Complet list of 1jtb con file
Complete list of 1jtb.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 433
C A 0001 LEU C 2.432 C A 0002 ASN CA
C A 0001 LEU C 3.705 C A 0002 ASN C
C A 0001 LEU C 2.926 C A 0002 ASN CB
C A 0002 ASN C 2.436 H A 0003 CYS CA
C A 0002 ASN C 3.378 H A 0003 CYS C
C A 0002 ASN C 3.658 H A 0003 CYS CB
C A 0002 ASN CG 3.416 H A 0046 THR CG2
H A 0003 CYS C 2.484 H A 0004 GLY CA
H A 0003 CYS C 3.309 H A 0004 GLY C
H A 0003 CYS CA 3.792 H A 0006 VAL CB
H A 0003 CYS CA 3.208 H A 0006 VAL CG2
H A 0003 CYS C 3.477 H A 0006 VAL CB
H A 0003 CYS C 3.552 H A 0006 VAL CG2
H A 0003 CYS CB 3.544 H A 0006 VAL CG2
H A 0004 GLY C 2.459 H A 0005 GLN CA
H A 0004 GLY C 2.817 H A 0005 GLN C
H A 0004 GLY C 3.714 H A 0005 GLN CB
H A 0005 GLN C 2.505 H A 0006 VAL CA
H A 0005 GLN C 2.852 H A 0006 VAL C
H A 0005 GLN C 3.588 H A 0006 VAL CB
H A 0005 GLN CA 3.643 H A 0008 SER CB
H A 0005 GLN C 3.770 H A 0008 SER CB
H A 0006 VAL CA 3.706 H A 0007 ASP CA
H A 0006 VAL C 2.431 H A 0007 ASP CA
H A 0006 VAL C 3.267 H A 0007 ASP C
H A 0006 VAL C 3.496 H A 0007 ASP CB
H A 0006 VAL CG2 3.288 H A 0047 VAL CG2
H A 0007 ASP C 2.483 H A 0008 SER CA
H A 0007 ASP C 2.885 H A 0008 SER C
H A 0007 ASP C 3.670 H A 0008 SER CB
H A 0007 ASP CG 3.741 H A 0011 LYS CE
H A 0008 SER CA 3.789 H A 0009 LYS CA
H A 0008 SER C 2.463 H A 0009 LYS CA
H A 0008 SER C 3.552 H A 0009 LYS C
H A 0008 SER C 3.532 H A 0009 LYS CB
H A 0008 SER C 3.522 H A 0009 LYS CG
H A 0008 SER C 3.305 H A 0009 LYS CD
H A 0009 LYS C 2.448 H A 0010 MET CA
H A 0009 LYS C 3.577 H A 0010 MET C
H A 0009 LYS C 3.373 H A 0010 MET CB
H A 0009 LYS C 3.282 H A 0010 MET CG
H A 0009 LYS CB 3.520 H A 0034 LEU CG
H A 0009 LYS CB 3.040 H A 0034 LEU CD2
H A 0009 LYS CG 3.332 H A 0034 LEU CD2
H A 0010 MET C 2.444 H A 0011 LYS CA
H A 0010 MET C 2.857 H A 0011 LYS C
H A 0010 MET C 3.632 H A 0011 LYS CB
H A 0010 MET C 3.377 H A 0012 PRO CD
H A 0010 MET CE 3.425 H A 0013 CYS CB
H A 0010 MET CE 3.470 H A 0031 VAL CG2
H A 0010 MET CG 3.199 H A 0034 LEU CG
H A 0010 MET CG 3.255 H A 0034 LEU CD1
H A 0011 LYS CA 2.938 H A 0012 PRO CD
H A 0011 LYS C 2.490 H A 0012 PRO CA
H A 0011 LYS C 3.095 H A 0012 PRO C
H A 0011 LYS C 3.654 H A 0012 PRO CB
H A 0011 LYS C 3.586 H A 0012 PRO CG
H A 0011 LYS C 2.537 H A 0012 PRO CD
H A 0011 LYS CB 3.003 H A 0012 PRO CD
H A 0011 LYS CG 3.343 H A 0012 PRO CD
H A 0011 LYS CD 3.608 H A 0015 THR CG2
H A 0012 PRO CA 3.800 H A 0013 CYS CA
H A 0012 PRO C 2.384 H A 0013 CYS CA
H A 0012 PRO C 3.161 H A 0013 CYS C
H A 0012 PRO C 3.571 H A 0013 CYS CB
H A 0012 PRO CB 3.142 H A 0026 GLU CG
H A 0012 PRO CG 3.756 H A 0026 GLU C
H A 0012 PRO CG 3.400 H A 0026 GLU CG
H A 0012 PRO CG 3.635 H A 0027 CYS CA
H A 0013 CYS CA 3.778 H A 0014 LEU CA
H A 0013 CYS C 2.370 H A 0014 LEU CA
H A 0013 CYS C 2.805 H A 0014 LEU C
H A 0013 CYS C 3.752 H A 0014 LEU CB
H A 0014 LEU C 2.479 H A 0015 THR CA
H A 0014 LEU C 2.757 H A 0015 THR C
H A 0014 LEU C 3.770 H A 0015 THR CB
H A 0014 LEU CD1 3.515 H A 0017 VAL CG2
H A 0014 LEU C 3.723 H A 0018 GLN CG
H A 0014 LEU CD2 3.686 H A 0054 ILE CG2
H A 0014 LEU CD2 3.726 H A 0054 ILE CD1
H A 0015 THR C 2.425 H A 0016 TYR CA
H A 0015 THR C 2.907 H A 0016 TYR C
H A 0015 THR C 3.653 H A 0016 TYR CB
H A 0015 THR CA 3.674 H A 0018 GLN CG
H A 0015 THR C 3.797 H A 0018 GLN CG
H A 0015 THR CB 3.708 C A 0020 GLY C
