Complet list of 1r05 con file
Complete list of 1r05.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 368
C A 0001 MET C 2.425 C A 0002 ALA CA
C A 0001 MET C 3.674 C A 0002 ALA C
C A 0001 MET C 3.084 C A 0002 ALA CB
C A 0001 MET CE 3.555 C A 0008 HIS CE1
C A 0002 ALA C 2.422 C A 0003 ASP CA
C A 0002 ALA C 3.073 C A 0003 ASP C
C A 0002 ALA C 3.632 C A 0003 ASP CB
C A 0003 ASP C 2.423 C A 0004 LYS CA
C A 0003 ASP C 3.108 C A 0004 LYS C
C A 0003 ASP C 3.625 C A 0004 LYS CB
C A 0004 LYS C 2.419 C A 0005 ARG CA
C A 0004 LYS C 3.198 C A 0005 ARG C
C A 0004 LYS C 3.593 C A 0005 ARG CB
C A 0005 ARG C 2.424 C A 0006 ALA CA
C A 0005 ARG C 2.921 C A 0006 ALA C
C A 0005 ARG C 2.925 C A 0006 ALA CB
C A 0006 ALA C 2.426 C A 0007 HIS CA
C A 0006 ALA C 3.480 C A 0007 HIS C
C A 0006 ALA C 3.411 C A 0007 HIS CB
C A 0007 HIS C 2.423 C A 0008 HIS CA
C A 0007 HIS C 3.451 C A 0008 HIS C
C A 0007 HIS C 3.437 C A 0008 HIS CB
C A 0007 HIS CE1 3.488 C A 0014 LYS CG
C A 0008 HIS C 2.423 C A 0009 ASN CA
C A 0008 HIS C 3.015 C A 0009 ASN C
C A 0008 HIS C 2.824 C A 0009 ASN CB
C A 0009 ASN C 2.423 C A 0010 ALA CA
C A 0009 ASN C 3.346 C A 0010 ALA C
C A 0009 ASN C 3.520 C A 0010 ALA CB
C A 0010 ALA C 2.420 C A 0011 LEU CA
C A 0010 ALA C 2.856 C A 0011 LEU C
C A 0010 ALA C 3.623 C A 0011 LEU CB
C A 0011 LEU C 2.423 C A 0012 GLU CA
C A 0011 LEU C 3.039 C A 0012 GLU C
C A 0011 LEU C 3.635 C A 0012 GLU CB
C A 0012 GLU C 2.439 C A 0013 ARG CA
C A 0012 GLU C 2.853 C A 0013 ARG C
C A 0012 GLU C 3.105 C A 0013 ARG CB
C A 0012 GLU C 3.113 C A 0013 ARG CG
C A 0012 GLU C 3.013 C A 0013 ARG CD
C A 0013 ARG C 2.426 C A 0014 LYS CA
C A 0013 ARG C 3.689 C A 0014 LYS C
C A 0013 ARG C 3.013 C A 0014 LYS CB
C A 0013 ARG C 3.728 C A 0014 LYS CG
C A 0013 ARG CB 3.763 H A 0017 ASP CG
C A 0013 ARG CG 3.605 H A 0017 ASP CG
C A 0014 LYS C 2.426 C A 0015 ARG CA
C A 0014 LYS C 3.204 C A 0015 ARG C
C A 0014 LYS C 3.600 C A 0015 ARG CB
C A 0014 LYS CE 3.723 C A 0015 ARG CG
C A 0015 ARG C 2.423 C A 0016 ARG CA
C A 0015 ARG C 3.357 C A 0016 ARG C
C A 0015 ARG C 3.509 C A 0016 ARG CB
C A 0016 ARG C 2.429 H A 0017 ASP CA
C A 0016 ARG C 3.513 H A 0017 ASP C
C A 0016 ARG C 3.381 H A 0017 ASP CB
H A 0017 ASP C 2.417 H A 0018 HIS CA
H A 0017 ASP C 2.843 H A 0018 HIS C
H A 0017 ASP C 3.637 H A 0018 HIS CB
H A 0018 HIS C 2.420 H A 0019 ILE CA
H A 0018 HIS C 2.889 H A 0019 ILE C
H A 0018 HIS C 3.646 H A 0019 ILE CB
H A 0018 HIS CD2 3.628 H A 0019 ILE CA
H A 0018 HIS CD2 3.444 H A 0019 ILE CG1
H A 0018 HIS CE1 3.662 H A 0019 ILE CG1
H A 0019 ILE C 2.454 H A 0020 LYS CA
H A 0019 ILE C 2.802 H A 0020 LYS C
H A 0019 ILE C 3.587 H A 0020 LYS CB
H A 0019 ILE CG2 3.682 H A 0023 PHE CG
H A 0019 ILE CG2 3.464 H A 0023 PHE CD1
H A 0019 ILE CG2 3.600 H A 0023 PHE CD2
H A 0019 ILE CG2 3.142 H A 0023 PHE CE1
H A 0019 ILE CG2 3.288 H A 0023 PHE CE2
H A 0019 ILE CG2 3.044 H A 0023 PHE CZ
H A 0020 LYS C 2.413 H A 0021 ASP CA
H A 0020 LYS C 2.899 H A 0021 ASP C
H A 0020 LYS C 3.641 H A 0021 ASP CB
H A 0020 LYS CA 3.263 H A 0023 PHE CB
H A 0020 LYS CA 3.683 H A 0023 PHE CG
H A 0020 LYS CA 3.629 H A 0023 PHE CD2
H A 0020 LYS C 3.338 H A 0023 PHE CB
H A 0020 LYS CD 3.544 H A 0023 PHE CD2
H A 0021 ASP C 2.414 H A 0022 SER CA
H A 0021 ASP C 2.879 H A 0022 SER C
H A 0021 ASP C 3.635 H A 0022 SER CB
H A 0022 SER C 2.429 H A 0023 PHE CA
H A 0022 SER C 2.821 H A 0023 PHE C
H A 0022 SER C 3.615 H A 0023 PHE CB
H A 0023 PHE C 2.427 H A 0024 HIS CA
H A 0023 PHE C 2.803 H A 0024 HIS C
H A 0023 PHE C 3.619 H A 0024 HIS CB
H A 0023 PHE C 3.735 H A 0026 LEU CB
H A 0023 PHE CE1 3.619 H A 0044 LEU CD1
H A 0023 PHE CE1 3.583 H A 0044 LEU CD2
H A 0023 PHE CZ 3.421 H A 0044 LEU CD1
H A 0024 HIS C 2.417 H A 0025 SER CA
H A 0024 HIS C 2.883 H A 0025 SER C
H A 0024 HIS C 3.639 H A 0025 SER CB
H A 0024 HIS CA 3.746 H A 0027 ARG CB
H A 0024 HIS C 3.615 H A 0027 ARG CB
H A 0025 SER C 2.420 H A 0026 LEU CA
H A 0025 SER C 3.008 H A 0026 LEU C
H A 0025 SER C 3.628 H A 0026 LEU CB
H A 0026 LEU C 2.427 H A 0027 ARG CA
H A 0026 LEU C 2.833 H A 0027 ARG C
H A 0026 LEU C 3.622 H A 0027 ARG CB
H A 0026 LEU CA 3.629 H A 0029 SER CB
H A 0026 LEU C 3.564 H A 0029 SER CB
H A 0026 LEU CA 3.784 H A 0043 ILE CG2
H A 0026 LEU C 3.269 H A 0043 ILE CG2
H A 0026 LEU CB 3.320 H A 0043 ILE CG2
H A 0026 LEU CD2 3.485 H A 0043 ILE CG2
H A 0027 ARG C 2.423 H A 0028 ASP CA
H A 0027 ARG C 3.141 H A 0028 ASP C
H A 0027 ARG C 3.614 H A 0028 ASP CB
H A 0028 ASP C 2.411 H A 0029 SER CA
H A 0028 ASP C 2.813 H A 0029 SER C
H A 0028 ASP C 3.635 H A 0029 SER CB
H A 0029 SER C 2.409 H A 0030 VAL CA
H A 0029 SER C 3.264 H A 0030 VAL C
H A 0029 SER C 3.530 H A 0030 VAL CB
H A 0029 SER C 3.579 H A 0030 VAL CG2
H A 0030 VAL CA 3.794 C A 0031 PRO CA
H A 0030 VAL CA 2.866 C A 0031 PRO CD
H A 0030 VAL C 2.411 C A 0031 PRO CA
H A 0030 VAL C 3.075 C A 0031 PRO C
H A 0030 VAL C 3.592 C A 0031 PRO CB
H A 0030 VAL C 3.617 C A 0031 PRO CG
H A 0030 VAL C 2.482 C A 0031 PRO CD
H A 0030 VAL CB 3.416 H A 0033 LEU CB
H A 0030 VAL CB 3.267 H A 0033 LEU CG
H A 0030 VAL CB 3.378 H A 0033 LEU CD2
H A 0030 VAL CG1 3.602 H A 0033 LEU CB
H A 0030 VAL CG1 3.520 H A 0033 LEU CG
H A 0030 VAL CG1 3.022 H A 0033 LEU CD2
H A 0030 VAL CG1 3.650 H A 0046 LYS CG
H A 0030 VAL CG1 3.759 H A 0046 LYS CD
H A 0030 VAL CG2 3.736 H A 0046 LYS CB
H A 0030 VAL CG2 3.733 H A 0050 TYR CE2
C A 0031 PRO C 2.426 H A 0032 SER CA
C A 0031 PRO C 3.204 H A 0032 SER C
C A 0031 PRO C 3.597 H A 0032 SER CB
H A 0032 SER C 2.436 H A 0033 LEU CA
H A 0032 SER C 2.909 H A 0033 LEU C
H A 0032 SER C 3.630 H A 0033 LEU CB
H A 0033 LEU C 2.424 H A 0034 GLN CA
H A 0033 LEU C 2.957 H A 0034 GLN C
H A 0033 LEU C 3.639 H A 0034 GLN CB
H A 0033 LEU CD1 3.156 H A 0042 GLN C
H A 0033 LEU CD1 3.408 H A 0042 GLN CB
H A 0033 LEU CD1 3.474 H A 0042 GLN CG
H A 0033 LEU CD1 3.658 H A 0042 GLN CD
H A 0033 LEU CD1 3.529 H A 0043 ILE CA
H A 0033 LEU CD2 3.518 H A 0046 LYS CB
H A 0033 LEU CD2 3.788 H A 0046 LYS CG
H A 0033 LEU CD2 3.302 H A 0046 LYS CD
H A 0034 GLN C 2.422 H A 0035 GLY CA
H A 0034 GLN C 3.141 H A 0035 GLY C
H A 0035 GLY C 2.419 H A 0036 GLU CA
H A 0035 GLY C 3.492 H A 0036 GLU C
H A 0035 GLY C 3.390 H A 0036 GLU CB
H A 0036 GLU C 2.425 H A 0037 LYS CA
H A 0036 GLU C 2.889 H A 0037 LYS C
H A 0036 GLU C 3.649 H A 0037 LYS CB
H A 0036 GLU C 3.468 H A 0037 LYS CD
H A 0037 LYS C 2.427 C A 0038 ALA CA
H A 0037 LYS C 3.332 C A 0038 ALA C
H A 0037 LYS C 3.537 C A 0038 ALA CB
C A 0038 ALA C 2.428 C A 0039 SER CA
C A 0038 ALA C 3.041 C A 0039 SER C
C A 0038 ALA C 2.812 C A 0039 SER CB
C A 0038 ALA CA 3.517 H A 0042 GLN CB
C A 0038 ALA C 3.579 H A 0042 GLN CA
C A 0038 ALA C 3.337 H A 0042 GLN CB
C A 0038 ALA CB 3.524 H A 0042 GLN CA
C A 0038 ALA CB 3.624 H A 0042 GLN CB
C A 0039 SER C 2.430 C A 0040 ARG CA
C A 0039 SER C 2.897 C A 0040 ARG C
C A 0039 SER C 3.633 C A 0040 ARG CB
C A 0040 ARG C 2.428 H A 0041 ALA CA
C A 0040 ARG C 3.128 H A 0041 ALA C
C A 0040 ARG C 3.624 H A 0041 ALA CB
H A 0041 ALA C 2.418 H A 0042 GLN CA
H A 0041 ALA C 2.865 H A 0042 GLN C
H A 0041 ALA C 3.608 H A 0042 GLN CB
H A 0041 ALA CA 3.722 H A 0044 LEU CB
H A 0041 ALA CA 3.371 H A 0044 LEU CG
H A 0041 ALA CA 3.415 H A 0044 LEU CD1
H A 0041 ALA C 3.635 H A 0044 LEU CB
H A 0041 ALA C 3.674 H A 0044 LEU CG
H A 0041 ALA CB 3.643 H A 0044 LEU CB
H A 0041 ALA CB 3.654 H A 0044 LEU CG
H A 0041 ALA CB 3.310 H A 0044 LEU CD1
H A 0042 GLN C 2.410 H A 0043 ILE CA
H A 0042 GLN C 3.045 H A 0043 ILE C
H A 0042 GLN C 3.662 H A 0043 ILE CB
H A 0042 GLN CG 3.723 H A 0043 ILE CG1
H A 0042 GLN CG 3.745 H A 0043 ILE CD1
H A 0043 ILE CA 3.799 H A 0044 LEU CA
H A 0043 ILE C 2.419 H A 0044 LEU CA
H A 0043 ILE C 3.031 H A 0044 LEU C
H A 0043 ILE C 3.619 H A 0044 LEU CB
H A 0043 ILE C 3.624 H A 0047 ALA CB
H A 0044 LEU C 2.415 H A 0045 ASP CA
H A 0044 LEU C 2.872 H A 0045 ASP C
H A 0044 LEU C 3.631 H A 0045 ASP CB
H A 0044 LEU CA 3.575 H A 0047 ALA CB
H A 0045 ASP C 2.418 H A 0046 LYS CA
H A 0045 ASP C 3.134 H A 0046 LYS C
H A 0045 ASP C 3.613 H A 0046 LYS CB
H A 0046 LYS C 2.426 H A 0047 ALA CA
H A 0046 LYS C 2.917 H A 0047 ALA C
H A 0046 LYS C 3.657 H A 0047 ALA CB
H A 0046 LYS CA 3.723 H A 0049 GLU CG
H A 0046 LYS C 3.770 H A 0049 GLU CG
H A 0046 LYS C 3.716 H A 0050 TYR CD2
H A 0046 LYS CG 3.571 H A 0050 TYR CE2
H A 0047 ALA C 2.423 H A 0048 THR CA
H A 0047 ALA C 3.064 H A 0048 THR C
H A 0047 ALA C 3.637 H A 0048 THR CB
H A 0048 THR C 2.419 H A 0049 GLU CA
H A 0048 THR C 3.033 H A 0049 GLU C
H A 0048 THR C 3.646 H A 0049 GLU CB
H A 0049 GLU C 2.424 H A 0050 TYR CA
H A 0049 GLU C 3.018 H A 0050 TYR C
H A 0049 GLU C 3.638 H A 0050 TYR CB
H A 0049 GLU CD 3.517 H A 0053 TYR CD2
