Complet list of 3crd con file
Complete list of 3crd.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 645
C A 0001 MET C 2.434 C A 0002 GLU CA
C A 0001 MET C 3.116 C A 0002 GLU C
C A 0001 MET C 3.696 C A 0002 GLU CB
C A 0002 GLU C 2.435 C A 0003 ALA CA
C A 0002 GLU C 3.719 C A 0003 ALA C
C A 0002 GLU C 2.997 C A 0003 ALA CB
C A 0003 ALA C 2.434 C A 0004 ARG CA
C A 0003 ALA C 3.476 C A 0004 ARG C
C A 0003 ALA C 3.492 C A 0004 ARG CB
C A 0003 ALA CA 3.587 H A 0006 LYS CG
C A 0003 ALA CA 3.491 H A 0006 LYS CD
C A 0003 ALA CA 3.708 H A 0006 LYS CE
C A 0003 ALA CB 3.793 H A 0006 LYS CE
C A 0004 ARG C 2.433 H A 0005 ASP CA
C A 0004 ARG C 3.110 H A 0005 ASP C
C A 0004 ARG C 3.698 H A 0005 ASP CB
C A 0004 ARG C 3.732 H A 0008 VAL CG2
C A 0004 ARG CA 3.332 C A 0094 MET CG
C A 0004 ARG CB 3.407 C A 0094 MET CG
C A 0004 ARG CG 3.440 C A 0094 MET CG
C A 0004 ARG CD 3.739 C A 0094 MET CG
H A 0005 ASP CA 3.790 H A 0006 LYS CA
H A 0005 ASP C 2.431 H A 0006 LYS CA
H A 0005 ASP C 3.033 H A 0006 LYS C
H A 0005 ASP C 3.691 H A 0006 LYS CB
H A 0005 ASP CA 3.774 H A 0008 VAL CG2
H A 0005 ASP CG 3.320 H A 0069 PHE CB
H A 0006 LYS C 2.432 H A 0007 GLN CA
H A 0006 LYS C 3.084 H A 0007 GLN C
H A 0006 LYS C 3.705 H A 0007 GLN CB
H A 0007 GLN CA 3.774 H A 0008 VAL CA
H A 0007 GLN C 2.418 H A 0008 VAL CA
H A 0007 GLN C 2.964 H A 0008 VAL C
H A 0007 GLN C 3.716 H A 0008 VAL CB
H A 0007 GLN C 3.403 C A 0093 ALA CB
H A 0007 GLN CB 3.596 C A 0093 ALA C
H A 0007 GLN CB 3.603 C A 0094 MET CA
H A 0008 VAL CA 3.756 H A 0009 LEU CA
H A 0008 VAL C 2.415 H A 0009 LEU CA
H A 0008 VAL C 2.820 H A 0009 LEU C
H A 0008 VAL C 3.657 H A 0009 LEU CB
H A 0008 VAL CB 3.255 H A 0069 PHE CE2
H A 0008 VAL CB 3.407 H A 0069 PHE CZ
H A 0008 VAL CG1 3.092 H A 0069 PHE CE2
H A 0008 VAL CG1 3.263 H A 0069 PHE CZ
H A 0008 VAL CG2 3.737 H A 0069 PHE CE2
H A 0008 VAL CG1 3.149 H A 0089 ALA C
H A 0008 VAL CG1 3.759 H A 0089 ALA CB
H A 0008 VAL CB 3.707 H A 0090 ARG CA
H A 0008 VAL CG1 3.084 H A 0090 ARG CA
H A 0008 VAL CG1 3.394 H A 0090 ARG CB
H A 0008 VAL CG2 3.224 H A 0090 ARG CA
H A 0008 VAL CG2 3.491 H A 0090 ARG CB
H A 0008 VAL CA 3.503 C A 0093 ALA CB
H A 0009 LEU CA 3.795 H A 0010 ARG CA
H A 0009 LEU C 2.445 H A 0010 ARG CA
H A 0009 LEU C 2.888 H A 0010 ARG C
H A 0009 LEU C 3.698 H A 0010 ARG CB
H A 0009 LEU C 3.322 H A 0013 ARG CB
H A 0009 LEU CD1 3.344 H A 0058 LEU CA
H A 0009 LEU CG 3.134 C A 0061 LEU CB
H A 0009 LEU CG 3.733 C A 0061 LEU CD1
H A 0009 LEU CD1 3.261 C A 0061 LEU CB
H A 0009 LEU CD1 3.737 C A 0061 LEU CG
H A 0009 LEU CD1 3.582 C A 0061 LEU CD1
H A 0009 LEU CD2 3.460 C A 0061 LEU CB
H A 0009 LEU CD2 3.176 C A 0061 LEU CD1
H A 0009 LEU CD2 2.813 H A 0069 PHE CD1
H A 0009 LEU CD2 2.804 H A 0069 PHE CE1
H A 0010 ARG C 2.433 H A 0011 SER CA
H A 0010 ARG C 2.934 H A 0011 SER C
H A 0010 ARG C 3.711 H A 0011 SER CB
H A 0010 ARG CA 3.507 H A 0013 ARG CB
H A 0010 ARG C 3.445 H A 0013 ARG CB
H A 0011 SER CA 3.794 H A 0012 LEU CA
H A 0011 SER C 2.426 H A 0012 LEU CA
H A 0011 SER C 3.001 H A 0012 LEU C
H A 0011 SER C 3.705 H A 0012 LEU CB
H A 0011 SER CB 3.092 C A 0093 ALA CB
H A 0012 LEU C 2.427 H A 0013 ARG CA
H A 0012 LEU C 2.944 H A 0013 ARG C
H A 0012 LEU C 3.720 H A 0013 ARG CB
H A 0012 LEU C 3.688 H A 0016 LEU CD1
H A 0012 LEU CD1 3.510 H A 0085 LYS C
H A 0012 LEU CB 3.345 H A 0086 LEU CD2
H A 0012 LEU CG 3.651 H A 0086 LEU CD2
H A 0012 LEU CG 3.305 H A 0089 ALA CB
H A 0012 LEU CD2 2.916 H A 0089 ALA CB
H A 0013 ARG CA 3.795 H A 0014 LEU CA
H A 0013 ARG C 2.429 H A 0014 LEU CA
H A 0013 ARG C 3.108 H A 0014 LEU C
H A 0013 ARG C 3.690 H A 0014 LEU CB
H A 0013 ARG CB 3.793 H A 0058 LEU CB
H A 0013 ARG CD 3.695 H A 0058 LEU C
H A 0013 ARG CD 2.967 H A 0058 LEU CB
H A 0013 ARG CZ 3.533 H A 0059 ASP CG
H A 0014 LEU C 2.429 H A 0015 GLU CA
H A 0014 LEU C 2.930 H A 0015 GLU C
H A 0014 LEU C 3.718 H A 0015 GLU CB
H A 0015 GLU CA 3.787 H A 0016 LEU CA
H A 0015 GLU C 2.420 H A 0016 LEU CA
H A 0015 GLU C 3.003 H A 0016 LEU C
H A 0015 GLU C 3.701 H A 0016 LEU CB
H A 0016 LEU CA 3.786 H A 0017 GLY CA
H A 0016 LEU C 2.416 H A 0017 GLY CA
H A 0016 LEU C 3.049 H A 0017 GLY C
H A 0016 LEU CD1 3.710 H A 0017 GLY CA
H A 0016 LEU CD1 3.066 H A 0058 LEU CD1
H A 0016 LEU CD1 3.678 H A 0058 LEU CD2
H A 0017 GLY CA 3.793 H A 0018 ALA CA
H A 0017 GLY C 2.433 H A 0018 ALA CA
H A 0017 GLY C 2.987 H A 0018 ALA C
H A 0017 GLY C 3.705 H A 0018 ALA CB
H A 0017 GLY CA 3.668 H A 0058 LEU CD1
H A 0018 ALA C 2.438 C A 0019 GLU CA
H A 0018 ALA C 3.716 C A 0019 GLU C
H A 0018 ALA C 2.959 C A 0019 GLU CB
C A 0019 GLU C 2.431 C A 0020 VAL CA
C A 0019 GLU C 3.704 C A 0020 VAL C
C A 0019 GLU C 3.144 C A 0020 VAL CB
C A 0020 VAL C 2.435 C A 0021 LEU CA
C A 0020 VAL C 3.536 C A 0021 LEU C
C A 0020 VAL C 3.432 C A 0021 LEU CB
C A 0021 LEU C 2.432 C A 0022 VAL CA
C A 0021 LEU C 3.567 C A 0022 VAL C
C A 0021 LEU C 3.421 C A 0022 VAL CB
C A 0021 LEU C 3.573 H A 0051 LEU CD1
C A 0021 LEU CD1 3.615 C A 0077 GLN CB
C A 0022 VAL C 2.432 C A 0023 GLU CA
C A 0022 VAL C 3.719 C A 0023 GLU C