H A 0016 TYR C 2.435 H A 0017 VAL CA
H A 0016 TYR C 3.051 H A 0017 VAL C
H A 0016 TYR C 3.779 H A 0017 VAL CB
H A 0016 TYR CG 3.666 C A 0023 PRO CB
H A 0016 TYR CD1 3.707 C A 0023 PRO CG
H A 0016 TYR CD1 3.382 C A 0023 PRO CD
H A 0016 TYR CG 3.757 H A 0065 ASN CG
H A 0016 TYR CD1 3.799 H A 0065 ASN CG
H A 0016 TYR CD2 3.405 H A 0065 ASN CG
H A 0016 TYR CE1 3.508 H A 0065 ASN CG
H A 0016 TYR CE2 3.529 H A 0065 ASN C
H A 0016 TYR CE2 3.725 H A 0065 ASN CB
H A 0016 TYR CE2 3.083 H A 0065 ASN CG
H A 0016 TYR CZ 3.417 H A 0065 ASN CB
H A 0016 TYR CZ 3.144 H A 0065 ASN CG
H A 0016 TYR CD2 3.590 H A 0069 ILE CG1
H A 0016 TYR CE2 3.754 H A 0069 ILE CG1
H A 0016 TYR CZ 3.668 H A 0072 LYS CE
H A 0017 VAL C 2.396 H A 0018 GLN CA
H A 0017 VAL C 3.168 H A 0018 GLN C
H A 0017 VAL C 3.659 H A 0018 GLN CB
H A 0017 VAL CA 3.561 H A 0065 ASN CG
H A 0017 VAL CG1 3.597 H A 0066 ALA CA
H A 0017 VAL CG1 3.292 H A 0066 ALA CB
H A 0018 GLN C 2.478 H A 0019 GLY CA
H A 0018 GLN C 3.526 H A 0019 GLY C
H A 0019 GLY C 2.469 C A 0020 GLY CA
H A 0019 GLY C 3.506 C A 0020 GLY C
C A 0020 GLY CA 2.926 C A 0021 PRO CD
C A 0020 GLY C 2.502 C A 0021 PRO CA
C A 0020 GLY C 3.321 C A 0021 PRO C
C A 0020 GLY C 3.665 C A 0021 PRO CB
C A 0020 GLY C 3.507 C A 0021 PRO CG
C A 0020 GLY C 2.503 C A 0021 PRO CD
C A 0021 PRO C 2.484 C A 0022 GLY CA
C A 0021 PRO C 3.551 C A 0022 GLY C
C A 0022 GLY CA 3.021 C A 0023 PRO CA
C A 0022 GLY C 2.523 C A 0023 PRO CA
C A 0022 GLY C 3.401 C A 0023 PRO C
C A 0022 GLY C 3.522 C A 0023 PRO CB
C A 0022 GLY C 3.632 C A 0023 PRO CG
C A 0022 GLY C 2.448 C A 0023 PRO CD
C A 0023 PRO C 2.488 C A 0024 SER CA
C A 0023 PRO C 3.058 C A 0024 SER C
C A 0023 PRO C 3.212 C A 0024 SER CB
C A 0023 PRO CA 3.392 H A 0027 CYS CB
C A 0023 PRO C 3.506 H A 0027 CYS CB
C A 0023 PRO CB 3.330 H A 0027 CYS CB
C A 0024 SER C 2.470 H A 0025 GLY CA
C A 0024 SER C 3.586 H A 0025 GLY C
C A 0024 SER CB 3.529 H A 0026 GLU CD
H A 0025 GLY CA 3.763 H A 0026 GLU CA
H A 0025 GLY C 2.448 H A 0026 GLU CA
H A 0025 GLY C 2.895 H A 0026 GLU C
H A 0025 GLY C 3.684 H A 0026 GLU CB
H A 0026 GLU C 2.413 H A 0027 CYS CA
H A 0026 GLU C 2.971 H A 0027 CYS C
H A 0026 GLU C 3.694 H A 0027 CYS CB
H A 0026 GLU CA 3.784 H A 0029 ASN CG
H A 0027 CYS C 2.424 H A 0028 CYS CA
H A 0027 CYS C 2.903 H A 0028 CYS C
H A 0027 CYS C 3.633 H A 0028 CYS CB
H A 0028 CYS C 2.386 H A 0029 ASN CA
H A 0028 CYS C 2.937 H A 0029 ASN C
H A 0028 CYS C 3.702 H A 0029 ASN CB
H A 0028 CYS CA 3.371 H A 0073 CYS CB
H A 0028 CYS CB 3.449 H A 0073 CYS CB
H A 0029 ASN C 2.449 H A 0030 GLY CA
H A 0029 ASN C 2.928 H A 0030 GLY C
H A 0030 GLY C 2.537 H A 0031 VAL CA
H A 0030 GLY C 3.229 H A 0031 VAL C
H A 0030 GLY C 3.704 H A 0031 VAL CB
H A 0030 GLY C 3.661 H A 0033 ASP CB
H A 0031 VAL C 2.470 H A 0032 ARG CA
H A 0031 VAL C 2.837 H A 0032 ARG C
H A 0031 VAL C 3.676 H A 0032 ARG CB
H A 0031 VAL CG2 3.730 H A 0069 ILE CG2
H A 0031 VAL CG1 3.446 C A 0075 VAL CB
H A 0031 VAL CG1 3.187 C A 0075 VAL CG1
H A 0031 VAL CG1 3.453 C A 0075 VAL CG2
H A 0032 ARG CA 3.795 H A 0033 ASP CA
H A 0032 ARG C 2.438 H A 0033 ASP CA
H A 0032 ARG C 2.818 H A 0033 ASP C
H A 0032 ARG C 3.750 H A 0033 ASP CB
H A 0032 ARG CA 3.736 C A 0075 VAL CG2
H A 0033 ASP C 2.462 H A 0034 LEU CA
H A 0033 ASP C 2.884 H A 0034 LEU C
H A 0033 ASP C 3.640 H A 0034 LEU CB
H A 0033 ASP CA 3.362 H A 0037 GLN CG
H A 0033 ASP C 3.565 H A 0037 GLN CB
