Complet list of 1xs8 con file
Complete list of 1xs8.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 387
C A 0001 MET CA 3.787 C A 0002 SER CA
C A 0001 MET C 2.420 C A 0002 SER CA
C A 0001 MET C 3.152 C A 0002 SER C
C A 0001 MET C 3.662 C A 0002 SER CB
C A 0002 SER CA 3.791 C A 0003 ARG CA
C A 0002 SER C 2.426 C A 0003 ARG CA
C A 0002 SER C 3.158 C A 0003 ARG C
C A 0002 SER C 3.675 C A 0003 ARG CB
C A 0003 ARG CA 3.788 E A 0004 THR CA
C A 0003 ARG C 2.427 E A 0004 THR CA
C A 0003 ARG C 3.219 E A 0004 THR C
C A 0003 ARG C 3.666 E A 0004 THR CB
E A 0004 THR CA 3.790 E A 0005 ILE CA
E A 0004 THR C 2.431 E A 0005 ILE CA
E A 0004 THR C 3.551 E A 0005 ILE C
E A 0004 THR C 3.416 E A 0005 ILE CB
E A 0004 THR C 3.520 E A 0005 ILE CG2
E A 0005 ILE CA 3.795 E A 0006 PHE CA
E A 0005 ILE C 2.420 E A 0006 PHE CA
E A 0005 ILE C 3.399 E A 0006 PHE C
E A 0005 ILE C 3.524 E A 0006 PHE CB
E A 0005 ILE C 3.679 E A 0006 PHE CG
E A 0005 ILE CG1 3.738 C A 0016 GLY CA
E A 0006 PHE CA 3.779 C A 0007 CYS CA
E A 0006 PHE C 2.420 C A 0007 CYS CA
E A 0006 PHE C 3.126 C A 0007 CYS C
E A 0006 PHE C 3.680 C A 0007 CYS CB
C A 0007 CYS C 2.442 C A 0008 THR CA
C A 0007 CYS C 3.019 C A 0008 THR C
C A 0007 CYS C 3.722 C A 0008 THR CB
C A 0008 THR CA 3.798 C A 0009 TYR CA
C A 0008 THR C 2.435 C A 0009 TYR CA
C A 0008 THR C 3.148 C A 0009 TYR C
C A 0008 THR C 3.676 C A 0009 TYR CB
C A 0009 TYR C 2.431 C A 0010 LEU CA
C A 0009 TYR C 3.436 C A 0010 LEU C
C A 0009 TYR C 3.531 C A 0010 LEU CB
C A 0009 TYR C 3.748 C A 0010 LEU CG
C A 0009 TYR CB 3.712 H A 0038 ALA CB
C A 0009 TYR CD2 3.668 H A 0038 ALA CB
C A 0009 TYR CE1 3.513 H A 0073 PHE CZ
C A 0009 TYR CZ 3.622 H A 0073 PHE CZ
C A 0010 LEU C 2.459 C A 0011 GLN CA
C A 0010 LEU C 3.064 C A 0011 GLN C
C A 0010 LEU C 3.035 C A 0011 GLN CB
C A 0010 LEU C 3.776 C A 0011 GLN CG
C A 0010 LEU CB 3.747 C A 0012 ARG CG
C A 0011 GLN CA 3.795 C A 0012 ARG CA
C A 0011 GLN C 2.429 C A 0012 ARG CA
C A 0011 GLN C 3.616 C A 0012 ARG C
C A 0011 GLN C 3.299 C A 0012 ARG CB
C A 0012 ARG CA 3.791 E A 0013 ASP CA
C A 0012 ARG C 2.436 E A 0013 ASP CA
C A 0012 ARG C 2.986 E A 0013 ASP C
C A 0012 ARG C 3.721 E A 0013 ASP CB
E A 0013 ASP CA 3.783 E A 0014 ALA CA
E A 0013 ASP C 2.424 E A 0014 ALA CA
E A 0013 ASP C 3.616 E A 0014 ALA C
E A 0013 ASP C 3.250 E A 0014 ALA CB
E A 0014 ALA CA 3.785 E A 0015 GLU CA
E A 0014 ALA C 2.416 E A 0015 GLU CA
E A 0014 ALA C 3.224 E A 0015 GLU C
E A 0014 ALA C 3.629 E A 0015 GLU CB
E A 0014 ALA CB 3.521 H A 0035 SER CB
E A 0015 GLU CA 3.783 C A 0016 GLY CA
E A 0015 GLU C 2.416 C A 0016 GLY CA
E A 0015 GLU C 3.016 C A 0016 GLY C
C A 0016 GLY CA 3.790 C A 0017 GLN CA
C A 0016 GLY C 2.438 C A 0017 GLN CA
C A 0016 GLY C 3.061 C A 0017 GLN C
C A 0016 GLY C 3.700 C A 0017 GLN CB
C A 0017 GLN C 2.442 C A 0018 ASP CA
C A 0017 GLN C 3.130 C A 0018 ASP C
C A 0017 GLN C 3.719 C A 0018 ASP CB
C A 0017 GLN CB 3.747 H A 0031 TYR CB
C A 0017 GLN CB 3.608 H A 0031 TYR CG
C A 0017 GLN CB 3.468 H A 0031 TYR CD1
C A 0017 GLN CG 3.636 H A 0031 TYR CD1
C A 0018 ASP C 2.435 C A 0019 PHE CA
C A 0018 ASP C 3.690 C A 0019 PHE C
C A 0018 ASP C 3.130 C A 0019 PHE CB
C A 0018 ASP C 3.681 C A 0019 PHE CG
C A 0018 ASP C 3.626 C A 0019 PHE CD2
C A 0018 ASP CB 3.696 C A 0019 PHE CD2
C A 0019 PHE CA 3.792 C A 0020 GLN CA
C A 0019 PHE C 2.428 C A 0020 GLN CA
C A 0019 PHE C 3.102 C A 0020 GLN C