C A 0022 VAL C 2.949 C A 0023 GLU CB
C A 0022 VAL C 3.499 C A 0023 GLU CG
C A 0022 VAL CB 3.698 H A 0051 LEU CD2
C A 0022 VAL CG2 3.503 H A 0051 LEU CD2
C A 0023 GLU CA 3.793 C A 0024 GLY CA
C A 0023 GLU C 2.419 C A 0024 GLY CA
C A 0023 GLU C 3.641 C A 0024 GLY C
C A 0024 GLY CA 3.800 C A 0025 LEU CA
C A 0024 GLY C 2.437 C A 0025 LEU CA
C A 0024 GLY C 2.937 C A 0025 LEU C
C A 0024 GLY C 3.716 C A 0025 LEU CB
C A 0024 GLY CA 3.475 C A 0077 GLN CG
C A 0024 GLY CA 3.621 C A 0077 GLN CD
C A 0024 GLY C 3.462 C A 0077 GLN CG
C A 0025 LEU CA 3.800 C A 0026 VAL CA
C A 0025 LEU C 2.435 C A 0026 VAL CA
C A 0025 LEU C 3.664 C A 0026 VAL C
C A 0025 LEU C 3.231 C A 0026 VAL CB
C A 0025 LEU C 3.470 C A 0026 VAL CG1
C A 0026 VAL C 2.442 H A 0027 LEU CA
C A 0026 VAL C 3.011 H A 0027 LEU C
C A 0026 VAL C 3.720 H A 0027 LEU CB
C A 0026 VAL CG1 3.776 H A 0027 LEU CD1
C A 0026 VAL CA 3.528 H A 0075 SER CB
C A 0026 VAL C 3.430 H A 0075 SER CB
C A 0026 VAL CG2 3.353 H A 0075 SER CB
H A 0027 LEU C 2.439 H A 0028 GLN CA
H A 0027 LEU C 3.103 H A 0028 GLN C
H A 0027 LEU C 3.699 H A 0028 GLN CB
H A 0027 LEU CA 3.707 H A 0030 LEU CB
H A 0027 LEU CA 3.600 H A 0030 LEU CG
H A 0027 LEU C 3.692 H A 0030 LEU CB
H A 0027 LEU CD2 3.471 H A 0044 ILE CD1
H A 0027 LEU CD1 3.764 H A 0053 LYS CB
H A 0027 LEU CD2 3.723 H A 0057 LEU CD2
H A 0028 GLN CA 3.796 H A 0029 TYR CA
H A 0028 GLN C 2.431 H A 0029 TYR CA
H A 0028 GLN C 3.018 H A 0029 TYR C
H A 0028 GLN C 3.708 H A 0029 TYR CB
H A 0029 TYR CA 3.753 H A 0030 LEU CA
H A 0029 TYR C 2.428 H A 0030 LEU CA
H A 0029 TYR C 3.113 H A 0030 LEU C
H A 0029 TYR C 3.639 H A 0030 LEU CB
H A 0029 TYR C 3.682 H A 0030 LEU CD2
H A 0029 TYR CG 3.517 H A 0030 LEU CD2
H A 0029 TYR CD2 3.109 H A 0030 LEU CD2
H A 0029 TYR CE2 3.219 H A 0030 LEU CD2
H A 0029 TYR CZ 3.705 H A 0030 LEU CD2
H A 0029 TYR CD1 3.661 H A 0033 GLU CG
H A 0029 TYR CE1 3.752 H A 0033 GLU CB
H A 0029 TYR CE1 3.200 H A 0033 GLU CG
H A 0029 TYR CE1 3.183 H A 0071 THR CG2
H A 0029 TYR CE2 3.745 H A 0071 THR C
H A 0029 TYR CZ 3.765 H A 0071 THR C
H A 0029 TYR CZ 2.921 H A 0071 THR CG2
H A 0029 TYR CD2 3.556 H A 0074 ASP C
H A 0029 TYR CE2 3.502 H A 0074 ASP CA
H A 0029 TYR CE2 3.102 H A 0074 ASP C
H A 0029 TYR CE2 2.960 H A 0074 ASP CB
H A 0029 TYR CZ 3.176 H A 0074 ASP CB
H A 0029 TYR CD2 3.232 H A 0075 SER CA
H A 0029 TYR CD2 3.185 H A 0075 SER CB
H A 0029 TYR CE2 3.571 H A 0075 SER CA
H A 0029 TYR CE2 3.686 H A 0075 SER CB
H A 0030 LEU CA 3.790 H A 0031 TYR CA
H A 0030 LEU C 2.436 H A 0031 TYR CA
H A 0030 LEU C 2.792 H A 0031 TYR C
H A 0030 LEU C 3.654 H A 0031 TYR CB
H A 0030 LEU CA 3.767 C A 0035 ILE CB
H A 0030 LEU CA 3.520 C A 0035 ILE CG1
H A 0030 LEU CB 3.447 C A 0035 ILE CB
H A 0030 LEU CB 3.480 C A 0035 ILE CG1
H A 0030 LEU CD2 3.668 C A 0035 ILE CG1
H A 0030 LEU CD2 3.510 C A 0035 ILE CD1
H A 0030 LEU CD2 3.783 H A 0071 THR C
H A 0030 LEU CD1 3.492 H A 0072 PHE CA
H A 0030 LEU CG 3.575 H A 0075 SER CB
H A 0030 LEU CD1 3.797 H A 0075 SER CB
H A 0030 LEU CD2 3.326 H A 0075 SER CB
H A 0031 TYR CA 3.790 H A 0032 GLN CA
H A 0031 TYR C 2.432 H A 0032 GLN CA
H A 0031 TYR C 3.185 H A 0032 GLN C
H A 0031 TYR C 3.674 H A 0032 GLN CB
H A 0031 TYR CA 3.585 C A 0036 LEU CB
H A 0031 TYR CA 3.248 C A 0036 LEU CG
H A 0031 TYR CA 3.588 C A 0036 LEU CD1
H A 0031 TYR CB 3.536 C A 0036 LEU CD1
H A 0031 TYR CG 3.586 C A 0036 LEU CB
H A 0031 TYR CG 3.443 C A 0036 LEU CG
H A 0031 TYR CG 2.799 C A 0036 LEU CD1
H A 0031 TYR CD1 2.971 C A 0036 LEU CB
H A 0031 TYR CD1 3.430 C A 0036 LEU CG
H A 0031 TYR CD1 3.100 C A 0036 LEU CD1
H A 0031 TYR CD2 2.795 C A 0036 LEU CD1
H A 0031 TYR CE1 3.301 C A 0036 LEU CB
H A 0031 TYR CE1 3.379 C A 0036 LEU CD1
H A 0031 TYR CE2 3.103 C A 0036 LEU CD1
H A 0031 TYR CZ 3.375 C A 0036 LEU CD1
H A 0031 TYR CE1 3.267 H A 0040 HIS CB
H A 0031 TYR CZ 3.653 H A 0040 HIS C
H A 0031 TYR CZ 3.469 H A 0040 HIS CB
H A 0031 TYR CD1 3.433 H A 0041 ILE CD1
H A 0031 TYR CE1 2.813 H A 0041 ILE CD1
H A 0031 TYR CZ 3.557 H A 0041 ILE CA
H A 0031 TYR CZ 3.174 H A 0041 ILE CD1
H A 0031 TYR CE2 3.333 H A 0044 ILE CB
H A 0031 TYR CE2 3.163 H A 0044 ILE CG1
H A 0031 TYR CE2 3.357 H A 0044 ILE CG2
H A 0031 TYR CZ 3.486 H A 0044 ILE CB
H A 0031 TYR CZ 3.251 H A 0044 ILE CG1
H A 0032 GLN CA 3.791 H A 0033 GLU CA
H A 0032 GLN C 2.416 H A 0033 GLU CA
H A 0032 GLN C 2.899 H A 0033 GLU C
H A 0032 GLN C 3.711 H A 0033 GLU CB
H A 0033 GLU CA 3.781 C A 0034 GLY CA
H A 0033 GLU C 2.414 C A 0034 GLY CA
H A 0033 GLU C 3.544 C A 0034 GLY C
H A 0033 GLU CB 3.784 H A 0071 THR CG2
C A 0034 GLY CA 3.767 C A 0035 ILE CA
C A 0034 GLY C 2.424 C A 0035 ILE CA
C A 0034 GLY C 2.789 C A 0035 ILE C
C A 0034 GLY C 3.661 C A 0035 ILE CB
C A 0035 ILE CA 3.729 C A 0036 LEU CA
C A 0035 ILE C 2.403 C A 0036 LEU CA
C A 0035 ILE C 3.299 C A 0036 LEU C
C A 0035 ILE C 3.550 C A 0036 LEU CB
C A 0035 ILE C 3.707 C A 0036 LEU CG
C A 0035 ILE C 3.223 C A 0036 LEU CD2
C A 0035 ILE CB 3.365 C A 0036 LEU CD2
C A 0035 ILE CG2 2.977 C A 0036 LEU CD2
