
H A 0023 ILE C 3.043 H A 0024 ARG C
H A 0023 ILE C 3.684 H A 0024 ARG CB
H A 0024 ARG C 2.426 H A 0025 GLU CA
H A 0024 ARG C 3.131 H A 0025 GLU C
H A 0024 ARG C 3.675 H A 0025 GLU CB
H A 0025 GLU C 2.416 H A 0026 LEU CA
H A 0025 GLU C 3.099 H A 0026 LEU C
H A 0025 GLU C 3.668 H A 0026 LEU CB
H A 0026 LEU C 2.422 H A 0027 VAL CA
H A 0026 LEU C 3.130 H A 0027 VAL C
H A 0026 LEU C 3.663 H A 0027 VAL CB
H A 0027 VAL C 2.421 H A 0028 GLU CA
H A 0027 VAL C 3.109 H A 0028 GLU C
H A 0027 VAL C 3.672 H A 0028 GLU CB
H A 0028 GLU C 2.421 H A 0029 LYS CA
H A 0028 GLU C 3.089 H A 0029 LYS C
H A 0028 GLU C 3.675 H A 0029 LYS CB
H A 0029 LYS C 2.419 H A 0030 ASN CA
H A 0029 LYS C 3.062 H A 0030 ASN C
H A 0029 LYS C 3.682 H A 0030 ASN CB
H A 0030 ASN C 2.424 H A 0031 SER CA
H A 0030 ASN C 3.040 H A 0031 SER C
H A 0030 ASN C 3.691 H A 0031 SER CB
H A 0031 SER C 2.418 H A 0032 GLN CA
H A 0031 SER C 3.041 H A 0032 GLN C
H A 0031 SER C 3.685 H A 0032 GLN CB
H A 0032 GLN C 2.421 H A 0033 LEU CA
H A 0032 GLN C 3.138 H A 0033 LEU C
H A 0032 GLN C 3.666 H A 0033 LEU CB
H A 0033 LEU C 2.419 H A 0034 GLU CA
H A 0033 LEU C 3.100 H A 0034 GLU C
H A 0033 LEU C 3.674 H A 0034 GLU CB
H A 0034 GLU C 2.422 H A 0035 ARG CA
H A 0034 GLU C 3.123 H A 0035 ARG C
H A 0034 GLU C 3.669 H A 0035 ARG CB
H A 0035 ARG C 2.423 H A 0036 GLU CA
H A 0035 ARG C 3.051 H A 0036 GLU C
H A 0035 ARG C 3.685 H A 0036 GLU CB
H A 0036 GLU C 2.422 H A 0037 ASN CA
H A 0036 GLU C 3.068 H A 0037 ASN C
H A 0036 GLU C 3.684 H A 0037 ASN CB
H A 0037 ASN C 2.420 H A 0038 THR CA
H A 0037 ASN C 3.042 H A 0038 THR C
H A 0037 ASN C 3.687 H A 0038 THR CB
H A 0038 THR C 2.422 H A 0039 LEU CA
H A 0038 THR C 3.071 H A 0039 LEU C
H A 0038 THR C 3.681 H A 0039 LEU CB
H A 0039 LEU C 2.418 H A 0040 LEU CA
H A 0039 LEU C 3.105 H A 0040 LEU C
H A 0039 LEU C 3.673 H A 0040 LEU CB
H A 0040 LEU C 2.424 H A 0041 LYS CA
H A 0040 LEU C 3.057 H A 0041 LYS C
H A 0040 LEU C 3.691 H A 0041 LYS CB
H A 0041 LYS C 2.422 H A 0042 THR CA
H A 0041 LYS C 3.088 H A 0042 THR C
H A 0041 LYS C 3.681 H A 0042 THR CB
H A 0042 THR C 2.421 H A 0043 LEU CA
H A 0042 THR C 3.037 H A 0043 LEU C
H A 0042 THR C 3.690 H A 0043 LEU CB
H A 0042 THR C 3.725 C A 0046 PRO CD
H A 0043 LEU C 2.421 C A 0044 ALA CA
H A 0043 LEU C 3.268 C A 0044 ALA C
H A 0043 LEU C 3.615 C A 0044 ALA CB
H A 0043 LEU C 3.737 C A 0046 PRO CD
C A 0044 ALA C 2.422 C A 0045 SER CA
C A 0044 ALA C 3.152 C A 0045 SER C
C A 0044 ALA C 3.666 C A 0045 SER CB
C A 0044 ALA C 3.638 C A 0046 PRO CD
C A 0045 SER CA 2.801 C A 0046 PRO CD
C A 0045 SER C 2.444 C A 0046 PRO CA
C A 0045 SER C 3.174 C A 0046 PRO C
C A 0045 SER C 3.609 C A 0046 PRO CB
C A 0045 SER C 3.649 C A 0046 PRO CG
C A 0045 SER C 2.453 C A 0046 PRO CD
C A 0045 SER CB 2.997 C A 0046 PRO CD
C A 0046 PRO C 2.415 C A 0047 GLU CA
C A 0046 PRO C 3.579 C A 0047 GLU C
C A 0046 PRO C 3.312 C A 0047 GLU CB
C A 0046 PRO C 3.625 C A 0047 GLU CG
C A 0047 GLU C 2.426 C A 0048 GLN CA
C A 0047 GLU C 3.655 C A 0048 GLN C
C A 0047 GLU C 3.106 C A 0048 GLN CB
C A 0048 GLN CA 3.790 C A 0049 LEU CA
C A 0048 GLN C 2.414 C A 0049 LEU CA
C A 0048 GLN C 3.483 C A 0049 LEU C
C A 0048 GLN C 3.373 C A 0049 LEU CB
C A 0048 GLN C 3.487 C A 0049 LEU CG
C A 0049 LEU C 2.430 C A 0050 GLU CA
C A 0049 LEU C 3.487 C A 0050 GLU C
C A 0049 LEU C 3.437 C A 0050 GLU CB
C A 0049 LEU CA 3.756 C A 0052 PHE CE2
C A 0049 LEU C 3.711 C A 0052 PHE CE2
C A 0049 LEU CB 3.762 C A 0052 PHE CD2
C A 0049 LEU CB 2.647 C A 0052 PHE CE2
C A 0049 LEU CB 2.802 C A 0052 PHE CZ
C A 0049 LEU CG 3.657 C A 0052 PHE CE2
C A 0049 LEU CG 3.350 C A 0052 PHE CZ
C A 0049 LEU CD1 3.424 C A 0052 PHE CE1
C A 0049 LEU CD1 3.754 C A 0052 PHE CE2
C A 0049 LEU CD1 2.889 C A 0052 PHE CZ
C A 0050 GLU C 2.463 C A 0051 LYS CA
C A 0050 GLU C 2.974 C A 0051 LYS C
C A 0050 GLU C 3.090 C A 0051 LYS CB
C A 0050 GLU C 3.170 C A 0051 LYS CG
C A 0050 GLU C 3.784 C A 0051 LYS CD
C A 0050 GLU C 3.368 C A 0052 PHE CD2
C A 0050 GLU C 3.401 C A 0052 PHE CE2
C A 0051 LYS CA 3.750 C A 0052 PHE CG
C A 0051 LYS CA 2.990 C A 0052 PHE CD2
C A 0051 LYS CA 3.037 C A 0052 PHE CE2
C A 0051 LYS C 2.438 C A 0052 PHE CA
C A 0051 LYS C 3.694 C A 0052 PHE C
C A 0051 LYS C 3.033 C A 0052 PHE CB
C A 0051 LYS C 2.869 C A 0052 PHE CG
C A 0051 LYS C 2.464 C A 0052 PHE CD2
C A 0051 LYS C 3.185 C A 0052 PHE CE2
C A 0051 LYS CA 3.526 C A 0056 LEU CB
C A 0051 LYS CA 3.579 C A 0056 LEU CD1
C A 0051 LYS CA 3.718 C A 0056 LEU CD2
C A 0051 LYS CB 3.499 C A 0056 LEU CB
C A 0051 LYS CD 3.076 C A 0056 LEU CB
C A 0051 LYS CD 3.483 C A 0056 LEU CD2
C A 0051 LYS CB 2.967 C A 0057 SER CB
C A 0052 PHE CA 3.796 C A 0053 GLN CA
C A 0052 PHE C 2.427 C A 0053 GLN CA
C A 0052 PHE C 3.205 C A 0053 GLN C
C A 0052 PHE C 3.625 C A 0053 GLN CB
C A 0052 PHE CD1 3.650 C A 0053 GLN CB
C A 0052 PHE CD1 3.734 C A 0053 GLN CG
C A 0052 PHE CD1 3.485 C A 0053 GLN CD
C A 0052 PHE CE1 3.527 C A 0053 GLN CD
C A 0052 PHE CD1 3.331 C A 0056 LEU CD1
C A 0052 PHE CE1 2.936 C A 0056 LEU CD1
C A 0052 PHE CE1 3.612 C A 0056 LEU CD2
C A 0052 PHE CE2 3.589 C A 0056 LEU CD2
C A 0052 PHE CZ 3.727 C A 0056 LEU CG
C A 0052 PHE CZ 3.225 C A 0056 LEU CD1
C A 0052 PHE CZ 2.974 C A 0056 LEU CD2
C A 0053 GLN C 2.418 C A 0054 SER CA
C A 0053 GLN C 3.249 C A 0054 SER C
C A 0053 GLN C 3.615 C A 0054 SER CB
C A 0053 GLN CB 3.697 C A 0055 ARG CG
C A 0053 GLN CB 3.663 C A 0056 LEU CD1
C A 0054 SER C 2.424 C A 0055 ARG CA
C A 0054 SER C 3.157 C A 0055 ARG C
C A 0054 SER C 3.687 C A 0055 ARG CB
C A 0055 ARG C 2.419 C A 0056 LEU CA
C A 0055 ARG C 3.199 C A 0056 LEU C
C A 0055 ARG C 3.665 C A 0056 LEU CB
C A 0056 LEU C 2.419 C A 0057 SER CA
C A 0056 LEU C 3.550 C A 0057 SER C
C A 0056 LEU C 3.360 C A 0057 SER CB