H A 0033 ASP C 3.070 H A 0037 GLN CG
H A 0033 ASP CB 3.401 H A 0037 GLN CG
H A 0033 ASP CG 3.406 H A 0037 GLN CG
H A 0033 ASP CG 3.658 H A 0037 GLN CD
H A 0034 LEU C 2.436 H A 0035 HIS CA
H A 0034 LEU C 2.893 H A 0035 HIS C
H A 0034 LEU C 3.704 H A 0035 HIS CB
H A 0034 LEU CA 3.798 H A 0037 GLN CB
H A 0035 HIS C 2.487 H A 0036 ASN CA
H A 0035 HIS C 3.381 H A 0036 ASN C
H A 0035 HIS C 3.586 H A 0036 ASN CB
H A 0035 HIS CB 3.352 C A 0075 VAL CG2
H A 0035 HIS CE1 3.679 C A 0077 VAL CB
H A 0036 ASN C 2.457 H A 0037 GLN CA
H A 0036 ASN C 3.367 H A 0037 GLN C
H A 0036 ASN C 3.663 H A 0037 GLN CB
H A 0036 ASN CA 3.601 C A 0039 GLN CD
H A 0036 ASN C 3.780 C A 0039 GLN CD
H A 0037 GLN C 2.470 C A 0038 ALA CA
H A 0037 GLN C 3.276 C A 0038 ALA C
H A 0037 GLN C 3.611 C A 0038 ALA CB
C A 0038 ALA C 2.475 C A 0039 GLN CA
C A 0038 ALA C 3.463 C A 0039 GLN C
C A 0038 ALA C 3.537 C A 0039 GLN CB
C A 0038 ALA C 3.598 C A 0039 GLN CG
C A 0038 ALA CA 3.351 C A 0043 ASP CB
C A 0038 ALA CA 3.599 C A 0043 ASP CG
C A 0038 ALA C 3.591 C A 0043 ASP CB
C A 0038 ALA C 3.692 C A 0043 ASP CG
C A 0038 ALA CB 3.406 C A 0043 ASP CB
C A 0038 ALA CB 3.679 H A 0044 ARG CG
C A 0039 GLN C 2.436 C A 0040 SER CA
C A 0039 GLN C 3.264 C A 0040 SER C
C A 0039 GLN C 3.640 C A 0040 SER CB
C A 0040 SER C 2.441 C A 0041 SER CA
C A 0040 SER C 3.522 C A 0041 SER C
C A 0040 SER C 3.405 C A 0041 SER CB
C A 0041 SER C 2.473 C A 0042 GLY CA
C A 0041 SER C 3.415 C A 0042 GLY C
C A 0042 GLY C 2.483 C A 0043 ASP CA
C A 0042 GLY C 2.997 C A 0043 ASP C
C A 0042 GLY C 3.565 C A 0043 ASP CB
C A 0042 GLY C 3.771 H A 0044 ARG CD
C A 0043 ASP C 2.472 H A 0044 ARG CA
C A 0043 ASP C 3.113 H A 0044 ARG C
C A 0043 ASP C 3.751 H A 0044 ARG CB
H A 0044 ARG C 2.488 H A 0045 GLN CA
H A 0044 ARG C 3.262 H A 0045 GLN C
H A 0044 ARG C 3.702 H A 0045 GLN CB
H A 0044 ARG CA 3.629 H A 0047 VAL CB
H A 0044 ARG C 3.769 H A 0047 VAL CB
H A 0044 ARG CB 3.438 C A 0079 TYR CE1
H A 0044 ARG CZ 3.333 C A 0091 TYR C
H A 0045 GLN C 2.483 H A 0046 THR CA
H A 0045 GLN C 3.126 H A 0046 THR C
H A 0045 GLN C 3.709 H A 0046 THR CB
H A 0045 GLN CD 3.729 C A 0090 ILE CG2
H A 0046 THR C 2.462 H A 0047 VAL CA
H A 0046 THR C 2.826 H A 0047 VAL C
H A 0046 THR C 3.711 H A 0047 VAL CB
H A 0047 VAL C 2.456 H A 0048 CYS CA
H A 0047 VAL C 2.805 H A 0048 CYS C
H A 0047 VAL C 3.608 H A 0048 CYS CB
H A 0047 VAL C 3.663 H A 0051 LEU CG
H A 0047 VAL CG1 3.774 H A 0051 LEU CG
H A 0047 VAL CG1 3.650 H A 0051 LEU CD1
H A 0048 CYS C 2.458 H A 0049 ASN CA
H A 0048 CYS C 2.989 H A 0049 ASN C
H A 0048 CYS C 3.658 H A 0049 ASN CB
H A 0048 CYS C 3.678 H A 0052 LYS CG
H A 0048 CYS CB 3.739 C A 0087 CYS CA
H A 0048 CYS CB 3.581 C A 0087 CYS CB
H A 0049 ASN C 2.428 H A 0050 CYS CA
H A 0049 ASN C 2.939 H A 0050 CYS C
H A 0049 ASN C 3.749 H A 0050 CYS CB
H A 0050 CYS C 2.467 H A 0051 LEU CA
H A 0050 CYS C 2.882 H A 0051 LEU C
H A 0050 CYS C 3.754 H A 0051 LEU CB
H A 0051 LEU C 2.473 H A 0052 LYS CA
H A 0051 LEU C 2.916 H A 0052 LYS C
H A 0051 LEU C 3.661 H A 0052 LYS CB
H A 0051 LEU CB 3.523 C A 0085 ILE CG2
H A 0052 LYS C 2.423 H A 0053 GLY CA
H A 0052 LYS C 3.034 H A 0053 GLY C
H A 0052 LYS CE 3.776 C A 0084 ASP C
H A 0052 LYS CG 3.712 C A 0085 ILE CG2
H A 0053 GLY CA 3.797 H A 0054 ILE CA
H A 0053 GLY C 2.374 H A 0054 ILE CA
H A 0053 GLY C 2.999 H A 0054 ILE C
H A 0053 GLY C 3.634 H A 0054 ILE CB