C A 0035 ILE CG2 3.470 C A 0068 ALA CB
C A 0035 ILE CD1 3.722 C A 0068 ALA C
C A 0035 ILE CG1 3.771 H A 0071 THR CB
C A 0035 ILE CG1 3.322 H A 0071 THR CG2
C A 0035 ILE CD1 3.708 H A 0071 THR CA
C A 0035 ILE CD1 3.244 H A 0071 THR C
C A 0035 ILE CD1 3.075 H A 0071 THR CB
C A 0035 ILE CD1 3.122 H A 0071 THR CG2
C A 0035 ILE CD1 3.359 H A 0072 PHE CA
C A 0035 ILE CD1 3.743 H A 0072 PHE CB
C A 0036 LEU CA 3.771 C A 0037 THR CA
C A 0036 LEU C 2.428 C A 0037 THR CA
C A 0036 LEU C 3.708 C A 0037 THR C
C A 0036 LEU C 2.902 C A 0037 THR CB
C A 0036 LEU C 2.773 C A 0037 THR CG2
C A 0036 LEU CA 3.447 H A 0040 HIS CG
C A 0036 LEU CA 3.772 H A 0040 HIS CD2
C A 0036 LEU CA 3.208 H A 0040 HIS CE1
C A 0036 LEU CB 3.517 H A 0040 HIS CB
C A 0036 LEU CB 3.290 H A 0040 HIS CG
C A 0036 LEU CB 3.629 H A 0040 HIS CE1
C A 0036 LEU CD2 3.289 H A 0040 HIS CE1
C A 0036 LEU CD2 3.140 H A 0057 LEU CD2
C A 0037 THR C 2.431 H A 0038 GLU CA
C A 0037 THR C 2.835 H A 0038 GLU C
C A 0037 THR C 3.694 H A 0038 GLU CB
C A 0037 THR CG2 3.316 H A 0040 HIS CD2
H A 0038 GLU CA 3.795 H A 0039 ASN CA
H A 0038 GLU C 2.428 H A 0039 ASN CA
H A 0038 GLU C 2.899 H A 0039 ASN C
H A 0038 GLU C 3.708 H A 0039 ASN CB
H A 0039 ASN CA 3.789 H A 0040 HIS CA
H A 0039 ASN C 2.417 H A 0040 HIS CA
H A 0039 ASN C 2.937 H A 0040 HIS C
H A 0039 ASN C 3.719 H A 0040 HIS CB
H A 0040 HIS CA 3.794 H A 0041 ILE CA
H A 0040 HIS C 2.437 H A 0041 ILE CA
H A 0040 HIS C 2.804 H A 0041 ILE C
H A 0040 HIS C 3.671 H A 0041 ILE CB
H A 0040 HIS CG 3.342 H A 0060 ILE CG2
H A 0040 HIS CG 3.413 H A 0060 ILE CD1
H A 0040 HIS CD2 2.938 H A 0060 ILE CG2
H A 0040 HIS CE1 3.159 H A 0060 ILE CB
H A 0040 HIS CE1 3.673 H A 0060 ILE CG1
H A 0040 HIS CE1 2.908 H A 0060 ILE CG2
H A 0040 HIS CE1 3.079 H A 0060 ILE CD1
H A 0041 ILE CA 3.777 H A 0042 GLN CA
H A 0041 ILE C 2.419 H A 0042 GLN CA
H A 0041 ILE C 3.005 H A 0042 GLN C
H A 0041 ILE C 3.695 H A 0042 GLN CB
H A 0041 ILE C 3.573 C A 0045 ASN CG
H A 0042 GLN CA 3.792 H A 0043 GLU CA
H A 0042 GLN C 2.427 H A 0043 GLU CA
H A 0042 GLN C 3.075 H A 0043 GLU C
H A 0042 GLN C 3.693 H A 0043 GLU CB
H A 0043 GLU C 2.427 H A 0044 ILE CA
H A 0043 GLU C 3.032 H A 0044 ILE C
H A 0043 GLU C 3.705 H A 0044 ILE CB
H A 0043 GLU C 3.724 C A 0046 ALA CB
H A 0043 GLU CA 3.736 H A 0056 LEU CD1
H A 0043 GLU C 3.401 H A 0056 LEU CG
H A 0043 GLU C 3.377 H A 0056 LEU CD1
H A 0043 GLU C 3.442 H A 0056 LEU CD2
H A 0043 GLU CB 3.598 H A 0056 LEU CG
H A 0043 GLU CB 2.908 H A 0056 LEU CD1
H A 0043 GLU CB 3.350 H A 0056 LEU CD2
H A 0044 ILE CA 3.786 C A 0045 ASN CA
H A 0044 ILE C 2.415 C A 0045 ASN CA
H A 0044 ILE C 3.043 C A 0045 ASN C
H A 0044 ILE C 3.694 C A 0045 ASN CB
H A 0044 ILE C 3.678 C A 0047 GLN CG
H A 0044 ILE CA 3.532 H A 0056 LEU CG
H A 0044 ILE CA 3.623 H A 0056 LEU CD1
H A 0044 ILE CG1 3.584 H A 0056 LEU CG
H A 0044 ILE CG1 3.052 H A 0056 LEU CD1
H A 0044 ILE CD1 3.056 H A 0056 LEU CB
H A 0044 ILE CD1 3.046 H A 0056 LEU CG
H A 0044 ILE CD1 2.995 H A 0056 LEU CD1
C A 0045 ASN C 2.444 C A 0046 ALA CA
C A 0045 ASN C 3.251 C A 0046 ALA C
C A 0045 ASN C 3.665 C A 0046 ALA CB
C A 0046 ALA C 2.468 C A 0047 GLN CA
C A 0046 ALA C 2.801 C A 0047 GLN C
C A 0046 ALA C 3.669 C A 0047 GLN CB
C A 0047 GLN C 2.437 C A 0048 THR CA
C A 0047 GLN C 3.187 C A 0048 THR C
C A 0047 GLN C 2.855 C A 0048 THR CB
C A 0047 GLN C 3.451 C A 0048 THR CG2
C A 0047 GLN CA 3.205 H A 0052 ARG CB
C A 0047 GLN CA 3.658 H A 0052 ARG CG
C A 0047 GLN CB 3.310 H A 0052 ARG CB
C A 0047 GLN CG 3.646 H A 0053 LYS CG
C A 0047 GLN CD 3.201 H A 0053 LYS CG
C A 0047 GLN CD 3.275 H A 0053 LYS CD
C A 0048 THR C 2.435 C A 0049 THR CA
C A 0048 THR C 3.630 C A 0049 THR C
C A 0048 THR C 3.295 C A 0049 THR CB
C A 0048 THR C 3.193 C A 0049 THR CG2
C A 0048 THR CG2 3.585 C A 0049 THR CG2
C A 0049 THR CA 3.790 C A 0050 GLY CA
C A 0049 THR C 2.419 C A 0050 GLY CA
C A 0049 THR C 3.697 C A 0050 GLY C
C A 0050 GLY CA 3.792 H A 0051 LEU CA
C A 0050 GLY C 2.434 H A 0051 LEU CA
C A 0050 GLY C 3.118 H A 0051 LEU C
C A 0050 GLY C 3.696 H A 0051 LEU CB
H A 0051 LEU CA 3.799 H A 0052 ARG CA
H A 0051 LEU C 2.430 H A 0052 ARG CA
H A 0051 LEU C 2.983 H A 0052 ARG C
H A 0051 LEU C 3.712 H A 0052 ARG CB
H A 0052 ARG C 2.432 H A 0053 LYS CA
H A 0052 ARG C 2.812 H A 0053 LYS C
H A 0052 ARG C 3.691 H A 0053 LYS CB
H A 0053 LYS CA 3.793 H A 0054 THR CA
H A 0053 LYS C 2.423 H A 0054 THR CA
H A 0053 LYS C 2.957 H A 0054 THR C
H A 0053 LYS C 3.697 H A 0054 THR CB
H A 0053 LYS C 3.606 H A 0056 LEU CB
H A 0054 THR CA 3.785 H A 0055 MET CA
H A 0054 THR C 2.423 H A 0055 MET CA
H A 0054 THR C 2.832 H A 0055 MET C
H A 0054 THR C 3.696 H A 0055 MET CB
H A 0055 MET CA 3.760 H A 0056 LEU CA
H A 0055 MET C 2.413 H A 0056 LEU CA
H A 0055 MET C 2.874 H A 0056 LEU C
H A 0055 MET C 3.663 H A 0056 LEU CB
H A 0056 LEU CA 3.787 H A 0057 LEU CA
H A 0056 LEU C 2.408 H A 0057 LEU CA
H A 0056 LEU C 2.799 H A 0057 LEU C
H A 0056 LEU C 3.664 H A 0057 LEU CB
H A 0056 LEU C 2.999 H A 0060 ILE CG1
H A 0056 LEU C 3.531 H A 0060 ILE CD1
H A 0056 LEU CD1 3.746 H A 0060 ILE CG1