C A 0057 SER CA 2.806 C A 0058 PRO CD
C A 0057 SER C 2.426 C A 0058 PRO CA
C A 0057 SER C 3.132 C A 0058 PRO C
C A 0057 SER C 3.594 C A 0058 PRO CB
C A 0057 SER C 3.645 C A 0058 PRO CG
C A 0057 SER C 2.455 C A 0058 PRO CD
C A 0057 SER CB 3.725 C A 0058 PRO CD
C A 0058 PRO C 2.417 C A 0059 GLU CA
C A 0058 PRO C 3.659 C A 0059 GLU C
C A 0058 PRO C 3.130 C A 0059 GLU CB
C A 0058 PRO C 3.551 C A 0059 GLU CG
C A 0059 GLU C 2.417 C A 0060 GLU CA
C A 0059 GLU C 2.888 C A 0060 GLU C
C A 0059 GLU C 3.007 C A 0060 GLU CB
C A 0059 GLU C 3.716 C A 0061 PRO CD
C A 0060 GLU CA 2.781 C A 0061 PRO CD
C A 0060 GLU C 2.444 C A 0061 PRO CA
C A 0060 GLU C 3.173 C A 0061 PRO C
C A 0060 GLU C 3.607 C A 0061 PRO CB
C A 0060 GLU C 3.649 C A 0061 PRO CG
C A 0060 GLU C 2.454 C A 0061 PRO CD
C A 0061 PRO C 2.421 C A 0062 ALA CA
C A 0061 PRO C 2.954 C A 0062 ALA C
C A 0061 PRO C 2.964 C A 0062 ALA CB
C A 0062 ALA CA 2.784 C A 0063 PRO CD
C A 0062 ALA C 2.441 C A 0063 PRO CA
C A 0062 ALA C 3.156 C A 0063 PRO C
C A 0062 ALA C 3.606 C A 0063 PRO CB
C A 0062 ALA C 3.647 C A 0063 PRO CG
C A 0062 ALA C 2.453 C A 0063 PRO CD
C A 0062 ALA CB 3.290 C A 0063 PRO CD
C A 0063 PRO C 2.419 C A 0064 GLU CA
C A 0063 PRO C 3.051 C A 0064 GLU C
C A 0063 PRO C 3.682 C A 0064 GLU CB
C A 0064 GLU C 2.423 C A 0065 THR CA
C A 0064 GLU C 3.618 C A 0065 THR C
C A 0064 GLU C 3.260 C A 0065 THR CB
C A 0064 GLU C 3.745 C A 0065 THR CG2
C A 0065 THR CA 2.783 C A 0066 PRO CD
C A 0065 THR C 2.439 C A 0066 PRO CA
C A 0065 THR C 3.146 C A 0066 PRO C
C A 0065 THR C 3.608 C A 0066 PRO CB
C A 0065 THR C 3.648 C A 0066 PRO CG
C A 0065 THR C 2.452 C A 0066 PRO CD
C A 0065 THR CB 3.385 C A 0066 PRO CD
C A 0066 PRO C 2.419 C A 0067 GLU CA
C A 0066 PRO C 3.441 C A 0067 GLU C
C A 0066 PRO C 3.485 C A 0067 GLU CB
C A 0066 PRO C 3.735 C A 0067 GLU CG
C A 0067 GLU C 2.423 C A 0068 ALA CA
C A 0067 GLU C 3.693 C A 0068 ALA C
C A 0067 GLU C 3.036 C A 0068 ALA CB
C A 0068 ALA CA 2.791 C A 0069 PRO CD
C A 0068 ALA C 2.442 C A 0069 PRO CA
C A 0068 ALA C 3.165 C A 0069 PRO C
C A 0068 ALA C 3.606 C A 0069 PRO CB
C A 0068 ALA C 3.648 C A 0069 PRO CG
C A 0068 ALA C 2.453 C A 0069 PRO CD
C A 0068 ALA CB 3.532 C A 0069 PRO CD
C A 0069 PRO C 2.421 C A 0070 GLU CA
C A 0069 PRO C 3.569 C A 0070 GLU C
C A 0069 PRO C 3.343 C A 0070 GLU CB
C A 0070 GLU C 2.423 C A 0071 ALA CA
C A 0070 GLU C 3.276 C A 0071 ALA C
C A 0070 GLU C 3.614 C A 0071 ALA CB
C A 0071 ALA CA 2.795 C A 0072 PRO CD
C A 0071 ALA C 2.440 C A 0072 PRO CA
C A 0071 ALA C 3.156 C A 0072 PRO C
C A 0071 ALA C 3.606 C A 0072 PRO CB
C A 0071 ALA C 3.649 C A 0072 PRO CG
C A 0071 ALA C 2.456 C A 0072 PRO CD
C A 0071 ALA CB 3.517 C A 0072 PRO CD
C A 0072 PRO C 2.421 C A 0073 GLY CA
C A 0072 PRO C 3.577 C A 0073 GLY C
C A 0073 GLY C 2.422 C A 0074 GLY CA
C A 0073 GLY C 2.881 C A 0074 GLY C
C A 0074 GLY C 2.425 C A 0075 SER CA
C A 0074 GLY C 3.570 C A 0075 SER C
C A 0074 GLY C 3.349 C A 0075 SER CB
C A 0075 SER C 2.424 C A 0076 ALA CA
C A 0075 SER C 3.185 C A 0076 ALA C
C A 0075 SER C 3.654 C A 0076 ALA CB
C A 0076 ALA C 2.422 C A 0077 VAL CA
C A 0076 ALA C 3.115 C A 0077 VAL C
C A 0076 ALA C 3.671 C A 0077 VAL CB
CHARGE_ATTR 2.00 12.00 67
C A 0002 ASP OD1 4.878 C A 0005 LYS NZ
C A 0002 ASP OD2 6.410 C A 0005 LYS NZ
C A 0002 ASP OD1 10.73 H A 0007 HIS ND1
C A 0002 ASP OD1 9.897 H A 0007 HIS NE2
C A 0002 ASP OD2 11.77 H A 0007 HIS NE2
C A 0002 ASP OD1 11.74 C A 0013 ARG NH1
C A 0014 GLU OE1 8.748 C A 0005 LYS NZ
C A 0014 GLU OE2 9.902 C A 0005 LYS NZ
C A 0014 GLU OE1 10.72 H A 0007 HIS NE2
C A 0014 GLU OE2 11.88 H A 0007 HIS NE2
C A 0014 GLU OE1 11.69 C A 0013 ARG NH1
C A 0014 GLU OE1 11.84 C A 0013 ARG NH2
H A 0017 GLU OE1 11.89 H A 0007 HIS NE2
H A 0017 GLU OE2 11.64 H A 0007 HIS ND1
H A 0017 GLU OE2 10.19 H A 0007 HIS NE2
H A 0017 GLU OE1 10.41 C A 0013 ARG NH1
H A 0017 GLU OE1 8.371 C A 0013 ARG NH2
H A 0017 GLU OE2 8.992 C A 0013 ARG NH1
H A 0017 GLU OE2 7.176 C A 0013 ARG NH2
H A 0017 GLU OE1 10.03 H A 0020 LYS NZ
H A 0017 GLU OE2 9.565 H A 0020 LYS NZ
H A 0021 GLU OE1 5.293 H A 0020 LYS NZ
H A 0021 GLU OE2 3.777 H A 0020 LYS NZ
H A 0021 GLU OE1 8.280 H A 0024 ARG NH1
H A 0021 GLU OE1 8.636 H A 0024 ARG NH2
H A 0021 GLU OE2 6.762 H A 0024 ARG NH1
H A 0021 GLU OE2 6.752 H A 0024 ARG NH2
H A 0025 GLU OE1 6.524 H A 0020 LYS NZ
H A 0025 GLU OE2 7.478 H A 0020 LYS NZ
H A 0025 GLU OE1 4.845 H A 0024 ARG NH1
H A 0025 GLU OE1 6.532 H A 0024 ARG NH2
H A 0025 GLU OE2 3.605 H A 0024 ARG NH1
H A 0025 GLU OE2 5.708 H A 0024 ARG NH2
H A 0025 GLU OE1 8.754 H A 0029 LYS NZ
H A 0025 GLU OE2 7.478 H A 0029 LYS NZ
H A 0028 GLU OE1 10.30 H A 0020 LYS NZ
H A 0028 GLU OE2 9.409 H A 0020 LYS NZ
H A 0028 GLU OE1 5.178 H A 0024 ARG NH1
H A 0028 GLU OE1 6.054 H A 0024 ARG NH2
H A 0028 GLU OE2 3.547 H A 0024 ARG NH1
H A 0028 GLU OE2 4.642 H A 0024 ARG NH2
H A 0028 GLU OE1 9.216 H A 0029 LYS NZ
H A 0028 GLU OE2 8.865 H A 0029 LYS NZ
H A 0028 GLU OE1 11.34 H A 0035 ARG NH1
H A 0028 GLU OE1 11.96 H A 0035 ARG NH2
H A 0028 GLU OE2 11.99 H A 0035 ARG NH1
H A 0034 GLU OE1 10.97 H A 0035 ARG NH1
H A 0034 GLU OE1 11.39 H A 0035 ARG NH2
H A 0034 GLU OE1 8.793 H A 0041 LYS NZ
H A 0034 GLU OE2 7.112 H A 0041 LYS NZ
H A 0036 GLU OE1 7.195 H A 0029 LYS NZ
H A 0036 GLU OE2 8.914 H A 0029 LYS NZ
H A 0036 GLU OE1 7.710 H A 0035 ARG NH1
H A 0036 GLU OE1 9.932 H A 0035 ARG NH2
H A 0036 GLU OE2 7.797 H A 0035 ARG NH1
H A 0036 GLU OE2 10.01 H A 0035 ARG NH2
C A 0047 GLU OE1 5.584 C A 0051 LYS NZ
C A 0047 GLU OE2 4.162 C A 0051 LYS NZ
C A 0047 GLU OE1 9.856 C A 0055 ARG NH1
C A 0047 GLU OE1 10.92 C A 0055 ARG NH2
C A 0047 GLU OE2 10.31 C A 0055 ARG NH1
C A 0047 GLU OE2 11.29 C A 0055 ARG NH2
C A 0050 GLU OE1 9.017 C A 0051 LYS NZ