H A 0050 TYR C 2.430 H A 0051 ILE CA
H A 0050 TYR C 2.844 H A 0051 ILE C
H A 0050 TYR C 3.614 H A 0051 ILE CB
H A 0050 TYR C 3.244 H A 0054 MET CB
H A 0050 TYR CD1 3.144 H A 0054 MET CE
H A 0050 TYR CE1 3.277 H A 0054 MET CE
H A 0051 ILE C 2.423 H A 0052 GLN CA
H A 0051 ILE C 3.126 H A 0052 GLN C
H A 0051 ILE C 3.623 H A 0052 GLN CB
H A 0052 GLN C 2.422 H A 0053 TYR CA
H A 0052 GLN C 2.926 H A 0053 TYR C
H A 0052 GLN C 3.645 H A 0053 TYR CB
H A 0053 TYR C 2.422 H A 0054 MET CA
H A 0053 TYR C 2.846 H A 0054 MET C
H A 0053 TYR C 3.628 H A 0054 MET CB
H A 0053 TYR CD2 3.551 H A 0054 MET CA
H A 0054 MET C 2.422 H A 0055 ARG CA
H A 0054 MET C 2.988 H A 0055 ARG C
H A 0054 MET C 3.640 H A 0055 ARG CB
H A 0055 ARG C 2.422 H A 0056 ARG CA
H A 0055 ARG C 2.910 H A 0056 ARG C
H A 0055 ARG C 3.634 H A 0056 ARG CB
H A 0056 ARG C 2.424 H A 0057 LYS CA
H A 0056 ARG C 2.943 H A 0057 LYS C
H A 0056 ARG C 3.640 H A 0057 LYS CB
H A 0057 LYS C 2.422 H A 0058 VAL CA
H A 0057 LYS C 2.872 H A 0058 VAL C
H A 0057 LYS C 3.625 H A 0058 VAL CB
H A 0057 LYS C 3.735 H A 0061 LEU CB
H A 0057 LYS C 3.727 H A 0061 LEU CG
H A 0057 LYS C 3.483 H A 0061 LEU CD1
H A 0058 VAL C 2.422 H A 0059 HIS CA
H A 0058 VAL C 2.871 H A 0059 HIS C
H A 0058 VAL C 3.626 H A 0059 HIS CB
H A 0058 VAL CA 3.718 H A 0061 LEU CB
H A 0058 VAL C 3.703 H A 0061 LEU CB
H A 0059 HIS C 2.422 H A 0060 THR CA
H A 0059 HIS C 2.949 H A 0060 THR C
H A 0059 HIS C 3.638 H A 0060 THR CB
H A 0060 THR C 2.421 H A 0061 LEU CA
H A 0060 THR C 2.960 H A 0061 LEU C
H A 0060 THR C 3.640 H A 0061 LEU CB
H A 0060 THR CA 3.734 H A 0063 GLN CB
H A 0060 THR C 3.486 H A 0063 GLN CB
H A 0061 LEU C 2.423 H A 0062 GLN CA
H A 0061 LEU C 2.841 H A 0062 GLN C
H A 0061 LEU C 3.620 H A 0062 GLN CB
H A 0061 LEU C 3.524 H A 0064 ASP CG
H A 0061 LEU C 3.552 H A 0065 ILE CG1
H A 0062 GLN C 2.420 H A 0063 GLN CA
H A 0062 GLN C 2.956 H A 0063 GLN C
H A 0062 GLN C 3.638 H A 0063 GLN CB
H A 0062 GLN CA 3.190 H A 0065 ILE CG1
H A 0062 GLN CA 3.274 H A 0065 ILE CD1
H A 0062 GLN C 3.581 H A 0065 ILE CG1
H A 0063 GLN C 2.423 H A 0064 ASP CA
H A 0063 GLN C 3.111 H A 0064 ASP C
H A 0063 GLN C 3.626 H A 0064 ASP CB
H A 0064 ASP C 2.423 H A 0065 ILE CA
H A 0064 ASP C 3.127 H A 0065 ILE C
H A 0064 ASP C 3.642 H A 0065 ILE CB
H A 0064 ASP C 3.783 H A 0065 ILE CG1
H A 0064 ASP C 3.453 H A 0068 LEU CD1
H A 0065 ILE C 2.421 H A 0066 ASP CA
H A 0065 ILE C 2.974 H A 0066 ASP C
H A 0065 ILE C 3.641 H A 0066 ASP CB
H A 0066 ASP C 2.424 H A 0067 ASP CA
H A 0066 ASP C 3.060 H A 0067 ASP C
H A 0066 ASP C 3.635 H A 0067 ASP CB
H A 0067 ASP C 2.423 H A 0068 LEU CA
H A 0067 ASP C 2.995 H A 0068 LEU C
H A 0067 ASP C 3.641 H A 0068 LEU CB
H A 0068 LEU C 2.424 H A 0069 LYS CA
H A 0068 LEU C 2.957 H A 0069 LYS C
H A 0068 LEU C 3.638 H A 0069 LYS CB
H A 0068 LEU CA 3.787 H A 0071 GLN CD
H A 0069 LYS C 2.423 H A 0070 ARG CA
H A 0069 LYS C 3.029 H A 0070 ARG C
H A 0069 LYS C 3.637 H A 0070 ARG CB
H A 0070 ARG C 2.423 H A 0071 GLN CA
H A 0070 ARG C 2.958 H A 0071 GLN C
H A 0070 ARG C 3.640 H A 0071 GLN CB
H A 0070 ARG CA 3.764 H A 0073 ALA CB
H A 0070 ARG C 3.596 H A 0073 ALA CB
H A 0071 GLN C 2.429 H A 0072 ASN CA
H A 0071 GLN C 2.844 H A 0072 ASN C
H A 0071 GLN C 3.625 H A 0072 ASN CB
H A 0071 GLN CA 3.310 H A 0075 LEU CD1
H A 0071 GLN C 3.542 H A 0075 LEU CB
H A 0071 GLN C 3.776 H A 0075 LEU CG
H A 0071 GLN C 2.974 H A 0075 LEU CD1
H A 0071 GLN CB 3.223 H A 0075 LEU CD1
H A 0072 ASN C 2.421 H A 0073 ALA CA
H A 0072 ASN C 2.997 H A 0073 ALA C
H A 0072 ASN C 3.640 H A 0073 ALA CB
H A 0072 ASN CA 3.418 H A 0075 LEU CB
H A 0072 ASN C 3.774 H A 0075 LEU CB
H A 0073 ALA C 2.422 H A 0074 LEU CA
H A 0073 ALA C 3.147 H A 0074 LEU C
H A 0073 ALA C 3.606 H A 0074 LEU CB
H A 0073 ALA C 3.301 H A 0074 LEU CD1
H A 0073 ALA CB 3.572 H A 0074 LEU CD1
H A 0074 LEU C 2.426 H A 0075 LEU CA
H A 0074 LEU C 3.007 H A 0075 LEU C
H A 0074 LEU C 3.632 H A 0075 LEU CB
H A 0075 LEU C 2.424 H A 0076 GLU CA
H A 0075 LEU C 3.039 H A 0076 GLU C
H A 0075 LEU C 3.636 H A 0076 GLU CB
H A 0076 GLU C 2.425 H A 0077 GLN CA
H A 0076 GLU C 3.021 H A 0077 GLN C
H A 0076 GLU C 3.640 H A 0077 GLN CB
H A 0077 GLN C 2.423 H A 0078 GLN CA
H A 0077 GLN C 3.331 H A 0078 GLN C
H A 0077 GLN C 3.505 H A 0078 GLN CB
H A 0078 GLN CA 3.786 H A 0079 VAL CA
H A 0078 GLN C 2.415 H A 0079 VAL CA
H A 0078 GLN C 2.954 H A 0079 VAL C
H A 0078 GLN C 3.616 H A 0079 VAL CB
H A 0079 VAL C 2.427 H A 0080 ARG CA
H A 0079 VAL C 3.327 H A 0080 ARG C
H A 0079 VAL C 3.534 H A 0080 ARG CB
H A 0080 ARG C 2.425 H A 0081 ALA CA
H A 0080 ARG C 3.192 H A 0081 ALA C
H A 0080 ARG C 3.602 H A 0081 ALA CB
H A 0080 ARG CA 3.595 H A 0083 GLU CD
H A 0081 ALA C 2.427 H A 0082 LEU CA
H A 0081 ALA C 3.490 H A 0082 LEU C
H A 0081 ALA C 3.401 H A 0082 LEU CB
H A 0082 LEU C 2.424 H A 0083 GLU CA
H A 0082 LEU C 2.901 H A 0083 GLU C
H A 0082 LEU C 3.633 H A 0083 GLU CB
H A 0083 GLU C 2.423 C A 0084 GLY CA
H A 0083 GLU C 3.310 C A 0084 GLY C
C A 0084 GLY C 2.423 C A 0085 SER CA
C A 0084 GLY C 3.008 C A 0085 SER C
C A 0084 GLY C 2.828 C A 0085 SER CB
C A 0085 SER C 2.423 C A 0086 GLY CA
C A 0085 SER C 3.674 C A 0086 GLY C
C A 0086 GLY C 2.432 C A 0087 CYS CA
C A 0086 GLY C 2.841 C A 0087 CYS C
C A 0086 GLY C 3.610 C A 0087 CYS CB
CHARGE_ATTR 2.00 12.00 118
C A 0003 ASP OD1 11.39 C A 0004 LYS NZ
C A 0003 ASP OD2 11.43 C A 0004 LYS NZ
C A 0003 ASP OD1 10.29 C A 0005 ARG NH1
C A 0003 ASP OD1 9.334 C A 0005 ARG NH2
C A 0003 ASP OD2 11.01 C A 0005 ARG NH1
C A 0003 ASP OD2 10.29 C A 0005 ARG NH2
C A 0003 ASP OD2 11.48 C A 0008 HIS ND1
C A 0012 GLU OE1 8.501 C A 0004 LYS NZ
C A 0012 GLU OE2 6.751 C A 0004 LYS NZ
C A 0012 GLU OE2 10.75 C A 0005 ARG NH1
C A 0012 GLU OE2 10.52 C A 0005 ARG NH2
C A 0012 GLU OE1 7.876 C A 0007 HIS ND1
C A 0012 GLU OE1 8.424 C A 0007 HIS NE2
C A 0012 GLU OE2 6.632 C A 0007 HIS ND1
C A 0012 GLU OE2 7.687 C A 0007 HIS NE2
C A 0012 GLU OE1 10.29 C A 0008 HIS ND1
C A 0012 GLU OE2 9.668 C A 0008 HIS ND1
C A 0012 GLU OE2 11.76 C A 0008 HIS NE2
C A 0012 GLU OE1 7.190 C A 0013 ARG NH1
C A 0012 GLU OE1 9.048 C A 0013 ARG NH2
C A 0012 GLU OE2 8.492 C A 0013 ARG NH1
C A 0012 GLU OE2 10.18 C A 0013 ARG NH2
H A 0017 ASP OD1 10.53 C A 0007 HIS ND1
H A 0017 ASP OD1 9.522 C A 0007 HIS NE2
H A 0017 ASP OD2 9.573 C A 0007 HIS ND1
H A 0017 ASP OD2 8.932 C A 0007 HIS NE2
H A 0017 ASP OD1 5.569 C A 0013 ARG NH1
H A 0017 ASP OD1 4.454 C A 0013 ARG NH2
H A 0017 ASP OD2 6.603 C A 0013 ARG NH1
H A 0017 ASP OD2 6.087 C A 0013 ARG NH2
H A 0017 ASP OD1 10.27 C A 0014 LYS NZ
H A 0017 ASP OD2 9.466 C A 0014 LYS NZ
H A 0017 ASP OD1 11.34 C A 0015 ARG NH1
H A 0017 ASP OD2 10.76 C A 0015 ARG NH1
H A 0017 ASP OD2 11.72 C A 0015 ARG NH2
H A 0017 ASP OD1 6.604 C A 0016 ARG NH1
H A 0017 ASP OD1 8.640 C A 0016 ARG NH2
H A 0017 ASP OD2 4.809 C A 0016 ARG NH1
H A 0017 ASP OD2 6.787 C A 0016 ARG NH2
H A 0017 ASP OD1 6.378 H A 0018 HIS ND1
H A 0017 ASP OD1 8.088 H A 0018 HIS NE2
H A 0017 ASP OD2 6.741 H A 0018 HIS ND1
H A 0017 ASP OD2 8.643 H A 0018 HIS NE2
H A 0017 ASP OD1 7.247 H A 0020 LYS NZ
H A 0017 ASP OD2 7.270 H A 0020 LYS NZ
H A 0017 ASP OD1 9.895 H A 0024 HIS ND1
H A 0017 ASP OD1 9.856 H A 0024 HIS NE2
H A 0017 ASP OD2 11.66 H A 0024 HIS ND1
H A 0017 ASP OD2 11.35 H A 0024 HIS NE2
H A 0017 ASP OD1 10.40 C A 0040 ARG NH2
H A 0017 ASP OD2 10.22 C A 0040 ARG NH2
H A 0021 ASP OD1 8.035 C A 0013 ARG NH1
H A 0021 ASP OD1 5.939 C A 0013 ARG NH2
H A 0021 ASP OD2 5.971 C A 0013 ARG NH1
H A 0021 ASP OD2 3.835 C A 0013 ARG NH2
H A 0021 ASP OD2 11.87 C A 0016 ARG NH1
H A 0021 ASP OD1 9.382 H A 0018 HIS ND1
H A 0021 ASP OD1 9.760 H A 0018 HIS NE2
H A 0021 ASP OD2 8.845 H A 0018 HIS ND1
H A 0021 ASP OD2 9.673 H A 0018 HIS NE2
H A 0021 ASP OD1 10.89 H A 0020 LYS NZ
H A 0021 ASP OD2 9.989 H A 0020 LYS NZ
H A 0021 ASP OD1 6.287 H A 0024 HIS ND1
H A 0021 ASP OD1 7.743 H A 0024 HIS NE2
H A 0021 ASP OD2 6.567 H A 0024 HIS ND1
H A 0021 ASP OD2 7.738 H A 0024 HIS NE2
H A 0028 ASP OD1 8.360 H A 0024 HIS ND1
H A 0028 ASP OD1 9.272 H A 0024 HIS NE2
H A 0028 ASP OD2 10.50 H A 0024 HIS ND1
H A 0028 ASP OD2 11.41 H A 0024 HIS NE2
H A 0028 ASP OD1 7.376 H A 0027 ARG NH1
H A 0028 ASP OD1 7.266 H A 0027 ARG NH2
H A 0028 ASP OD2 9.100 H A 0027 ARG NH1
H A 0028 ASP OD2 8.619 H A 0027 ARG NH2
H A 0036 GLU OE1 11.55 H A 0027 ARG NH2
H A 0036 GLU OE1 8.026 H A 0037 LYS NZ
H A 0036 GLU OE2 6.885 H A 0037 LYS NZ
H A 0036 GLU OE1 4.076 H A 0046 LYS NZ
H A 0036 GLU OE2 6.008 H A 0046 LYS NZ
H A 0045 ASP OD1 11.40 H A 0037 LYS NZ
H A 0045 ASP OD2 10.71 H A 0037 LYS NZ
H A 0045 ASP OD1 9.040 H A 0046 LYS NZ
H A 0045 ASP OD2 6.902 H A 0046 LYS NZ
H A 0049 GLU OE1 7.773 H A 0046 LYS NZ