H A 0053 GLY CA 3.515 H A 0056 ARG CZ
H A 0053 GLY C 3.601 H A 0056 ARG CB
H A 0054 ILE C 2.492 H A 0055 ALA CA
H A 0054 ILE C 2.835 H A 0055 ALA C
H A 0054 ILE C 3.687 H A 0055 ALA CB
H A 0054 ILE C 3.472 C A 0058 ILE CG1
H A 0054 ILE CG2 3.774 C A 0058 ILE CG1
H A 0054 ILE CG2 3.658 C A 0058 ILE CD1
H A 0055 ALA CA 3.789 H A 0056 ARG CA
H A 0055 ALA C 2.497 H A 0056 ARG CA
H A 0055 ALA C 2.896 H A 0056 ARG C
H A 0055 ALA C 3.575 H A 0056 ARG CB
H A 0055 ALA CA 3.491 C A 0058 ILE CG1
H A 0055 ALA CA 3.761 C A 0058 ILE CD1
H A 0056 ARG C 2.468 C A 0057 GLY CA
H A 0056 ARG C 3.601 C A 0057 GLY C
C A 0057 GLY C 2.505 C A 0058 ILE CA
C A 0057 GLY C 3.075 C A 0058 ILE C
C A 0057 GLY C 3.420 C A 0058 ILE CB
C A 0058 ILE C 2.467 C A 0059 HIS CA
C A 0058 ILE C 3.506 C A 0059 HIS C
C A 0058 ILE C 3.440 C A 0059 HIS CB
C A 0058 ILE CG2 3.720 C A 0059 HIS CA
C A 0059 HIS C 2.469 C A 0060 ASN CA
C A 0059 HIS C 3.634 C A 0060 ASN C
C A 0059 HIS C 3.412 C A 0060 ASN CB
C A 0059 HIS C 3.418 C A 0060 ASN CG
C A 0060 ASN C 2.403 C A 0061 LEU CA
C A 0060 ASN C 2.988 C A 0061 LEU C
C A 0060 ASN C 3.663 C A 0061 LEU CB
C A 0061 LEU C 2.443 C A 0062 ASN CA
C A 0061 LEU C 3.221 C A 0062 ASN C
C A 0061 LEU C 3.518 C A 0062 ASN CB
C A 0061 LEU CD2 3.549 C A 0083 PRO CA
C A 0061 LEU CD2 3.555 C A 0083 PRO CB
C A 0062 ASN C 2.425 H A 0063 LEU CA
C A 0062 ASN C 2.874 H A 0063 LEU C
C A 0062 ASN C 3.707 H A 0063 LEU CB
C A 0062 ASN CG 3.602 H A 0065 ASN CB
H A 0063 LEU C 2.452 H A 0064 ASN CA
H A 0063 LEU C 2.907 H A 0064 ASN C
H A 0063 LEU C 3.709 H A 0064 ASN CB
H A 0063 LEU CA 3.790 H A 0066 ALA CB
H A 0063 LEU CD1 3.532 C A 0083 PRO CG
H A 0063 LEU CD1 3.482 C A 0083 PRO CD
H A 0064 ASN C 2.437 H A 0065 ASN CA
H A 0064 ASN C 2.980 H A 0065 ASN C
H A 0064 ASN C 3.672 H A 0065 ASN CB
H A 0065 ASN C 2.459 H A 0066 ALA CA
H A 0065 ASN C 2.997 H A 0066 ALA C
H A 0065 ASN C 3.698 H A 0066 ALA CB
H A 0065 ASN C 3.704 H A 0068 SER CB
H A 0066 ALA C 2.479 H A 0067 ALA CA
H A 0066 ALA C 3.064 H A 0067 ALA C
H A 0066 ALA C 3.740 H A 0067 ALA CB
H A 0067 ALA C 2.431 H A 0068 SER CA
H A 0067 ALA C 3.267 H A 0068 SER C
H A 0067 ALA C 3.582 H A 0068 SER CB
H A 0067 ALA C 3.463 H A 0070 PRO CD
H A 0067 ALA CA 3.280 C A 0081 ILE CG2
H A 0067 ALA CB 3.384 C A 0081 ILE CG2
H A 0068 SER C 2.429 H A 0069 ILE CA
H A 0068 SER C 2.874 H A 0069 ILE C
H A 0068 SER C 3.261 H A 0070 PRO CD
H A 0069 ILE CA 3.015 H A 0070 PRO CD
H A 0069 ILE C 2.451 H A 0070 PRO CA
H A 0069 ILE C 3.071 H A 0070 PRO C
H A 0069 ILE C 3.674 H A 0070 PRO CB
H A 0069 ILE C 3.618 H A 0070 PRO CG
H A 0069 ILE C 2.526 H A 0070 PRO CD
H A 0069 ILE CB 3.406 H A 0070 PRO CD
H A 0070 PRO CA 3.793 H A 0071 SER CA
H A 0070 PRO C 2.475 H A 0071 SER CA
H A 0070 PRO C 3.056 H A 0071 SER C
H A 0070 PRO C 3.686 H A 0071 SER CB
H A 0070 PRO CA 3.335 C A 0075 VAL CG1
H A 0071 SER CA 3.778 H A 0072 LYS CA
H A 0071 SER C 2.457 H A 0072 LYS CA
H A 0071 SER C 3.145 H A 0072 LYS C
H A 0071 SER C 3.616 H A 0072 LYS CB
H A 0072 LYS C 2.455 H A 0073 CYS CA
H A 0072 LYS C 3.537 H A 0073 CYS C
H A 0072 LYS C 3.478 H A 0073 CYS CB
H A 0073 CYS C 2.484 H A 0074 ASN CA
H A 0073 CYS C 2.929 H A 0074 ASN C
H A 0073 CYS C 3.364 H A 0074 ASN CB
H A 0074 ASN C 2.467 C A 0075 VAL CA
H A 0074 ASN C 3.551 C A 0075 VAL C
H A 0074 ASN C 3.508 C A 0075 VAL CB
C A 0075 VAL C 2.511 C A 0076 ASN CA