H A 0056 LEU CD1 3.221 H A 0060 ILE CD1
H A 0057 LEU CA 3.768 H A 0058 LEU CA
H A 0057 LEU C 2.419 H A 0058 LEU CA
H A 0057 LEU C 2.942 H A 0058 LEU C
H A 0057 LEU C 3.689 H A 0058 LEU CB
H A 0057 LEU CA 3.245 H A 0060 ILE CG1
H A 0057 LEU CA 3.535 H A 0060 ILE CD1
H A 0057 LEU C 3.631 H A 0060 ILE CG1
H A 0057 LEU CD2 3.521 H A 0060 ILE CD1
H A 0057 LEU CD1 2.892 C A 0061 LEU CG
H A 0057 LEU CD1 3.138 C A 0061 LEU CD1
H A 0057 LEU CD1 2.923 C A 0061 LEU CD2
H A 0057 LEU CG 3.570 H A 0072 PHE CD1
H A 0057 LEU CD1 3.554 H A 0072 PHE CB
H A 0057 LEU CD1 3.620 H A 0072 PHE CG
H A 0057 LEU CD1 3.413 H A 0072 PHE CD1
H A 0058 LEU C 2.443 H A 0059 ASP CA
H A 0058 LEU C 3.285 H A 0059 ASP C
H A 0058 LEU C 3.650 H A 0059 ASP CB
H A 0058 LEU C 3.609 C A 0062 PRO CG
H A 0058 LEU C 3.526 C A 0062 PRO CD
H A 0059 ASP C 2.435 H A 0060 ILE CA
H A 0059 ASP C 3.252 H A 0060 ILE C
H A 0059 ASP C 3.682 H A 0060 ILE CB
H A 0059 ASP C 3.328 C A 0062 PRO CD
H A 0060 ILE C 2.436 C A 0061 LEU CA
H A 0060 ILE C 2.875 C A 0061 LEU C
H A 0060 ILE C 3.692 C A 0061 LEU CB
H A 0060 ILE CA 3.699 C A 0062 PRO CD
H A 0060 ILE C 2.893 C A 0062 PRO CD
C A 0061 LEU CA 2.916 C A 0062 PRO CD
C A 0061 LEU C 2.466 C A 0062 PRO CA
C A 0061 LEU C 3.125 C A 0062 PRO C
C A 0061 LEU C 3.663 C A 0062 PRO CB
C A 0061 LEU C 3.596 C A 0062 PRO CG
C A 0061 LEU C 2.501 C A 0062 PRO CD
C A 0061 LEU CB 3.331 C A 0062 PRO CD
C A 0061 LEU CD2 3.028 C A 0068 ALA CB
C A 0061 LEU CD1 3.644 H A 0069 PHE CD1
C A 0061 LEU CD1 3.561 H A 0072 PHE CB
C A 0061 LEU CD1 3.407 H A 0072 PHE CG
C A 0061 LEU CD1 3.378 H A 0072 PHE CD2
C A 0062 PRO C 2.429 C A 0063 SER CA
C A 0062 PRO C 3.547 C A 0063 SER C
C A 0062 PRO C 3.406 C A 0063 SER CB
C A 0063 SER C 2.433 C A 0064 ARG CA
C A 0063 SER C 3.433 C A 0064 ARG C
C A 0063 SER C 3.531 C A 0064 ARG CB
C A 0063 SER C 3.576 C A 0064 ARG CG
C A 0064 ARG CA 3.794 C A 0065 GLY CA
C A 0064 ARG C 2.421 C A 0065 GLY CA
C A 0064 ARG C 3.668 C A 0065 GLY C
C A 0065 GLY CA 2.897 C A 0066 PRO CD
C A 0065 GLY C 2.465 C A 0066 PRO CA
C A 0065 GLY C 3.183 C A 0066 PRO C
C A 0065 GLY C 3.633 C A 0066 PRO CB
C A 0065 GLY C 3.649 C A 0066 PRO CG
C A 0065 GLY C 2.499 C A 0066 PRO CD
C A 0066 PRO C 2.436 C A 0067 LYS CA
C A 0066 PRO C 3.498 C A 0067 LYS C
C A 0066 PRO C 3.470 C A 0067 LYS CB
C A 0066 PRO C 3.530 C A 0067 LYS CG
C A 0067 LYS C 2.435 C A 0068 ALA CA
C A 0067 LYS C 3.220 C A 0068 ALA C
C A 0067 LYS C 3.653 C A 0068 ALA CB
C A 0068 ALA CA 3.791 H A 0069 PHE CA
C A 0068 ALA C 2.423 H A 0069 PHE CA
C A 0068 ALA C 3.008 H A 0069 PHE C
C A 0068 ALA C 3.707 H A 0069 PHE CB
H A 0069 PHE C 2.440 H A 0070 ASP CA
H A 0069 PHE C 2.822 H A 0070 ASP C
H A 0069 PHE C 3.677 H A 0070 ASP CB
H A 0069 PHE CD1 3.150 H A 0072 PHE CD2
H A 0069 PHE CD1 3.514 H A 0072 PHE CE2
H A 0069 PHE CE1 3.264 H A 0072 PHE CD2
H A 0069 PHE CE1 3.048 H A 0072 PHE CE2
H A 0069 PHE C 3.272 H A 0073 LEU CD1
H A 0069 PHE CD2 3.736 H A 0073 LEU CD1
H A 0069 PHE CZ 3.234 H A 0086 LEU CD2
H A 0070 ASP C 2.434 H A 0071 THR CA
H A 0070 ASP C 3.199 H A 0071 THR C
H A 0070 ASP C 3.666 H A 0071 THR CB
H A 0070 ASP CA 3.447 H A 0073 LEU CD1
H A 0071 THR C 2.426 H A 0072 PHE CA
H A 0071 THR C 2.962 H A 0072 PHE C
H A 0071 THR C 3.731 H A 0072 PHE CB
H A 0072 PHE C 2.432 H A 0073 LEU CA
H A 0072 PHE C 3.178 H A 0073 LEU C
H A 0072 PHE C 3.688 H A 0073 LEU CB
H A 0072 PHE CE2 2.933 H A 0086 LEU CD1
H A 0072 PHE CZ 3.269 H A 0086 LEU CD1
H A 0073 LEU CA 3.776 H A 0074 ASP CA
H A 0073 LEU C 2.413 H A 0074 ASP CA
H A 0073 LEU C 2.924 H A 0074 ASP C
H A 0073 LEU C 3.703 H A 0074 ASP CB
H A 0073 LEU CA 3.638 C A 0076 LEU CG
H A 0073 LEU CA 3.600 C A 0076 LEU CD1
H A 0073 LEU CB 3.697 C A 0076 LEU CD1
H A 0073 LEU CD2 3.606 C A 0076 LEU CD1
H A 0073 LEU CD2 3.345 H A 0086 LEU CB
H A 0073 LEU CD2 3.706 H A 0086 LEU CG
H A 0073 LEU CD2 2.969 H A 0086 LEU CD1
H A 0074 ASP C 2.445 H A 0075 SER CA
H A 0074 ASP C 3.253 H A 0075 SER C
H A 0074 ASP C 3.668 H A 0075 SER CB
H A 0074 ASP C 3.390 H A 0079 PHE CE2
H A 0075 SER CA 3.799 C A 0076 LEU CA
H A 0075 SER C 2.454 C A 0076 LEU CA
H A 0075 SER C 2.853 C A 0076 LEU C
H A 0075 SER C 3.613 C A 0076 LEU CB
H A 0075 SER CA 3.714 H A 0079 PHE CE2
H A 0075 SER C 3.797 H A 0079 PHE CD2
H A 0075 SER C 2.951 H A 0079 PHE CE2
H A 0075 SER C 3.522 H A 0079 PHE CZ
C A 0076 LEU C 2.432 C A 0077 GLN CA
C A 0076 LEU C 2.866 C A 0077 GLN C
C A 0076 LEU C 3.672 C A 0077 GLN CB
C A 0076 LEU CA 3.355 H A 0079 PHE CD2
C A 0076 LEU CA 3.366 H A 0079 PHE CE2
C A 0076 LEU C 3.492 H A 0079 PHE CG
C A 0076 LEU C 3.607 H A 0079 PHE CD1
C A 0076 LEU C 3.195 H A 0079 PHE CD2
C A 0076 LEU C 3.462 H A 0079 PHE CE1
C A 0076 LEU C 3.026 H A 0079 PHE CE2
C A 0076 LEU C 3.170 H A 0079 PHE CZ
C A 0076 LEU CB 3.600 H A 0079 PHE CA
C A 0076 LEU CB 3.768 H A 0079 PHE CB
C A 0076 LEU CB 3.536 H A 0079 PHE CG
C A 0076 LEU CB 3.027 H A 0079 PHE CD2
C A 0076 LEU CB 3.631 H A 0079 PHE CE2
C A 0076 LEU CB 3.185 H A 0082 VAL CG2
C A 0076 LEU CG 3.280 H A 0082 VAL CG2