H A 0049 GLU OE2 6.389 H A 0046 LYS NZ
H A 0049 GLU OE1 11.38 H A 0055 ARG NH1
H A 0049 GLU OE1 9.213 H A 0057 LYS NZ
H A 0049 GLU OE2 9.279 H A 0057 LYS NZ
H A 0064 ASP OD2 11.25 H A 0056 ARG NH1
H A 0064 ASP OD1 11.28 H A 0057 LYS NZ
H A 0064 ASP OD2 9.392 H A 0057 LYS NZ
H A 0064 ASP OD1 11.06 H A 0059 HIS ND1
H A 0064 ASP OD2 10.56 H A 0059 HIS ND1
H A 0064 ASP OD2 11.91 H A 0059 HIS NE2
H A 0064 ASP OD1 10.53 H A 0069 LYS NZ
H A 0066 ASP OD1 11.53 H A 0059 HIS ND1
H A 0066 ASP OD1 11.01 H A 0059 HIS NE2
H A 0066 ASP OD2 9.888 H A 0059 HIS ND1
H A 0066 ASP OD2 9.451 H A 0059 HIS NE2
H A 0066 ASP OD1 6.247 H A 0069 LYS NZ
H A 0066 ASP OD2 6.820 H A 0069 LYS NZ
H A 0066 ASP OD1 8.087 H A 0070 ARG NH1
H A 0066 ASP OD1 6.867 H A 0070 ARG NH2
H A 0066 ASP OD2 10.20 H A 0070 ARG NH1
H A 0066 ASP OD2 8.968 H A 0070 ARG NH2
H A 0067 ASP OD1 11.77 H A 0069 LYS NZ
H A 0067 ASP OD1 8.836 H A 0070 ARG NH1
H A 0067 ASP OD1 8.636 H A 0070 ARG NH2
H A 0067 ASP OD2 10.28 H A 0070 ARG NH1
H A 0067 ASP OD2 10.41 H A 0070 ARG NH2
H A 0076 GLU OE1 8.785 H A 0080 ARG NH1
H A 0076 GLU OE1 7.413 H A 0080 ARG NH2
H A 0076 GLU OE2 7.150 H A 0080 ARG NH1
H A 0076 GLU OE2 5.780 H A 0080 ARG NH2
H A 0083 GLU OE1 6.735 H A 0080 ARG NH1
H A 0083 GLU OE1 7.009 H A 0080 ARG NH2
H A 0083 GLU OE2 5.015 H A 0080 ARG NH1
H A 0083 GLU OE2 5.840 H A 0080 ARG NH2
CHARGE_REPU 2.00 12.00 128
C A 0003 ASP OD1 11.68 C A 0012 GLU OE1
C A 0003 ASP OD1 11.24 C A 0012 GLU OE2
C A 0003 ASP OD2 10.26 C A 0012 GLU OE1
C A 0003 ASP OD2 10.16 C A 0012 GLU OE2
C A 0004 LYS NZ 10.19 C A 0005 ARG NH1
C A 0004 LYS NZ 8.733 C A 0005 ARG NH2
C A 0004 LYS NZ 10.22 C A 0007 HIS ND1
C A 0005 ARG NH1 10.44 C A 0007 HIS ND1
C A 0005 ARG NH2 11.21 C A 0007 HIS ND1
C A 0005 ARG NH1 7.921 C A 0008 HIS ND1
C A 0005 ARG NH1 9.297 C A 0008 HIS NE2
C A 0005 ARG NH2 9.598 C A 0008 HIS ND1
C A 0005 ARG NH2 11.20 C A 0008 HIS NE2
C A 0007 HIS ND1 8.522 C A 0008 HIS ND1
C A 0007 HIS ND1 9.888 C A 0008 HIS NE2
C A 0007 HIS NE2 9.267 C A 0008 HIS ND1
C A 0007 HIS NE2 10.35 C A 0008 HIS NE2
C A 0007 HIS ND1 10.78 C A 0013 ARG NH1
C A 0007 HIS ND1 11.24 C A 0013 ARG NH2
C A 0007 HIS NE2 9.983 C A 0013 ARG NH1
C A 0007 HIS NE2 10.06 C A 0013 ARG NH2
C A 0007 HIS ND1 6.142 C A 0014 LYS NZ
C A 0007 HIS NE2 5.147 C A 0014 LYS NZ
C A 0007 HIS ND1 11.07 C A 0015 ARG NH1
C A 0007 HIS NE2 9.945 C A 0015 ARG NH1
C A 0007 HIS NE2 11.53 C A 0015 ARG NH2
C A 0007 HIS NE2 11.65 H A 0018 HIS ND1
C A 0012 GLU OE1 10.70 H A 0017 ASP OD1
C A 0012 GLU OE1 10.35 H A 0017 ASP OD2
C A 0012 GLU OE2 11.01 H A 0017 ASP OD1
C A 0012 GLU OE2 10.25 H A 0017 ASP OD2
C A 0013 ARG NH1 10.29 C A 0016 ARG NH1
C A 0013 ARG NH2 10.32 C A 0016 ARG NH1
C A 0013 ARG NH1 11.60 H A 0018 HIS ND1
C A 0013 ARG NH2 9.900 H A 0018 HIS ND1
C A 0013 ARG NH2 11.39 H A 0018 HIS NE2
C A 0013 ARG NH1 11.21 H A 0020 LYS NZ
C A 0013 ARG NH2 10.43 H A 0020 LYS NZ
C A 0013 ARG NH1 9.753 H A 0024 HIS ND1
C A 0013 ARG NH1 10.38 H A 0024 HIS NE2
C A 0013 ARG NH2 8.674 H A 0024 HIS ND1
C A 0013 ARG NH2 9.465 H A 0024 HIS NE2
C A 0014 LYS NZ 5.074 C A 0015 ARG NH1
C A 0014 LYS NZ 6.550 C A 0015 ARG NH2
C A 0014 LYS NZ 11.99 C A 0016 ARG NH1
C A 0014 LYS NZ 9.355 H A 0018 HIS ND1
C A 0014 LYS NZ 11.25 H A 0018 HIS NE2
C A 0015 ARG NH1 7.345 H A 0018 HIS ND1
C A 0015 ARG NH1 8.499 H A 0018 HIS NE2
C A 0015 ARG NH2 8.282 H A 0018 HIS ND1
C A 0015 ARG NH2 9.204 H A 0018 HIS NE2
C A 0016 ARG NH1 9.301 H A 0018 HIS ND1
C A 0016 ARG NH1 10.80 H A 0018 HIS NE2
C A 0016 ARG NH2 10.22 H A 0018 HIS ND1
C A 0016 ARG NH2 11.55 H A 0018 HIS NE2
C A 0016 ARG NH1 6.412 H A 0020 LYS NZ
C A 0016 ARG NH2 7.474 H A 0020 LYS NZ
C A 0016 ARG NH1 10.31 C A 0040 ARG NH1
C A 0016 ARG NH1 8.124 C A 0040 ARG NH2
C A 0016 ARG NH2 10.82 C A 0040 ARG NH1
C A 0016 ARG NH2 8.798 C A 0040 ARG NH2
H A 0017 ASP OD1 7.399 H A 0021 ASP OD1
H A 0017 ASP OD1 5.584 H A 0021 ASP OD2
H A 0017 ASP OD2 9.549 H A 0021 ASP OD1
H A 0017 ASP OD2 7.730 H A 0021 ASP OD2
H A 0018 HIS ND1 8.761 H A 0020 LYS NZ
H A 0018 HIS NE2 9.096 H A 0020 LYS NZ
H A 0020 LYS NZ 9.693 H A 0024 HIS ND1
H A 0020 LYS NZ 8.158 H A 0024 HIS NE2
H A 0020 LYS NZ 5.863 C A 0040 ARG NH1
H A 0020 LYS NZ 3.895 C A 0040 ARG NH2
H A 0021 ASP OD1 11.79 H A 0028 ASP OD1
H A 0024 HIS ND1 6.747 H A 0027 ARG NH1
H A 0024 HIS ND1 8.547 H A 0027 ARG NH2
H A 0024 HIS NE2 5.887 H A 0027 ARG NH1
H A 0024 HIS NE2 7.674 H A 0027 ARG NH2
H A 0024 HIS ND1 11.53 C A 0040 ARG NH1
H A 0024 HIS ND1 10.85 C A 0040 ARG NH2
H A 0024 HIS NE2 9.363 C A 0040 ARG NH1
H A 0024 HIS NE2 8.845 C A 0040 ARG NH2
H A 0027 ARG NH1 11.16 C A 0040 ARG NH1
H A 0027 ARG NH1 11.83 C A 0040 ARG NH2
H A 0027 ARG NH2 11.95 C A 0040 ARG NH1
H A 0036 GLU OE1 6.251 H A 0045 ASP OD1
H A 0036 GLU OE1 4.460 H A 0045 ASP OD2
H A 0036 GLU OE2 5.300 H A 0045 ASP OD1
H A 0036 GLU OE2 4.009 H A 0045 ASP OD2
H A 0036 GLU OE1 9.558 H A 0049 GLU OE1
H A 0036 GLU OE1 8.798 H A 0049 GLU OE2
H A 0036 GLU OE2 10.63 H A 0049 GLU OE1
H A 0036 GLU OE2 10.24 H A 0049 GLU OE2
H A 0037 LYS NZ 10.88 H A 0046 LYS NZ
H A 0045 ASP OD1 9.303 H A 0049 GLU OE1
H A 0045 ASP OD1 9.837 H A 0049 GLU OE2
H A 0045 ASP OD2 7.956 H A 0049 GLU OE1
H A 0045 ASP OD2 8.191 H A 0049 GLU OE2
H A 0055 ARG NH1 9.145 H A 0056 ARG NH1
H A 0055 ARG NH1 8.376 H A 0056 ARG NH2
H A 0055 ARG NH2 10.78 H A 0056 ARG NH1
H A 0055 ARG NH2 10.07 H A 0056 ARG NH2
H A 0055 ARG NH1 7.881 H A 0059 HIS ND1
H A 0055 ARG NH1 8.015 H A 0059 HIS NE2
H A 0055 ARG NH2 7.955 H A 0059 HIS ND1
H A 0055 ARG NH2 7.460 H A 0059 HIS NE2
H A 0056 ARG NH1 8.520 H A 0057 LYS NZ
H A 0056 ARG NH2 10.20 H A 0057 LYS NZ
H A 0056 ARG NH1 7.276 H A 0059 HIS ND1
H A 0056 ARG NH1 9.375 H A 0059 HIS NE2
H A 0056 ARG NH2 7.963 H A 0059 HIS ND1
H A 0056 ARG NH2 9.834 H A 0059 HIS NE2
H A 0064 ASP OD1 9.072 H A 0066 ASP OD1
H A 0064 ASP OD1 7.738 H A 0066 ASP OD2
H A 0064 ASP OD2 10.76 H A 0066 ASP OD1
H A 0064 ASP OD2 9.299 H A 0066 ASP OD2
H A 0064 ASP OD1 8.950 H A 0067 ASP OD1
H A 0064 ASP OD1 8.687 H A 0067 ASP OD2
H A 0064 ASP OD2 9.840 H A 0067 ASP OD1
H A 0064 ASP OD2 9.374 H A 0067 ASP OD2
H A 0066 ASP OD1 7.534 H A 0067 ASP OD1
H A 0066 ASP OD1 9.207 H A 0067 ASP OD2
H A 0066 ASP OD2 8.131 H A 0067 ASP OD1
H A 0066 ASP OD2 9.614 H A 0067 ASP OD2
H A 0069 LYS NZ 10.07 H A 0070 ARG NH1
H A 0069 LYS NZ 9.935 H A 0070 ARG NH2
H A 0076 GLU OE1 9.238 H A 0083 GLU OE1
H A 0076 GLU OE1 9.579 H A 0083 GLU OE2
H A 0076 GLU OE2 9.099 H A 0083 GLU OE1
H A 0076 GLU OE2 8.957 H A 0083 GLU OE2
HB_MM 2.00 3.20 171
C A 0002 ALA N 2.197 C A 0001 MET O
C A 0003 ASP N 2.196 C A 0002 ALA O
C A 0004 LYS N 2.197 C A 0003 ASP O
C A 0005 ARG N 2.195 C A 0004 LYS O
C A 0006 ALA N 2.196 C A 0005 ARG O
C A 0007 HIS N 2.445 C A 0005 ARG O
C A 0007 HIS N 2.196 C A 0006 ALA O
C A 0008 HIS N 2.195 C A 0007 HIS O
C A 0009 ASN N 2.197 C A 0008 HIS O
C A 0010 ALA N 2.884 C A 0008 HIS O
C A 0010 ALA N 2.196 C A 0009 ASN O
C A 0011 LEU N 2.197 C A 0010 ALA O
C A 0012 GLU N 3.056 C A 0010 ALA O
C A 0012 GLU N 2.196 C A 0011 LEU O
C A 0013 ARG N 2.202 C A 0012 GLU O
C A 0014 LYS N 2.197 C A 0013 ARG O
C A 0015 ARG N 2.195 C A 0014 LYS O
C A 0016 ARG N 3.002 C A 0014 LYS O
C A 0016 ARG N 2.195 C A 0015 ARG O
H A 0017 ASP N 2.200 C A 0016 ARG O
H A 0018 HIS N 2.202 H A 0017 ASP O
H A 0019 ILE N 2.724 H A 0017 ASP O
H A 0019 ILE N 2.197 H A 0018 HIS O
H A 0020 LYS N 3.156 H A 0017 ASP O
H A 0020 LYS N 2.215 H A 0019 ILE O
H A 0021 ASP N 3.121 H A 0018 HIS O
H A 0021 ASP N 2.439 H A 0019 ILE O
H A 0021 ASP N 2.199 H A 0020 LYS O
H A 0022 SER N 3.089 H A 0018 HIS O
H A 0022 SER N 2.565 H A 0019 ILE O
H A 0022 SER N 2.203 H A 0021 ASP O
H A 0023 PHE N 2.632 H A 0019 ILE O
H A 0023 PHE N 3.164 H A 0020 LYS O
H A 0023 PHE N 3.084 H A 0021 ASP O
H A 0023 PHE N 2.202 H A 0022 SER O
H A 0024 HIS N 2.759 H A 0020 LYS O
H A 0024 HIS N 3.003 H A 0021 ASP O
H A 0024 HIS N 3.124 H A 0022 SER O
H A 0024 HIS N 2.210 H A 0023 PHE O
H A 0025 SER N 2.709 H A 0022 SER O
H A 0025 SER N 2.900 H A 0023 PHE O
H A 0025 SER N 2.204 H A 0024 HIS O
H A 0026 LEU N 2.813 H A 0022 SER O
H A 0026 LEU N 2.431 H A 0023 PHE O
H A 0026 LEU N 3.126 H A 0024 HIS O
H A 0026 LEU N 2.200 H A 0025 SER O
H A 0027 ARG N 2.490 H A 0023 PHE O
H A 0027 ARG N 2.837 H A 0024 HIS O
H A 0027 ARG N 2.204 H A 0026 LEU O
H A 0028 ASP N 2.778 H A 0026 LEU O
H A 0028 ASP N 2.199 H A 0027 ARG O
H A 0029 SER N 2.432 H A 0026 LEU O
H A 0029 SER N 2.199 H A 0028 ASP O
H A 0030 VAL N 3.136 H A 0028 ASP O
H A 0030 VAL N 2.202 H A 0029 SER O
C A 0031 PRO N 2.213 H A 0030 VAL O
H A 0032 SER N 2.198 C A 0031 PRO O
H A 0033 LEU N 2.201 H A 0032 SER O