C A 0019 PHE C 3.698 C A 0020 GLN CB
C A 0019 PHE CD1 3.706 C A 0020 GLN C
C A 0019 PHE C 3.402 H A 0031 TYR CE2
C A 0020 GLN CA 3.782 C A 0021 LEU CA
C A 0020 GLN C 2.426 C A 0021 LEU CA
C A 0020 GLN C 3.364 C A 0021 LEU C
C A 0020 GLN C 3.565 C A 0021 LEU CB
C A 0020 GLN CD 3.618 H A 0031 TYR CE2
C A 0021 LEU C 2.449 C A 0022 TYR CA
C A 0021 LEU C 3.732 C A 0022 TYR C
C A 0021 LEU C 3.049 C A 0022 TYR CB
C A 0022 TYR CA 3.004 C A 0023 PRO CD
C A 0022 TYR C 2.461 C A 0023 PRO CA
C A 0022 TYR C 3.208 C A 0023 PRO C
C A 0022 TYR C 3.647 C A 0023 PRO CB
C A 0022 TYR C 3.579 C A 0023 PRO CG
C A 0022 TYR C 2.533 C A 0023 PRO CD
C A 0022 TYR CB 3.344 C A 0023 PRO CD
C A 0023 PRO CA 3.779 H A 0024 GLY CA
C A 0023 PRO C 2.408 H A 0024 GLY CA
C A 0023 PRO C 3.616 H A 0024 GLY C
C A 0023 PRO CB 3.612 H A 0027 GLY CA
H A 0024 GLY CA 3.784 H A 0025 GLU CA
H A 0024 GLY C 2.427 H A 0025 GLU CA
H A 0024 GLY C 3.075 H A 0025 GLU C
H A 0024 GLY C 3.693 H A 0025 GLU CB
H A 0025 GLU CA 3.794 H A 0026 LEU CA
H A 0025 GLU C 2.433 H A 0026 LEU CA
H A 0025 GLU C 2.999 H A 0026 LEU C
H A 0025 GLU C 3.717 H A 0026 LEU CB
H A 0025 GLU CD 3.656 H A 0028 LYS CE
H A 0026 LEU CA 3.781 H A 0027 GLY CA
H A 0026 LEU C 2.424 H A 0027 GLY CA
H A 0026 LEU C 2.973 H A 0027 GLY C
H A 0027 GLY CA 3.787 H A 0028 LYS CA
H A 0027 GLY C 2.420 H A 0028 LYS CA
H A 0027 GLY C 3.065 H A 0028 LYS C
H A 0027 GLY C 3.706 H A 0028 LYS CB
H A 0027 GLY C 3.753 H A 0031 TYR CG
H A 0027 GLY C 3.664 H A 0031 TYR CD2
H A 0028 LYS C 2.436 H A 0029 ARG CA
H A 0028 LYS C 3.040 H A 0029 ARG C
H A 0028 LYS C 3.719 H A 0029 ARG CB
H A 0029 ARG CA 3.799 H A 0030 ILE CA
H A 0029 ARG C 2.426 H A 0030 ILE CA
H A 0029 ARG C 3.260 H A 0030 ILE C
H A 0029 ARG C 3.653 H A 0030 ILE CB
H A 0030 ILE C 2.454 H A 0031 TYR CA
H A 0030 ILE C 3.019 H A 0031 TYR C
H A 0030 ILE C 3.737 H A 0031 TYR CB
H A 0030 ILE CG2 3.555 C A 0034 ILE CG1
H A 0031 TYR C 2.419 H A 0032 ASN CA
H A 0031 TYR C 3.161 H A 0032 ASN C
H A 0031 TYR C 3.694 H A 0032 ASN CB
H A 0031 TYR CE1 3.786 H A 0039 TRP CH2
H A 0032 ASN C 2.440 C A 0033 GLU CA
H A 0032 ASN C 3.443 C A 0033 GLU C
H A 0032 ASN C 3.541 C A 0033 GLU CB
H A 0032 ASN C 3.747 C A 0033 GLU CG
C A 0033 GLU CA 3.794 C A 0034 ILE CA
C A 0033 GLU C 2.427 C A 0034 ILE CA
C A 0033 GLU C 3.525 C A 0034 ILE C
C A 0033 GLU C 3.454 C A 0034 ILE CB
C A 0033 GLU C 3.540 C A 0034 ILE CG1
C A 0034 ILE CA 3.782 H A 0035 SER CA
C A 0034 ILE C 2.430 H A 0035 SER CA
C A 0034 ILE C 3.157 H A 0035 SER C
C A 0034 ILE C 3.672 H A 0035 SER CB
C A 0034 ILE CD1 3.795 H A 0074 LEU CA
C A 0034 ILE CD1 3.699 H A 0074 LEU CB
C A 0034 ILE CD1 3.740 H A 0074 LEU CD2
H A 0035 SER C 2.446 H A 0036 LYS CA
H A 0035 SER C 2.956 H A 0036 LYS C
H A 0035 SER C 3.701 H A 0036 LYS CB
H A 0036 LYS C 2.447 H A 0037 ASP CA
H A 0036 LYS C 3.000 H A 0037 ASP C
H A 0036 LYS C 3.716 H A 0037 ASP CB
H A 0037 ASP C 2.443 H A 0038 ALA CA
H A 0037 ASP C 3.054 H A 0038 ALA C
H A 0037 ASP C 3.702 H A 0038 ALA CB
H A 0038 ALA C 2.441 H A 0039 TRP CA
H A 0038 ALA C 2.978 H A 0039 TRP C
H A 0038 ALA C 3.711 H A 0039 TRP CB
H A 0039 TRP CA 3.799 H A 0040 ALA CA
H A 0039 TRP C 2.433 H A 0040 ALA CA
H A 0039 TRP C 3.075 H A 0040 ALA C
H A 0039 TRP C 3.700 H A 0040 ALA CB
H A 0040 ALA C 2.447 H A 0041 GLN CA
H A 0040 ALA C 2.966 H A 0041 GLN C
H A 0040 ALA C 3.728 H A 0041 GLN CB