C A 0076 LEU CD1 3.581 H A 0082 VAL C
C A 0076 LEU CD1 3.452 H A 0082 VAL CG2
C A 0076 LEU CD2 3.287 H A 0082 VAL CB
C A 0076 LEU CD2 2.806 H A 0082 VAL CG2
C A 0076 LEU CD1 2.994 H A 0083 ARG CA
C A 0076 LEU CD1 3.272 H A 0083 ARG CB
C A 0076 LEU CD1 3.648 H A 0086 LEU CD1
C A 0077 GLN C 2.444 C A 0078 GLU CA
C A 0077 GLN C 3.519 C A 0078 GLU C
C A 0077 GLN C 3.479 C A 0078 GLU CB
C A 0077 GLN C 3.717 C A 0078 GLU CG
C A 0077 GLN CA 3.710 H A 0079 PHE CE1
C A 0077 GLN CA 3.745 H A 0079 PHE CZ
C A 0077 GLN C 3.753 H A 0079 PHE CD1
C A 0077 GLN C 3.458 H A 0079 PHE CE1
C A 0078 GLU C 2.461 H A 0079 PHE CA
C A 0078 GLU C 2.848 H A 0079 PHE C
C A 0078 GLU C 3.629 H A 0079 PHE CB
C A 0078 GLU C 3.680 H A 0079 PHE CD1
C A 0078 GLU C 3.077 H A 0080 PRO CD
C A 0078 GLU C 3.111 H A 0082 VAL CG2
C A 0078 GLU CB 3.532 H A 0082 VAL CG1
C A 0078 GLU CG 2.969 H A 0082 VAL CG1
C A 0078 GLU CG 3.786 H A 0082 VAL CG2
C A 0078 GLU CD 2.918 H A 0082 VAL CG1
H A 0079 PHE CA 2.945 H A 0080 PRO CD
H A 0079 PHE C 2.469 H A 0080 PRO CA
H A 0079 PHE C 2.897 H A 0080 PRO C
H A 0079 PHE C 3.570 H A 0080 PRO CB
H A 0079 PHE C 3.661 H A 0080 PRO CG
H A 0079 PHE C 2.515 H A 0080 PRO CD
H A 0079 PHE CB 3.076 H A 0080 PRO CD
H A 0079 PHE CG 3.614 H A 0080 PRO CD
H A 0079 PHE CD1 3.247 H A 0080 PRO CD
H A 0079 PHE CA 3.023 H A 0082 VAL CG2
H A 0079 PHE C 3.753 H A 0082 VAL CG2
H A 0079 PHE CA 3.337 H A 0083 ARG CB
H A 0079 PHE C 3.539 H A 0083 ARG CB
H A 0079 PHE CB 3.327 H A 0083 ARG CB
H A 0080 PRO C 2.427 H A 0081 TRP CA
H A 0080 PRO C 3.543 H A 0081 TRP C
H A 0080 PRO C 3.413 H A 0081 TRP CB
H A 0080 PRO C 3.696 H A 0084 GLU CG
H A 0081 TRP C 2.425 H A 0082 VAL CA
H A 0081 TRP C 3.201 H A 0082 VAL C
H A 0081 TRP C 3.683 H A 0082 VAL CB
H A 0082 VAL C 2.437 H A 0083 ARG CA
H A 0082 VAL C 3.074 H A 0083 ARG C
H A 0082 VAL C 3.714 H A 0083 ARG CB
H A 0083 ARG CA 3.787 H A 0084 GLU CA
H A 0083 ARG C 2.416 H A 0084 GLU CA
H A 0083 ARG C 2.945 H A 0084 GLU C
H A 0083 ARG C 3.693 H A 0084 GLU CB
H A 0084 GLU CA 3.781 H A 0085 LYS CA
H A 0084 GLU C 2.423 H A 0085 LYS CA
H A 0084 GLU C 2.977 H A 0085 LYS C
H A 0084 GLU C 3.703 H A 0085 LYS CB
H A 0085 LYS CA 3.800 H A 0086 LEU CA
H A 0085 LYS C 2.425 H A 0086 LEU CA
H A 0085 LYS C 3.156 H A 0086 LEU C
H A 0085 LYS C 3.679 H A 0086 LEU CB
H A 0085 LYS CA 3.217 H A 0088 LYS CD
H A 0085 LYS C 3.772 H A 0088 LYS CB
H A 0085 LYS C 3.479 H A 0088 LYS CD
H A 0086 LEU CA 3.766 H A 0087 LYS CA
H A 0086 LEU C 2.407 H A 0087 LYS CA
H A 0086 LEU C 2.883 H A 0087 LYS C
H A 0086 LEU C 3.699 H A 0087 LYS CB
H A 0087 LYS CA 3.759 H A 0088 LYS CA
H A 0087 LYS C 2.401 H A 0088 LYS CA
H A 0087 LYS C 2.962 H A 0088 LYS C
H A 0087 LYS C 3.700 H A 0088 LYS CB
H A 0087 LYS CA 3.735 H A 0090 ARG CB
H A 0087 LYS C 3.752 H A 0090 ARG CB
H A 0088 LYS CA 3.779 H A 0089 ALA CA
H A 0088 LYS C 2.435 H A 0089 ALA CA
H A 0088 LYS C 3.111 H A 0089 ALA C
H A 0088 LYS C 3.689 H A 0089 ALA CB
H A 0089 ALA CA 3.793 H A 0090 ARG CA
H A 0089 ALA C 2.416 H A 0090 ARG CA
H A 0089 ALA C 3.069 H A 0090 ARG C
H A 0089 ALA C 3.679 H A 0090 ARG CB
H A 0089 ALA C 3.634 C A 0093 ALA CB
H A 0090 ARG CA 3.738 H A 0091 GLU CA
H A 0090 ARG C 2.418 H A 0091 GLU CA
H A 0090 ARG C 3.147 H A 0091 GLU C
H A 0090 ARG C 3.635 H A 0091 GLU CB
H A 0091 GLU C 2.446 H A 0092 GLU CA
H A 0091 GLU C 3.310 H A 0092 GLU C
H A 0091 GLU C 3.645 H A 0092 GLU CB
H A 0092 GLU C 2.441 C A 0093 ALA CA
H A 0092 GLU C 3.015 C A 0093 ALA C
H A 0092 GLU C 3.724 C A 0093 ALA CB
C A 0093 ALA C 2.431 C A 0094 MET CA
C A 0093 ALA C 3.008 C A 0094 MET C
C A 0093 ALA C 3.712 C A 0094 MET CB
C A 0094 MET C 2.437 C A 0095 THR CA
C A 0094 MET C 2.925 C A 0095 THR C
C A 0094 MET C 3.714 C A 0095 THR CB
C A 0095 THR C 2.433 C A 0096 ASP CA
C A 0095 THR C 3.345 C A 0096 ASP C
C A 0095 THR C 3.595 C A 0096 ASP CB
C A 0095 THR C 3.720 C A 0096 ASP CG
C A 0096 ASP C 2.435 C A 0097 LEU CA
C A 0096 ASP C 3.200 C A 0097 LEU C
C A 0096 ASP C 3.670 C A 0097 LEU CB
C A 0096 ASP C 3.654 C A 0098 PRO CD
C A 0097 LEU CA 2.878 C A 0098 PRO CD
C A 0097 LEU C 2.468 C A 0098 PRO CA
C A 0097 LEU C 3.021 C A 0098 PRO C
C A 0097 LEU C 3.654 C A 0098 PRO CB
C A 0097 LEU C 3.628 C A 0098 PRO CG
C A 0097 LEU C 2.497 C A 0098 PRO CD
C A 0097 LEU CB 3.189 C A 0098 PRO CD
C A 0098 PRO C 2.432 C A 0099 ALA CA
C A 0098 PRO C 3.716 C A 0099 ALA C
C A 0098 PRO C 2.972 C A 0099 ALA CB
C A 0099 ALA CA 3.790 C A 0100 GLY CA
C A 0099 ALA C 2.417 C A 0100 GLY CA
C A 0099 ALA C 3.437 C A 0100 GLY C
CHARGE_ATTR 2.00 12.00 122
C A 0002 GLU OE1 9.278 C A 0004 ARG NH1
C A 0002 GLU OE1 9.140 C A 0004 ARG NH2
C A 0002 GLU OE2 11.06 C A 0004 ARG NH1
C A 0002 GLU OE2 10.64 C A 0004 ARG NH2
C A 0002 GLU OE1 8.126 H A 0006 LYS NZ
C A 0002 GLU OE2 7.785 H A 0006 LYS NZ
C A 0002 GLU OE1 11.47 C A 0064 ARG NH2
C A 0002 GLU OE2 11.18 C A 0064 ARG NH2
C A 0002 GLU OE1 8.667 C A 0067 LYS NZ
C A 0002 GLU OE2 10.80 C A 0067 LYS NZ
C A 0002 GLU OE1 11.97 H A 0090 ARG NH2
H A 0005 ASP OD1 5.783 C A 0004 ARG NH1