H A 0034 GLN N 2.849 H A 0032 SER O
H A 0034 GLN N 2.198 H A 0033 LEU O
H A 0035 GLY N 2.859 H A 0032 SER O
H A 0035 GLY N 2.196 H A 0034 GLN O
H A 0036 GLU N 2.854 H A 0033 LEU O
H A 0036 GLU N 2.196 H A 0035 GLY O
H A 0037 LYS N 3.132 H A 0033 LEU O
H A 0037 LYS N 2.198 H A 0036 GLU O
C A 0038 ALA N 2.412 H A 0036 GLU O
C A 0038 ALA N 2.193 H A 0037 LYS O
C A 0039 SER N 2.197 C A 0038 ALA O
C A 0040 ARG N 2.197 C A 0039 SER O
H A 0041 ALA N 2.947 C A 0039 SER O
H A 0041 ALA N 2.197 C A 0040 ARG O
H A 0042 GLN N 2.947 C A 0038 ALA O
H A 0042 GLN N 2.521 C A 0039 SER O
H A 0042 GLN N 3.000 C A 0040 ARG O
H A 0042 GLN N 2.193 H A 0041 ALA O
H A 0043 ILE N 2.798 H A 0041 ALA O
H A 0043 ILE N 2.200 H A 0042 GLN O
H A 0044 LEU N 2.407 H A 0041 ALA O
H A 0044 LEU N 2.197 H A 0043 ILE O
H A 0045 ASP N 2.797 H A 0041 ALA O
H A 0045 ASP N 2.199 H A 0044 LEU O
H A 0046 LYS N 3.140 H A 0044 LEU O
H A 0046 LYS N 2.202 H A 0045 ASP O
H A 0047 ALA N 2.425 H A 0043 ILE O
H A 0047 ALA N 3.091 H A 0044 LEU O
H A 0047 ALA N 2.197 H A 0046 LYS O
H A 0048 THR N 2.692 H A 0044 LEU O
H A 0048 THR N 3.099 H A 0046 LYS O
H A 0048 THR N 2.199 H A 0047 ALA O
H A 0049 GLU N 2.977 H A 0046 LYS O
H A 0049 GLU N 2.197 H A 0048 THR O
H A 0050 TYR N 2.708 H A 0046 LYS O
H A 0050 TYR N 2.196 H A 0049 GLU O
H A 0051 ILE N 2.200 H A 0050 TYR O
H A 0052 GLN N 2.663 H A 0050 TYR O
H A 0052 GLN N 2.197 H A 0051 ILE O
H A 0053 TYR N 2.741 H A 0049 GLU O
H A 0053 TYR N 2.197 H A 0052 GLN O
H A 0054 MET N 2.501 H A 0050 TYR O
H A 0054 MET N 2.197 H A 0053 TYR O
H A 0055 ARG N 3.044 H A 0052 GLN O
H A 0055 ARG N 2.936 H A 0053 TYR O
H A 0055 ARG N 2.198 H A 0054 MET O
H A 0056 ARG N 2.891 H A 0052 GLN O
H A 0056 ARG N 2.722 H A 0053 TYR O
H A 0056 ARG N 2.198 H A 0055 ARG O
H A 0057 LYS N 2.901 H A 0053 TYR O
H A 0057 LYS N 3.150 H A 0055 ARG O
H A 0057 LYS N 2.198 H A 0056 ARG O
H A 0058 VAL N 3.073 H A 0055 ARG O
H A 0058 VAL N 2.195 H A 0057 LYS O
H A 0059 HIS N 3.174 H A 0055 ARG O
H A 0059 HIS N 3.200 H A 0057 LYS O
H A 0059 HIS N 2.196 H A 0058 VAL O
H A 0060 THR N 3.152 H A 0056 ARG O
H A 0060 THR N 3.170 H A 0057 LYS O
H A 0060 THR N 2.196 H A 0059 HIS O
H A 0061 LEU N 2.483 H A 0057 LYS O
H A 0061 LEU N 2.889 H A 0058 VAL O
H A 0061 LEU N 3.145 H A 0059 HIS O
H A 0061 LEU N 2.197 H A 0060 THR O
H A 0062 GLN N 2.798 H A 0058 VAL O
H A 0062 GLN N 2.197 H A 0061 LEU O
H A 0063 GLN N 3.019 H A 0059 HIS O
H A 0063 GLN N 3.193 H A 0060 THR O
H A 0063 GLN N 2.517 H A 0061 LEU O
H A 0063 GLN N 2.196 H A 0062 GLN O
H A 0064 ASP N 2.610 H A 0061 LEU O
H A 0064 ASP N 2.197 H A 0063 GLN O
H A 0065 ILE N 2.972 H A 0062 GLN O
H A 0065 ILE N 2.198 H A 0064 ASP O
H A 0066 ASP N 2.769 H A 0062 GLN O
H A 0066 ASP N 2.199 H A 0065 ILE O
H A 0067 ASP N 2.201 H A 0066 ASP O
H A 0068 LEU N 2.984 H A 0064 ASP O
H A 0068 LEU N 2.199 H A 0067 ASP O
H A 0069 LYS N 2.623 H A 0065 ILE O
H A 0069 LYS N 2.199 H A 0068 LEU O
H A 0070 ARG N 2.197 H A 0069 LYS O
H A 0071 GLN N 3.103 H A 0067 ASP O
H A 0071 GLN N 3.063 H A 0068 LEU O
H A 0071 GLN N 2.198 H A 0070 ARG O
H A 0072 ASN N 2.199 H A 0071 GLN O
H A 0073 ALA N 2.481 H A 0071 GLN O
H A 0073 ALA N 2.197 H A 0072 ASN O
H A 0074 LEU N 2.904 H A 0070 ARG O
H A 0074 LEU N 2.662 H A 0071 GLN O
H A 0074 LEU N 2.198 H A 0073 ALA O
H A 0075 LEU N 2.523 H A 0071 GLN O
H A 0075 LEU N 2.202 H A 0074 LEU O
H A 0076 GLU N 2.865 H A 0072 ASN O
H A 0076 GLU N 2.199 H A 0075 LEU O
H A 0077 GLN N 2.198 H A 0076 GLU O
H A 0078 GLN N 3.067 H A 0075 LEU O
H A 0078 GLN N 2.961 H A 0076 GLU O
H A 0078 GLN N 2.198 H A 0077 GLN O
H A 0079 VAL N 2.987 H A 0075 LEU O
H A 0079 VAL N 2.200 H A 0078 GLN O
H A 0080 ARG N 2.917 H A 0076 GLU O
H A 0080 ARG N 3.025 H A 0078 GLN O
H A 0080 ARG N 2.201 H A 0079 VAL O
H A 0081 ALA N 3.142 H A 0078 GLN O
H A 0081 ALA N 2.199 H A 0080 ARG O
H A 0082 LEU N 2.957 H A 0078 GLN O
H A 0082 LEU N 2.197 H A 0081 ALA O
H A 0083 GLU N 2.196 H A 0082 LEU O
C A 0084 GLY N 2.196 H A 0083 GLU O
C A 0085 SER N 2.196 C A 0084 GLY O
C A 0086 GLY N 2.197 C A 0085 SER O
C A 0087 CYS N 2.201 C A 0086 GLY O
HB_MS 2.00 3.20 11
C A 0015 ARG O 2.875 H A 0018 HIS ND1
H A 0019 ILE O 2.556 H A 0022 SER OG
H A 0023 PHE N 2.825 H A 0022 SER OG
C A 0038 ALA O 2.646 C A 0039 SER OG
H A 0044 LEU O 2.342 H A 0048 THR OG1
H A 0056 ARG O 2.932 H A 0060 THR OG1
H A 0057 LYS O 2.632 H A 0060 THR OG1
H A 0059 HIS O 2.515 H A 0063 GLN NE2
H A 0061 LEU N 2.961 H A 0060 THR OG1
H A 0065 ILE N 2.425 H A 0064 ASP OD1
H A 0073 ALA N 2.640 H A 0072 ASN OD1
AROMATIC 0.00 8.00 2
H A 0057 LYS 5.538 H A 0053 TYR
C A 0014 LYS 6.134 C A 0007 HIS
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 84
H A 0018 HIS CD2 3.675 C B 0039 SER CB
H A 0018 HIS CE1 3.777 C B 0039 SER CB
H A 0018 HIS CE1 3.253 C B 0040 ARG CB
H A 0018 HIS CE1 3.537 C B 0040 ARG CG
H A 0018 HIS CD2 3.299 H B 0041 ALA CB
H A 0019 ILE CD1 2.991 H B 0023 PHE CE2
H A 0019 ILE CD1 2.933 H B 0023 PHE CZ
H A 0019 ILE CD1 3.427 C B 0040 ARG C
H A 0019 ILE CD1 3.433 C B 0040 ARG CB
H A 0019 ILE CA 3.744 H B 0041 ALA CB
H A 0019 ILE CD1 3.382 H B 0041 ALA CA
H A 0019 ILE CD1 3.503 H B 0041 ALA CB
H A 0019 ILE CG2 3.393 H B 0044 LEU CD1
H A 0019 ILE CD1 3.745 H B 0044 LEU CD1
H A 0023 PHE CE2 3.005 H B 0019 ILE CD1
H A 0023 PHE CZ 3.795 H B 0019 ILE CG2
H A 0023 PHE CZ 2.918 H B 0019 ILE CD1
H A 0023 PHE CD1 3.220 H B 0044 LEU CD1
H A 0023 PHE CE1 2.856 H B 0044 LEU CD1
H A 0026 LEU CD1 3.643 H B 0044 LEU CA
H A 0026 LEU CD1 3.353 H B 0044 LEU CB
C A 0039 SER CB 3.678 H B 0018 HIS CD2
C A 0039 SER CB 3.733 H B 0018 HIS CE1
C A 0040 ARG CB 3.246 H B 0018 HIS CE1
C A 0040 ARG CG 3.565 H B 0018 HIS CE1
C A 0040 ARG C 3.408 H B 0019 ILE CD1
C A 0040 ARG CB 3.467 H B 0019 ILE CD1
H A 0041 ALA CB 3.228 H B 0018 HIS CD2
H A 0041 ALA CA 3.324 H B 0019 ILE CD1
H A 0041 ALA CB 3.705 H B 0019 ILE CA
H A 0041 ALA CB 3.448 H B 0019 ILE CD1
H A 0044 LEU CD1 3.329 H B 0019 ILE CG2
H A 0044 LEU CD1 3.664 H B 0019 ILE CD1
H A 0044 LEU CD1 3.222 H B 0023 PHE CD1
H A 0044 LEU CD1 2.854 H B 0023 PHE CE1
H A 0044 LEU CA 3.659 H B 0026 LEU CD1
H A 0044 LEU CB 3.402 H B 0026 LEU CD1
H A 0044 LEU CD2 2.799 H B 0044 LEU CD2
H A 0047 ALA CA 3.512 H B 0051 ILE CD1
H A 0050 TYR CB 3.334 H B 0051 ILE CG1
H A 0050 TYR CG 3.514 H B 0051 ILE CG1
H A 0050 TYR CD2 3.594 H B 0051 ILE CG1
H A 0050 TYR CD2 3.728 H B 0051 ILE CD1
H A 0051 ILE CD1 3.481 H B 0047 ALA CA
H A 0051 ILE CG1 3.365 H B 0050 TYR CB
H A 0051 ILE CG1 3.551 H B 0050 TYR CG
H A 0051 ILE CG1 3.609 H B 0050 TYR CD2
H A 0051 ILE CD1 3.776 H B 0050 TYR CD2
H A 0054 MET CG 3.660 H B 0054 MET CG
H A 0055 ARG CB 3.799 H B 0054 MET CE
H A 0061 LEU CD2 3.609 H B 0062 GLN CD
H A 0061 LEU CD2 3.405 H B 0065 ILE CD1
H A 0062 GLN CD 3.612 H B 0061 LEU CD2
H A 0064 ASP CG 3.454 H B 0065 ILE CG2
H A 0065 ILE CD1 3.319 H B 0061 LEU CD2
H A 0065 ILE CG2 3.437 H B 0064 ASP CG
H A 0065 ILE CG1 3.213 H B 0065 ILE CG1
H A 0065 ILE CG1 3.065 H B 0065 ILE CD1
H A 0065 ILE CD1 3.144 H B 0065 ILE CG1
H A 0065 ILE CD1 3.016 H B 0065 ILE CD1
H A 0065 ILE CG2 3.535 H B 0068 LEU CD1
H A 0068 LEU CD1 3.464 H B 0065 ILE CG2
H A 0068 LEU CB 3.749 H B 0068 LEU CB
H A 0068 LEU CD2 3.767 H B 0072 ASN CG
H A 0071 GLN CB 3.571 H B 0072 ASN CB
H A 0072 ASN CB 3.526 H B 0071 GLN CB
H A 0072 ASN CA 3.669 H B 0075 LEU CD1
H A 0072 ASN CB 3.451 H B 0075 LEU CD1
H A 0075 LEU CD1 3.634 H B 0072 ASN CA
H A 0075 LEU CD1 3.442 H B 0072 ASN CB
H A 0075 LEU C 3.169 H B 0075 LEU CD2
H A 0075 LEU CB 3.670 H B 0075 LEU CB
H A 0075 LEU CB 3.290 H B 0075 LEU CD2
H A 0075 LEU CD2 3.201 H B 0075 LEU C
H A 0075 LEU CD2 3.287 H B 0075 LEU CB
H A 0075 LEU CD2 3.061 H B 0076 GLU CA
H A 0075 LEU CD2 3.301 H B 0076 GLU CB
H A 0076 GLU CA 3.035 H B 0075 LEU CD2
H A 0076 GLU CB 3.302 H B 0075 LEU CD2
H A 0078 GLN CG 3.764 H B 0079 VAL CG2
H A 0079 VAL CG2 3.793 H B 0079 VAL CG2
H A 0082 LEU CG 3.162 H B 0082 LEU CD1
H A 0082 LEU CD1 3.165 H B 0082 LEU CG
H A 0082 LEU CD1 2.813 H B 0082 LEU CD1
CHARGE_ATTR 2.00 12.00 35
H A 0017 ASP OD2 11.98 C B 0016 ARG NH2
H A 0017 ASP OD2 11.75 H B 0020 LYS NZ
H A 0017 ASP OD2 11.31 C B 0040 ARG NH1
H A 0017 ASP OD2 11.25 C B 0040 ARG NH2
H A 0018 HIS ND1 11.93 H B 0036 GLU OE2
H A 0018 HIS NE2 11.55 H B 0036 GLU OE1
H A 0018 HIS NE2 10.57 H B 0036 GLU OE2
H A 0018 HIS ND1 10.57 H B 0045 ASP OD1
H A 0018 HIS ND1 11.97 H B 0045 ASP OD2
H A 0018 HIS NE2 9.404 H B 0045 ASP OD1
H A 0018 HIS NE2 10.57 H B 0045 ASP OD2
H A 0020 LYS NZ 11.74 H B 0017 ASP OD2
H A 0028 ASP OD1 11.48 H B 0055 ARG NH1
H A 0028 ASP OD1 11.36 H B 0055 ARG NH2
H A 0028 ASP OD2 9.700 H B 0055 ARG NH1