H A 0041 GLN CA 3.791 H A 0042 TRP CA
H A 0041 GLN C 2.421 H A 0042 TRP CA
H A 0041 GLN C 3.066 H A 0042 TRP C
H A 0041 GLN C 3.708 H A 0042 TRP CB
H A 0042 TRP C 2.421 H A 0043 GLN CA
H A 0042 TRP C 3.005 H A 0043 GLN C
H A 0042 TRP C 3.714 H A 0043 GLN CB
H A 0042 TRP CZ3 3.793 H A 0045 LYS CG
H A 0042 TRP CZ2 3.551 H A 0069 GLU C
H A 0042 TRP CZ2 3.342 H A 0069 GLU CB
H A 0042 TRP CH2 3.507 H A 0069 GLU CB
H A 0042 TRP CE2 3.753 H A 0070 MET CA
H A 0042 TRP CB 3.526 H A 0073 PHE CD2
H A 0042 TRP CB 3.727 H A 0073 PHE CE2
H A 0042 TRP CE3 3.578 H A 0073 PHE CG
H A 0042 TRP CE3 3.697 H A 0073 PHE CD2
H A 0043 GLN C 2.423 H A 0044 HIS CA
H A 0043 GLN C 3.052 H A 0044 HIS C
H A 0043 GLN C 3.709 H A 0044 HIS CB
H A 0044 HIS CA 3.791 H A 0045 LYS CA
H A 0044 HIS C 2.432 H A 0045 LYS CA
H A 0044 HIS C 3.040 H A 0045 LYS C
H A 0044 HIS C 3.710 H A 0045 LYS CB
H A 0045 LYS C 2.425 H A 0046 GLN CA
H A 0045 LYS C 3.036 H A 0046 GLN C
H A 0045 LYS C 3.711 H A 0046 GLN CB
H A 0046 GLN C 2.429 H A 0047 THR CA
H A 0046 GLN C 2.948 H A 0047 THR C
H A 0046 GLN C 3.741 H A 0047 THR CB
H A 0046 GLN CG 3.633 H A 0066 LEU CD1
H A 0047 THR C 2.443 H A 0048 MET CA
H A 0047 THR C 3.011 H A 0048 MET C
H A 0047 THR C 3.716 H A 0048 MET CB
H A 0048 MET C 2.436 H A 0049 LEU CA
H A 0048 MET C 3.014 H A 0049 LEU C
H A 0048 MET C 3.724 H A 0049 LEU CB
H A 0049 LEU C 2.440 H A 0050 ILE CA
H A 0049 LEU C 3.020 H A 0050 ILE C
H A 0049 LEU C 3.747 H A 0050 ILE CB
H A 0050 ILE C 2.432 H A 0051 ASN CA
H A 0050 ILE C 3.077 H A 0051 ASN C
H A 0050 ILE C 3.714 H A 0051 ASN CB
H A 0051 ASN CA 3.799 H A 0052 GLU CA
H A 0051 ASN C 2.432 H A 0052 GLU CA
H A 0051 ASN C 3.195 H A 0052 GLU C
H A 0051 ASN C 3.665 H A 0052 GLU CB
H A 0052 GLU CA 3.800 H A 0053 LYS CA
H A 0052 GLU C 2.438 H A 0053 LYS CA
H A 0052 GLU C 3.126 H A 0053 LYS C
H A 0052 GLU C 3.696 H A 0053 LYS CB
H A 0053 LYS C 2.460 H A 0054 LYS CA
H A 0053 LYS C 3.050 H A 0054 LYS C
H A 0053 LYS C 3.022 H A 0054 LYS CB
H A 0053 LYS C 3.530 H A 0054 LYS CG
H A 0053 LYS CB 3.730 C A 0055 LEU CD2
H A 0053 LYS CD 3.473 C A 0055 LEU CD2
H A 0054 LYS CA 3.792 C A 0055 LEU CA
H A 0054 LYS C 2.424 C A 0055 LEU CA
H A 0054 LYS C 3.222 C A 0055 LEU C
H A 0054 LYS C 3.656 C A 0055 LEU CB
C A 0055 LEU CA 3.792 C A 0056 ASN CA
C A 0055 LEU C 2.434 C A 0056 ASN CA
C A 0055 LEU C 3.440 C A 0056 ASN C
C A 0055 LEU C 3.515 C A 0056 ASN CB
C A 0055 LEU CD1 3.762 C A 0057 MET CE
C A 0055 LEU CB 3.676 H A 0062 HIS CB
C A 0055 LEU CB 3.508 H A 0062 HIS CG
C A 0056 ASN C 2.429 C A 0057 MET CA
C A 0056 ASN C 3.263 C A 0057 MET C
C A 0056 ASN C 3.644 C A 0057 MET CB
C A 0057 MET C 2.433 C A 0058 MET CA
C A 0057 MET C 3.287 C A 0058 MET C
C A 0057 MET C 3.640 C A 0058 MET CB
C A 0058 MET CA 3.796 H A 0059 ASN CA
C A 0058 MET C 2.426 H A 0059 ASN CA
C A 0058 MET C 3.443 H A 0059 ASN C
C A 0058 MET C 3.512 H A 0059 ASN CB
C A 0058 MET C 3.660 H A 0059 ASN CG
H A 0059 ASN C 2.444 H A 0060 ALA CA
H A 0059 ASN C 2.992 H A 0060 ALA C
H A 0059 ASN C 3.710 H A 0060 ALA CB
H A 0059 ASN CB 3.640 H A 0062 HIS CD2
H A 0060 ALA C 2.443 H A 0061 GLU CA
H A 0060 ALA C 2.941 H A 0061 GLU C
H A 0060 ALA C 3.711 H A 0061 GLU CB
H A 0061 GLU CA 3.780 H A 0062 HIS CA
H A 0061 GLU C 2.424 H A 0062 HIS CA
H A 0061 GLU C 3.156 H A 0062 HIS C
H A 0061 GLU C 3.673 H A 0062 HIS CB
H A 0061 GLU CB 3.783 C A 0085 TYR CE1