C A 0050 GLU OE2 9.489 C A 0051 LYS NZ
C A 0059 GLU OE1 10.20 C A 0051 LYS NZ
C A 0059 GLU OE2 11.65 C A 0051 LYS NZ
C A 0060 GLU OE1 11.81 C A 0051 LYS NZ
CHARGE_REPU 2.00 12.00 58
C A 0005 LYS NZ 10.98 H A 0007 HIS ND1
C A 0005 LYS NZ 9.310 H A 0007 HIS NE2
C A 0005 LYS NZ 9.892 C A 0013 ARG NH1
C A 0005 LYS NZ 11.43 C A 0013 ARG NH2
H A 0007 HIS ND1 5.388 C A 0013 ARG NH1
H A 0007 HIS ND1 6.839 C A 0013 ARG NH2
H A 0007 HIS NE2 4.078 C A 0013 ARG NH1
H A 0007 HIS NE2 5.573 C A 0013 ARG NH2
H A 0007 HIS ND1 10.93 H A 0020 LYS NZ
H A 0007 HIS NE2 11.01 H A 0020 LYS NZ
C A 0013 ARG NH2 11.95 H A 0020 LYS NZ
C A 0014 GLU OE1 7.205 C A 0015 GLU OE1
C A 0014 GLU OE1 6.199 C A 0015 GLU OE2
C A 0014 GLU OE2 6.240 C A 0015 GLU OE1
C A 0014 GLU OE2 5.791 C A 0015 GLU OE2
C A 0014 GLU OE1 10.33 H A 0017 GLU OE2
C A 0014 GLU OE2 11.57 H A 0017 GLU OE1
C A 0014 GLU OE2 9.682 H A 0017 GLU OE2
C A 0015 GLU OE1 10.87 H A 0017 GLU OE1
C A 0015 GLU OE1 9.685 H A 0017 GLU OE2
C A 0015 GLU OE2 10.75 H A 0017 GLU OE2
H A 0017 GLU OE1 7.731 H A 0021 GLU OE1
H A 0017 GLU OE1 8.926 H A 0021 GLU OE2
H A 0017 GLU OE2 8.471 H A 0021 GLU OE1
H A 0017 GLU OE2 9.280 H A 0021 GLU OE2
H A 0020 LYS NZ 6.279 H A 0024 ARG NH1
H A 0020 LYS NZ 5.501 H A 0024 ARG NH2
H A 0021 GLU OE1 5.710 H A 0025 GLU OE1
H A 0021 GLU OE1 7.276 H A 0025 GLU OE2
H A 0021 GLU OE2 5.530 H A 0025 GLU OE1
H A 0021 GLU OE2 6.656 H A 0025 GLU OE2
H A 0021 GLU OE1 11.71 H A 0028 GLU OE2
H A 0021 GLU OE2 11.68 H A 0028 GLU OE1
H A 0021 GLU OE2 10.29 H A 0028 GLU OE2
H A 0024 ARG NH1 9.860 H A 0029 LYS NZ
H A 0025 GLU OE1 8.350 H A 0028 GLU OE1
H A 0025 GLU OE1 7.313 H A 0028 GLU OE2
H A 0025 GLU OE2 6.882 H A 0028 GLU OE1
H A 0025 GLU OE2 5.587 H A 0028 GLU OE2
H A 0028 GLU OE1 10.74 H A 0034 GLU OE1
H A 0028 GLU OE1 11.86 H A 0036 GLU OE1
H A 0034 GLU OE1 11.46 H A 0036 GLU OE1
H A 0041 LYS NZ 11.16 C A 0055 ARG NH1
C A 0050 GLU OE1 6.221 C A 0059 GLU OE1
C A 0050 GLU OE1 8.000 C A 0059 GLU OE2
C A 0050 GLU OE2 8.351 C A 0059 GLU OE1
C A 0050 GLU OE2 10.15 C A 0059 GLU OE2
C A 0050 GLU OE1 6.099 C A 0060 GLU OE1
C A 0050 GLU OE1 5.705 C A 0060 GLU OE2
C A 0050 GLU OE2 7.703 C A 0060 GLU OE1
C A 0050 GLU OE2 6.979 C A 0060 GLU OE2
C A 0051 LYS NZ 9.895 C A 0055 ARG NH1
C A 0051 LYS NZ 11.25 C A 0055 ARG NH2
C A 0059 GLU OE1 4.234 C A 0060 GLU OE1
C A 0059 GLU OE1 5.643 C A 0060 GLU OE2
C A 0059 GLU OE2 5.842 C A 0060 GLU OE1
C A 0059 GLU OE2 7.124 C A 0060 GLU OE2
C A 0064 GLU OE2 11.27 C A 0070 GLU OE1
HB_MM 2.00 3.20 118
C A 0002 ASP N 2.196 C A 0001 MET O
C A 0003 LEU N 2.197 C A 0002 ASP O
C A 0004 VAL N 2.194 C A 0003 LEU O
C A 0005 LYS N 2.199 C A 0004 VAL O
C A 0006 ASN N 3.000 C A 0003 LEU O
C A 0006 ASN N 3.048 C A 0004 VAL O
C A 0006 ASN N 2.201 C A 0005 LYS O
H A 0007 HIS N 3.162 C A 0003 LEU O
H A 0007 HIS N 2.195 C A 0006 ASN O
H A 0008 LEU N 2.851 C A 0006 ASN O
H A 0008 LEU N 2.170 H A 0007 HIS O
H A 0009 MET N 3.081 H A 0007 HIS O
H A 0009 MET N 2.182 H A 0008 LEU O
H A 0010 TYR N 2.901 H A 0007 HIS O
H A 0010 TYR N 3.199 H A 0008 LEU O
H A 0010 TYR N 2.206 H A 0009 MET O
C A 0011 ALA N 3.144 H A 0008 LEU O
C A 0011 ALA N 2.196 H A 0010 TYR O
C A 0012 VAL N 2.393 H A 0008 LEU O
C A 0012 VAL N 2.193 C A 0011 ALA O
C A 0013 ARG N 2.692 C A 0011 ALA O
C A 0013 ARG N 2.205 C A 0012 VAL O
C A 0014 GLU N 2.791 C A 0012 VAL O
C A 0014 GLU N 2.194 C A 0013 ARG O
C A 0015 GLU N 2.199 C A 0014 GLU O
C A 0016 VAL N 2.194 C A 0015 GLU O
H A 0017 GLU N 2.193 C A 0016 VAL O
H A 0018 ILE N 2.195 H A 0017 GLU O
H A 0019 LEU N 2.197 H A 0018 ILE O
H A 0020 LYS N 2.838 C A 0016 VAL O
H A 0020 LYS N 2.194 H A 0019 LEU O
H A 0021 GLU N 2.989 H A 0017 GLU O
H A 0021 GLU N 2.198 H A 0020 LYS O
H A 0022 GLN N 2.781 H A 0018 ILE O
H A 0022 GLN N 2.195 H A 0021 GLU O
H A 0023 ILE N 2.959 H A 0019 LEU O
H A 0023 ILE N 2.199 H A 0022 GLN O
H A 0024 ARG N 2.929 H A 0020 LYS O
H A 0024 ARG N 2.199 H A 0023 ILE O
H A 0025 GLU N 2.850 H A 0021 GLU O
H A 0025 GLU N 2.202 H A 0024 ARG O
H A 0026 LEU N 2.758 H A 0022 GLN O
H A 0026 LEU N 2.194 H A 0025 GLU O
H A 0027 VAL N 2.908 H A 0023 ILE O
H A 0027 VAL N 2.200 H A 0026 LEU O
H A 0028 GLU N 2.899 H A 0024 ARG O
H A 0028 GLU N 2.198 H A 0027 VAL O
H A 0029 LYS N 2.823 H A 0025 GLU O
H A 0029 LYS N 2.197 H A 0028 GLU O
H A 0030 ASN N 2.900 H A 0026 LEU O
H A 0030 ASN N 2.197 H A 0029 LYS O
H A 0031 SER N 2.927 H A 0027 VAL O
H A 0031 SER N 2.196 H A 0030 ASN O
H A 0032 GLN N 2.960 H A 0028 GLU O
H A 0032 GLN N 2.196 H A 0031 SER O
H A 0033 LEU N 2.840 H A 0029 LYS O
H A 0033 LEU N 2.198 H A 0032 GLN O
H A 0034 GLU N 2.701 H A 0030 ASN O
H A 0034 GLU N 2.195 H A 0033 LEU O
H A 0035 ARG N 2.957 H A 0031 SER O
H A 0035 ARG N 2.199 H A 0034 GLU O
H A 0036 GLU N 2.921 H A 0032 GLN O
H A 0036 GLU N 2.197 H A 0035 ARG O
H A 0037 ASN N 2.863 H A 0033 LEU O
H A 0037 ASN N 2.198 H A 0036 GLU O
H A 0038 THR N 2.924 H A 0034 GLU O
H A 0038 THR N 2.194 H A 0037 ASN O
H A 0039 LEU N 2.834 H A 0035 ARG O
H A 0039 LEU N 2.199 H A 0038 THR O
H A 0040 LEU N 2.987 H A 0036 GLU O
H A 0040 LEU N 2.195 H A 0039 LEU O
H A 0041 LYS N 2.776 H A 0037 ASN O
H A 0041 LYS N 2.198 H A 0040 LEU O
H A 0042 THR N 3.010 H A 0038 THR O
H A 0042 THR N 2.199 H A 0041 LYS O
H A 0043 LEU N 2.940 H A 0039 LEU O
H A 0043 LEU N 2.191 H A 0042 THR O
C A 0044 ALA N 2.957 H A 0040 LEU O
C A 0044 ALA N 2.195 H A 0043 LEU O
C A 0045 SER N 2.963 H A 0041 LYS O
C A 0045 SER N 2.194 C A 0044 ALA O
C A 0046 PRO N 2.226 C A 0045 SER O
C A 0047 GLU N 2.191 C A 0046 PRO O
C A 0048 GLN N 2.197 C A 0047 GLU O
C A 0049 LEU N 2.198 C A 0048 GLN O
C A 0050 GLU N 2.189 C A 0049 LEU O
C A 0051 LYS N 2.212 C A 0050 GLU O
C A 0052 PHE N 2.190 C A 0051 LYS O