H A 0028 ASP OD2 9.448 H B 0055 ARG NH2
H A 0036 GLU OE1 11.49 H B 0018 HIS NE2
H A 0036 GLU OE2 11.87 H B 0018 HIS ND1
H A 0036 GLU OE2 10.51 H B 0018 HIS NE2
C A 0040 ARG NH1 11.32 H B 0017 ASP OD2
C A 0040 ARG NH2 11.26 H B 0017 ASP OD2
H A 0045 ASP OD1 10.49 H B 0018 HIS ND1
H A 0045 ASP OD1 9.331 H B 0018 HIS NE2
H A 0045 ASP OD2 11.89 H B 0018 HIS ND1
H A 0045 ASP OD2 10.50 H B 0018 HIS NE2
H A 0055 ARG NH1 11.42 H B 0028 ASP OD1
H A 0055 ARG NH1 9.636 H B 0028 ASP OD2
H A 0055 ARG NH2 11.28 H B 0028 ASP OD1
H A 0055 ARG NH2 9.370 H B 0028 ASP OD2
H A 0064 ASP OD1 7.865 H B 0069 LYS NZ
H A 0064 ASP OD2 7.353 H B 0069 LYS NZ
H A 0067 ASP OD2 11.29 H B 0069 LYS NZ
H A 0069 LYS NZ 7.837 H B 0064 ASP OD1
H A 0069 LYS NZ 7.315 H B 0064 ASP OD2
H A 0069 LYS NZ 11.33 H B 0067 ASP OD2
CHARGE_REPU 2.00 12.00 74
C A 0014 LYS NZ 11.33 C B 0040 ARG NH1
C A 0015 ARG NH2 11.92 H B 0020 LYS NZ
C A 0015 ARG NH1 11.46 H B 0037 LYS NZ
C A 0015 ARG NH1 7.594 C B 0040 ARG NH1
C A 0015 ARG NH1 9.568 C B 0040 ARG NH2
C A 0015 ARG NH2 6.296 C B 0040 ARG NH1
C A 0015 ARG NH2 8.345 C B 0040 ARG NH2
C A 0016 ARG NH1 9.394 C B 0016 ARG NH1
C A 0016 ARG NH1 7.630 C B 0016 ARG NH2
C A 0016 ARG NH2 7.640 C B 0016 ARG NH1
C A 0016 ARG NH2 5.817 C B 0016 ARG NH2
C A 0016 ARG NH1 9.946 H B 0020 LYS NZ
C A 0016 ARG NH2 9.116 H B 0020 LYS NZ
C A 0016 ARG NH1 10.81 C B 0040 ARG NH1
C A 0016 ARG NH1 9.927 C B 0040 ARG NH2
C A 0016 ARG NH2 10.09 C B 0040 ARG NH1
C A 0016 ARG NH2 8.960 C B 0040 ARG NH2
H A 0018 HIS ND1 9.099 H B 0020 LYS NZ
H A 0018 HIS NE2 8.548 H B 0020 LYS NZ
H A 0018 HIS ND1 7.367 C B 0040 ARG NH1
H A 0018 HIS ND1 8.116 C B 0040 ARG NH2
H A 0018 HIS NE2 7.365 C B 0040 ARG NH1
H A 0018 HIS NE2 8.046 C B 0040 ARG NH2
H A 0020 LYS NZ 11.92 C B 0015 ARG NH2
H A 0020 LYS NZ 9.905 C B 0016 ARG NH1
H A 0020 LYS NZ 9.061 C B 0016 ARG NH2
H A 0020 LYS NZ 9.129 H B 0018 HIS ND1
H A 0020 LYS NZ 8.593 H B 0018 HIS NE2
H A 0020 LYS NZ 8.485 H B 0020 LYS NZ
H A 0020 LYS NZ 11.72 C B 0040 ARG NH1
H A 0020 LYS NZ 10.52 C B 0040 ARG NH2
H A 0021 ASP OD1 9.679 H B 0045 ASP OD1
H A 0021 ASP OD1 11.79 H B 0045 ASP OD2
H A 0021 ASP OD2 11.24 H B 0045 ASP OD1
H A 0037 LYS NZ 11.41 C B 0015 ARG NH1
C A 0040 ARG NH1 11.34 C B 0014 LYS NZ
C A 0040 ARG NH1 7.621 C B 0015 ARG NH1
C A 0040 ARG NH1 6.308 C B 0015 ARG NH2
C A 0040 ARG NH2 9.595 C B 0015 ARG NH1
C A 0040 ARG NH2 8.362 C B 0015 ARG NH2
C A 0040 ARG NH1 10.79 C B 0016 ARG NH1
C A 0040 ARG NH1 10.05 C B 0016 ARG NH2
C A 0040 ARG NH2 9.906 C B 0016 ARG NH1
C A 0040 ARG NH2 8.922 C B 0016 ARG NH2
C A 0040 ARG NH1 7.422 H B 0018 HIS ND1
C A 0040 ARG NH1 7.433 H B 0018 HIS NE2
C A 0040 ARG NH2 8.171 H B 0018 HIS ND1
C A 0040 ARG NH2 8.113 H B 0018 HIS NE2
C A 0040 ARG NH1 11.73 H B 0020 LYS NZ
C A 0040 ARG NH2 10.54 H B 0020 LYS NZ
H A 0045 ASP OD1 9.657 H B 0021 ASP OD1
H A 0045 ASP OD1 11.21 H B 0021 ASP OD2
H A 0045 ASP OD2 11.76 H B 0021 ASP OD1
H A 0064 ASP OD1 5.717 H B 0064 ASP OD1
H A 0064 ASP OD1 7.342 H B 0064 ASP OD2
H A 0064 ASP OD2 7.350 H B 0064 ASP OD1
H A 0064 ASP OD2 8.939 H B 0064 ASP OD2
H A 0064 ASP OD1 9.924 H B 0066 ASP OD1
H A 0064 ASP OD1 8.775 H B 0066 ASP OD2
H A 0064 ASP OD2 9.960 H B 0066 ASP OD1
H A 0064 ASP OD2 8.758 H B 0066 ASP OD2
H A 0066 ASP OD1 9.915 H B 0064 ASP OD1
H A 0066 ASP OD1 9.951 H B 0064 ASP OD2
H A 0066 ASP OD2 8.780 H B 0064 ASP OD1
H A 0066 ASP OD2 8.762 H B 0064 ASP OD2
H A 0067 ASP OD1 11.13 H B 0076 GLU OE1
H A 0067 ASP OD1 11.85 H B 0076 GLU OE2
H A 0067 ASP OD2 9.642 H B 0076 GLU OE1
H A 0067 ASP OD2 10.15 H B 0076 GLU OE2
H A 0076 GLU OE1 11.07 H B 0067 ASP OD1
H A 0076 GLU OE1 9.581 H B 0067 ASP OD2
H A 0076 GLU OE2 11.81 H B 0067 ASP OD1
H A 0076 GLU OE2 10.10 H B 0067 ASP OD2
H A 0076 GLU OE1 11.32 H B 0076 GLU OE1
HB_SS 2.00 3.20 1
H A 0072 ASN ND2 2.433 H B 0071 GLN OE1
AROMATIC 0.00 8.00 2
H A 0018 HIS 7.912 C B 0040 ARG
C A 0040 ARG 7.974 H B 0018 HIS
SS_BOND 1.50 2.80 1
C A 0087 CYS SG 2.020 C B 0087 CYS SG
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 368
C B 0001 MET C 2.422 C B 0002 ALA CA
C B 0001 MET C 3.672 C B 0002 ALA C
C B 0001 MET C 3.082 C B 0002 ALA CB
C B 0001 MET CE 3.555 C B 0008 HIS CE1
C B 0002 ALA C 2.423 C B 0003 ASP CA
C B 0002 ALA C 3.073 C B 0003 ASP C
C B 0002 ALA C 3.632 C B 0003 ASP CB
C B 0003 ASP C 2.424 C B 0004 LYS CA
C B 0003 ASP C 3.109 C B 0004 LYS C
C B 0003 ASP C 3.626 C B 0004 LYS CB
C B 0004 LYS C 2.420 C B 0005 ARG CA
C B 0004 LYS C 3.199 C B 0005 ARG C
C B 0004 LYS C 3.593 C B 0005 ARG CB
C B 0005 ARG C 2.423 C B 0006 ALA CA
C B 0005 ARG C 2.921 C B 0006 ALA C
C B 0005 ARG C 2.924 C B 0006 ALA CB
C B 0006 ALA C 2.423 C B 0007 HIS CA
C B 0006 ALA C 3.478 C B 0007 HIS C
C B 0006 ALA C 3.411 C B 0007 HIS CB
C B 0007 HIS C 2.424 C B 0008 HIS CA
C B 0007 HIS C 3.454 C B 0008 HIS C
C B 0007 HIS C 3.438 C B 0008 HIS CB
C B 0007 HIS CE1 3.489 C B 0014 LYS CG
C B 0008 HIS C 2.423 C B 0009 ASN CA
C B 0008 HIS C 3.016 C B 0009 ASN C
C B 0008 HIS C 2.826 C B 0009 ASN CB
C B 0009 ASN C 2.423 C B 0010 ALA CA
C B 0009 ASN C 3.346 C B 0010 ALA C
C B 0009 ASN C 3.520 C B 0010 ALA CB
C B 0010 ALA C 2.420 C B 0011 LEU CA
C B 0010 ALA C 2.856 C B 0011 LEU C
C B 0010 ALA C 3.622 C B 0011 LEU CB
C B 0011 LEU C 2.424 C B 0012 GLU CA
C B 0011 LEU C 3.038 C B 0012 GLU C
C B 0011 LEU C 3.635 C B 0012 GLU CB
C B 0012 GLU C 2.438 C B 0013 ARG CA
C B 0012 GLU C 2.853 C B 0013 ARG C
C B 0012 GLU C 3.103 C B 0013 ARG CB
C B 0012 GLU C 3.112 C B 0013 ARG CG
C B 0012 GLU C 3.014 C B 0013 ARG CD
C B 0013 ARG C 2.426 C B 0014 LYS CA
C B 0013 ARG C 3.689 C B 0014 LYS C
C B 0013 ARG C 3.013 C B 0014 LYS CB
C B 0013 ARG C 3.729 C B 0014 LYS CG
C B 0013 ARG CB 3.765 H B 0017 ASP CG
C B 0013 ARG CG 3.606 H B 0017 ASP CG
C B 0014 LYS C 2.427 C B 0015 ARG CA
C B 0014 LYS C 3.204 C B 0015 ARG C
C B 0014 LYS C 3.601 C B 0015 ARG CB
C B 0014 LYS CE 3.725 C B 0015 ARG CG
C B 0015 ARG C 2.421 C B 0016 ARG CA
C B 0015 ARG C 3.356 C B 0016 ARG C
C B 0015 ARG C 3.508 C B 0016 ARG CB
C B 0016 ARG C 2.428 H B 0017 ASP CA
C B 0016 ARG C 3.512 H B 0017 ASP C
C B 0016 ARG C 3.382 H B 0017 ASP CB
H B 0017 ASP C 2.417 H B 0018 HIS CA
H B 0017 ASP C 2.842 H B 0018 HIS C
H B 0017 ASP C 3.636 H B 0018 HIS CB
H B 0018 HIS C 2.419 H B 0019 ILE CA
H B 0018 HIS C 2.889 H B 0019 ILE C
H B 0018 HIS C 3.644 H B 0019 ILE CB
H B 0018 HIS CD2 3.628 H B 0019 ILE CA
H B 0018 HIS CD2 3.441 H B 0019 ILE CG1
H B 0018 HIS CE1 3.659 H B 0019 ILE CG1
H B 0019 ILE C 2.453 H B 0020 LYS CA
H B 0019 ILE C 2.800 H B 0020 LYS C
H B 0019 ILE C 3.586 H B 0020 LYS CB
H B 0019 ILE CG2 3.680 H B 0023 PHE CG
H B 0019 ILE CG2 3.469 H B 0023 PHE CD1
H B 0019 ILE CG2 3.595 H B 0023 PHE CD2
H B 0019 ILE CG2 3.151 H B 0023 PHE CE1
H B 0019 ILE CG2 3.285 H B 0023 PHE CE2
H B 0019 ILE CG2 3.049 H B 0023 PHE CZ
H B 0020 LYS C 2.413 H B 0021 ASP CA
H B 0020 LYS C 2.897 H B 0021 ASP C
H B 0020 LYS C 3.641 H B 0021 ASP CB
H B 0020 LYS CA 3.264 H B 0023 PHE CB
H B 0020 LYS CA 3.689 H B 0023 PHE CG
H B 0020 LYS CA 3.637 H B 0023 PHE CD2
H B 0020 LYS C 3.340 H B 0023 PHE CB
H B 0020 LYS CD 3.546 H B 0023 PHE CD2
H B 0021 ASP C 2.415 H B 0022 SER CA
H B 0021 ASP C 2.882 H B 0022 SER C
H B 0021 ASP C 3.635 H B 0022 SER CB
H B 0022 SER C 2.428 H B 0023 PHE CA
H B 0022 SER C 2.821 H B 0023 PHE C
H B 0022 SER C 3.615 H B 0023 PHE CB
H B 0023 PHE C 2.427 H B 0024 HIS CA
H B 0023 PHE C 2.802 H B 0024 HIS C
H B 0023 PHE C 3.621 H B 0024 HIS CB
H B 0023 PHE C 3.738 H B 0026 LEU CB
H B 0023 PHE CE1 3.601 H B 0044 LEU CD1
H B 0023 PHE CE1 3.590 H B 0044 LEU CD2
H B 0023 PHE CZ 3.412 H B 0044 LEU CD1
H B 0024 HIS C 2.417 H B 0025 SER CA
H B 0024 HIS C 2.883 H B 0025 SER C
H B 0024 HIS C 3.640 H B 0025 SER CB
H B 0024 HIS CA 3.745 H B 0027 ARG CB
H B 0024 HIS C 3.613 H B 0027 ARG CB
H B 0025 SER C 2.422 H B 0026 LEU CA
H B 0025 SER C 3.010 H B 0026 LEU C
H B 0025 SER C 3.630 H B 0026 LEU CB
H B 0026 LEU C 2.426 H B 0027 ARG CA
H B 0026 LEU C 2.831 H B 0027 ARG C
H B 0026 LEU C 3.622 H B 0027 ARG CB
H B 0026 LEU CA 3.635 H B 0029 SER CB
H B 0026 LEU C 3.569 H B 0029 SER CB
H B 0026 LEU CA 3.788 H B 0043 ILE CG2
H B 0026 LEU C 3.269 H B 0043 ILE CG2
H B 0026 LEU CB 3.325 H B 0043 ILE CG2
H B 0026 LEU CD2 3.507 H B 0043 ILE CG2
H B 0027 ARG C 2.422 H B 0028 ASP CA
H B 0027 ARG C 3.144 H B 0028 ASP C
H B 0027 ARG C 3.613 H B 0028 ASP CB
H B 0028 ASP C 2.413 H B 0029 SER CA
H B 0028 ASP C 2.816 H B 0029 SER C
H B 0028 ASP C 3.633 H B 0029 SER CB
H B 0029 SER C 2.414 H B 0030 VAL CA
H B 0029 SER C 3.269 H B 0030 VAL C
H B 0029 SER C 3.539 H B 0030 VAL CB
H B 0029 SER C 3.587 H B 0030 VAL CG2
H B 0030 VAL CA 3.796 C B 0031 PRO CA