C A 0075 VAL C 3.112 C A 0076 ASN C
C A 0075 VAL C 3.561 C A 0076 ASN CB
C A 0075 VAL C 3.477 C A 0076 ASN CG
C A 0076 ASN C 2.444 C A 0077 VAL CA
C A 0076 ASN C 3.374 C A 0077 VAL C
C A 0076 ASN C 3.546 C A 0077 VAL CB
C A 0077 VAL CA 2.924 C A 0078 PRO CD
C A 0077 VAL C 2.472 C A 0078 PRO CA
C A 0077 VAL C 3.167 C A 0078 PRO C
C A 0077 VAL C 3.634 C A 0078 PRO CB
C A 0077 VAL C 3.612 C A 0078 PRO CG
C A 0077 VAL C 2.507 C A 0078 PRO CD
C A 0077 VAL CG2 3.487 C A 0078 PRO CD
C A 0078 PRO C 2.527 C A 0079 TYR CA
C A 0078 PRO C 3.148 C A 0079 TYR C
C A 0078 PRO C 3.430 C A 0079 TYR CB
C A 0078 PRO CG 3.352 C A 0091 TYR CG
C A 0078 PRO CG 3.102 C A 0091 TYR CD1
C A 0078 PRO CG 3.491 C A 0091 TYR CE1
C A 0079 TYR C 2.480 C A 0080 THR CA
C A 0079 TYR C 3.126 C A 0080 THR C
C A 0079 TYR C 3.044 C A 0080 THR CB
C A 0079 TYR CE2 3.514 C A 0085 ILE CD1
C A 0079 TYR C 3.627 C A 0090 ILE CG1
C A 0079 TYR CD1 3.271 C A 0090 ILE CG1
C A 0079 TYR CD1 3.524 C A 0090 ILE CG2
C A 0079 TYR CD1 3.360 C A 0090 ILE CD1
C A 0079 TYR CE1 3.345 C A 0090 ILE CG1
C A 0079 TYR CE1 3.450 C A 0090 ILE CG2
C A 0079 TYR CE1 2.864 C A 0090 ILE CD1
C A 0079 TYR CZ 3.212 C A 0090 ILE CD1
C A 0080 THR C 2.526 C A 0081 ILE CA
C A 0080 THR C 3.260 C A 0081 ILE C
C A 0080 THR C 2.982 C A 0081 ILE CB
C A 0080 THR C 3.409 C A 0081 ILE CG1
C A 0081 ILE C 2.464 C A 0082 SER CA
C A 0081 ILE C 3.208 C A 0082 SER CB
C A 0082 SER CA 2.953 C A 0083 PRO CD
C A 0082 SER C 2.499 C A 0083 PRO CA
C A 0082 SER C 3.103 C A 0083 PRO C
C A 0082 SER C 3.673 C A 0083 PRO CB
C A 0082 SER C 3.616 C A 0083 PRO CG
C A 0082 SER C 2.515 C A 0083 PRO CD
C A 0082 SER CB 3.093 C A 0083 PRO CD
C A 0083 PRO CA 3.783 C A 0084 ASP CA
C A 0083 PRO C 2.473 C A 0084 ASP CA
C A 0083 PRO C 3.445 C A 0084 ASP C
C A 0083 PRO C 3.472 C A 0084 ASP CB
C A 0084 ASP C 2.471 C A 0085 ILE CA
C A 0084 ASP C 2.992 C A 0085 ILE C
C A 0084 ASP C 3.603 C A 0085 ILE CB
C A 0084 ASP C 3.722 C A 0085 ILE CG2
C A 0085 ILE C 2.446 C A 0086 ASP CA
C A 0085 ILE C 3.265 C A 0086 ASP C
C A 0085 ILE C 3.627 C A 0086 ASP CB
C A 0086 ASP C 2.456 C A 0087 CYS CA
C A 0086 ASP C 3.104 C A 0087 CYS C
C A 0086 ASP C 3.646 C A 0087 CYS CB
C A 0086 ASP CB 3.432 C A 0089 ARG CG
C A 0086 ASP CB 3.580 C A 0089 ARG CD
C A 0087 CYS C 2.436 C A 0088 SER CA
C A 0087 CYS C 3.212 C A 0088 SER C
C A 0087 CYS C 3.643 C A 0088 SER CB
C A 0088 SER C 2.438 C A 0089 ARG CA
C A 0088 SER C 3.514 C A 0089 ARG C
C A 0088 SER C 3.441 C A 0089 ARG CB
C A 0088 SER C 3.473 C A 0089 ARG CG
C A 0089 ARG C 2.484 C A 0090 ILE CA
C A 0089 ARG C 3.363 C A 0090 ILE C
C A 0089 ARG C 3.595 C A 0090 ILE CB
C A 0090 ILE CA 3.787 C A 0091 TYR CA
C A 0090 ILE CA 3.766 C A 0091 TYR CD1
C A 0090 ILE C 2.427 C A 0091 TYR CA
C A 0090 ILE C 3.514 C A 0091 TYR C
C A 0090 ILE C 3.388 C A 0091 TYR CB
C A 0090 ILE C 3.449 C A 0091 TYR CG
C A 0090 ILE C 3.011 C A 0091 TYR CD1
CHARGE_ATTR 2.00 12.00 36
H A 0007 ASP OD1 11.09 H A 0009 LYS NZ
H A 0007 ASP OD2 10.44 H A 0009 LYS NZ
H A 0007 ASP OD1 2.773 H A 0011 LYS NZ
H A 0007 ASP OD2 2.757 H A 0011 LYS NZ
H A 0026 GLU OE1 11.95 H A 0009 LYS NZ
H A 0026 GLU OE1 11.44 H A 0011 LYS NZ
H A 0026 GLU OE2 10.04 H A 0011 LYS NZ
H A 0026 GLU OE2 11.74 H A 0072 LYS NZ
H A 0033 ASP OD1 4.871 H A 0009 LYS NZ
H A 0033 ASP OD2 2.724 H A 0009 LYS NZ
H A 0033 ASP OD1 8.736 H A 0032 ARG NH1