C A 0052 PHE N 3.001 C A 0057 SER O
C A 0053 GLN N 2.204 C A 0052 PHE O
C A 0053 GLN N 3.118 C A 0057 SER O
C A 0054 SER N 2.192 C A 0053 GLN O
C A 0055 ARG N 2.198 C A 0054 SER O
C A 0056 LEU N 2.196 C A 0055 ARG O
C A 0057 SER N 2.197 C A 0056 LEU O
C A 0058 PRO N 3.098 C A 0053 GLN O
C A 0058 PRO N 2.222 C A 0057 SER O
C A 0059 GLU N 3.176 C A 0052 PHE O
C A 0059 GLU N 2.194 C A 0058 PRO O
C A 0060 GLU N 2.195 C A 0059 GLU O
C A 0061 PRO N 2.229 C A 0060 GLU O
C A 0062 ALA N 2.197 C A 0061 PRO O
C A 0063 PRO N 2.226 C A 0062 ALA O
C A 0064 GLU N 2.196 C A 0063 PRO O
C A 0065 THR N 2.698 C A 0063 PRO O
C A 0065 THR N 2.196 C A 0064 GLU O
C A 0066 PRO N 2.227 C A 0065 THR O
C A 0067 GLU N 2.195 C A 0066 PRO O
C A 0068 ALA N 2.196 C A 0067 GLU O
C A 0069 PRO N 2.227 C A 0068 ALA O
C A 0070 GLU N 2.196 C A 0069 PRO O
C A 0071 ALA N 2.197 C A 0070 GLU O
C A 0072 PRO N 2.227 C A 0071 ALA O
C A 0073 GLY N 2.196 C A 0072 PRO O
C A 0074 GLY N 2.197 C A 0073 GLY O
C A 0075 SER N 2.197 C A 0074 GLY O
C A 0076 ALA N 2.196 C A 0075 SER O
C A 0077 VAL N 2.195 C A 0076 ALA O
HB_MS 2.00 3.20 5
C A 0004 VAL O 3.114 H A 0007 HIS NE2
H A 0034 GLU O 2.594 H A 0038 THR OG1
H A 0038 THR O 2.373 H A 0042 THR OG1
H A 0039 LEU O 3.092 H A 0042 THR OG1
C A 0066 PRO N 2.929 C A 0065 THR OG1
AROMATIC 0.00 8.00 6
H A 0007 HIS 3.326 H A 0010 TYR
C A 0013 ARG 5.829 H A 0010 TYR
H A 0020 LYS 7.990 H A 0010 TYR
C A 0051 LYS 6.233 C A 0052 PHE
C A 0055 ARG 7.773 C A 0052 PHE
C A 0013 ARG 5.176 H A 0007 HIS
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 26
H A 0019 LEU CB 3.715 H B 0019 LEU CD1
H A 0019 LEU CD2 3.525 H B 0019 LEU CB
H A 0019 LEU CD2 3.514 H B 0019 LEU CG
H A 0019 LEU CD2 3.080 H B 0019 LEU CD1
H A 0019 LEU CD2 3.396 H B 0019 LEU CD2
H A 0022 GLN CD 3.793 H B 0023 ILE CD1
H A 0023 ILE CD1 3.780 H B 0023 ILE CB
H A 0023 ILE CG2 3.739 H B 0026 LEU CD2
H A 0026 LEU CB 3.621 H B 0026 LEU CB
H A 0026 LEU CB 3.538 H B 0026 LEU CD2
H A 0026 LEU CG 3.793 H B 0026 LEU CB
H A 0026 LEU CD1 3.500 H B 0026 LEU C
H A 0026 LEU CD1 3.796 H B 0026 LEU CB
H A 0027 VAL CG2 3.398 H B 0026 LEU CD2
H A 0033 LEU C 3.509 H B 0033 LEU CD1
H A 0033 LEU CD2 3.728 H B 0034 GLU CD
H A 0037 ASN CB 2.995 H B 0033 LEU CD1
H A 0037 ASN CG 3.486 H B 0033 LEU CD1
H A 0037 ASN CG 3.794 H B 0036 GLU CG
H A 0040 LEU CD1 3.649 H B 0041 LYS CG
H A 0041 LYS CA 3.343 H B 0040 LEU CD2
H A 0041 LYS CB 3.392 H B 0040 LEU CD2
H A 0041 LYS CG 3.072 H B 0040 LEU CD2
C A 0044 ALA CB 3.287 H B 0044 ALA CB
C A 0049 LEU CD2 3.516 H B 0043 LEU C
C A 0049 LEU CD2 3.379 H B 0043 LEU CD2
CHARGE_ATTR 2.00 12.00 25
C A 0002 ASP OD1 11.66 H B 0005 LYS NZ
C A 0005 LYS NZ 11.05 C B 0002 ASP OD1
H A 0007 HIS NE2 11.75 C B 0002 ASP OD1
C A 0014 GLU OE1 4.770 H B 0005 LYS NZ
C A 0014 GLU OE2 5.445 H B 0005 LYS NZ
C A 0015 GLU OE1 10.45 H B 0005 LYS NZ
C A 0015 GLU OE2 9.183 H B 0005 LYS NZ
C A 0015 GLU OE1 11.41 C B 0013 ARG NH1
C A 0015 GLU OE2 10.14 C B 0013 ARG NH1
C A 0015 GLU OE2 11.92 C B 0013 ARG NH2
H A 0029 LYS NZ 9.177 H B 0034 GLU OE1
H A 0029 LYS NZ 8.058 H B 0034 GLU OE2
H A 0029 LYS NZ 11.59 C B 0059 GLU OE1
H A 0029 LYS NZ 10.70 C B 0059 GLU OE2
H A 0034 GLU OE1 11.21 H B 0029 LYS NZ
H A 0034 GLU OE2 10.73 H B 0029 LYS NZ
H A 0036 GLU OE1 6.454 H B 0041 LYS NZ
H A 0036 GLU OE2 4.659 H B 0041 LYS NZ
H A 0041 LYS NZ 5.902 H B 0036 GLU OE1
H A 0041 LYS NZ 4.151 H B 0036 GLU OE2
C A 0064 GLU OE1 11.97 H B 0035 ARG NH1
C A 0064 GLU OE1 5.200 C B 0055 ARG NH1
C A 0064 GLU OE1 4.393 C B 0055 ARG NH2
C A 0064 GLU OE2 7.149 C B 0055 ARG NH1
C A 0064 GLU OE2 6.157 C B 0055 ARG NH2
CHARGE_REPU 2.00 12.00 40
C A 0002 ASP OD1 10.16 C B 0002 ASP OD1
C A 0002 ASP OD1 10.76 C B 0002 ASP OD2
C A 0002 ASP OD2 11.68 C B 0002 ASP OD1
C A 0005 LYS NZ 8.477 H B 0005 LYS NZ
C A 0014 GLU OE1 9.336 C B 0002 ASP OD1
C A 0014 GLU OE1 11.49 C B 0002 ASP OD2
C A 0014 GLU OE2 11.45 C B 0002 ASP OD1
C A 0014 GLU OE1 6.065 C B 0014 GLU OE1
C A 0014 GLU OE1 4.699 C B 0014 GLU OE2
C A 0014 GLU OE2 6.787 C B 0014 GLU OE1
C A 0014 GLU OE2 5.398 C B 0014 GLU OE2
C A 0015 GLU OE1 6.982 C B 0014 GLU OE1
C A 0015 GLU OE1 5.478 C B 0014 GLU OE2
C A 0015 GLU OE2 4.921 C B 0014 GLU OE1
C A 0015 GLU OE2 3.424 C B 0014 GLU OE2
C A 0015 GLU OE1 9.661 C B 0015 GLU OE1
C A 0015 GLU OE1 10.58 C B 0015 GLU OE2
C A 0015 GLU OE2 9.822 C B 0015 GLU OE1
C A 0015 GLU OE2 10.39 C B 0015 GLU OE2
C A 0015 GLU OE1 10.53 H B 0017 GLU OE1
C A 0015 GLU OE2 10.54 H B 0017 GLU OE1
C A 0015 GLU OE2 11.87 H B 0017 GLU OE2
H A 0034 GLU OE1 10.03 H B 0036 GLU OE2
H A 0034 GLU OE2 10.39 H B 0036 GLU OE1
H A 0034 GLU OE2 8.297 H B 0036 GLU OE2
H A 0035 ARG NH1 11.70 H B 0041 LYS NZ
H A 0036 GLU OE1 9.614 H B 0034 GLU OE1
H A 0036 GLU OE1 7.529 H B 0034 GLU OE2
H A 0036 GLU OE2 10.90 H B 0034 GLU OE1
H A 0036 GLU OE2 8.756 H B 0034 GLU OE2
H A 0036 GLU OE1 10.84 C B 0059 GLU OE1
H A 0036 GLU OE1 10.50 C B 0059 GLU OE2
H A 0036 GLU OE2 10.39 C B 0059 GLU OE1
H A 0036 GLU OE2 10.43 C B 0059 GLU OE2
C A 0050 GLU OE1 11.94 C B 0047 GLU OE2
C A 0050 GLU OE2 10.47 C B 0047 GLU OE1
C A 0050 GLU OE2 10.05 C B 0047 GLU OE2
C A 0050 GLU OE1 10.81 C B 0050 GLU OE2
C A 0050 GLU OE2 10.31 C B 0050 GLU OE1
C A 0050 GLU OE2 8.980 C B 0050 GLU OE2
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 356
C B 0001 MET C 2.421 C B 0002 ASP CA
C B 0001 MET C 2.928 C B 0002 ASP C
C B 0001 MET C 2.989 C B 0002 ASP CB
C B 0001 MET C 3.372 C B 0002 ASP CG
C B 0002 ASP C 2.425 C B 0003 LEU CA
C B 0002 ASP C 3.473 C B 0003 LEU C
C B 0002 ASP C 3.466 C B 0003 LEU CB
C B 0003 LEU C 2.420 H B 0004 VAL CA
C B 0003 LEU C 3.024 H B 0004 VAL C
C B 0003 LEU C 3.687 H B 0004 VAL CB
C B 0003 LEU CD2 3.792 H B 0007 HIS CE1