H B 0030 VAL CA 2.866 C B 0031 PRO CD
H B 0030 VAL C 2.412 C B 0031 PRO CA
H B 0030 VAL C 3.077 C B 0031 PRO C
H B 0030 VAL C 3.593 C B 0031 PRO CB
H B 0030 VAL C 3.616 C B 0031 PRO CG
H B 0030 VAL C 2.481 C B 0031 PRO CD
H B 0030 VAL CB 3.421 H B 0033 LEU CB
H B 0030 VAL CB 3.289 H B 0033 LEU CG
H B 0030 VAL CB 3.363 H B 0033 LEU CD2
H B 0030 VAL CG1 3.602 H B 0033 LEU CB
H B 0030 VAL CG1 3.533 H B 0033 LEU CG
H B 0030 VAL CG1 3.001 H B 0033 LEU CD2
H B 0030 VAL CG1 3.644 H B 0046 LYS CG
H B 0030 VAL CG1 3.757 H B 0046 LYS CD
H B 0030 VAL CG2 3.741 H B 0046 LYS CB
H B 0030 VAL CG2 3.735 H B 0050 TYR CE2
C B 0031 PRO C 2.426 H B 0032 SER CA
C B 0031 PRO C 3.205 H B 0032 SER C
C B 0031 PRO C 3.596 H B 0032 SER CB
H B 0032 SER C 2.436 H B 0033 LEU CA
H B 0032 SER C 2.909 H B 0033 LEU C
H B 0032 SER C 3.632 H B 0033 LEU CB
H B 0033 LEU C 2.424 H B 0034 GLN CA
H B 0033 LEU C 2.956 H B 0034 GLN C
H B 0033 LEU C 3.638 H B 0034 GLN CB
H B 0033 LEU CD1 3.151 H B 0042 GLN C
H B 0033 LEU CD1 3.370 H B 0042 GLN CB
H B 0033 LEU CD1 3.455 H B 0042 GLN CG
H B 0033 LEU CD1 3.634 H B 0042 GLN CD
H B 0033 LEU CD1 3.566 H B 0043 ILE CA
H B 0033 LEU CD2 3.518 H B 0046 LYS CB
H B 0033 LEU CD2 3.787 H B 0046 LYS CG
H B 0033 LEU CD2 3.308 H B 0046 LYS CD
H B 0034 GLN C 2.424 H B 0035 GLY CA
H B 0034 GLN C 3.143 H B 0035 GLY C
H B 0035 GLY C 2.421 H B 0036 GLU CA
H B 0035 GLY C 3.493 H B 0036 GLU C
H B 0035 GLY C 3.392 H B 0036 GLU CB
H B 0036 GLU C 2.424 H B 0037 LYS CA
H B 0036 GLU C 2.890 H B 0037 LYS C
H B 0036 GLU C 3.648 H B 0037 LYS CB
H B 0036 GLU C 3.468 H B 0037 LYS CD
H B 0037 LYS C 2.425 C B 0038 ALA CA
H B 0037 LYS C 3.331 C B 0038 ALA C
H B 0037 LYS C 3.536 C B 0038 ALA CB
C B 0038 ALA C 2.428 C B 0039 SER CA
C B 0038 ALA C 3.042 C B 0039 SER C
C B 0038 ALA C 2.811 C B 0039 SER CB
C B 0038 ALA CA 3.519 H B 0042 GLN CB
C B 0038 ALA C 3.579 H B 0042 GLN CA
C B 0038 ALA C 3.337 H B 0042 GLN CB
C B 0038 ALA CB 3.536 H B 0042 GLN CA
C B 0038 ALA CB 3.635 H B 0042 GLN CB
C B 0039 SER C 2.430 C B 0040 ARG CA
C B 0039 SER C 2.897 C B 0040 ARG C
C B 0039 SER C 3.635 C B 0040 ARG CB
C B 0040 ARG C 2.426 H B 0041 ALA CA
C B 0040 ARG C 3.127 H B 0041 ALA C
C B 0040 ARG C 3.622 H B 0041 ALA CB
H B 0041 ALA C 2.417 H B 0042 GLN CA
H B 0041 ALA C 2.866 H B 0042 GLN C
H B 0041 ALA C 3.607 H B 0042 GLN CB
H B 0041 ALA CA 3.728 H B 0044 LEU CB
H B 0041 ALA CA 3.385 H B 0044 LEU CG
H B 0041 ALA CA 3.430 H B 0044 LEU CD1
H B 0041 ALA C 3.640 H B 0044 LEU CB
H B 0041 ALA C 3.685 H B 0044 LEU CG
H B 0041 ALA CB 3.645 H B 0044 LEU CB
H B 0041 ALA CB 3.662 H B 0044 LEU CG
H B 0041 ALA CB 3.323 H B 0044 LEU CD1
H B 0042 GLN C 2.409 H B 0043 ILE CA
H B 0042 GLN C 3.046 H B 0043 ILE C
H B 0042 GLN C 3.664 H B 0043 ILE CB
H B 0042 GLN CG 3.723 H B 0043 ILE CG1
H B 0042 GLN CG 3.747 H B 0043 ILE CD1
H B 0043 ILE CA 3.800 H B 0044 LEU CA
H B 0043 ILE C 2.419 H B 0044 LEU CA
H B 0043 ILE C 3.032 H B 0044 LEU C
H B 0043 ILE C 3.619 H B 0044 LEU CB
H B 0043 ILE C 3.632 H B 0047 ALA CB
H B 0044 LEU C 2.415 H B 0045 ASP CA
H B 0044 LEU C 2.871 H B 0045 ASP C
H B 0044 LEU C 3.631 H B 0045 ASP CB
H B 0044 LEU CA 3.589 H B 0047 ALA CB
H B 0045 ASP C 2.418 H B 0046 LYS CA
H B 0045 ASP C 3.134 H B 0046 LYS C
H B 0045 ASP C 3.615 H B 0046 LYS CB
H B 0046 LYS C 2.421 H B 0047 ALA CA
H B 0046 LYS C 2.918 H B 0047 ALA C
H B 0046 LYS C 3.644 H B 0047 ALA CB
H B 0046 LYS CA 3.720 H B 0049 GLU CG
H B 0046 LYS C 3.764 H B 0049 GLU CG
H B 0046 LYS C 3.717 H B 0050 TYR CD2
H B 0046 LYS CG 3.572 H B 0050 TYR CE2
H B 0047 ALA C 2.423 H B 0048 THR CA
H B 0047 ALA C 3.060 H B 0048 THR C
H B 0047 ALA C 3.635 H B 0048 THR CB
H B 0048 THR C 2.419 H B 0049 GLU CA
H B 0048 THR C 3.034 H B 0049 GLU C
H B 0048 THR C 3.647 H B 0049 GLU CB
H B 0049 GLU C 2.423 H B 0050 TYR CA
H B 0049 GLU C 3.018 H B 0050 TYR C
H B 0049 GLU C 3.638 H B 0050 TYR CB
H B 0049 GLU CD 3.519 H B 0053 TYR CD2
H B 0050 TYR C 2.430 H B 0051 ILE CA
H B 0050 TYR C 2.842 H B 0051 ILE C
H B 0050 TYR C 3.616 H B 0051 ILE CB
H B 0050 TYR C 3.245 H B 0054 MET CB
H B 0050 TYR CD1 3.141 H B 0054 MET CE
H B 0050 TYR CE1 3.274 H B 0054 MET CE
H B 0051 ILE C 2.423 H B 0052 GLN CA
H B 0051 ILE C 3.125 H B 0052 GLN C
H B 0051 ILE C 3.622 H B 0052 GLN CB
H B 0052 GLN C 2.422 H B 0053 TYR CA
H B 0052 GLN C 2.926 H B 0053 TYR C
H B 0052 GLN C 3.645 H B 0053 TYR CB
H B 0053 TYR C 2.421 H B 0054 MET CA
H B 0053 TYR C 2.845 H B 0054 MET C
H B 0053 TYR C 3.627 H B 0054 MET CB
H B 0053 TYR CD2 3.551 H B 0054 MET CA
H B 0054 MET C 2.422 H B 0055 ARG CA
H B 0054 MET C 2.988 H B 0055 ARG C
H B 0054 MET C 3.641 H B 0055 ARG CB
H B 0055 ARG C 2.422 H B 0056 ARG CA
H B 0055 ARG C 2.912 H B 0056 ARG C
H B 0055 ARG C 3.635 H B 0056 ARG CB
H B 0056 ARG C 2.423 H B 0057 LYS CA
H B 0056 ARG C 2.942 H B 0057 LYS C
H B 0056 ARG C 3.638 H B 0057 LYS CB
H B 0057 LYS C 2.422 H B 0058 VAL CA
H B 0057 LYS C 2.872 H B 0058 VAL C
H B 0057 LYS C 3.625 H B 0058 VAL CB
H B 0057 LYS C 3.736 H B 0061 LEU CB
H B 0057 LYS C 3.726 H B 0061 LEU CG
H B 0057 LYS C 3.484 H B 0061 LEU CD1
H B 0058 VAL C 2.422 H B 0059 HIS CA
H B 0058 VAL C 2.871 H B 0059 HIS C
H B 0058 VAL C 3.625 H B 0059 HIS CB
H B 0058 VAL CA 3.718 H B 0061 LEU CB
H B 0058 VAL C 3.705 H B 0061 LEU CB
H B 0059 HIS C 2.420 H B 0060 THR CA
H B 0059 HIS C 2.947 H B 0060 THR C
H B 0059 HIS C 3.637 H B 0060 THR CB
H B 0060 THR C 2.422 H B 0061 LEU CA
H B 0060 THR C 2.960 H B 0061 LEU C
H B 0060 THR C 3.641 H B 0061 LEU CB
H B 0060 THR CA 3.732 H B 0063 GLN CB
H B 0060 THR C 3.483 H B 0063 GLN CB
H B 0061 LEU C 2.424 H B 0062 GLN CA
H B 0061 LEU C 2.839 H B 0062 GLN C
H B 0061 LEU C 3.621 H B 0062 GLN CB
H B 0061 LEU C 3.525 H B 0064 ASP CG
H B 0061 LEU C 3.549 H B 0065 ILE CG1
H B 0062 GLN C 2.420 H B 0063 GLN CA
H B 0062 GLN C 2.956 H B 0063 GLN C
H B 0062 GLN C 3.639 H B 0063 GLN CB
H B 0062 GLN CA 3.183 H B 0065 ILE CG1
H B 0062 GLN CA 3.300 H B 0065 ILE CD1
H B 0062 GLN C 3.566 H B 0065 ILE CG1
H B 0063 GLN C 2.424 H B 0064 ASP CA
H B 0063 GLN C 3.112 H B 0064 ASP C
H B 0063 GLN C 3.627 H B 0064 ASP CB
H B 0064 ASP C 2.425 H B 0065 ILE CA
H B 0064 ASP C 3.128 H B 0065 ILE C
H B 0064 ASP C 3.644 H B 0065 ILE CB
H B 0064 ASP C 3.774 H B 0065 ILE CG1
H B 0064 ASP C 3.457 H B 0068 LEU CD1
H B 0065 ILE C 2.421 H B 0066 ASP CA
H B 0065 ILE C 2.971 H B 0066 ASP C
H B 0065 ILE C 3.640 H B 0066 ASP CB
H B 0066 ASP C 2.423 H B 0067 ASP CA
H B 0066 ASP C 3.060 H B 0067 ASP C
H B 0066 ASP C 3.635 H B 0067 ASP CB
H B 0067 ASP C 2.424 H B 0068 LEU CA
H B 0067 ASP C 2.997 H B 0068 LEU C
H B 0067 ASP C 3.642 H B 0068 LEU CB
H B 0068 LEU C 2.425 H B 0069 LYS CA
H B 0068 LEU C 2.957 H B 0069 LYS C
H B 0068 LEU C 3.639 H B 0069 LYS CB
H B 0068 LEU CA 3.787 H B 0071 GLN CD
H B 0069 LYS C 2.422 H B 0070 ARG CA
H B 0069 LYS C 3.030 H B 0070 ARG C
H B 0069 LYS C 3.637 H B 0070 ARG CB
H B 0070 ARG C 2.424 H B 0071 GLN CA
H B 0070 ARG C 2.957 H B 0071 GLN C
H B 0070 ARG C 3.640 H B 0071 GLN CB
H B 0070 ARG CA 3.763 H B 0073 ALA CB
H B 0070 ARG C 3.596 H B 0073 ALA CB
H B 0071 GLN C 2.430 H B 0072 ASN CA
H B 0071 GLN C 2.842 H B 0072 ASN C
H B 0071 GLN C 3.615 H B 0072 ASN CB
H B 0071 GLN CA 3.306 H B 0075 LEU CD1
H B 0071 GLN C 3.542 H B 0075 LEU CB
H B 0071 GLN C 3.777 H B 0075 LEU CG
H B 0071 GLN C 2.971 H B 0075 LEU CD1
H B 0071 GLN CB 3.219 H B 0075 LEU CD1
H B 0072 ASN C 2.422 H B 0073 ALA CA
H B 0072 ASN C 2.999 H B 0073 ALA C
H B 0072 ASN C 3.641 H B 0073 ALA CB
H B 0072 ASN CA 3.427 H B 0075 LEU CB
H B 0072 ASN C 3.773 H B 0075 LEU CB
H B 0073 ALA C 2.421 H B 0074 LEU CA
H B 0073 ALA C 3.146 H B 0074 LEU C
H B 0073 ALA C 3.606 H B 0074 LEU CB
H B 0073 ALA C 3.300 H B 0074 LEU CD1
H B 0073 ALA CB 3.572 H B 0074 LEU CD1
H B 0074 LEU C 2.425 H B 0075 LEU CA
H B 0074 LEU C 3.006 H B 0075 LEU C
H B 0074 LEU C 3.631 H B 0075 LEU CB
H B 0075 LEU C 2.424 H B 0076 GLU CA
H B 0075 LEU C 3.037 H B 0076 GLU C
H B 0075 LEU C 3.637 H B 0076 GLU CB
H B 0076 GLU C 2.425 H B 0077 GLN CA
H B 0076 GLU C 3.022 H B 0077 GLN C
H B 0076 GLU C 3.640 H B 0077 GLN CB
H B 0077 GLN C 2.422 H B 0078 GLN CA
H B 0077 GLN C 3.332 H B 0078 GLN C
H B 0077 GLN C 3.504 H B 0078 GLN CB
H B 0078 GLN CA 3.787 H B 0079 VAL CA
H B 0078 GLN C 2.416 H B 0079 VAL CA
H B 0078 GLN C 2.955 H B 0079 VAL C
H B 0078 GLN C 3.615 H B 0079 VAL CB
H B 0079 VAL C 2.427 H B 0080 ARG CA
H B 0079 VAL C 3.327 H B 0080 ARG C
H B 0079 VAL C 3.535 H B 0080 ARG CB
H B 0080 ARG C 2.424 H B 0081 ALA CA
H B 0080 ARG C 3.192 H B 0081 ALA C
H B 0080 ARG C 3.601 H B 0081 ALA CB
H B 0080 ARG CA 3.594 H B 0083 GLU CD
H B 0081 ALA C 2.427 H B 0082 LEU CA