H A 0005 ASP OD1 7.915 C A 0004 ARG NH2
H A 0005 ASP OD2 6.490 C A 0004 ARG NH1
H A 0005 ASP OD2 8.556 C A 0004 ARG NH2
H A 0005 ASP OD1 11.14 H A 0006 LYS NZ
H A 0005 ASP OD2 11.27 H A 0006 LYS NZ
H A 0005 ASP OD1 7.204 C A 0067 LYS NZ
H A 0005 ASP OD2 6.265 C A 0067 LYS NZ
H A 0005 ASP OD1 8.861 H A 0087 LYS NZ
H A 0005 ASP OD2 9.821 H A 0087 LYS NZ
H A 0005 ASP OD1 4.636 H A 0090 ARG NH1
H A 0005 ASP OD1 2.577 H A 0090 ARG NH2
H A 0005 ASP OD2 6.007 H A 0090 ARG NH1
H A 0005 ASP OD2 3.942 H A 0090 ARG NH2
H A 0015 GLU OE2 11.91 H A 0013 ARG NH2
H A 0015 GLU OE1 9.383 H A 0085 LYS NZ
H A 0015 GLU OE2 11.43 H A 0085 LYS NZ
H A 0015 GLU OE1 7.401 H A 0088 LYS NZ
H A 0015 GLU OE2 9.019 H A 0088 LYS NZ
C A 0023 GLU OE1 4.747 H A 0053 LYS NZ
C A 0023 GLU OE2 2.618 H A 0053 LYS NZ
H A 0038 GLU OE1 11.06 H A 0040 HIS ND1
H A 0038 GLU OE1 10.47 H A 0040 HIS NE2
H A 0038 GLU OE2 11.85 H A 0040 HIS ND1
H A 0038 GLU OE2 11.52 H A 0040 HIS NE2
H A 0038 GLU OE1 10.18 C A 0064 ARG NH1
H A 0043 GLU OE1 7.692 H A 0013 ARG NH1
H A 0043 GLU OE1 8.245 H A 0013 ARG NH2
H A 0043 GLU OE2 8.172 H A 0013 ARG NH1
H A 0043 GLU OE2 8.131 H A 0013 ARG NH2
H A 0043 GLU OE1 6.725 H A 0040 HIS ND1
H A 0043 GLU OE1 6.705 H A 0040 HIS NE2
H A 0043 GLU OE2 8.691 H A 0040 HIS ND1
H A 0043 GLU OE2 8.790 H A 0040 HIS NE2
H A 0043 GLU OE1 8.265 H A 0052 ARG NH1
H A 0043 GLU OE1 7.426 H A 0052 ARG NH2
H A 0043 GLU OE2 6.602 H A 0052 ARG NH1
H A 0043 GLU OE2 5.749 H A 0052 ARG NH2
H A 0043 GLU OE1 9.672 C A 0064 ARG NH1
H A 0043 GLU OE1 10.15 C A 0064 ARG NH2
H A 0043 GLU OE2 10.90 C A 0064 ARG NH1
H A 0043 GLU OE2 11.43 C A 0064 ARG NH2
H A 0059 ASP OD1 8.681 H A 0010 ARG NH1
H A 0059 ASP OD1 10.82 H A 0010 ARG NH2
H A 0059 ASP OD2 9.040 H A 0010 ARG NH1
H A 0059 ASP OD2 11.29 H A 0010 ARG NH2
H A 0059 ASP OD1 3.628 H A 0013 ARG NH1
H A 0059 ASP OD1 3.849 H A 0013 ARG NH2
H A 0059 ASP OD2 3.019 H A 0013 ARG NH1
H A 0059 ASP OD2 2.586 H A 0013 ARG NH2
H A 0059 ASP OD1 10.27 H A 0040 HIS ND1
H A 0059 ASP OD1 10.12 H A 0040 HIS NE2
H A 0059 ASP OD2 10.72 H A 0040 HIS ND1
H A 0059 ASP OD2 10.95 H A 0040 HIS NE2
H A 0059 ASP OD1 8.201 H A 0052 ARG NH1
H A 0059 ASP OD1 6.328 H A 0052 ARG NH2
H A 0059 ASP OD2 7.482 H A 0052 ARG NH1
H A 0059 ASP OD2 5.716 H A 0052 ARG NH2
H A 0059 ASP OD1 11.82 C A 0064 ARG NH2
H A 0070 ASP OD1 7.766 C A 0004 ARG NH1
H A 0070 ASP OD1 10.03 C A 0004 ARG NH2
H A 0070 ASP OD2 7.744 C A 0004 ARG NH1
H A 0070 ASP OD2 9.885 C A 0004 ARG NH2
H A 0070 ASP OD1 7.497 C A 0067 LYS NZ
H A 0070 ASP OD2 6.152 C A 0067 LYS NZ
H A 0070 ASP OD1 11.54 H A 0083 ARG NH1
H A 0070 ASP OD1 5.420 H A 0087 LYS NZ
H A 0070 ASP OD2 6.839 H A 0087 LYS NZ
H A 0070 ASP OD1 2.982 H A 0090 ARG NH1
H A 0070 ASP OD1 3.123 H A 0090 ARG NH2
H A 0070 ASP OD2 4.497 H A 0090 ARG NH1
H A 0070 ASP OD2 4.337 H A 0090 ARG NH2
H A 0074 ASP OD1 8.789 H A 0083 ARG NH1
H A 0074 ASP OD1 9.502 H A 0083 ARG NH2
H A 0074 ASP OD2 10.02 H A 0083 ARG NH1
H A 0074 ASP OD2 10.32 H A 0083 ARG NH2
H A 0074 ASP OD1 5.755 H A 0087 LYS NZ
H A 0074 ASP OD2 7.834 H A 0087 LYS NZ
H A 0074 ASP OD1 9.317 H A 0090 ARG NH1
H A 0074 ASP OD1 10.40 H A 0090 ARG NH2
H A 0074 ASP OD2 11.44 H A 0090 ARG NH1
C A 0078 GLU OE2 11.76 H A 0053 LYS NZ
C A 0078 GLU OE1 11.37 H A 0085 LYS NZ
H A 0084 GLU OE1 5.758 H A 0083 ARG NH1
H A 0084 GLU OE1 6.091 H A 0083 ARG NH2
H A 0084 GLU OE2 4.615 H A 0083 ARG NH1
H A 0084 GLU OE2 4.245 H A 0083 ARG NH2
H A 0084 GLU OE1 6.987 H A 0085 LYS NZ
H A 0084 GLU OE2 8.510 H A 0085 LYS NZ
H A 0084 GLU OE1 10.51 H A 0087 LYS NZ
H A 0084 GLU OE2 10.24 H A 0087 LYS NZ
H A 0084 GLU OE1 8.925 H A 0088 LYS NZ
H A 0084 GLU OE2 10.75 H A 0088 LYS NZ
H A 0091 GLU OE1 11.91 C A 0004 ARG NH1
H A 0091 GLU OE2 9.891 C A 0004 ARG NH1
H A 0091 GLU OE2 10.49 C A 0004 ARG NH2
H A 0091 GLU OE1 11.55 H A 0087 LYS NZ
H A 0091 GLU OE2 10.71 H A 0087 LYS NZ
H A 0091 GLU OE1 11.74 H A 0088 LYS NZ
H A 0091 GLU OE1 9.969 H A 0090 ARG NH1
H A 0091 GLU OE1 11.15 H A 0090 ARG NH2
H A 0091 GLU OE2 8.410 H A 0090 ARG NH1
H A 0091 GLU OE2 9.491 H A 0090 ARG NH2
H A 0092 GLU OE1 9.551 H A 0085 LYS NZ
H A 0092 GLU OE2 9.235 H A 0085 LYS NZ
H A 0092 GLU OE1 5.576 H A 0088 LYS NZ
H A 0092 GLU OE2 5.725 H A 0088 LYS NZ
C A 0096 ASP OD1 11.32 C A 0004 ARG NH1
C A 0096 ASP OD1 10.97 C A 0004 ARG NH2
C A 0096 ASP OD2 10.33 C A 0004 ARG NH1
C A 0096 ASP OD2 9.908 C A 0004 ARG NH2
CHARGE_REPU 2.00 12.00 81
C A 0002 GLU OE1 10.46 H A 0005 ASP OD1
C A 0002 GLU OE1 9.454 H A 0005 ASP OD2
C A 0002 GLU OE2 11.44 H A 0005 ASP OD2
C A 0004 ARG NH1 11.87 H A 0006 LYS NZ
C A 0004 ARG NH2 11.94 H A 0006 LYS NZ
C A 0004 ARG NH1 5.221 C A 0067 LYS NZ
C A 0004 ARG NH2 6.370 C A 0067 LYS NZ
C A 0004 ARG NH1 11.85 H A 0087 LYS NZ
C A 0004 ARG NH1 6.638 H A 0090 ARG NH1
C A 0004 ARG NH1 5.172 H A 0090 ARG NH2
C A 0004 ARG NH2 8.764 H A 0090 ARG NH1
C A 0004 ARG NH2 7.435 H A 0090 ARG NH2
H A 0005 ASP OD1 4.574 H A 0070 ASP OD1
H A 0005 ASP OD1 5.764 H A 0070 ASP OD2
H A 0005 ASP OD2 4.841 H A 0070 ASP OD1