H B 0004 VAL C 2.424 H B 0005 LYS CA
H B 0004 VAL C 3.200 H B 0005 LYS C
H B 0004 VAL C 3.648 H B 0005 LYS CB
H B 0004 VAL C 3.754 H B 0007 HIS CD2
H B 0005 LYS C 2.428 H B 0006 ASN CA
H B 0005 LYS C 3.401 H B 0006 ASN C
H B 0005 LYS C 3.527 H B 0006 ASN CB
H B 0005 LYS CA 3.554 H B 0008 LEU CG
H B 0005 LYS CA 3.469 H B 0008 LEU CD2
H B 0005 LYS C 3.191 H B 0008 LEU CG
H B 0005 LYS C 3.310 H B 0008 LEU CD2
H B 0005 LYS CG 3.409 H B 0008 LEU CD2
H B 0006 ASN CA 3.799 H B 0007 HIS CA
H B 0006 ASN C 2.410 H B 0007 HIS CA
H B 0006 ASN C 3.138 H B 0007 HIS C
H B 0006 ASN C 3.664 H B 0007 HIS CB
H B 0006 ASN C 3.750 H B 0008 LEU CG
H B 0006 ASN C 3.267 H B 0008 LEU CD1
H B 0007 HIS C 2.474 H B 0008 LEU CA
H B 0007 HIS C 2.876 H B 0008 LEU C
H B 0007 HIS C 3.674 H B 0008 LEU CB
H B 0007 HIS C 3.720 H B 0008 LEU CG
H B 0007 HIS C 3.254 H B 0008 LEU CD1
H B 0007 HIS C 3.496 H B 0010 TYR CG
H B 0007 HIS C 2.867 H B 0010 TYR CD1
H B 0007 HIS C 3.183 H B 0010 TYR CE1
H B 0007 HIS CB 3.336 H B 0010 TYR CG
H B 0007 HIS CB 3.549 H B 0010 TYR CD1
H B 0007 HIS CB 3.263 H B 0010 TYR CD2
H B 0007 HIS CB 3.693 H B 0010 TYR CE1
H B 0007 HIS CB 3.415 H B 0010 TYR CE2
H B 0007 HIS CB 3.630 H B 0010 TYR CZ
H B 0007 HIS CG 3.449 H B 0010 TYR CD2
H B 0007 HIS CG 3.377 H B 0010 TYR CE1
H B 0007 HIS CG 2.964 H B 0010 TYR CE2
H B 0007 HIS CG 2.927 H B 0010 TYR CZ
H B 0007 HIS CD2 3.115 H B 0010 TYR CE1
H B 0007 HIS CD2 3.404 H B 0010 TYR CE2
H B 0007 HIS CD2 2.782 H B 0010 TYR CZ
H B 0007 HIS CE1 3.406 H B 0010 TYR CE2
H B 0007 HIS CE1 3.337 H B 0010 TYR CZ
H B 0008 LEU C 2.368 H B 0009 MET CA
H B 0008 LEU C 2.882 H B 0009 MET C
H B 0008 LEU C 3.672 H B 0009 MET CB
H B 0008 LEU CA 3.482 H B 0010 TYR CD1
H B 0008 LEU CA 3.335 H B 0010 TYR CE1
H B 0008 LEU C 3.439 H B 0010 TYR CD1
H B 0008 LEU CA 3.562 C B 0012 VAL CA
H B 0008 LEU C 3.394 C B 0012 VAL CA
H B 0008 LEU CB 3.794 C B 0012 VAL CA
H B 0009 MET C 2.459 H B 0010 TYR CA
H B 0009 MET C 2.957 H B 0010 TYR C
H B 0009 MET C 3.683 H B 0010 TYR CB
H B 0009 MET C 3.742 H B 0010 TYR CD1
H B 0010 TYR C 2.414 C B 0011 ALA CA
H B 0010 TYR C 3.661 C B 0011 ALA C
H B 0010 TYR C 3.043 C B 0011 ALA CB
H B 0010 TYR CD1 3.529 C B 0011 ALA CA
H B 0010 TYR CD1 3.311 C B 0011 ALA CB
H B 0010 TYR CE1 3.308 C B 0011 ALA CB
C B 0011 ALA CA 3.799 C B 0012 VAL CA
C B 0011 ALA C 2.445 C B 0012 VAL CA
C B 0011 ALA C 3.236 C B 0012 VAL C
C B 0011 ALA C 2.849 C B 0012 VAL CB
C B 0011 ALA C 3.267 C B 0012 VAL CG1
C B 0012 VAL C 2.429 C B 0013 ARG CA
C B 0012 VAL C 2.855 C B 0013 ARG C
C B 0012 VAL C 3.673 C B 0013 ARG CB
C B 0013 ARG C 2.469 C B 0014 GLU CA
C B 0013 ARG C 3.384 C B 0014 GLU C
C B 0013 ARG C 2.805 C B 0014 GLU CB
C B 0014 GLU C 2.419 C B 0015 GLU CA
C B 0014 GLU C 2.951 C B 0015 GLU C
C B 0014 GLU C 3.695 C B 0015 GLU CB
C B 0014 GLU CA 3.598 H B 0018 ILE CG1
C B 0014 GLU CA 3.655 H B 0018 ILE CG2
C B 0014 GLU CA 3.450 H B 0018 ILE CD1
C B 0014 GLU C 3.484 H B 0018 ILE CG1
C B 0014 GLU C 3.733 H B 0018 ILE CD1
C B 0014 GLU CD 3.615 H B 0018 ILE CD1
C B 0015 GLU C 2.420 H B 0016 VAL CA
C B 0015 GLU C 3.056 H B 0016 VAL C
C B 0015 GLU C 3.688 H B 0016 VAL CB
H B 0016 VAL C 2.423 H B 0017 GLU CA
H B 0016 VAL C 3.096 H B 0017 GLU C
H B 0016 VAL C 3.680 H B 0017 GLU CB
H B 0017 GLU C 2.419 H B 0018 ILE CA
H B 0017 GLU C 3.064 H B 0018 ILE C
H B 0017 GLU C 3.683 H B 0018 ILE CB
H B 0018 ILE C 2.422 H B 0019 LEU CA
H B 0018 ILE C 3.208 H B 0019 LEU C
H B 0018 ILE C 3.641 H B 0019 LEU CB
H B 0019 LEU C 2.425 H B 0020 LYS CA
H B 0019 LEU C 3.086 H B 0020 LYS C
H B 0019 LEU C 3.684 H B 0020 LYS CB
H B 0020 LYS C 2.420 H B 0021 GLU CA
H B 0020 LYS C 3.106 H B 0021 GLU C
H B 0020 LYS C 3.671 H B 0021 GLU CB
H B 0020 LYS CA 3.363 H B 0023 ILE CG2
H B 0020 LYS C 3.463 H B 0023 ILE CG2
H B 0021 GLU C 2.420 H B 0022 GLN CA
H B 0021 GLU C 3.072 H B 0022 GLN C
H B 0021 GLU C 3.679 H B 0022 GLN CB
H B 0022 GLN C 2.424 H B 0023 ILE CA
H B 0022 GLN C 3.097 H B 0023 ILE C
H B 0022 GLN C 3.680 H B 0023 ILE CB
H B 0023 ILE C 2.424 H B 0024 ARG CA
H B 0023 ILE C 3.104 H B 0024 ARG C
H B 0023 ILE C 3.678 H B 0024 ARG CB
H B 0023 ILE CG1 3.798 H B 0027 VAL CG2
H B 0024 ARG C 2.420 H B 0025 GLU CA
H B 0024 ARG C 3.090 H B 0025 GLU C
H B 0024 ARG C 3.674 H B 0025 GLU CB
H B 0025 GLU C 2.423 H B 0026 LEU CA
H B 0025 GLU C 3.095 H B 0026 LEU C
H B 0025 GLU C 3.673 H B 0026 LEU CB
H B 0026 LEU C 2.421 H B 0027 VAL CA
H B 0026 LEU C 3.150 H B 0027 VAL C
H B 0026 LEU C 3.658 H B 0027 VAL CB
H B 0027 VAL C 2.420 H B 0028 GLU CA
H B 0027 VAL C 3.086 H B 0028 GLU C
H B 0027 VAL C 3.678 H B 0028 GLU CB
H B 0028 GLU C 2.419 H B 0029 LYS CA
H B 0028 GLU C 3.055 H B 0029 LYS C
H B 0028 GLU C 3.680 H B 0029 LYS CB
H B 0029 LYS C 2.420 H B 0030 ASN CA
H B 0029 LYS C 2.991 H B 0030 ASN C
H B 0029 LYS C 3.694 H B 0030 ASN CB
H B 0030 ASN C 2.428 H B 0031 SER CA
H B 0030 ASN C 3.016 H B 0031 SER C
H B 0030 ASN C 3.699 H B 0031 SER CB
H B 0031 SER C 2.415 H B 0032 GLN CA
H B 0031 SER C 2.995 H B 0032 GLN C
H B 0031 SER C 3.691 H B 0032 GLN CB
H B 0032 GLN C 2.423 H B 0033 LEU CA
H B 0032 GLN C 3.111 H B 0033 LEU C
H B 0032 GLN C 3.670 H B 0033 LEU CB
H B 0033 LEU C 2.423 H B 0034 GLU CA
H B 0033 LEU C 3.160 H B 0034 GLU C
H B 0033 LEU C 3.660 H B 0034 GLU CB
H B 0034 GLU C 2.420 H B 0035 ARG CA
H B 0034 GLU C 3.102 H B 0035 ARG C
H B 0034 GLU C 3.671 H B 0035 ARG CB
H B 0035 ARG C 2.421 H B 0036 GLU CA
H B 0035 ARG C 3.140 H B 0036 GLU C
H B 0035 ARG C 3.666 H B 0036 GLU CB
H B 0036 GLU C 2.424 H B 0037 ASN CA
H B 0036 GLU C 3.086 H B 0037 ASN C
H B 0036 GLU C 3.683 H B 0037 ASN CB
H B 0037 ASN C 2.420 H B 0038 THR CA
H B 0037 ASN C 3.058 H B 0038 THR C
H B 0037 ASN C 3.681 H B 0038 THR CB