H A 0062 HIS CA 3.791 H A 0063 ARG CA
H A 0062 HIS C 2.427 H A 0063 ARG CA
H A 0062 HIS C 3.061 H A 0063 ARG C
H A 0062 HIS C 3.698 H A 0063 ARG CB
H A 0062 HIS C 3.780 H A 0065 LEU CB
H A 0063 ARG CA 3.798 H A 0064 LYS CA
H A 0063 ARG C 2.422 H A 0064 LYS CA
H A 0063 ARG C 3.086 H A 0064 LYS C
H A 0063 ARG C 3.713 H A 0064 LYS CB
H A 0064 LYS C 2.438 H A 0065 LEU CA
H A 0064 LYS C 2.962 H A 0065 LEU C
H A 0064 LYS C 3.728 H A 0065 LEU CB
H A 0065 LEU CA 3.793 H A 0066 LEU CA
H A 0065 LEU C 2.441 H A 0066 LEU CA
H A 0065 LEU C 2.953 H A 0066 LEU C
H A 0065 LEU C 3.715 H A 0066 LEU CB
H A 0065 LEU CD1 3.632 C A 0084 GLY CA
H A 0065 LEU CD2 3.442 C A 0084 GLY C
H A 0065 LEU CD2 3.610 C A 0085 TYR CE1
H A 0065 LEU CD2 3.673 C A 0085 TYR CZ
H A 0066 LEU CA 3.800 H A 0067 GLU CA
H A 0066 LEU C 2.436 H A 0067 GLU CA
H A 0066 LEU C 3.013 H A 0067 GLU C
H A 0066 LEU C 3.704 H A 0067 GLU CB
H A 0067 GLU C 2.449 H A 0068 GLN CA
H A 0067 GLU C 2.959 H A 0068 GLN C
H A 0067 GLU C 3.727 H A 0068 GLN CB
H A 0068 GLN CA 3.786 H A 0069 GLU CA
H A 0068 GLN C 2.432 H A 0069 GLU CA
H A 0068 GLN C 3.040 H A 0069 GLU C
H A 0068 GLN C 3.702 H A 0069 GLU CB
H A 0068 GLN C 3.624 C A 0082 ILE CD1
H A 0068 GLN CB 3.525 C A 0082 ILE CD1
H A 0069 GLU C 2.435 H A 0070 MET CA
H A 0069 GLU C 3.021 H A 0070 MET C
H A 0069 GLU C 3.720 H A 0070 MET CB
H A 0070 MET CA 3.799 H A 0071 VAL CA
H A 0070 MET C 2.426 H A 0071 VAL CA
H A 0070 MET C 3.034 H A 0071 VAL C
H A 0070 MET C 3.740 H A 0071 VAL CB
H A 0071 VAL C 2.428 H A 0072 SER CA
H A 0071 VAL C 3.065 H A 0072 SER C
H A 0071 VAL C 3.705 H A 0072 SER CB
H A 0071 VAL CG1 3.792 C A 0078 LYS CB
H A 0072 SER C 2.421 H A 0073 PHE CA
H A 0072 SER C 3.168 H A 0073 PHE C
H A 0072 SER C 3.664 H A 0073 PHE CB
H A 0072 SER CA 3.706 C A 0078 LYS CG
H A 0072 SER CB 3.791 C A 0078 LYS CG
H A 0072 SER CB 3.697 C A 0082 ILE CD1
H A 0073 PHE C 2.433 H A 0074 LEU CA
H A 0073 PHE C 3.220 H A 0074 LEU C
H A 0073 PHE C 3.667 H A 0074 LEU CB
H A 0074 LEU C 2.429 H A 0075 PHE CA
H A 0074 LEU C 3.226 H A 0075 PHE C
H A 0074 LEU C 3.648 H A 0075 PHE CB
H A 0075 PHE C 2.475 C A 0076 GLU CA
H A 0075 PHE C 3.178 C A 0076 GLU C
H A 0075 PHE C 3.002 C A 0076 GLU CB
H A 0075 PHE C 3.430 C A 0076 GLU CG
C A 0076 GLU C 2.426 C A 0077 GLY CA
C A 0076 GLU C 3.178 C A 0077 GLY C
C A 0077 GLY CA 3.792 C A 0078 LYS CA
C A 0077 GLY C 2.432 C A 0078 LYS CA
C A 0077 GLY C 3.278 C A 0078 LYS C
C A 0077 GLY C 3.637 C A 0078 LYS CB
C A 0078 LYS C 2.429 C A 0079 ASP CA
C A 0078 LYS C 3.435 C A 0079 ASP C
C A 0078 LYS C 3.513 C A 0079 ASP CB
C A 0078 LYS CE 3.796 C A 0082 ILE CG1
C A 0079 ASP CA 3.791 C A 0080 VAL CA
C A 0079 ASP C 2.427 C A 0080 VAL CA
C A 0079 ASP C 3.318 C A 0080 VAL C
C A 0079 ASP C 3.634 C A 0080 VAL CB
C A 0080 VAL C 2.443 C A 0081 HIS CA
C A 0080 VAL C 3.011 C A 0081 HIS C
C A 0080 VAL C 3.715 C A 0081 HIS CB
C A 0081 HIS CA 3.773 C A 0082 ILE CA
C A 0081 HIS C 2.398 C A 0082 ILE CA
C A 0081 HIS C 3.166 C A 0082 ILE C
C A 0081 HIS C 3.665 C A 0082 ILE CB
C A 0082 ILE CA 3.779 C A 0083 GLU CA
C A 0082 ILE C 2.430 C A 0083 GLU CA
C A 0082 ILE C 3.467 C A 0083 GLU C
C A 0082 ILE C 3.460 C A 0083 GLU CB
C A 0082 ILE C 3.566 C A 0083 GLU CG
C A 0083 GLU CA 3.765 C A 0084 GLY CA
C A 0083 GLU C 2.415 C A 0084 GLY CA
C A 0083 GLU C 3.107 C A 0084 GLY C
C A 0084 GLY CA 3.761 C A 0085 TYR CA
C A 0084 GLY C 2.411 C A 0085 TYR CA