H A 0005 ASP OD2 5.375 H A 0070 ASP OD2
H A 0005 ASP OD1 11.39 H A 0074 ASP OD1
H A 0005 ASP OD2 11.26 H A 0074 ASP OD1
H A 0005 ASP OD1 11.06 H A 0091 GLU OE2
H A 0006 LYS NZ 8.242 H A 0010 ARG NH1
H A 0006 LYS NZ 7.741 H A 0010 ARG NH2
H A 0006 LYS NZ 11.88 H A 0013 ARG NH1
H A 0010 ARG NH1 6.454 H A 0013 ARG NH1
H A 0010 ARG NH1 7.222 H A 0013 ARG NH2
H A 0010 ARG NH2 8.745 H A 0013 ARG NH1
H A 0010 ARG NH2 9.454 H A 0013 ARG NH2
H A 0013 ARG NH1 11.64 H A 0040 HIS ND1
H A 0013 ARG NH1 11.55 H A 0040 HIS NE2
H A 0013 ARG NH1 10.44 H A 0052 ARG NH1
H A 0013 ARG NH1 8.574 H A 0052 ARG NH2
H A 0013 ARG NH2 9.019 H A 0052 ARG NH1
H A 0013 ARG NH2 7.044 H A 0052 ARG NH2
H A 0015 GLU OE1 9.350 H A 0092 GLU OE1
H A 0015 GLU OE1 10.99 H A 0092 GLU OE2
H A 0015 GLU OE2 9.818 H A 0092 GLU OE1
H A 0015 GLU OE2 11.72 H A 0092 GLU OE2
C A 0019 GLU OE1 11.95 C A 0078 GLU OE1
C A 0019 GLU OE1 11.34 C A 0078 GLU OE2
C A 0019 GLU OE2 11.12 C A 0078 GLU OE1
C A 0019 GLU OE2 10.72 C A 0078 GLU OE2
C A 0023 GLU OE1 12.00 C A 0078 GLU OE2
H A 0033 GLU OE1 11.72 H A 0070 ASP OD2
H A 0033 GLU OE1 10.28 H A 0074 ASP OD1
H A 0033 GLU OE1 9.450 H A 0074 ASP OD2
H A 0033 GLU OE2 9.534 H A 0074 ASP OD1
H A 0033 GLU OE2 8.304 H A 0074 ASP OD2
H A 0040 HIS ND1 10.04 C A 0064 ARG NH1
H A 0040 HIS ND1 10.90 C A 0064 ARG NH2
H A 0040 HIS NE2 8.079 C A 0064 ARG NH1
H A 0040 HIS NE2 8.852 C A 0064 ARG NH2
H A 0043 GLU OE1 4.707 H A 0059 ASP OD1
H A 0043 GLU OE1 5.810 H A 0059 ASP OD2
H A 0043 GLU OE2 4.737 H A 0059 ASP OD1
H A 0043 GLU OE2 5.780 H A 0059 ASP OD2
C A 0067 LYS NZ 8.282 H A 0090 ARG NH1
C A 0067 LYS NZ 6.771 H A 0090 ARG NH2
H A 0070 ASP OD1 7.431 H A 0074 ASP OD1
H A 0070 ASP OD1 9.401 H A 0074 ASP OD2
H A 0070 ASP OD2 7.856 H A 0074 ASP OD1
H A 0070 ASP OD2 9.537 H A 0074 ASP OD2
H A 0070 ASP OD1 11.39 H A 0091 GLU OE2
C A 0078 GLU OE1 11.79 H A 0084 GLU OE2
H A 0083 ARG NH1 6.193 H A 0087 LYS NZ
H A 0083 ARG NH2 8.117 H A 0087 LYS NZ
H A 0083 ARG NH1 10.99 H A 0090 ARG NH1
H A 0084 GLU OE1 11.67 H A 0092 GLU OE2
H A 0085 LYS NZ 4.090 H A 0088 LYS NZ
H A 0087 LYS NZ 5.245 H A 0090 ARG NH1
H A 0087 LYS NZ 7.189 H A 0090 ARG NH2
H A 0091 GLU OE1 9.227 H A 0092 GLU OE1
H A 0091 GLU OE1 7.805 H A 0092 GLU OE2
H A 0091 GLU OE2 10.58 H A 0092 GLU OE1
H A 0091 GLU OE2 9.464 H A 0092 GLU OE2
H A 0091 GLU OE1 8.099 C A 0096 ASP OD1
H A 0091 GLU OE1 6.820 C A 0096 ASP OD2
H A 0091 GLU OE2 8.006 C A 0096 ASP OD1
H A 0091 GLU OE2 6.419 C A 0096 ASP OD2
H A 0092 GLU OE1 8.912 C A 0096 ASP OD1
H A 0092 GLU OE1 9.987 C A 0096 ASP OD2
H A 0092 GLU OE2 9.024 C A 0096 ASP OD1
H A 0092 GLU OE2 9.690 C A 0096 ASP OD2
HB_MM 2.00 3.20 187
C A 0002 GLU N 2.251 C A 0001 MET O
C A 0003 ALA N 2.686 C A 0001 MET O
C A 0003 ALA N 2.251 C A 0002 GLU O
C A 0004 ARG N 2.250 C A 0003 ALA O
H A 0005 ASP N 2.251 C A 0004 ARG O
H A 0006 LYS N 2.251 H A 0005 ASP O
H A 0007 GLN N 2.251 H A 0006 LYS O
H A 0008 VAL N 3.198 H A 0005 ASP O
H A 0008 VAL N 2.245 H A 0007 GLN O
H A 0009 LEU N 3.115 H A 0005 ASP O
H A 0009 LEU N 2.251 H A 0008 VAL O
H A 0010 ARG N 2.252 H A 0009 LEU O
H A 0011 SER N 3.176 H A 0007 GLN O
H A 0011 SER N 3.038 H A 0008 VAL O
H A 0011 SER N 3.040 H A 0009 LEU O
H A 0011 SER N 2.248 H A 0010 ARG O
H A 0012 LEU N 3.065 H A 0008 VAL O
H A 0012 LEU N 2.251 H A 0011 SER O
H A 0013 ARG N 2.433 H A 0009 LEU O
H A 0013 ARG N 3.169 H A 0010 ARG O
H A 0013 ARG N 2.877 H A 0011 SER O
H A 0013 ARG N 2.245 H A 0012 LEU O
H A 0014 LEU N 2.250 H A 0013 ARG O
H A 0015 GLU N 2.250 H A 0014 LEU O
H A 0016 LEU N 3.129 H A 0012 LEU O
H A 0016 LEU N 2.247 H A 0015 GLU O
H A 0017 GLY N 2.864 H A 0013 ARG O
H A 0017 GLY N 2.980 H A 0015 GLU O
H A 0017 GLY N 2.253 H A 0016 LEU O
H A 0018 ALA N 2.960 H A 0014 LEU O
H A 0018 ALA N 3.089 H A 0015 GLU O
H A 0018 ALA N 2.251 H A 0017 GLY O
C A 0019 GLU N 2.251 H A 0018 ALA O
C A 0020 VAL N 2.249 C A 0019 GLU O
C A 0021 LEU N 2.250 C A 0020 VAL O
C A 0022 VAL N 2.250 C A 0021 LEU O
C A 0023 GLU N 2.249 C A 0022 VAL O
C A 0024 GLY N 2.251 C A 0023 GLU O
C A 0025 LEU N 2.252 C A 0024 GLY O
C A 0026 VAL N 3.002 C A 0024 GLY O
C A 0026 VAL N 2.250 C A 0025 LEU O
H A 0027 LEU N 2.253 C A 0026 VAL O
H A 0028 GLN N 2.837 C A 0026 VAL O
H A 0028 GLN N 2.246 H A 0027 LEU O
H A 0029 TYR N 2.986 C A 0026 VAL O
H A 0029 TYR N 2.252 H A 0028 GLN O
H A 0030 LEU N 2.251 H A 0029 TYR O
H A 0031 TYR N 2.572 H A 0027 LEU O
H A 0031 TYR N 2.253 H A 0030 LEU O
H A 0032 GLN N 2.430 H A 0030 LEU O
H A 0032 GLN N 2.256 H A 0031 TYR O
H A 0033 GLU N 2.777 H A 0029 TYR O
H A 0033 GLU N 2.511 H A 0030 LEU O
H A 0033 GLU N 2.247 H A 0032 GLN O
C A 0034 GLY N 2.715 H A 0030 LEU O
C A 0034 GLY N 3.023 H A 0032 GLN O
C A 0034 GLY N 2.252 H A 0033 GLU O
C A 0035 ILE N 2.253 C A 0034 GLY O
C A 0036 LEU N 2.733 C A 0034 GLY O
C A 0036 LEU N 2.252 C A 0035 ILE O
C A 0037 THR N 2.253 C A 0036 LEU O
H A 0038 GLU N 2.251 C A 0037 THR O
H A 0039 ASN N 2.895 C A 0037 THR O
H A 0039 ASN N 2.251 H A 0038 GLU O