H A 0033 ASP OD1 9.931 H A 0032 ARG NH2
H A 0033 ASP OD2 10.68 H A 0032 ARG NH1
H A 0033 ASP OD2 11.76 H A 0032 ARG NH2
H A 0033 ASP OD1 9.981 H A 0035 HIS ND1
H A 0033 ASP OD1 10.68 H A 0035 HIS NE2
H A 0033 ASP OD2 11.12 H A 0035 HIS ND1
H A 0033 ASP OD2 11.98 H A 0035 HIS NE2
C A 0043 ASP OD1 11.98 H A 0009 LYS NZ
C A 0043 ASP OD2 11.17 H A 0009 LYS NZ
C A 0043 ASP OD1 7.304 H A 0044 ARG NH1
C A 0043 ASP OD1 7.322 H A 0044 ARG NH2
C A 0043 ASP OD2 9.170 H A 0044 ARG NH1
C A 0043 ASP OD2 9.136 H A 0044 ARG NH2
C A 0084 ASP OD1 6.046 H A 0052 LYS NZ
C A 0084 ASP OD2 4.498 H A 0052 LYS NZ
C A 0084 ASP OD1 10.12 C A 0089 ARG NH1
C A 0084 ASP OD1 8.608 C A 0089 ARG NH2
C A 0084 ASP OD2 9.157 C A 0089 ARG NH1
C A 0084 ASP OD2 7.360 C A 0089 ARG NH2
C A 0086 ASP OD1 2.539 H A 0052 LYS NZ
C A 0086 ASP OD2 4.708 H A 0052 LYS NZ
C A 0086 ASP OD1 6.505 C A 0089 ARG NH1
C A 0086 ASP OD1 4.878 C A 0089 ARG NH2
C A 0086 ASP OD2 4.376 C A 0089 ARG NH1
C A 0086 ASP OD2 2.719 C A 0089 ARG NH2
CHARGE_REPU 2.00 12.00 21
H A 0007 ASP OD1 11.12 H A 0026 GLU OE2
H A 0007 ASP OD2 11.75 H A 0026 GLU OE2
H A 0009 LYS NZ 11.78 H A 0011 LYS NZ
H A 0032 ARG NH1 6.269 H A 0035 HIS ND1
H A 0032 ARG NH1 6.604 H A 0035 HIS NE2
H A 0032 ARG NH2 7.442 H A 0035 HIS ND1
H A 0032 ARG NH2 8.143 H A 0035 HIS NE2
H A 0033 ASP OD2 11.90 C A 0043 ASP OD1
H A 0033 ASP OD2 11.58 C A 0043 ASP OD2
H A 0035 HIS ND1 9.304 H A 0044 ARG NH1
H A 0035 HIS ND1 7.214 H A 0044 ARG NH2
H A 0035 HIS NE2 8.350 H A 0044 ARG NH1
H A 0035 HIS NE2 6.293 H A 0044 ARG NH2
H A 0052 LYS NZ 11.33 H A 0056 ARG NH1
H A 0052 LYS NZ 10.93 H A 0056 ARG NH2
H A 0052 LYS NZ 8.931 C A 0089 ARG NH1
H A 0052 LYS NZ 7.390 C A 0089 ARG NH2
C A 0084 ASP OD1 6.345 C A 0086 ASP OD1
C A 0084 ASP OD1 7.210 C A 0086 ASP OD2
C A 0084 ASP OD2 4.625 C A 0086 ASP OD1
C A 0084 ASP OD2 5.680 C A 0086 ASP OD2
HB_MM 2.00 3.20 194
C A 0002 ASN N 2.201 C A 0001 LEU O
H A 0003 CYS N 2.240 C A 0002 ASN O
H A 0004 GLY N 2.214 H A 0003 CYS O
H A 0005 GLN N 2.239 H A 0004 GLY O
H A 0006 VAL N 2.960 H A 0004 GLY O
H A 0006 VAL N 2.254 H A 0005 GLN O
H A 0007 ASP N 3.057 H A 0004 GLY O
H A 0007 ASP N 2.707 H A 0005 GLN O
H A 0007 ASP N 2.225 H A 0006 VAL O
H A 0008 SER N 3.095 H A 0004 GLY O
H A 0008 SER N 2.660 H A 0005 GLN O
H A 0008 SER N 2.261 H A 0007 ASP O
H A 0009 LYS N 2.789 H A 0005 GLN O
H A 0009 LYS N 2.680 H A 0007 ASP O
H A 0009 LYS N 2.248 H A 0008 SER O
H A 0010 MET N 3.015 H A 0006 VAL O
H A 0010 MET N 2.967 H A 0007 ASP O
H A 0010 MET N 2.209 H A 0009 LYS O
H A 0011 LYS N 2.878 H A 0007 ASP O
H A 0011 LYS N 2.229 H A 0010 MET O
H A 0012 PRO N 3.107 H A 0010 MET O
H A 0012 PRO N 2.241 H A 0011 LYS O
H A 0013 CYS N 2.629 H A 0010 MET O
H A 0013 CYS N 3.016 H A 0011 LYS O
H A 0013 CYS N 2.214 H A 0012 PRO O
H A 0014 LEU N 2.880 H A 0010 MET O
H A 0014 LEU N 3.170 H A 0011 LYS O
H A 0014 LEU N 2.217 H A 0013 CYS O
H A 0015 THR N 2.807 H A 0011 LYS O
H A 0015 THR N 2.241 H A 0014 LEU O
H A 0016 TYR N 3.073 H A 0012 PRO O
H A 0016 TYR N 3.071 H A 0014 LEU O
H A 0016 TYR N 2.227 H A 0015 THR O
H A 0017 VAL N 2.980 H A 0013 CYS O
H A 0017 VAL N 2.883 H A 0014 LEU O
H A 0017 VAL N 2.208 H A 0016 TYR O
H A 0018 GLN N 2.904 H A 0014 LEU O
H A 0018 GLN N 3.039 H A 0015 THR O
H A 0018 GLN N 2.209 H A 0017 VAL O
H A 0019 GLY N 2.748 H A 0015 THR O