C A 0084 GLY C 3.320 C A 0085 TYR C
C A 0084 GLY C 3.547 C A 0085 TYR CB
C A 0084 GLY C 3.726 C A 0085 TYR CG
C A 0085 TYR CA 3.776 C A 0086 THR CA
C A 0085 TYR C 2.407 C A 0086 THR CA
C A 0085 TYR C 3.366 C A 0086 THR C
C A 0085 TYR C 3.547 C A 0086 THR CB
C A 0086 THR CA 2.890 C A 0087 PRO CD
C A 0086 THR C 2.462 C A 0087 PRO CA
C A 0086 THR C 3.218 C A 0087 PRO C
C A 0086 THR C 3.616 C A 0087 PRO CB
C A 0086 THR C 3.656 C A 0087 PRO CG
C A 0086 THR C 2.501 C A 0087 PRO CD
C A 0087 PRO CA 3.799 C A 0088 GLU CA
C A 0087 PRO C 2.427 C A 0088 GLU CA
C A 0087 PRO C 3.284 C A 0088 GLU C
C A 0087 PRO C 3.619 C A 0088 GLU CB
C A 0088 GLU C 2.433 C A 0089 ASP CA
C A 0088 GLU C 3.068 C A 0089 ASP C
C A 0088 GLU C 3.715 C A 0089 ASP CB
C A 0089 ASP CA 3.799 C A 0090 LYS CA
C A 0089 ASP C 2.424 C A 0090 LYS CA
C A 0089 ASP C 3.171 C A 0090 LYS C
C A 0089 ASP C 3.659 C A 0090 LYS CB
C A 0090 LYS CA 3.795 C A 0091 LYS CA
C A 0090 LYS C 2.427 C A 0091 LYS CA
C A 0090 LYS C 3.440 C A 0091 LYS C
C A 0090 LYS C 3.500 C A 0091 LYS CB
C A 0090 LYS C 3.581 C A 0091 LYS CG
CHARGE_ATTR 2.00 12.00 100
E A 0013 ASP OD1 4.599 C A 0012 ARG NH1
E A 0013 ASP OD1 2.987 C A 0012 ARG NH2
E A 0013 ASP OD2 4.957 C A 0012 ARG NH1
E A 0013 ASP OD2 2.752 C A 0012 ARG NH2
E A 0015 GLU OE1 11.71 C A 0003 ARG NH1
E A 0015 GLU OE1 10.77 C A 0012 ARG NH2
E A 0015 GLU OE2 11.87 C A 0012 ARG NH2
E A 0015 GLU OE1 6.453 H A 0036 LYS NZ
E A 0015 GLU OE2 4.328 H A 0036 LYS NZ
C A 0018 ASP OD1 2.748 H A 0036 LYS NZ
C A 0018 ASP OD2 2.732 H A 0036 LYS NZ
H A 0025 GLU OE1 2.994 H A 0028 LYS NZ
H A 0025 GLU OE2 3.423 H A 0028 LYS NZ
H A 0025 GLU OE1 9.529 H A 0029 ARG NH1
H A 0025 GLU OE1 10.29 H A 0029 ARG NH2
H A 0025 GLU OE2 10.73 H A 0029 ARG NH1
H A 0025 GLU OE2 11.09 H A 0029 ARG NH2
C A 0033 GLU OE1 11.34 H A 0029 ARG NH1
C A 0033 GLU OE1 11.62 H A 0029 ARG NH2
C A 0033 GLU OE2 10.20 H A 0029 ARG NH1
C A 0033 GLU OE2 10.41 H A 0029 ARG NH2
H A 0037 ASP OD1 10.71 C A 0012 ARG NH1
H A 0037 ASP OD1 11.42 C A 0012 ARG NH2
H A 0037 ASP OD2 9.077 C A 0012 ARG NH1
H A 0037 ASP OD2 9.715 C A 0012 ARG NH2
H A 0037 ASP OD1 11.68 H A 0036 LYS NZ
H A 0037 ASP OD2 11.32 H A 0036 LYS NZ
H A 0037 ASP OD1 8.555 H A 0044 HIS ND1
H A 0037 ASP OD1 9.700 H A 0044 HIS NE2
H A 0037 ASP OD2 9.940 H A 0044 HIS ND1
H A 0037 ASP OD2 10.92 H A 0044 HIS NE2
H A 0052 GLU OE2 11.38 H A 0045 LYS NZ
H A 0052 GLU OE1 10.59 H A 0053 LYS NZ
H A 0052 GLU OE2 10.33 H A 0053 LYS NZ
H A 0052 GLU OE1 8.582 H A 0054 LYS NZ
H A 0052 GLU OE2 10.06 H A 0054 LYS NZ
H A 0061 GLU OE1 5.873 H A 0062 HIS ND1
H A 0061 GLU OE1 5.233 H A 0062 HIS NE2
H A 0061 GLU OE2 5.801 H A 0062 HIS ND1
H A 0061 GLU OE2 4.592 H A 0062 HIS NE2
H A 0061 GLU OE1 9.097 H A 0064 LYS NZ
H A 0061 GLU OE2 10.28 H A 0064 LYS NZ
H A 0061 GLU OE1 9.502 C A 0091 LYS NZ
H A 0061 GLU OE2 10.53 C A 0091 LYS NZ
H A 0067 GLU OE1 10.02 H A 0029 ARG NH1
H A 0067 GLU OE1 8.226 H A 0029 ARG NH2
H A 0067 GLU OE2 9.522 H A 0029 ARG NH1
H A 0067 GLU OE2 7.870 H A 0029 ARG NH2
H A 0067 GLU OE1 8.681 H A 0063 ARG NH1
H A 0067 GLU OE1 7.693 H A 0063 ARG NH2
H A 0067 GLU OE2 10.68 H A 0063 ARG NH1
H A 0067 GLU OE2 9.839 H A 0063 ARG NH2
H A 0067 GLU OE1 9.296 H A 0064 LYS NZ
H A 0067 GLU OE2 8.220 H A 0064 LYS NZ
H A 0069 GLU OE1 10.30 H A 0045 LYS NZ
H A 0069 GLU OE2 9.242 H A 0045 LYS NZ