H B 0038 THR C 2.420 H B 0039 LEU CA
H B 0038 THR C 3.041 H B 0039 LEU C
H B 0038 THR C 3.685 H B 0039 LEU CB
H B 0038 THR CG2 3.751 C B 0058 PRO CD
H B 0039 LEU C 2.425 H B 0040 LEU CA
H B 0039 LEU C 3.116 H B 0040 LEU C
H B 0039 LEU C 3.673 H B 0040 LEU CB
H B 0039 LEU CD2 3.272 H B 0043 LEU CD1
H B 0040 LEU C 2.421 H B 0041 LYS CA
H B 0040 LEU C 3.088 H B 0041 LYS C
H B 0040 LEU C 3.678 H B 0041 LYS CB
H B 0041 LYS C 2.418 H B 0042 THR CA
H B 0041 LYS C 3.135 H B 0042 THR C
H B 0041 LYS C 3.664 H B 0042 THR CB
H B 0042 THR C 2.425 H B 0043 LEU CA
H B 0042 THR C 3.047 H B 0043 LEU C
H B 0042 THR C 3.696 H B 0043 LEU CB
H B 0042 THR C 3.788 C B 0045 SER C
H B 0043 LEU C 2.422 H B 0044 ALA CA
H B 0043 LEU C 3.074 H B 0044 ALA C
H B 0043 LEU C 3.683 H B 0044 ALA CB
H B 0044 ALA C 2.423 C B 0045 SER CA
H B 0044 ALA C 3.499 C B 0045 SER C
H B 0044 ALA C 3.433 C B 0045 SER CB
H B 0044 ALA C 3.451 C B 0046 PRO CD
C B 0045 SER CA 2.782 C B 0046 PRO CD
C B 0045 SER C 2.439 C B 0046 PRO CA
C B 0045 SER C 3.128 C B 0046 PRO C
C B 0045 SER C 3.610 C B 0046 PRO CB
C B 0045 SER C 3.647 C B 0046 PRO CG
C B 0045 SER C 2.452 C B 0046 PRO CD
C B 0046 PRO C 2.423 C B 0047 GLU CA
C B 0046 PRO C 3.150 C B 0047 GLU C
C B 0046 PRO C 3.664 C B 0047 GLU CB
C B 0047 GLU C 2.420 C B 0048 GLN CA
C B 0047 GLU C 3.620 C B 0048 GLN C
C B 0047 GLU C 3.028 C B 0048 GLN CB
C B 0048 GLN CA 3.762 C B 0049 LEU CA
C B 0048 GLN C 2.393 C B 0049 LEU CA
C B 0048 GLN C 3.660 C B 0049 LEU C
C B 0048 GLN C 2.804 C B 0049 LEU CB
C B 0049 LEU C 2.447 C B 0050 GLU CA
C B 0049 LEU C 2.775 C B 0050 GLU C
C B 0049 LEU C 3.694 C B 0050 GLU CB
C B 0049 LEU CD2 3.784 C B 0050 GLU CA
C B 0049 LEU C 3.787 C B 0051 LYS CA
C B 0049 LEU CG 2.978 C B 0052 PHE CE1
C B 0049 LEU CG 3.011 C B 0052 PHE CZ
C B 0049 LEU CD1 3.037 C B 0052 PHE CE1
C B 0049 LEU CD1 2.933 C B 0052 PHE CZ
C B 0049 LEU CD2 3.483 C B 0052 PHE CE1
C B 0049 LEU CD2 3.313 C B 0054 SER CA
C B 0049 LEU CD1 3.712 C B 0057 SER C
C B 0049 LEU CB 3.629 C B 0058 PRO CA
C B 0049 LEU CB 3.617 C B 0058 PRO CB
C B 0050 GLU C 2.454 C B 0051 LYS CA
C B 0050 GLU C 2.803 C B 0051 LYS C
C B 0050 GLU C 3.571 C B 0051 LYS CB
C B 0051 LYS C 2.432 C B 0052 PHE CA
C B 0051 LYS C 3.494 C B 0052 PHE C
C B 0051 LYS C 3.453 C B 0052 PHE CB
C B 0051 LYS CE 3.308 C B 0052 PHE CD2
C B 0051 LYS CE 3.532 C B 0052 PHE CE2
C B 0051 LYS CE 3.646 C B 0060 GLU CB
C B 0051 LYS CE 3.572 C B 0060 GLU CG
C B 0051 LYS CE 3.677 C B 0060 GLU CD
C B 0052 PHE CA 3.798 C B 0053 GLN CA
C B 0052 PHE C 2.441 C B 0053 GLN CA
C B 0052 PHE C 2.801 C B 0053 GLN C
C B 0052 PHE C 3.610 C B 0053 GLN CB
C B 0052 PHE CD1 3.686 C B 0053 GLN CA
C B 0052 PHE CD1 3.766 C B 0053 GLN C
C B 0052 PHE CD1 3.548 C B 0056 LEU CG
C B 0052 PHE CD1 3.615 C B 0056 LEU CD1
C B 0052 PHE CD1 3.461 C B 0056 LEU CD2
C B 0052 PHE CE1 3.040 C B 0056 LEU CG
C B 0052 PHE CE1 3.580 C B 0056 LEU CD1
C B 0052 PHE CE1 3.203 C B 0056 LEU CD2
C B 0052 PHE CZ 3.364 C B 0056 LEU CG
C B 0052 PHE CZ 3.779 C B 0056 LEU CD1
C B 0052 PHE CE2 3.715 C B 0057 SER C
C B 0052 PHE CZ 3.358 C B 0057 SER C
C B 0052 PHE CD2 3.188 C B 0060 GLU CD
C B 0052 PHE CE2 3.774 C B 0060 GLU CG
C B 0052 PHE CE2 3.050 C B 0060 GLU CD
C B 0053 GLN C 2.454 C B 0054 SER CA
C B 0053 GLN C 3.603 C B 0054 SER C
C B 0053 GLN C 2.808 C B 0054 SER CB
C B 0053 GLN CB 3.307 C B 0056 LEU CD2
C B 0053 GLN CD 3.516 C B 0056 LEU CD1
C B 0053 GLN CD 3.799 C B 0056 LEU CD2
C B 0054 SER C 2.416 C B 0055 ARG CA
C B 0054 SER C 3.720 C B 0055 ARG C
C B 0054 SER C 2.836 C B 0055 ARG CB
C B 0054 SER C 2.990 C B 0055 ARG CG
C B 0055 ARG CA 3.712 C B 0056 LEU CD2
C B 0055 ARG C 2.399 C B 0056 LEU CA
C B 0055 ARG C 3.563 C B 0056 LEU C
C B 0055 ARG C 3.363 C B 0056 LEU CB
C B 0055 ARG C 3.663 C B 0056 LEU CG
C B 0055 ARG C 3.170 C B 0056 LEU CD2
C B 0055 ARG CG 3.488 C B 0056 LEU CD2
C B 0055 ARG CD 3.257 C B 0056 LEU CD2
C B 0056 LEU C 2.407 C B 0057 SER CA
C B 0056 LEU C 3.654 C B 0057 SER C
C B 0056 LEU C 3.156 C B 0057 SER CB
C B 0057 SER CA 2.814 C B 0058 PRO CD
C B 0057 SER C 2.430 C B 0058 PRO CA
C B 0057 SER C 3.149 C B 0058 PRO C
C B 0057 SER C 3.593 C B 0058 PRO CB
C B 0057 SER C 3.647 C B 0058 PRO CG
C B 0057 SER C 2.458 C B 0058 PRO CD
C B 0058 PRO C 2.439 C B 0059 GLU CA
C B 0058 PRO C 3.684 C B 0059 GLU C
C B 0058 PRO C 2.848 C B 0059 GLU CB
C B 0059 GLU C 2.442 C B 0060 GLU CA
C B 0059 GLU C 2.853 C B 0060 GLU C
C B 0059 GLU C 3.156 C B 0060 GLU CB
C B 0059 GLU C 3.194 C B 0060 GLU CG
C B 0060 GLU CA 2.798 C B 0061 PRO CD
C B 0060 GLU C 2.445 C B 0061 PRO CA
C B 0060 GLU C 3.140 C B 0061 PRO C
C B 0060 GLU C 3.616 C B 0061 PRO CB
C B 0060 GLU C 3.651 C B 0061 PRO CG
C B 0060 GLU C 2.456 C B 0061 PRO CD
C B 0061 PRO C 2.420 C B 0062 ALA CA
C B 0061 PRO C 3.667 C B 0062 ALA C
C B 0061 PRO C 3.161 C B 0062 ALA CB
C B 0062 ALA CA 2.811 C B 0063 PRO CD
C B 0062 ALA C 2.444 C B 0063 PRO CA
C B 0062 ALA C 3.159 C B 0063 PRO C
C B 0062 ALA C 3.612 C B 0063 PRO CB
C B 0062 ALA C 3.654 C B 0063 PRO CG
C B 0062 ALA C 2.460 C B 0063 PRO CD
C B 0063 PRO C 2.425 C B 0064 GLU CA
C B 0063 PRO C 3.035 C B 0064 GLU C
C B 0063 PRO C 3.693 C B 0064 GLU CB
C B 0063 PRO C 3.622 C B 0065 THR CG2
C B 0064 GLU C 2.420 C B 0065 THR CA
C B 0064 GLU C 3.332 C B 0065 THR C
C B 0064 GLU C 3.575 C B 0065 THR CB
C B 0064 GLU C 3.581 C B 0065 THR CG2
C B 0065 THR CA 2.783 C B 0066 PRO CD
C B 0065 THR C 2.442 C B 0066 PRO CA
C B 0065 THR C 3.160 C B 0066 PRO C
C B 0065 THR C 3.608 C B 0066 PRO CB
C B 0065 THR C 3.647 C B 0066 PRO CG
C B 0065 THR C 2.451 C B 0066 PRO CD
C B 0065 THR CB 3.249 C B 0066 PRO CD
C B 0066 PRO C 2.420 C B 0067 GLU CA
C B 0066 PRO C 3.457 C B 0067 GLU C
C B 0066 PRO C 3.473 C B 0067 GLU CB