H A 0019 GLY N 3.021 H A 0016 TYR O
H A 0019 GLY N 2.234 H A 0018 GLN O
C A 0020 GLY N 2.759 H A 0015 THR O
C A 0020 GLY N 2.215 H A 0019 GLY O
C A 0021 PRO N 2.218 C A 0020 GLY O
C A 0022 GLY N 2.685 C A 0020 GLY O
C A 0022 GLY N 2.217 C A 0021 PRO O
C A 0023 PRO N 2.201 C A 0022 GLY O
C A 0024 SER N 2.236 C A 0023 PRO O
H A 0025 GLY N 2.793 C A 0023 PRO O
H A 0025 GLY N 2.204 C A 0024 SER O
H A 0026 GLU N 2.246 H A 0025 GLY O
H A 0027 CYS N 2.913 C A 0023 PRO O
H A 0027 CYS N 3.029 H A 0025 GLY O
H A 0027 CYS N 2.225 H A 0026 GLU O
H A 0028 CYS N 3.195 H A 0025 GLY O
H A 0028 CYS N 2.195 H A 0027 CYS O
H A 0029 ASN N 3.056 H A 0025 GLY O
H A 0029 ASN N 2.892 H A 0027 CYS O
H A 0029 ASN N 2.221 H A 0028 CYS O
H A 0030 GLY N 2.742 H A 0026 GLU O
H A 0030 GLY N 2.773 H A 0027 CYS O
H A 0030 GLY N 2.193 H A 0029 ASN O
H A 0031 VAL N 2.719 H A 0027 CYS O
H A 0031 VAL N 2.821 H A 0029 ASN O
H A 0031 VAL N 2.239 H A 0030 GLY O
H A 0032 ARG N 2.817 H A 0028 CYS O
H A 0032 ARG N 3.087 H A 0029 ASN O
H A 0032 ARG N 2.228 H A 0031 VAL O
H A 0033 ASP N 2.708 H A 0029 ASN O
H A 0033 ASP N 3.077 H A 0031 VAL O
H A 0033 ASP N 2.260 H A 0032 ARG O
H A 0034 LEU N 2.733 H A 0030 GLY O
H A 0034 LEU N 3.174 H A 0031 VAL O
H A 0034 LEU N 2.204 H A 0033 ASP O
H A 0035 HIS N 2.755 H A 0031 VAL O
H A 0035 HIS N 2.765 H A 0033 ASP O
H A 0035 HIS N 2.219 H A 0034 LEU O
H A 0036 ASN N 3.146 H A 0032 ARG O
H A 0036 ASN N 2.552 H A 0033 ASP O
H A 0036 ASN N 3.122 H A 0034 LEU O
H A 0036 ASN N 2.255 H A 0035 HIS O
H A 0037 GLN N 2.583 H A 0033 ASP O
H A 0037 GLN N 3.098 H A 0034 LEU O
H A 0037 GLN N 2.206 H A 0036 ASN O
C A 0038 ALA N 2.712 H A 0034 LEU O
C A 0038 ALA N 2.218 H A 0037 GLN O
C A 0039 GLN N 2.974 H A 0037 GLN O
C A 0039 GLN N 2.230 C A 0038 ALA O
C A 0040 SER N 2.216 C A 0039 GLN O
C A 0041 SER N 2.214 C A 0040 SER O
C A 0042 GLY N 2.238 C A 0041 SER O
C A 0043 ASP N 2.202 C A 0042 GLY O
H A 0044 ARG N 2.771 C A 0042 GLY O
H A 0044 ARG N 2.203 C A 0043 ASP O
H A 0045 GLN N 2.801 C A 0042 GLY O
H A 0045 GLN N 2.839 C A 0043 ASP O
H A 0045 GLN N 2.230 H A 0044 ARG O
H A 0046 THR N 2.705 C A 0043 ASP O
H A 0046 THR N 2.220 H A 0045 GLN O
H A 0047 VAL N 2.752 C A 0043 ASP O
H A 0047 VAL N 2.245 H A 0046 THR O
H A 0048 CYS N 2.965 H A 0044 ARG O
H A 0048 CYS N 3.100 H A 0046 THR O
H A 0048 CYS N 2.240 H A 0047 VAL O
H A 0049 ASN N 2.905 H A 0046 THR O
H A 0049 ASN N 3.052 H A 0047 VAL O
H A 0049 ASN N 2.202 H A 0048 CYS O
H A 0050 CYS N 3.120 H A 0046 THR O
H A 0050 CYS N 2.582 H A 0047 VAL O
H A 0050 CYS N 3.153 H A 0048 CYS O
H A 0050 CYS N 2.215 H A 0049 ASN O
H A 0051 LEU N 2.746 H A 0047 VAL O
H A 0051 LEU N 2.904 H A 0048 CYS O
H A 0051 LEU N 2.218 H A 0050 CYS O
H A 0052 LYS N 2.727 H A 0048 CYS O
H A 0052 LYS N 2.223 H A 0051 LEU O
H A 0053 GLY N 2.878 H A 0049 ASN O
H A 0053 GLY N 3.087 H A 0050 CYS O
H A 0053 GLY N 3.050 H A 0051 LEU O
H A 0053 GLY N 2.211 H A 0052 LYS O
H A 0054 ILE N 2.996 H A 0050 CYS O
H A 0054 ILE N 2.906 H A 0051 LEU O
H A 0054 ILE N 2.191 H A 0053 GLY O
H A 0055 ALA N 2.722 H A 0051 LEU O
H A 0055 ALA N 2.251 H A 0054 ILE O
H A 0056 ARG N 2.830 H A 0052 LYS O
H A 0056 ARG N 2.847 H A 0054 ILE O
H A 0056 ARG N 2.266 H A 0055 ALA O
C A 0057 GLY N 2.984 H A 0054 ILE O
C A 0057 GLY N 2.598 H A 0055 ALA O
C A 0057 GLY N 2.249 H A 0056 ARG O
C A 0058 ILE N 2.947 H A 0054 ILE O