H A 0069 GLU OE1 2.733 H A 0053 LYS NZ
H A 0069 GLU OE2 2.788 H A 0053 LYS NZ
H A 0069 GLU OE1 8.981 H A 0062 HIS ND1
H A 0069 GLU OE1 11.09 H A 0062 HIS NE2
H A 0069 GLU OE2 10.09 H A 0062 HIS ND1
H A 0069 GLU OE1 11.72 H A 0063 ARG NH1
H A 0069 GLU OE1 10.08 H A 0064 LYS NZ
H A 0069 GLU OE2 10.50 H A 0064 LYS NZ
H A 0069 GLU OE2 11.27 C A 0078 LYS NZ
C A 0076 GLU OE1 8.346 C A 0078 LYS NZ
C A 0076 GLU OE2 8.306 C A 0078 LYS NZ
C A 0079 ASP OD1 11.81 H A 0029 ARG NH1
C A 0079 ASP OD1 12.00 H A 0029 ARG NH2
C A 0079 ASP OD2 11.80 H A 0029 ARG NH1
C A 0079 ASP OD2 11.83 H A 0029 ARG NH2
C A 0079 ASP OD1 9.620 C A 0078 LYS NZ
C A 0079 ASP OD2 10.35 C A 0078 LYS NZ
C A 0079 ASP OD1 10.18 C A 0081 HIS ND1
C A 0079 ASP OD1 8.874 C A 0081 HIS NE2
C A 0079 ASP OD2 9.590 C A 0081 HIS ND1
C A 0079 ASP OD2 8.671 C A 0081 HIS NE2
C A 0079 ASP OD2 11.55 C A 0090 LYS NZ
C A 0083 GLU OE1 9.059 H A 0064 LYS NZ
C A 0083 GLU OE2 7.852 H A 0064 LYS NZ
C A 0083 GLU OE2 11.20 C A 0078 LYS NZ
C A 0083 GLU OE1 4.302 C A 0081 HIS ND1
C A 0083 GLU OE1 6.289 C A 0081 HIS NE2
C A 0083 GLU OE2 2.784 C A 0081 HIS ND1
C A 0083 GLU OE2 4.921 C A 0081 HIS NE2
C A 0083 GLU OE1 11.79 C A 0091 LYS NZ
C A 0083 GLU OE2 10.84 C A 0091 LYS NZ
C A 0088 GLU OE2 10.95 H A 0064 LYS NZ
C A 0088 GLU OE1 9.005 C A 0081 HIS ND1
C A 0088 GLU OE1 10.13 C A 0081 HIS NE2
C A 0088 GLU OE2 8.530 C A 0081 HIS ND1
C A 0088 GLU OE2 9.539 C A 0081 HIS NE2
C A 0088 GLU OE1 8.810 C A 0090 LYS NZ
C A 0088 GLU OE2 7.103 C A 0090 LYS NZ
C A 0088 GLU OE1 9.196 C A 0091 LYS NZ
C A 0088 GLU OE2 8.099 C A 0091 LYS NZ
C A 0089 ASP OD1 8.076 C A 0090 LYS NZ
C A 0089 ASP OD2 8.261 C A 0090 LYS NZ
C A 0089 ASP OD1 6.778 C A 0091 LYS NZ
C A 0089 ASP OD2 7.155 C A 0091 LYS NZ
CHARGE_REPU 2.00 12.00 50
E A 0013 ASP OD1 11.65 E A 0015 GLU OE1
E A 0013 ASP OD2 9.509 E A 0015 GLU OE1
E A 0013 ASP OD2 10.76 E A 0015 GLU OE2
E A 0013 ASP OD1 11.69 H A 0037 ASP OD2
E A 0013 ASP OD2 10.81 H A 0037 ASP OD2
E A 0015 GLU OE1 8.201 C A 0018 ASP OD1
E A 0015 GLU OE1 9.114 C A 0018 ASP OD2
E A 0015 GLU OE2 6.351 C A 0018 ASP OD1
E A 0015 GLU OE2 7.026 C A 0018 ASP OD2
E A 0015 GLU OE1 10.91 H A 0037 ASP OD2
E A 0015 GLU OE2 11.30 H A 0037 ASP OD1
E A 0015 GLU OE2 10.20 H A 0037 ASP OD2
H A 0028 LYS NZ 9.522 H A 0029 ARG NH1
H A 0028 LYS NZ 10.25 H A 0029 ARG NH2
C A 0033 GLU OE1 9.633 C A 0076 GLU OE1
C A 0033 GLU OE1 11.07 C A 0076 GLU OE2
C A 0033 GLU OE2 8.102 C A 0076 GLU OE1
C A 0033 GLU OE2 9.701 C A 0076 GLU OE2
H A 0044 HIS ND1 9.589 H A 0045 LYS NZ
H A 0044 HIS NE2 11.39 H A 0045 LYS NZ
H A 0045 LYS NZ 10.37 H A 0053 LYS NZ
H A 0052 GLU OE2 11.97 H A 0069 GLU OE2
H A 0053 LYS NZ 7.922 H A 0062 HIS ND1
H A 0053 LYS NZ 9.964 H A 0062 HIS NE2
H A 0053 LYS NZ 10.86 H A 0064 LYS NZ
H A 0054 LYS NZ 11.75 H A 0062 HIS ND1
H A 0054 LYS NZ 11.38 H A 0062 HIS NE2
H A 0062 HIS ND1 11.13 H A 0063 ARG NH1
H A 0062 HIS NE2 11.75 H A 0063 ARG NH1
H A 0062 HIS ND1 9.784 H A 0064 LYS NZ
H A 0062 HIS NE2 11.13 H A 0064 LYS NZ
H A 0064 LYS NZ 9.618 C A 0081 HIS ND1
H A 0064 LYS NZ 11.24 C A 0081 HIS NE2
H A 0064 LYS NZ 7.087 C A 0091 LYS NZ
H A 0067 GLU OE1 11.47 H A 0069 GLU OE1
H A 0067 GLU OE2 11.50 H A 0069 GLU OE1
H A 0067 GLU OE2 11.93 C A 0079 ASP OD1
H A 0067 GLU OE2 10.60 C A 0079 ASP OD2
C A 0078 LYS NZ 9.971 C A 0081 HIS ND1
C A 0078 LYS NZ 9.337 C A 0081 HIS NE2
C A 0079 ASP OD2 11.30 C A 0083 GLU OE2