C B 0066 PRO C 3.387 C B 0067 GLU CG
C B 0067 GLU C 2.419 C B 0068 ALA CA
C B 0067 GLU C 3.124 C B 0068 ALA C
C B 0067 GLU C 3.669 C B 0068 ALA CB
C B 0068 ALA CA 2.790 C B 0069 PRO CD
C B 0068 ALA C 2.443 C B 0069 PRO CA
C B 0068 ALA C 3.165 C B 0069 PRO C
C B 0068 ALA C 3.606 C B 0069 PRO CB
C B 0068 ALA C 3.650 C B 0069 PRO CG
C B 0068 ALA C 2.455 C B 0069 PRO CD
C B 0068 ALA CB 3.511 C B 0069 PRO CD
C B 0069 PRO C 2.421 C B 0070 GLU CA
C B 0069 PRO C 3.685 C B 0070 GLU C
C B 0069 PRO C 3.069 C B 0070 GLU CB
C B 0069 PRO C 3.381 C B 0070 GLU CG
C B 0070 GLU C 2.422 C B 0071 ALA CA
C B 0070 GLU C 3.688 C B 0071 ALA C
C B 0070 GLU C 2.842 C B 0071 ALA CB
C B 0070 GLU C 3.534 C B 0072 PRO CD
C B 0070 GLU CB 3.785 C B 0072 PRO CD
C B 0071 ALA CA 2.800 C B 0072 PRO CD
C B 0071 ALA C 2.441 C B 0072 PRO CA
C B 0071 ALA C 3.161 C B 0072 PRO C
C B 0071 ALA C 3.606 C B 0072 PRO CB
C B 0071 ALA C 3.650 C B 0072 PRO CG
C B 0071 ALA C 2.456 C B 0072 PRO CD
C B 0071 ALA CB 2.978 C B 0072 PRO CD
C B 0072 PRO C 2.422 C B 0073 GLY CA
C B 0072 PRO C 3.355 C B 0073 GLY C
C B 0073 GLY C 2.423 C B 0074 GLY CA
C B 0073 GLY C 3.204 C B 0074 GLY C
C B 0074 GLY C 2.425 C B 0075 SER CA
C B 0074 GLY C 3.362 C B 0075 SER C
C B 0074 GLY C 3.562 C B 0075 SER CB
C B 0075 SER C 2.423 C B 0076 ALA CA
C B 0075 SER C 3.700 C B 0076 ALA C
C B 0075 SER C 2.962 C B 0076 ALA CB
C B 0076 ALA C 2.429 C B 0077 VAL CA
C B 0076 ALA C 3.030 C B 0077 VAL C
C B 0076 ALA C 2.936 C B 0077 VAL CB
C B 0076 ALA C 3.537 C B 0077 VAL CG1
CHARGE_ATTR 2.00 12.00 71
C B 0002 ASP OD1 10.00 H B 0005 LYS NZ
C B 0002 ASP OD2 11.92 H B 0005 LYS NZ
C B 0002 ASP OD1 11.28 H B 0007 HIS NE2
C B 0014 GLU OE1 6.692 H B 0005 LYS NZ
C B 0014 GLU OE2 6.873 H B 0005 LYS NZ
C B 0014 GLU OE1 9.729 H B 0007 HIS ND1
C B 0014 GLU OE1 7.538 H B 0007 HIS NE2
C B 0014 GLU OE2 11.84 H B 0007 HIS ND1
C B 0014 GLU OE2 9.650 H B 0007 HIS NE2
C B 0014 GLU OE1 8.502 C B 0013 ARG NH1
C B 0014 GLU OE1 9.640 C B 0013 ARG NH2
C B 0014 GLU OE2 9.922 C B 0013 ARG NH1
C B 0014 GLU OE2 11.24 C B 0013 ARG NH2
C B 0015 GLU OE2 11.93 H B 0007 HIS NE2
C B 0015 GLU OE1 9.149 C B 0013 ARG NH1
C B 0015 GLU OE1 11.17 C B 0013 ARG NH2
C B 0015 GLU OE2 8.979 C B 0013 ARG NH1
C B 0015 GLU OE2 10.77 C B 0013 ARG NH2
C B 0015 GLU OE1 11.47 H B 0020 LYS NZ
H B 0017 GLU OE1 7.221 C B 0013 ARG NH1
H B 0017 GLU OE1 9.220 C B 0013 ARG NH2
H B 0017 GLU OE2 6.492 C B 0013 ARG NH1
H B 0017 GLU OE2 8.213 C B 0013 ARG NH2
H B 0017 GLU OE1 8.956 H B 0020 LYS NZ
H B 0017 GLU OE2 8.899 H B 0020 LYS NZ
H B 0017 GLU OE1 11.77 H B 0024 ARG NH2
H B 0017 GLU OE2 11.83 H B 0024 ARG NH1
H B 0017 GLU OE2 10.84 H B 0024 ARG NH2
H B 0021 GLU OE1 7.510 C B 0013 ARG NH1
H B 0021 GLU OE1 8.634 C B 0013 ARG NH2
H B 0021 GLU OE2 6.289 C B 0013 ARG NH1
H B 0021 GLU OE2 6.994 C B 0013 ARG NH2
H B 0021 GLU OE1 6.842 H B 0020 LYS NZ
H B 0021 GLU OE2 8.822 H B 0020 LYS NZ
H B 0021 GLU OE1 6.458 H B 0024 ARG NH1
H B 0021 GLU OE1 6.396 H B 0024 ARG NH2
H B 0021 GLU OE2 7.734 H B 0024 ARG NH1
H B 0021 GLU OE2 8.022 H B 0024 ARG NH2
H B 0021 GLU OE1 11.29 H B 0029 LYS NZ
H B 0021 GLU OE2 10.96 H B 0029 LYS NZ
H B 0025 GLU OE1 11.74 C B 0013 ARG NH1
H B 0025 GLU OE1 11.54 C B 0013 ARG NH2
H B 0025 GLU OE2 10.39 C B 0013 ARG NH1
H B 0025 GLU OE2 10.06 C B 0013 ARG NH2
H B 0025 GLU OE1 11.78 H B 0024 ARG NH1
H B 0025 GLU OE2 10.70 H B 0024 ARG NH1
H B 0025 GLU OE1 3.229 H B 0029 LYS NZ
H B 0025 GLU OE2 3.869 H B 0029 LYS NZ
H B 0028 GLU OE1 6.919 H B 0024 ARG NH1
H B 0028 GLU OE1 8.890 H B 0024 ARG NH2
H B 0028 GLU OE2 7.402 H B 0024 ARG NH1
H B 0028 GLU OE2 9.573 H B 0024 ARG NH2
H B 0028 GLU OE1 5.858 H B 0029 LYS NZ
H B 0028 GLU OE2 7.022 H B 0029 LYS NZ
H B 0028 GLU OE2 11.29 H B 0035 ARG NH2
H B 0034 GLU OE1 11.94 H B 0041 LYS NZ
H B 0034 GLU OE2 9.944 H B 0041 LYS NZ
H B 0036 GLU OE1 8.401 H B 0035 ARG NH1
H B 0036 GLU OE1 9.016 H B 0035 ARG NH2
H B 0036 GLU OE2 10.27 H B 0035 ARG NH1
H B 0036 GLU OE2 10.78 H B 0035 ARG NH2
C B 0047 GLU OE2 11.90 C B 0051 LYS NZ
C B 0050 GLU OE1 9.932 C B 0051 LYS NZ
C B 0050 GLU OE2 10.30 C B 0051 LYS NZ
C B 0059 GLU OE1 8.553 H B 0041 LYS NZ
C B 0059 GLU OE2 9.116 H B 0041 LYS NZ
C B 0059 GLU OE1 7.685 C B 0051 LYS NZ
C B 0059 GLU OE2 8.738 C B 0051 LYS NZ
C B 0060 GLU OE1 4.718 C B 0051 LYS NZ
C B 0060 GLU OE2 5.136 C B 0051 LYS NZ
C B 0060 GLU OE2 11.06 C B 0055 ARG NH1
CHARGE_REPU 2.00 12.00 57
C B 0002 ASP OD1 8.992 C B 0014 GLU OE1
C B 0002 ASP OD1 8.959 C B 0014 GLU OE2
C B 0002 ASP OD2 10.82 C B 0014 GLU OE1
C B 0002 ASP OD2 10.94 C B 0014 GLU OE2
H B 0005 LYS NZ 10.58 H B 0007 HIS NE2
H B 0007 HIS ND1 9.361 C B 0013 ARG NH1
H B 0007 HIS ND1 8.392 C B 0013 ARG NH2
H B 0007 HIS NE2 7.969 C B 0013 ARG NH1
H B 0007 HIS NE2 7.386 C B 0013 ARG NH2
C B 0014 GLU OE1 10.63 C B 0015 GLU OE1
C B 0014 GLU OE1 10.23 C B 0015 GLU OE2
C B 0014 GLU OE2 11.22 C B 0015 GLU OE1
C B 0014 GLU OE2 11.15 C B 0015 GLU OE2
C B 0014 GLU OE1 11.37 H B 0017 GLU OE1
C B 0015 GLU OE1 3.625 H B 0017 GLU OE1
C B 0015 GLU OE1 5.614 H B 0017 GLU OE2
C B 0015 GLU OE2 4.883 H B 0017 GLU OE1
C B 0015 GLU OE2 6.449 H B 0017 GLU OE2
C B 0015 GLU OE1 11.37 H B 0021 GLU OE1
C B 0015 GLU OE1 11.64 H B 0021 GLU OE2
H B 0017 GLU OE1 8.043 H B 0021 GLU OE1
H B 0017 GLU OE1 8.278 H B 0021 GLU OE2
H B 0017 GLU OE2 6.885 H B 0021 GLU OE1
H B 0017 GLU OE2 6.774 H B 0021 GLU OE2
H B 0020 LYS NZ 6.909 H B 0024 ARG NH1
H B 0020 LYS NZ 4.841 H B 0024 ARG NH2
H B 0021 GLU OE1 9.397 H B 0025 GLU OE1
H B 0021 GLU OE1 8.005 H B 0025 GLU OE2
H B 0021 GLU OE2 9.173 H B 0025 GLU OE1
H B 0021 GLU OE2 7.457 H B 0025 GLU OE2
H B 0021 GLU OE1 8.660 H B 0028 GLU OE1
H B 0021 GLU OE1 10.23 H B 0028 GLU OE2
H B 0021 GLU OE2 8.996 H B 0028 GLU OE1