H B 0081 ALA C 3.492 H B 0082 LEU C
H B 0081 ALA C 3.401 H B 0082 LEU CB
H B 0082 LEU C 2.423 H B 0083 GLU CA
H B 0082 LEU C 2.902 H B 0083 GLU C
H B 0082 LEU C 3.632 H B 0083 GLU CB
H B 0083 GLU C 2.423 C B 0084 GLY CA
H B 0083 GLU C 3.311 C B 0084 GLY C
C B 0084 GLY C 2.423 C B 0085 SER CA
C B 0084 GLY C 3.009 C B 0085 SER C
C B 0084 GLY C 2.829 C B 0085 SER CB
C B 0085 SER C 2.423 C B 0086 GLY CA
C B 0085 SER C 3.673 C B 0086 GLY C
C B 0086 GLY C 2.430 C B 0087 CYS CA
C B 0086 GLY C 2.840 C B 0087 CYS C
C B 0086 GLY C 3.609 C B 0087 CYS CB
CHARGE_ATTR 2.00 12.00 118
C B 0003 ASP OD1 11.39 C B 0004 LYS NZ
C B 0003 ASP OD2 11.43 C B 0004 LYS NZ
C B 0003 ASP OD1 10.29 C B 0005 ARG NH1
C B 0003 ASP OD1 9.333 C B 0005 ARG NH2
C B 0003 ASP OD2 11.01 C B 0005 ARG NH1
C B 0003 ASP OD2 10.29 C B 0005 ARG NH2
C B 0003 ASP OD2 11.48 C B 0008 HIS ND1
C B 0012 GLU OE1 8.500 C B 0004 LYS NZ
C B 0012 GLU OE2 6.748 C B 0004 LYS NZ
C B 0012 GLU OE2 10.76 C B 0005 ARG NH1
C B 0012 GLU OE2 10.52 C B 0005 ARG NH2
C B 0012 GLU OE1 7.875 C B 0007 HIS ND1
C B 0012 GLU OE1 8.423 C B 0007 HIS NE2
C B 0012 GLU OE2 6.634 C B 0007 HIS ND1
C B 0012 GLU OE2 7.689 C B 0007 HIS NE2
C B 0012 GLU OE1 10.29 C B 0008 HIS ND1
C B 0012 GLU OE2 9.673 C B 0008 HIS ND1
C B 0012 GLU OE2 11.76 C B 0008 HIS NE2
C B 0012 GLU OE1 7.193 C B 0013 ARG NH1
C B 0012 GLU OE1 9.050 C B 0013 ARG NH2
C B 0012 GLU OE2 8.493 C B 0013 ARG NH1
C B 0012 GLU OE2 10.19 C B 0013 ARG NH2
H B 0017 ASP OD1 10.53 C B 0007 HIS ND1
H B 0017 ASP OD1 9.521 C B 0007 HIS NE2
H B 0017 ASP OD2 9.573 C B 0007 HIS ND1
H B 0017 ASP OD2 8.932 C B 0007 HIS NE2
H B 0017 ASP OD1 5.568 C B 0013 ARG NH1
H B 0017 ASP OD1 4.453 C B 0013 ARG NH2
H B 0017 ASP OD2 6.603 C B 0013 ARG NH1
H B 0017 ASP OD2 6.087 C B 0013 ARG NH2
H B 0017 ASP OD1 10.27 C B 0014 LYS NZ
H B 0017 ASP OD2 9.467 C B 0014 LYS NZ
H B 0017 ASP OD1 11.34 C B 0015 ARG NH1
H B 0017 ASP OD2 10.76 C B 0015 ARG NH1
H B 0017 ASP OD2 11.72 C B 0015 ARG NH2
H B 0017 ASP OD1 6.603 C B 0016 ARG NH1
H B 0017 ASP OD1 8.640 C B 0016 ARG NH2
H B 0017 ASP OD2 4.808 C B 0016 ARG NH1
H B 0017 ASP OD2 6.787 C B 0016 ARG NH2
H B 0017 ASP OD1 6.378 H B 0018 HIS ND1
H B 0017 ASP OD1 8.089 H B 0018 HIS NE2
H B 0017 ASP OD2 6.740 H B 0018 HIS ND1
H B 0017 ASP OD2 8.642 H B 0018 HIS NE2
H B 0017 ASP OD1 7.247 H B 0020 LYS NZ
H B 0017 ASP OD2 7.269 H B 0020 LYS NZ
H B 0017 ASP OD1 9.896 H B 0024 HIS ND1
H B 0017 ASP OD1 9.855 H B 0024 HIS NE2
H B 0017 ASP OD2 11.66 H B 0024 HIS ND1
H B 0017 ASP OD2 11.35 H B 0024 HIS NE2
H B 0017 ASP OD1 10.40 C B 0040 ARG NH2
H B 0017 ASP OD2 10.22 C B 0040 ARG NH2
H B 0021 ASP OD1 8.034 C B 0013 ARG NH1
H B 0021 ASP OD1 5.938 C B 0013 ARG NH2
H B 0021 ASP OD2 5.970 C B 0013 ARG NH1
H B 0021 ASP OD2 3.834 C B 0013 ARG NH2
H B 0021 ASP OD2 11.87 C B 0016 ARG NH1
H B 0021 ASP OD1 9.381 H B 0018 HIS ND1
H B 0021 ASP OD1 9.759 H B 0018 HIS NE2
H B 0021 ASP OD2 8.845 H B 0018 HIS ND1
H B 0021 ASP OD2 9.674 H B 0018 HIS NE2
H B 0021 ASP OD1 10.89 H B 0020 LYS NZ
H B 0021 ASP OD2 9.984 H B 0020 LYS NZ
H B 0021 ASP OD1 6.290 H B 0024 HIS ND1
H B 0021 ASP OD1 7.743 H B 0024 HIS NE2
H B 0021 ASP OD2 6.566 H B 0024 HIS ND1
H B 0021 ASP OD2 7.734 H B 0024 HIS NE2
H B 0028 ASP OD1 8.361 H B 0024 HIS ND1
H B 0028 ASP OD1 9.275 H B 0024 HIS NE2
H B 0028 ASP OD2 10.50 H B 0024 HIS ND1
H B 0028 ASP OD2 11.41 H B 0024 HIS NE2
H B 0028 ASP OD1 7.378 H B 0027 ARG NH1
H B 0028 ASP OD1 7.268 H B 0027 ARG NH2
H B 0028 ASP OD2 9.101 H B 0027 ARG NH1
H B 0028 ASP OD2 8.620 H B 0027 ARG NH2
H B 0036 GLU OE1 11.55 H B 0027 ARG NH2
H B 0036 GLU OE1 8.027 H B 0037 LYS NZ
H B 0036 GLU OE2 6.885 H B 0037 LYS NZ
H B 0036 GLU OE1 4.074 H B 0046 LYS NZ
H B 0036 GLU OE2 6.007 H B 0046 LYS NZ
H B 0045 ASP OD1 11.40 H B 0037 LYS NZ
H B 0045 ASP OD2 10.71 H B 0037 LYS NZ
H B 0045 ASP OD1 9.040 H B 0046 LYS NZ
H B 0045 ASP OD2 6.902 H B 0046 LYS NZ
H B 0049 GLU OE1 7.774 H B 0046 LYS NZ
H B 0049 GLU OE2 6.390 H B 0046 LYS NZ
H B 0049 GLU OE1 11.38 H B 0055 ARG NH1
H B 0049 GLU OE1 9.213 H B 0057 LYS NZ
H B 0049 GLU OE2 9.280 H B 0057 LYS NZ
H B 0064 ASP OD2 11.25 H B 0056 ARG NH1
H B 0064 ASP OD1 11.27 H B 0057 LYS NZ
H B 0064 ASP OD2 9.393 H B 0057 LYS NZ
H B 0064 ASP OD1 11.06 H B 0059 HIS ND1
H B 0064 ASP OD2 10.56 H B 0059 HIS ND1
H B 0064 ASP OD2 11.91 H B 0059 HIS NE2
H B 0064 ASP OD1 10.53 H B 0069 LYS NZ
H B 0066 ASP OD1 11.53 H B 0059 HIS ND1
H B 0066 ASP OD1 11.01 H B 0059 HIS NE2
H B 0066 ASP OD2 9.888 H B 0059 HIS ND1
H B 0066 ASP OD2 9.451 H B 0059 HIS NE2
H B 0066 ASP OD1 6.248 H B 0069 LYS NZ
H B 0066 ASP OD2 6.821 H B 0069 LYS NZ
H B 0066 ASP OD1 8.085 H B 0070 ARG NH1
H B 0066 ASP OD1 6.865 H B 0070 ARG NH2
H B 0066 ASP OD2 10.20 H B 0070 ARG NH1
H B 0066 ASP OD2 8.968 H B 0070 ARG NH2
H B 0067 ASP OD1 11.76 H B 0069 LYS NZ
H B 0067 ASP OD1 8.835 H B 0070 ARG NH1
H B 0067 ASP OD1 8.635 H B 0070 ARG NH2
H B 0067 ASP OD2 10.28 H B 0070 ARG NH1
H B 0067 ASP OD2 10.41 H B 0070 ARG NH2
H B 0076 GLU OE1 8.784 H B 0080 ARG NH1
H B 0076 GLU OE1 7.413 H B 0080 ARG NH2
H B 0076 GLU OE2 7.150 H B 0080 ARG NH1
H B 0076 GLU OE2 5.781 H B 0080 ARG NH2
H B 0083 GLU OE1 6.736 H B 0080 ARG NH1
H B 0083 GLU OE1 7.010 H B 0080 ARG NH2
H B 0083 GLU OE2 5.016 H B 0080 ARG NH1
H B 0083 GLU OE2 5.840 H B 0080 ARG NH2
CHARGE_REPU 2.00 12.00 128
C B 0003 ASP OD1 11.68 C B 0012 GLU OE1
C B 0003 ASP OD1 11.24 C B 0012 GLU OE2
C B 0003 ASP OD2 10.26 C B 0012 GLU OE1
C B 0003 ASP OD2 10.16 C B 0012 GLU OE2
C B 0004 LYS NZ 10.19 C B 0005 ARG NH1
C B 0004 LYS NZ 8.734 C B 0005 ARG NH2
C B 0004 LYS NZ 10.23 C B 0007 HIS ND1
C B 0005 ARG NH1 10.44 C B 0007 HIS ND1
C B 0005 ARG NH2 11.21 C B 0007 HIS ND1
C B 0005 ARG NH1 7.919 C B 0008 HIS ND1
C B 0005 ARG NH1 9.296 C B 0008 HIS NE2
C B 0005 ARG NH2 9.596 C B 0008 HIS ND1
C B 0005 ARG NH2 11.20 C B 0008 HIS NE2
C B 0007 HIS ND1 8.524 C B 0008 HIS ND1
C B 0007 HIS ND1 9.889 C B 0008 HIS NE2
C B 0007 HIS NE2 9.268 C B 0008 HIS ND1
C B 0007 HIS NE2 10.35 C B 0008 HIS NE2
C B 0007 HIS ND1 10.78 C B 0013 ARG NH1
C B 0007 HIS ND1 11.24 C B 0013 ARG NH2
C B 0007 HIS NE2 9.984 C B 0013 ARG NH1
C B 0007 HIS NE2 10.06 C B 0013 ARG NH2
C B 0007 HIS ND1 6.141 C B 0014 LYS NZ
C B 0007 HIS NE2 5.147 C B 0014 LYS NZ
C B 0007 HIS ND1 11.07 C B 0015 ARG NH1
C B 0007 HIS NE2 9.944 C B 0015 ARG NH1
C B 0007 HIS NE2 11.53 C B 0015 ARG NH2
C B 0007 HIS NE2 11.64 H B 0018 HIS ND1
C B 0012 GLU OE1 10.70 H B 0017 ASP OD1
C B 0012 GLU OE1 10.35 H B 0017 ASP OD2
C B 0012 GLU OE2 11.00 H B 0017 ASP OD1
C B 0012 GLU OE2 10.25 H B 0017 ASP OD2
C B 0013 ARG NH1 10.29 C B 0016 ARG NH1
C B 0013 ARG NH2 10.32 C B 0016 ARG NH1
C B 0013 ARG NH1 11.59 H B 0018 HIS ND1
C B 0013 ARG NH2 9.899 H B 0018 HIS ND1
C B 0013 ARG NH2 11.39 H B 0018 HIS NE2
C B 0013 ARG NH1 11.21 H B 0020 LYS NZ
C B 0013 ARG NH2 10.42 H B 0020 LYS NZ
C B 0013 ARG NH1 9.751 H B 0024 HIS ND1
C B 0013 ARG NH1 10.38 H B 0024 HIS NE2
C B 0013 ARG NH2 8.673 H B 0024 HIS ND1
C B 0013 ARG NH2 9.462 H B 0024 HIS NE2
C B 0014 LYS NZ 5.074 C B 0015 ARG NH1
C B 0014 LYS NZ 6.550 C B 0015 ARG NH2
C B 0014 LYS NZ 11.99 C B 0016 ARG NH1
C B 0014 LYS NZ 9.355 H B 0018 HIS ND1
C B 0014 LYS NZ 11.26 H B 0018 HIS NE2
C B 0015 ARG NH1 7.345 H B 0018 HIS ND1
C B 0015 ARG NH1 8.500 H B 0018 HIS NE2
C B 0015 ARG NH2 8.281 H B 0018 HIS ND1
C B 0015 ARG NH2 9.203 H B 0018 HIS NE2
C B 0016 ARG NH1 9.299 H B 0018 HIS ND1
C B 0016 ARG NH1 10.79 H B 0018 HIS NE2
C B 0016 ARG NH2 10.22 H B 0018 HIS ND1
C B 0016 ARG NH2 11.55 H B 0018 HIS NE2
C B 0016 ARG NH1 6.414 H B 0020 LYS NZ
C B 0016 ARG NH2 7.476 H B 0020 LYS NZ
C B 0016 ARG NH1 10.31 C B 0040 ARG NH1
C B 0016 ARG NH1 8.126 C B 0040 ARG NH2
C B 0016 ARG NH2 10.82 C B 0040 ARG NH1
C B 0016 ARG NH2 8.798 C B 0040 ARG NH2
H B 0017 ASP OD1 7.399 H B 0021 ASP OD1
H B 0017 ASP OD1 5.583 H B 0021 ASP OD2
H B 0017 ASP OD2 9.549 H B 0021 ASP OD1
H B 0017 ASP OD2 7.729 H B 0021 ASP OD2
H B 0018 HIS ND1 8.761 H B 0020 LYS NZ
H B 0018 HIS NE2 9.095 H B 0020 LYS NZ
H B 0020 LYS NZ 9.690 H B 0024 HIS ND1
H B 0020 LYS NZ 8.153 H B 0024 HIS NE2
H B 0020 LYS NZ 5.864 C B 0040 ARG NH1
H B 0020 LYS NZ 3.895 C B 0040 ARG NH2
H B 0021 ASP OD1 11.79 H B 0028 ASP OD1
H B 0024 HIS ND1 6.747 H B 0027 ARG NH1
H B 0024 HIS ND1 8.548 H B 0027 ARG NH2
H B 0024 HIS NE2 5.889 H B 0027 ARG NH1
H B 0024 HIS NE2 7.677 H B 0027 ARG NH2
H B 0024 HIS ND1 11.53 C B 0040 ARG NH1
H B 0024 HIS ND1 10.85 C B 0040 ARG NH2
H B 0024 HIS NE2 9.362 C B 0040 ARG NH1
H B 0024 HIS NE2 8.844 C B 0040 ARG NH2
H B 0027 ARG NH1 11.16 C B 0040 ARG NH1
H B 0027 ARG NH1 11.83 C B 0040 ARG NH2
H B 0027 ARG NH2 11.95 C B 0040 ARG NH1