C A 0083 GLU OE1 8.751 C A 0088 GLU OE1
C A 0083 GLU OE1 9.016 C A 0088 GLU OE2
C A 0083 GLU OE2 8.383 C A 0088 GLU OE1
C A 0083 GLU OE2 8.123 C A 0088 GLU OE2
C A 0088 GLU OE1 5.771 C A 0089 ASP OD1
C A 0088 GLU OE1 7.894 C A 0089 ASP OD2
C A 0088 GLU OE2 5.607 C A 0089 ASP OD1
C A 0088 GLU OE2 7.511 C A 0089 ASP OD2
C A 0090 LYS NZ 10.53 C A 0091 LYS NZ
HB_MM 2.00 3.20 145
C A 0002 SER N 2.245 C A 0001 MET O
C A 0003 ARG N 2.248 C A 0002 SER O
E A 0004 THR N 2.249 C A 0003 ARG O
E A 0005 ILE N 2.248 E A 0004 THR O
E A 0005 ILE N 2.798 E A 0014 ALA O
E A 0006 PHE N 2.240 E A 0005 ILE O
C A 0007 CYS N 2.247 E A 0006 PHE O
C A 0008 THR N 2.250 C A 0007 CYS O
C A 0008 THR N 2.874 C A 0033 GLU O
C A 0009 TYR N 2.245 C A 0008 THR O
C A 0010 LEU N 3.160 C A 0007 CYS O
C A 0010 LEU N 2.241 C A 0009 TYR O
C A 0011 GLN N 2.676 C A 0007 CYS O
C A 0011 GLN N 2.257 C A 0010 LEU O
C A 0012 ARG N 3.181 C A 0010 LEU O
C A 0012 ARG N 2.247 C A 0011 GLN O
E A 0013 ASP N 2.261 C A 0012 ARG O
E A 0014 ALA N 2.710 E A 0005 ILE O
E A 0014 ALA N 2.248 E A 0013 ASP O
E A 0015 GLU N 2.244 E A 0014 ALA O
C A 0016 GLY N 2.845 C A 0003 ARG O
C A 0016 GLY N 2.252 E A 0015 GLU O
C A 0017 GLN N 2.255 C A 0016 GLY O
C A 0018 ASP N 2.252 C A 0017 GLN O
C A 0019 PHE N 2.247 C A 0018 ASP O
C A 0020 GLN N 2.258 C A 0019 PHE O
C A 0021 LEU N 2.991 C A 0019 PHE O
C A 0021 LEU N 2.244 C A 0020 GLN O
C A 0022 TYR N 2.256 C A 0021 LEU O
C A 0023 PRO N 2.251 C A 0022 TYR O
H A 0024 GLY N 2.246 C A 0023 PRO O
H A 0025 GLU N 2.248 H A 0024 GLY O
H A 0026 LEU N 2.255 H A 0025 GLU O
H A 0027 GLY N 2.257 H A 0026 LEU O
H A 0028 LYS N 2.241 H A 0027 GLY O
H A 0029 ARG N 3.173 H A 0025 GLU O
H A 0029 ARG N 2.256 H A 0028 LYS O
H A 0030 ILE N 3.019 H A 0026 LEU O
H A 0030 ILE N 3.089 H A 0027 GLY O
H A 0030 ILE N 2.246 H A 0029 ARG O
H A 0031 TYR N 2.797 H A 0027 GLY O
H A 0031 TYR N 2.249 H A 0030 ILE O
H A 0032 ASN N 3.108 H A 0030 ILE O
H A 0032 ASN N 2.238 H A 0031 TYR O
C A 0033 GLU N 2.870 H A 0030 ILE O
C A 0033 GLU N 2.249 H A 0032 ASN O
C A 0034 ILE N 2.765 H A 0030 ILE O
C A 0034 ILE N 2.246 C A 0033 GLU O
H A 0035 SER N 2.251 C A 0034 ILE O
H A 0036 LYS N 2.254 H A 0035 SER O
H A 0037 ASP N 3.072 H A 0035 SER O
H A 0037 ASP N 2.257 H A 0036 LYS O
H A 0038 ALA N 3.173 H A 0035 SER O
H A 0038 ALA N 2.253 H A 0037 ASP O
H A 0039 TRP N 2.950 H A 0035 SER O
H A 0039 TRP N 2.258 H A 0038 ALA O
H A 0040 ALA N 2.959 H A 0036 LYS O
H A 0040 ALA N 3.138 H A 0037 ASP O
H A 0040 ALA N 2.254 H A 0039 TRP O
H A 0041 GLN N 2.897 H A 0037 ASP O
H A 0041 GLN N 2.259 H A 0040 ALA O
H A 0042 TRP N 3.006 H A 0038 ALA O
H A 0042 TRP N 2.252 H A 0041 GLN O
H A 0043 GLN N 2.244 H A 0042 TRP O
H A 0044 HIS N 3.081 H A 0040 ALA O
H A 0044 HIS N 3.112 H A 0042 TRP O
H A 0044 HIS N 2.239 H A 0043 GLN O
H A 0045 LYS N 2.954 H A 0042 TRP O
H A 0045 LYS N 2.251 H A 0044 HIS O
H A 0046 GLN N 2.799 H A 0042 TRP O
H A 0046 GLN N 2.244 H A 0045 LYS O
H A 0047 THR N 3.156 H A 0043 GLN O
H A 0047 THR N 2.240 H A 0046 GLN O
H A 0048 MET N 3.116 H A 0044 HIS O
H A 0048 MET N 3.138 H A 0045 LYS O
H A 0048 MET N 2.258 H A 0047 THR O
H A 0049 LEU N 2.838 H A 0045 LYS O
H A 0049 LEU N 2.970 H A 0046 GLN O
H A 0049 LEU N 2.250 H A 0048 MET O
H A 0050 ILE N 2.758 H A 0046 GLN O
H A 0050 ILE N 2.246 H A 0049 LEU O
H A 0051 ASN N 3.174 H A 0047 THR O