H B 0021 GLU OE2 10.47 H B 0028 GLU OE2
H B 0025 GLU OE1 6.688 H B 0028 GLU OE1
H B 0025 GLU OE1 8.502 H B 0028 GLU OE2
H B 0025 GLU OE2 6.115 H B 0028 GLU OE1
H B 0025 GLU OE2 7.875 H B 0028 GLU OE2
H B 0034 GLU OE1 10.70 C B 0059 GLU OE1
H B 0034 GLU OE1 8.759 C B 0059 GLU OE2
H B 0034 GLU OE2 9.588 C B 0059 GLU OE1
H B 0034 GLU OE2 7.884 C B 0059 GLU OE2
H B 0035 ARG NH1 11.02 C B 0055 ARG NH1
C B 0047 GLU OE1 5.637 C B 0050 GLU OE1
C B 0047 GLU OE1 7.016 C B 0050 GLU OE2
C B 0047 GLU OE2 3.643 C B 0050 GLU OE1
C B 0047 GLU OE2 5.137 C B 0050 GLU OE2
C B 0059 GLU OE1 9.533 C B 0060 GLU OE1
C B 0059 GLU OE1 9.322 C B 0060 GLU OE2
C B 0059 GLU OE2 9.720 C B 0060 GLU OE1
C B 0059 GLU OE2 9.192 C B 0060 GLU OE2
C B 0064 GLU OE1 8.761 C B 0067 GLU OE1
C B 0064 GLU OE1 7.504 C B 0067 GLU OE2
C B 0064 GLU OE2 10.58 C B 0067 GLU OE1
C B 0064 GLU OE2 9.128 C B 0067 GLU OE2
C B 0067 GLU OE1 11.38 C B 0070 GLU OE1
C B 0067 GLU OE2 11.94 C B 0070 GLU OE1
HB_MM 2.00 3.20 119
C B 0002 ASP N 2.196 C B 0001 MET O
C B 0003 LEU N 2.944 C B 0001 MET O
C B 0003 LEU N 2.198 C B 0002 ASP O
H B 0004 VAL N 2.193 C B 0003 LEU O
H B 0005 LYS N 2.196 H B 0004 VAL O
H B 0006 ASN N 3.083 C B 0003 LEU O
H B 0006 ASN N 3.101 H B 0004 VAL O
H B 0006 ASN N 2.199 H B 0005 LYS O
H B 0007 HIS N 2.197 H B 0006 ASN O
H B 0008 LEU N 2.192 H B 0007 HIS O
H B 0009 MET N 2.241 H B 0007 HIS O
H B 0009 MET N 2.143 H B 0008 LEU O
H B 0010 TYR N 2.460 H B 0007 HIS O
H B 0010 TYR N 2.203 H B 0009 MET O
C B 0011 ALA N 3.111 H B 0008 LEU O
C B 0011 ALA N 2.459 H B 0009 MET O
C B 0011 ALA N 2.186 H B 0010 TYR O
C B 0012 VAL N 2.234 H B 0008 LEU O
C B 0012 VAL N 2.205 C B 0011 ALA O
C B 0013 ARG N 2.201 C B 0012 VAL O
C B 0014 GLU N 2.219 C B 0013 ARG O
C B 0015 GLU N 2.194 C B 0014 GLU O
H B 0016 VAL N 2.193 C B 0015 GLU O
H B 0017 GLU N 2.985 C B 0015 GLU O
H B 0017 GLU N 2.195 H B 0016 VAL O
H B 0018 ILE N 2.192 H B 0017 GLU O
H B 0019 LEU N 2.197 H B 0018 ILE O
H B 0020 LYS N 2.886 H B 0016 VAL O
H B 0020 LYS N 2.197 H B 0019 LEU O
H B 0021 GLU N 2.886 H B 0017 GLU O
H B 0021 GLU N 2.197 H B 0020 LYS O
H B 0022 GLN N 2.195 H B 0021 GLU O
H B 0023 ILE N 3.009 H B 0019 LEU O
H B 0023 ILE N 2.198 H B 0022 GLN O
H B 0024 ARG N 2.834 H B 0020 LYS O
H B 0024 ARG N 2.196 H B 0023 ILE O
H B 0025 GLU N 2.899 H B 0021 GLU O
H B 0025 GLU N 2.195 H B 0024 ARG O
H B 0026 LEU N 2.886 H B 0022 GLN O
H B 0026 LEU N 2.199 H B 0025 GLU O
H B 0027 VAL N 2.840 H B 0023 ILE O
H B 0027 VAL N 2.198 H B 0026 LEU O
H B 0028 GLU N 2.812 H B 0024 ARG O
H B 0028 GLU N 2.196 H B 0027 VAL O
H B 0029 LYS N 2.931 H B 0025 GLU O
H B 0029 LYS N 2.198 H B 0028 GLU O
H B 0030 ASN N 2.964 H B 0026 LEU O
H B 0030 ASN N 2.197 H B 0029 LYS O
H B 0031 SER N 2.823 H B 0027 VAL O
H B 0031 SER N 2.202 H B 0030 ASN O
H B 0032 GLN N 2.982 H B 0028 GLU O
H B 0032 GLN N 2.193 H B 0031 SER O
H B 0033 LEU N 2.905 H B 0029 LYS O
H B 0033 LEU N 3.167 H B 0030 ASN O
H B 0033 LEU N 2.199 H B 0032 GLN O
H B 0034 GLU N 2.759 H B 0030 ASN O
H B 0034 GLU N 3.051 H B 0031 SER O
H B 0034 GLU N 2.197 H B 0033 LEU O
H B 0035 ARG N 2.950 H B 0031 SER O
H B 0035 ARG N 2.194 H B 0034 GLU O
H B 0036 GLU N 3.033 H B 0032 GLN O
H B 0036 GLU N 2.198 H B 0035 ARG O
H B 0037 ASN N 2.876 H B 0033 LEU O
H B 0037 ASN N 2.196 H B 0036 GLU O
H B 0038 THR N 2.899 H B 0034 GLU O
H B 0038 THR N 2.192 H B 0037 ASN O
H B 0039 LEU N 3.141 H B 0035 ARG O
H B 0039 LEU N 2.197 H B 0038 THR O
H B 0040 LEU N 2.926 H B 0036 GLU O
H B 0040 LEU N 2.195 H B 0039 LEU O
H B 0041 LYS N 2.794 H B 0037 ASN O
H B 0041 LYS N 2.196 H B 0040 LEU O
H B 0042 THR N 2.970 H B 0038 THR O
H B 0042 THR N 2.196 H B 0041 LYS O
H B 0043 LEU N 2.918 H B 0039 LEU O
H B 0043 LEU N 2.198 H B 0042 THR O
H B 0044 ALA N 3.023 H B 0040 LEU O
H B 0044 ALA N 2.197 H B 0043 LEU O
C B 0045 SER N 2.791 H B 0041 LYS O
C B 0045 SER N 2.196 H B 0044 ALA O
C B 0046 PRO N 3.105 H B 0042 THR O
C B 0046 PRO N 2.225 C B 0045 SER O
C B 0047 GLU N 2.197 C B 0046 PRO O
C B 0048 GLN N 2.857 C B 0046 PRO O
C B 0048 GLN N 2.196 C B 0047 GLU O
C B 0049 LEU N 2.198 C B 0048 GLN O
C B 0050 GLU N 2.211 C B 0049 LEU O
C B 0051 LYS N 2.419 C B 0049 LEU O
C B 0051 LYS N 2.219 C B 0050 GLU O
C B 0052 PHE N 2.966 C B 0049 LEU O
C B 0052 PHE N 2.487 C B 0050 GLU O
C B 0052 PHE N 2.201 C B 0051 LYS O
C B 0053 GLN N 2.217 C B 0052 PHE O
C B 0054 SER N 2.215 C B 0053 GLN O
C B 0055 ARG N 2.201 C B 0054 SER O
C B 0056 LEU N 2.183 C B 0055 ARG O
C B 0057 SER N 2.190 C B 0056 LEU O
C B 0058 PRO N 2.220 C B 0057 SER O
C B 0059 GLU N 2.198 C B 0058 PRO O
C B 0060 GLU N 2.201 C B 0059 GLU O
C B 0061 PRO N 2.226 C B 0060 GLU O
C B 0062 ALA N 2.196 C B 0061 PRO O
C B 0063 PRO N 2.228 C B 0062 ALA O
C B 0064 GLU N 2.195 C B 0063 PRO O
C B 0065 THR N 2.661 C B 0063 PRO O
C B 0065 THR N 2.194 C B 0064 GLU O
C B 0066 PRO N 2.226 C B 0065 THR O
C B 0067 GLU N 2.195 C B 0066 PRO O
C B 0068 ALA N 2.196 C B 0067 GLU O
C B 0069 PRO N 2.228 C B 0068 ALA O
C B 0070 GLU N 3.184 C B 0068 ALA O
C B 0070 GLU N 2.196 C B 0069 PRO O
C B 0071 ALA N 2.196 C B 0070 GLU O
C B 0072 PRO N 2.226 C B 0071 ALA O
C B 0073 GLY N 2.196 C B 0072 PRO O
C B 0074 GLY N 2.197 C B 0073 GLY O
C B 0075 SER N 2.197 C B 0074 GLY O
C B 0076 ALA N 2.198 C B 0075 SER O
C B 0077 VAL N 2.198 C B 0076 ALA O
HB_MS 2.00 3.20 6
H B 0018 ILE O 2.908 H B 0022 GLN NE2
H B 0034 GLU O 2.332 H B 0038 THR OG1
H B 0038 THR O 3.187 H B 0042 THR OG1
C B 0047 GLU O 2.545 C B 0048 GLN NE2
C B 0053 GLN O 2.338 C B 0054 SER OG
C B 0059 GLU O 3.140 C B 0051 LYS NZ
HB_SS 2.00 3.20 1
H B 0007 HIS NE2 2.486 H B 0010 TYR OH
AROMATIC 0.00 8.00 2
H B 0007 HIS 3.422 H B 0010 TYR
C B 0051 LYS 4.621 C B 0052 PHE