H B 0036 GLU OE1 6.251 H B 0045 ASP OD1
H B 0036 GLU OE1 4.459 H B 0045 ASP OD2
H B 0036 GLU OE2 5.299 H B 0045 ASP OD1
H B 0036 GLU OE2 4.007 H B 0045 ASP OD2
H B 0036 GLU OE1 9.557 H B 0049 GLU OE1
H B 0036 GLU OE1 8.797 H B 0049 GLU OE2
H B 0036 GLU OE2 10.62 H B 0049 GLU OE1
H B 0036 GLU OE2 10.23 H B 0049 GLU OE2
H B 0037 LYS NZ 10.88 H B 0046 LYS NZ
H B 0045 ASP OD1 9.303 H B 0049 GLU OE1
H B 0045 ASP OD1 9.836 H B 0049 GLU OE2
H B 0045 ASP OD2 7.956 H B 0049 GLU OE1
H B 0045 ASP OD2 8.190 H B 0049 GLU OE2
H B 0055 ARG NH1 9.145 H B 0056 ARG NH1
H B 0055 ARG NH1 8.376 H B 0056 ARG NH2
H B 0055 ARG NH2 10.78 H B 0056 ARG NH1
H B 0055 ARG NH2 10.07 H B 0056 ARG NH2
H B 0055 ARG NH1 7.881 H B 0059 HIS ND1
H B 0055 ARG NH1 8.015 H B 0059 HIS NE2
H B 0055 ARG NH2 7.956 H B 0059 HIS ND1
H B 0055 ARG NH2 7.460 H B 0059 HIS NE2
H B 0056 ARG NH1 8.519 H B 0057 LYS NZ
H B 0056 ARG NH2 10.20 H B 0057 LYS NZ
H B 0056 ARG NH1 7.276 H B 0059 HIS ND1
H B 0056 ARG NH1 9.376 H B 0059 HIS NE2
H B 0056 ARG NH2 7.963 H B 0059 HIS ND1
H B 0056 ARG NH2 9.834 H B 0059 HIS NE2
H B 0064 ASP OD1 9.075 H B 0066 ASP OD1
H B 0064 ASP OD1 7.740 H B 0066 ASP OD2
H B 0064 ASP OD2 10.76 H B 0066 ASP OD1
H B 0064 ASP OD2 9.298 H B 0066 ASP OD2
H B 0064 ASP OD1 8.951 H B 0067 ASP OD1
H B 0064 ASP OD1 8.687 H B 0067 ASP OD2
H B 0064 ASP OD2 9.837 H B 0067 ASP OD1
H B 0064 ASP OD2 9.372 H B 0067 ASP OD2
H B 0066 ASP OD1 7.530 H B 0067 ASP OD1
H B 0066 ASP OD1 9.205 H B 0067 ASP OD2
H B 0066 ASP OD2 8.129 H B 0067 ASP OD1
H B 0066 ASP OD2 9.612 H B 0067 ASP OD2
H B 0069 LYS NZ 10.07 H B 0070 ARG NH1
H B 0069 LYS NZ 9.935 H B 0070 ARG NH2
H B 0076 GLU OE1 9.236 H B 0083 GLU OE1
H B 0076 GLU OE1 9.576 H B 0083 GLU OE2
H B 0076 GLU OE2 9.099 H B 0083 GLU OE1
H B 0076 GLU OE2 8.957 H B 0083 GLU OE2
HB_MM 2.00 3.20 172
C B 0002 ALA N 2.196 C B 0001 MET O
C B 0003 ASP N 2.196 C B 0002 ALA O
C B 0004 LYS N 2.197 C B 0003 ASP O
C B 0005 ARG N 2.196 C B 0004 LYS O
C B 0006 ALA N 2.196 C B 0005 ARG O
C B 0007 HIS N 2.445 C B 0005 ARG O
C B 0007 HIS N 2.197 C B 0006 ALA O
C B 0008 HIS N 2.197 C B 0007 HIS O
C B 0009 ASN N 2.196 C B 0008 HIS O
C B 0010 ALA N 2.887 C B 0008 HIS O
C B 0010 ALA N 2.195 C B 0009 ASN O
C B 0011 LEU N 2.196 C B 0010 ALA O
C B 0012 GLU N 3.057 C B 0010 ALA O
C B 0012 GLU N 2.196 C B 0011 LEU O
C B 0013 ARG N 2.203 C B 0012 GLU O
C B 0014 LYS N 2.198 C B 0013 ARG O
C B 0015 ARG N 2.195 C B 0014 LYS O
C B 0016 ARG N 3.002 C B 0014 LYS O
C B 0016 ARG N 2.195 C B 0015 ARG O
H B 0017 ASP N 2.200 C B 0016 ARG O
H B 0018 HIS N 2.203 H B 0017 ASP O
H B 0019 ILE N 2.721 H B 0017 ASP O
H B 0019 ILE N 2.197 H B 0018 HIS O
H B 0020 LYS N 3.153 H B 0017 ASP O
H B 0020 LYS N 2.216 H B 0019 ILE O
H B 0021 ASP N 3.122 H B 0018 HIS O
H B 0021 ASP N 2.443 H B 0019 ILE O
H B 0021 ASP N 2.197 H B 0020 LYS O
H B 0022 SER N 3.091 H B 0018 HIS O
H B 0022 SER N 2.564 H B 0019 ILE O
H B 0022 SER N 2.201 H B 0021 ASP O
H B 0023 PHE N 2.635 H B 0019 ILE O
H B 0023 PHE N 3.160 H B 0020 LYS O
H B 0023 PHE N 3.086 H B 0021 ASP O
H B 0023 PHE N 2.203 H B 0022 SER O
H B 0024 HIS N 2.758 H B 0020 LYS O
H B 0024 HIS N 3.004 H B 0021 ASP O
H B 0024 HIS N 3.126 H B 0022 SER O
H B 0024 HIS N 2.208 H B 0023 PHE O
H B 0025 SER N 2.708 H B 0022 SER O
H B 0025 SER N 2.902 H B 0023 PHE O
H B 0025 SER N 2.204 H B 0024 HIS O
H B 0026 LEU N 2.808 H B 0022 SER O
H B 0026 LEU N 2.432 H B 0023 PHE O
H B 0026 LEU N 3.122 H B 0024 HIS O
H B 0026 LEU N 2.200 H B 0025 SER O
H B 0027 ARG N 2.488 H B 0023 PHE O
H B 0027 ARG N 2.833 H B 0024 HIS O
H B 0027 ARG N 2.203 H B 0026 LEU O
H B 0028 ASP N 2.775 H B 0026 LEU O
H B 0028 ASP N 2.199 H B 0027 ARG O
H B 0029 SER N 2.438 H B 0026 LEU O
H B 0029 SER N 2.198 H B 0028 ASP O
H B 0030 VAL N 3.127 H B 0028 ASP O
H B 0030 VAL N 2.195 H B 0029 SER O
C B 0031 PRO N 2.213 H B 0030 VAL O
H B 0032 SER N 2.198 C B 0031 PRO O
H B 0033 LEU N 2.201 H B 0032 SER O
H B 0034 GLN N 2.854 H B 0032 SER O
H B 0034 GLN N 2.198 H B 0033 LEU O
H B 0035 GLY N 2.864 H B 0032 SER O
H B 0035 GLY N 2.197 H B 0034 GLN O
H B 0036 GLU N 2.858 H B 0033 LEU O
H B 0036 GLU N 2.195 H B 0035 GLY O
H B 0037 LYS N 3.131 H B 0033 LEU O
H B 0037 LYS N 2.197 H B 0036 GLU O
C B 0038 ALA N 2.413 H B 0036 GLU O
C B 0038 ALA N 2.193 H B 0037 LYS O
C B 0039 SER N 2.196 C B 0038 ALA O
C B 0040 ARG N 2.198 C B 0039 SER O
H B 0041 ALA N 2.946 C B 0039 SER O
H B 0041 ALA N 2.197 C B 0040 ARG O
H B 0042 GLN N 2.951 C B 0038 ALA O
H B 0042 GLN N 2.521 C B 0039 SER O
H B 0042 GLN N 3.000 C B 0040 ARG O
H B 0042 GLN N 2.194 H B 0041 ALA O
H B 0043 ILE N 2.798 H B 0041 ALA O
H B 0043 ILE N 2.200 H B 0042 GLN O
H B 0044 LEU N 2.410 H B 0041 ALA O
H B 0044 LEU N 2.197 H B 0043 ILE O
H B 0045 ASP N 2.796 H B 0041 ALA O
H B 0045 ASP N 2.198 H B 0044 LEU O
H B 0046 LYS N 3.140 H B 0044 LEU O
H B 0046 LYS N 2.200 H B 0045 ASP O
H B 0047 ALA N 2.432 H B 0043 ILE O
H B 0047 ALA N 3.096 H B 0044 LEU O
H B 0047 ALA N 2.194 H B 0046 LYS O
H B 0048 THR N 2.697 H B 0044 LEU O
H B 0048 THR N 3.103 H B 0046 LYS O
H B 0048 THR N 2.198 H B 0047 ALA O
H B 0049 GLU N 2.977 H B 0046 LYS O
H B 0049 GLU N 2.197 H B 0048 THR O
H B 0050 TYR N 2.706 H B 0046 LYS O
H B 0050 TYR N 2.196 H B 0049 GLU O
H B 0051 ILE N 2.200 H B 0050 TYR O
H B 0052 GLN N 2.664 H B 0050 TYR O
H B 0052 GLN N 2.197 H B 0051 ILE O
H B 0053 TYR N 2.743 H B 0049 GLU O
H B 0053 TYR N 2.197 H B 0052 GLN O
H B 0054 MET N 2.503 H B 0050 TYR O
H B 0054 MET N 2.196 H B 0053 TYR O
H B 0055 ARG N 3.040 H B 0052 GLN O
H B 0055 ARG N 2.934 H B 0053 TYR O
H B 0055 ARG N 2.198 H B 0054 MET O
H B 0056 ARG N 2.891 H B 0052 GLN O
H B 0056 ARG N 2.719 H B 0053 TYR O
H B 0056 ARG N 2.198 H B 0055 ARG O
H B 0057 LYS N 2.902 H B 0053 TYR O
H B 0057 LYS N 3.155 H B 0055 ARG O
H B 0057 LYS N 2.198 H B 0056 ARG O
H B 0058 VAL N 3.078 H B 0055 ARG O
H B 0058 VAL N 2.195 H B 0057 LYS O
H B 0059 HIS N 3.174 H B 0055 ARG O
H B 0059 HIS N 3.200 H B 0057 LYS O
H B 0059 HIS N 2.195 H B 0058 VAL O
H B 0060 THR N 3.152 H B 0056 ARG O
H B 0060 THR N 3.171 H B 0057 LYS O
H B 0060 THR N 2.195 H B 0059 HIS O
H B 0061 LEU N 2.483 H B 0057 LYS O
H B 0061 LEU N 2.892 H B 0058 VAL O
H B 0061 LEU N 3.145 H B 0059 HIS O
H B 0061 LEU N 2.198 H B 0060 THR O
H B 0062 GLN N 2.800 H B 0058 VAL O
H B 0062 GLN N 2.198 H B 0061 LEU O
H B 0063 GLN N 3.019 H B 0059 HIS O
H B 0063 GLN N 3.190 H B 0060 THR O
H B 0063 GLN N 2.513 H B 0061 LEU O
H B 0063 GLN N 2.196 H B 0062 GLN O
H B 0064 ASP N 2.608 H B 0061 LEU O
H B 0064 ASP N 2.199 H B 0063 GLN O
H B 0065 ILE N 2.975 H B 0062 GLN O
H B 0065 ILE N 2.197 H B 0064 ASP O
H B 0066 ASP N 2.771 H B 0062 GLN O
H B 0066 ASP N 2.200 H B 0065 ILE O
H B 0067 ASP N 2.201 H B 0066 ASP O
H B 0068 LEU N 2.980 H B 0064 ASP O
H B 0068 LEU N 2.198 H B 0067 ASP O
H B 0069 LYS N 2.620 H B 0065 ILE O
H B 0069 LYS N 2.198 H B 0068 LEU O
H B 0070 ARG N 2.197 H B 0069 LYS O
H B 0071 GLN N 3.104 H B 0067 ASP O
H B 0071 GLN N 3.066 H B 0068 LEU O
H B 0071 GLN N 2.198 H B 0070 ARG O
H B 0072 ASN N 2.200 H B 0071 GLN O
H B 0073 ALA N 3.199 H B 0069 LYS O
H B 0073 ALA N 2.478 H B 0071 GLN O
H B 0073 ALA N 2.197 H B 0072 ASN O
H B 0074 LEU N 2.903 H B 0070 ARG O
H B 0074 LEU N 2.659 H B 0071 GLN O
H B 0074 LEU N 2.198 H B 0073 ALA O
H B 0075 LEU N 2.525 H B 0071 GLN O
H B 0075 LEU N 2.202 H B 0074 LEU O
H B 0076 GLU N 2.865 H B 0072 ASN O
H B 0076 GLU N 2.199 H B 0075 LEU O
H B 0077 GLN N 2.199 H B 0076 GLU O
H B 0078 GLN N 3.065 H B 0075 LEU O
H B 0078 GLN N 2.962 H B 0076 GLU O
H B 0078 GLN N 2.198 H B 0077 GLN O
H B 0079 VAL N 2.989 H B 0075 LEU O
H B 0079 VAL N 2.199 H B 0078 GLN O
H B 0080 ARG N 2.920 H B 0076 GLU O
H B 0080 ARG N 3.028 H B 0078 GLN O
H B 0080 ARG N 2.201 H B 0079 VAL O
H B 0081 ALA N 3.143 H B 0078 GLN O
H B 0081 ALA N 2.199 H B 0080 ARG O
H B 0082 LEU N 2.958 H B 0078 GLN O
H B 0082 LEU N 2.199 H B 0081 ALA O
H B 0083 GLU N 2.197 H B 0082 LEU O
C B 0084 GLY N 2.197 H B 0083 GLU O
C B 0085 SER N 2.197 C B 0084 GLY O
C B 0086 GLY N 2.197 C B 0085 SER O
C B 0087 CYS N 2.201 C B 0086 GLY O
HB_MS 2.00 3.20 12
C B 0015 ARG O 2.873 H B 0018 HIS ND1
H B 0019 ILE O 2.544 H B 0022 SER OG
H B 0023 PHE N 2.835 H B 0022 SER OG
C B 0038 ALA O 2.643 C B 0039 SER OG
H B 0044 LEU O 2.340 H B 0048 THR OG1
H B 0056 ARG O 2.931 H B 0060 THR OG1
H B 0057 LYS O 2.630 H B 0060 THR OG1
H B 0059 HIS O 2.515 H B 0063 GLN NE2
H B 0061 LEU N 2.960 H B 0060 THR OG1
H B 0065 ILE N 2.431 H B 0064 ASP OD1
H B 0068 LEU O 2.536 H B 0072 ASN ND2
H B 0069 LYS O 2.427 H B 0072 ASN ND2
AROMATIC 0.00 8.00 2
H B 0057 LYS 5.537 H B 0053 TYR
C B 0014 LYS 6.133 C B 0007 HIS