H A 0051 ASN N 3.072 H A 0048 MET O
H A 0051 ASN N 2.246 H A 0050 ILE O
H A 0052 GLU N 3.130 H A 0048 MET O
H A 0052 GLU N 2.988 H A 0049 LEU O
H A 0052 GLU N 2.246 H A 0051 ASN O
H A 0053 LYS N 2.702 H A 0049 LEU O
H A 0053 LYS N 2.255 H A 0052 GLU O
H A 0054 LYS N 2.814 H A 0050 ILE O
H A 0054 LYS N 2.262 H A 0053 LYS O
C A 0055 LEU N 2.248 H A 0054 LYS O
C A 0056 ASN N 2.249 C A 0055 LEU O
C A 0057 MET N 2.246 C A 0056 ASN O
C A 0058 MET N 2.245 C A 0057 MET O
H A 0059 ASN N 2.239 C A 0058 MET O
H A 0060 ALA N 2.257 H A 0059 ASN O
H A 0061 GLU N 3.125 H A 0059 ASN O
H A 0061 GLU N 2.255 H A 0060 ALA O
H A 0062 HIS N 3.075 H A 0059 ASN O
H A 0062 HIS N 2.248 H A 0061 GLU O
H A 0063 ARG N 2.809 H A 0059 ASN O
H A 0063 ARG N 2.248 H A 0062 HIS O
H A 0064 LYS N 2.825 H A 0060 ALA O
H A 0064 LYS N 2.250 H A 0063 ARG O
H A 0065 LEU N 2.248 H A 0064 LYS O
H A 0066 LEU N 2.259 H A 0065 LEU O
H A 0067 GLU N 2.253 H A 0066 LEU O
H A 0068 GLN N 2.865 H A 0064 LYS O
H A 0068 GLN N 2.258 H A 0067 GLU O
H A 0069 GLU N 3.010 H A 0065 LEU O
H A 0069 GLU N 2.255 H A 0068 GLN O
H A 0070 MET N 2.856 H A 0066 LEU O
H A 0070 MET N 2.249 H A 0069 GLU O
H A 0071 VAL N 3.002 H A 0067 GLU O
H A 0071 VAL N 2.248 H A 0070 MET O
H A 0072 SER N 2.951 H A 0068 GLN O
H A 0072 SER N 2.242 H A 0071 VAL O
H A 0073 PHE N 2.892 H A 0069 GLU O
H A 0073 PHE N 2.241 H A 0072 SER O
H A 0074 LEU N 2.965 H A 0070 MET O
H A 0074 LEU N 2.250 H A 0073 PHE O
H A 0075 PHE N 2.860 H A 0071 VAL O
H A 0075 PHE N 2.241 H A 0074 LEU O
C A 0076 GLU N 2.793 H A 0071 VAL O
C A 0076 GLU N 2.269 H A 0075 PHE O
C A 0077 GLY N 2.703 H A 0075 PHE O
C A 0077 GLY N 2.252 C A 0076 GLU O
C A 0078 LYS N 2.800 C A 0076 GLU O
C A 0078 LYS N 2.245 C A 0077 GLY O
C A 0079 ASP N 2.247 C A 0078 LYS O
C A 0080 VAL N 2.245 C A 0079 ASP O
C A 0081 HIS N 2.255 C A 0080 VAL O
C A 0082 ILE N 2.236 C A 0081 HIS O
C A 0083 GLU N 3.114 C A 0081 HIS O
C A 0083 GLU N 2.244 C A 0082 ILE O
C A 0084 GLY N 2.254 C A 0083 GLU O
C A 0085 TYR N 2.870 C A 0083 GLU O
C A 0085 TYR N 2.243 C A 0084 GLY O
C A 0086 THR N 2.236 C A 0085 TYR O
C A 0087 PRO N 2.249 C A 0086 THR O
C A 0088 GLU N 2.248 C A 0087 PRO O
C A 0089 ASP N 2.253 C A 0088 GLU O
C A 0090 LYS N 2.243 C A 0089 ASP O
C A 0091 LYS N 2.244 C A 0090 LYS O
HB_MS 2.00 3.20 16
C A 0008 THR O 2.852 C A 0011 GLN NE2
C A 0009 TYR N 3.146 C A 0008 THR OG1
E A 0015 GLU O 3.188 H A 0035 SER OG
C A 0019 PHE O 2.880 H A 0031 TYR OH
H A 0028 LYS O 2.708 H A 0032 ASN ND2
H A 0029 ARG O 2.967 H A 0032 ASN ND2
H A 0036 LYS N 2.860 H A 0035 SER OG
H A 0043 GLN O 2.597 H A 0047 THR OG1
C A 0058 MET N 2.917 C A 0056 ASN OD1
H A 0064 LYS O 2.981 H A 0068 GLN NE2
H A 0074 LEU O 2.755 C A 0008 THR OG1
C A 0076 GLU O 3.087 C A 0078 LYS NZ
C A 0084 GLY O 3.049 H A 0064 LYS NZ
C A 0084 GLY O 2.760 H A 0068 GLN NE2
C A 0089 ASP O 3.022 C A 0091 LYS NZ
C A 0090 LYS N 2.834 C A 0089 ASP OD1
HB_SS 2.00 3.20 6
E A 0015 GLU OE1 2.638 C A 0002 SER OG
C A 0056 ASN ND2 2.893 H A 0059 ASN OD1
H A 0062 HIS ND1 2.787 C A 0085 TYR OH
H A 0064 LYS NZ 3.029 C A 0086 THR OG1
H A 0069 GLU OE1 2.757 H A 0046 GLN NE2
C A 0078 LYS NZ 2.866 H A 0072 SER OG
AROMATIC 0.00 8.00 6
H A 0045 LYS 7.189 H A 0042 TRP
H A 0053 LYS 7.686 H A 0042 TRP
H A 0063 ARG 6.907 C A 0022 TYR
H A 0045 LYS 6.672 H A 0073 PHE
H A 0062 HIS 5.856 C A 0085 TYR
H A 0064 LYS 6.983 C A 0085 TYR