H A 0040 HIS N 2.528 C A 0037 THR O
H A 0040 HIS N 3.155 H A 0038 GLU O
H A 0040 HIS N 2.253 H A 0039 ASN O
H A 0041 ILE N 3.003 C A 0037 THR O
H A 0041 ILE N 2.961 H A 0038 GLU O
H A 0041 ILE N 2.255 H A 0040 HIS O
H A 0042 GLN N 3.193 H A 0039 ASN O
H A 0042 GLN N 2.612 H A 0040 HIS O
H A 0042 GLN N 2.247 H A 0041 ILE O
H A 0043 GLU N 2.428 H A 0040 HIS O
H A 0043 GLU N 2.248 H A 0042 GLN O
H A 0044 ILE N 2.672 H A 0040 HIS O
H A 0044 ILE N 2.253 H A 0043 GLU O
C A 0045 ASN N 2.713 H A 0041 ILE O
C A 0045 ASN N 2.231 H A 0044 ILE O
C A 0046 ALA N 3.050 H A 0042 GLN O
C A 0046 ALA N 2.993 H A 0043 GLU O
C A 0046 ALA N 3.064 H A 0044 ILE O
C A 0046 ALA N 2.256 C A 0045 ASN O
C A 0047 GLN N 2.264 C A 0046 ALA O
C A 0048 THR N 2.934 C A 0046 ALA O
C A 0048 THR N 2.252 C A 0047 GLN O
C A 0049 THR N 2.251 C A 0048 THR O
C A 0050 GLY N 2.250 C A 0049 THR O
H A 0051 LEU N 2.252 C A 0050 GLY O
H A 0052 ARG N 2.251 H A 0051 LEU O
H A 0053 LYS N 2.252 H A 0052 ARG O
H A 0054 THR N 2.786 H A 0052 ARG O
H A 0054 THR N 2.253 H A 0053 LYS O
H A 0055 MET N 2.615 H A 0052 ARG O
H A 0055 MET N 2.252 H A 0054 THR O
H A 0056 LEU N 2.656 H A 0052 ARG O
H A 0056 LEU N 3.129 H A 0053 LYS O
H A 0056 LEU N 2.867 H A 0054 THR O
H A 0056 LEU N 2.248 H A 0055 MET O
H A 0057 LEU N 3.155 H A 0054 THR O
H A 0057 LEU N 2.240 H A 0056 LEU O
H A 0058 LEU N 3.081 H A 0055 MET O
H A 0058 LEU N 2.969 H A 0056 LEU O
H A 0058 LEU N 2.246 H A 0057 LEU O
H A 0059 ASP N 2.453 H A 0055 MET O
H A 0059 ASP N 2.337 H A 0056 LEU O
H A 0059 ASP N 2.939 H A 0057 LEU O
H A 0059 ASP N 2.251 H A 0058 LEU O
H A 0060 ILE N 2.533 H A 0056 LEU O
H A 0060 ILE N 2.844 H A 0057 LEU O
H A 0060 ILE N 2.247 H A 0059 ASP O
C A 0061 LEU N 2.721 H A 0057 LEU O
C A 0061 LEU N 2.247 H A 0060 ILE O
C A 0062 PRO N 2.831 H A 0060 ILE O
C A 0062 PRO N 2.248 C A 0061 LEU O
C A 0063 SER N 2.478 H A 0060 ILE O
C A 0063 SER N 3.139 C A 0061 LEU O
C A 0063 SER N 2.248 C A 0062 PRO O
C A 0064 ARG N 2.422 H A 0060 ILE O
C A 0064 ARG N 2.249 C A 0063 SER O
C A 0065 GLY N 2.252 C A 0064 ARG O
C A 0066 PRO N 2.249 C A 0065 GLY O
C A 0067 LYS N 2.250 C A 0066 PRO O
C A 0068 ALA N 2.252 C A 0067 LYS O
H A 0069 PHE N 2.243 C A 0068 ALA O
H A 0070 ASP N 2.251 H A 0069 PHE O
H A 0071 THR N 2.557 H A 0069 PHE O
H A 0071 THR N 2.249 H A 0070 ASP O
H A 0072 PHE N 2.507 C A 0068 ALA O
H A 0072 PHE N 2.438 H A 0069 PHE O
H A 0072 PHE N 2.248 H A 0071 THR O
H A 0073 LEU N 2.773 H A 0069 PHE O
H A 0073 LEU N 3.021 H A 0071 THR O
H A 0073 LEU N 2.253 H A 0072 PHE O
H A 0074 ASP N 2.916 H A 0071 THR O
H A 0074 ASP N 2.239 H A 0073 LEU O
H A 0075 SER N 2.810 H A 0073 LEU O
H A 0075 SER N 2.259 H A 0074 ASP O
C A 0076 LEU N 2.849 H A 0073 LEU O
C A 0076 LEU N 2.259 H A 0075 SER O
C A 0077 GLN N 2.345 H A 0075 SER O
C A 0077 GLN N 2.223 C A 0076 LEU O
C A 0078 GLU N 2.415 C A 0076 LEU O
C A 0078 GLU N 2.248 C A 0077 GLN O
H A 0079 PHE N 2.426 C A 0076 LEU O
H A 0079 PHE N 2.251 C A 0078 GLU O
H A 0080 PRO N 2.595 C A 0078 GLU O
H A 0080 PRO N 2.252 H A 0079 PHE O
H A 0081 TRP N 2.751 C A 0078 GLU O
H A 0081 TRP N 2.405 H A 0079 PHE O
H A 0081 TRP N 2.245 H A 0080 PRO O
H A 0082 VAL N 2.830 H A 0079 PHE O
H A 0082 VAL N 2.245 H A 0081 TRP O
H A 0083 ARG N 2.580 H A 0079 PHE O
H A 0083 ARG N 2.251 H A 0082 VAL O
H A 0084 GLU N 2.246 H A 0083 ARG O
H A 0085 LYS N 2.248 H A 0084 GLU O
H A 0086 LEU N 2.932 H A 0082 VAL O
H A 0086 LEU N 3.008 H A 0083 ARG O
H A 0086 LEU N 2.967 H A 0084 GLU O
H A 0086 LEU N 2.249 H A 0085 LYS O
H A 0087 LYS N 2.760 H A 0083 ARG O
H A 0087 LYS N 2.245 H A 0086 LEU O
H A 0088 LYS N 2.825 H A 0084 GLU O
H A 0088 LYS N 2.780 H A 0086 LEU O
H A 0088 LYS N 2.252 H A 0087 LYS O
H A 0089 ALA N 2.500 H A 0086 LEU O
H A 0089 ALA N 2.262 H A 0088 LYS O
H A 0090 ARG N 2.906 H A 0086 LEU O
H A 0090 ARG N 3.080 H A 0087 LYS O
H A 0090 ARG N 2.241 H A 0089 ALA O
H A 0091 GLU N 3.125 H A 0087 LYS O
H A 0091 GLU N 3.176 H A 0088 LYS O
H A 0091 GLU N 2.251 H A 0090 ARG O
H A 0092 GLU N 2.801 H A 0088 LYS O
H A 0092 GLU N 2.257 H A 0091 GLU O
C A 0093 ALA N 2.492 H A 0089 ALA O
C A 0093 ALA N 2.252 H A 0092 GLU O
C A 0094 MET N 2.248 C A 0093 ALA O
C A 0095 THR N 2.982 C A 0093 ALA O
C A 0095 THR N 2.252 C A 0094 MET O
C A 0096 ASP N 2.979 C A 0094 MET O
C A 0096 ASP N 2.248 C A 0095 THR O
C A 0097 LEU N 2.252 C A 0096 ASP O
C A 0098 PRO N 2.252 C A 0097 LEU O
C A 0099 ALA N 2.249 C A 0098 PRO O
C A 0100 GLY N 2.251 C A 0099 ALA O
HB_MS 2.00 3.20 9
H A 0038 GLU N 2.573 C A 0037 THR OG1
H A 0040 HIS O 2.836 H A 0031 TYR OH
H A 0041 ILE N 2.406 H A 0031 TYR OH
H A 0041 ILE O 3.180 C A 0045 ASN ND2
C A 0050 GLY N 2.476 C A 0049 THR OG1
C A 0064 ARG O 3.114 H A 0040 HIS NE2
H A 0071 THR O 2.859 H A 0029 TYR OH
H A 0072 PHE O 2.333 H A 0075 SER OG
C A 0076 LEU N 2.884 H A 0075 SER OG
HB_SS 2.00 3.20 1
H A 0007 GLN NE2 2.775 C A 0095 THR OG1
AROMATIC 0.00 8.00 4
H A 0085 LYS 4.282 H A 0081 TRP
H A 0088 LYS 7.607 H A 0081 TRP
H A 0083 ARG 7.240 H A 0079 PHE
H A 0090 ARG 5.745 H A 0069 PHE