C A 0058 ILE N 2.238 C A 0057 GLY O
C A 0059 HIS N 2.179 C A 0058 ILE O
C A 0060 ASN N 3.141 H A 0018 GLN O
C A 0060 ASN N 2.219 C A 0059 HIS O
C A 0061 LEU N 2.197 C A 0060 ASN O
C A 0062 ASN N 2.712 H A 0017 VAL O
C A 0062 ASN N 2.730 C A 0060 ASN O
C A 0062 ASN N 2.211 C A 0061 LEU O
H A 0063 LEU N 3.139 C A 0061 LEU O
H A 0063 LEU N 2.228 C A 0062 ASN O
H A 0064 ASN N 2.864 C A 0062 ASN O
H A 0064 ASN N 2.203 H A 0063 LEU O
H A 0065 ASN N 2.656 C A 0062 ASN O
H A 0065 ASN N 3.136 H A 0063 LEU O
H A 0065 ASN N 2.212 H A 0064 ASN O
H A 0066 ALA N 3.019 C A 0062 ASN O
H A 0066 ALA N 2.885 H A 0063 LEU O
H A 0066 ALA N 2.225 H A 0065 ASN O
H A 0067 ALA N 2.708 H A 0063 LEU O
H A 0067 ALA N 2.221 H A 0066 ALA O
H A 0068 SER N 2.917 H A 0064 ASN O
H A 0068 SER N 2.761 H A 0065 ASN O
H A 0068 SER N 3.056 H A 0066 ALA O
H A 0068 SER N 2.213 H A 0067 ALA O
H A 0069 ILE N 2.757 H A 0065 ASN O
H A 0069 ILE N 2.764 H A 0066 ALA O
H A 0069 ILE N 2.222 H A 0068 SER O
H A 0070 PRO N 2.202 H A 0069 ILE O
H A 0071 SER N 2.257 H A 0070 PRO O
H A 0072 LYS N 3.028 H A 0068 SER O
H A 0072 LYS N 3.198 H A 0069 ILE O
H A 0072 LYS N 2.241 H A 0071 SER O
H A 0073 CYS N 2.694 H A 0069 ILE O
H A 0073 CYS N 2.226 H A 0072 LYS O
H A 0074 ASN N 3.132 H A 0070 PRO O
H A 0074 ASN N 2.212 H A 0073 CYS O
C A 0075 VAL N 2.625 H A 0073 CYS O
C A 0075 VAL N 2.195 H A 0074 ASN O
C A 0076 ASN N 2.227 C A 0075 VAL O
C A 0077 VAL N 2.564 C A 0075 VAL O
C A 0077 VAL N 2.209 C A 0076 ASN O
C A 0078 PRO N 2.223 C A 0077 VAL O
C A 0079 TYR N 3.098 C A 0077 VAL O
C A 0079 TYR N 2.224 C A 0078 PRO O
C A 0080 THR N 2.486 C A 0078 PRO O
C A 0080 THR N 2.192 C A 0079 TYR O
C A 0080 THR N 3.195 C A 0089 ARG O
C A 0081 ILE N 2.584 C A 0079 TYR O
C A 0081 ILE N 2.225 C A 0080 THR O
C A 0082 SER N 2.195 C A 0081 ILE O
C A 0083 PRO N 2.224 C A 0082 SER O
C A 0084 ASP N 3.086 C A 0082 SER O
C A 0084 ASP N 2.242 C A 0083 PRO O
C A 0085 ILE N 2.775 C A 0082 SER O
C A 0085 ILE N 2.202 C A 0084 ASP O
C A 0086 ASP N 2.204 C A 0085 ILE O
C A 0087 CYS N 2.223 C A 0086 ASP O
C A 0088 SER N 2.216 C A 0087 CYS O
C A 0089 ARG N 2.213 C A 0088 SER O
C A 0090 ILE N 2.239 C A 0089 ARG O
C A 0091 TYR N 2.216 C A 0090 ILE O
HB_MS 2.00 3.20 23
H A 0011 LYS O 2.707 H A 0015 THR OG1
H A 0012 PRO O 2.601 H A 0015 THR OG1
H A 0016 TYR N 2.712 H A 0015 THR OG1
H A 0016 TYR O 2.645 H A 0065 ASN ND2
H A 0025 GLY N 2.849 H A 0026 GLU OE1
H A 0025 GLY O 2.811 H A 0029 ASN ND2
H A 0030 GLY N 2.545 H A 0029 ASN OD1
H A 0036 ASN O 2.731 C A 0039 GLN NE2
C A 0040 SER N 2.877 C A 0043 ASP OD1
C A 0041 SER N 2.481 C A 0040 SER OG
H A 0045 GLN O 2.574 H A 0049 ASN ND2
H A 0053 GLY O 2.555 H A 0056 ARG NH1
H A 0066 ALA N 2.436 H A 0065 ASN OD1
H A 0068 SER O 2.653 H A 0072 LYS NZ
C A 0075 VAL O 2.666 H A 0035 HIS ND1
C A 0081 ILE O 2.748 C A 0082 SER OG
C A 0084 ASP O 2.535 H A 0052 LYS NZ
C A 0085 ILE O 2.592 H A 0052 LYS NZ
C A 0086 ASP O 3.007 C A 0080 THR OG1
C A 0087 CYS O 2.922 H A 0045 GLN NE2
C A 0089 ARG O 2.855 C A 0080 THR OG1
C A 0091 TYR O 2.675 H A 0044 ARG NH1
C A 0091 TYR O 2.750 H A 0044 ARG NH2
HB_SS 2.00 3.20 8
C A 0002 ASN ND2 2.812 H A 0046 THR OG1
H A 0032 ARG NH2 2.724 H A 0074 ASN OD1
H A 0033 ASP OD1 2.921 H A 0037 GLN NE2
C A 0043 ASP OD1 2.574 C A 0040 SER OG
C A 0043 ASP OD2 3.019 C A 0040 SER OG
H A 0044 ARG NH1 3.175 H A 0045 GLN OE1
H A 0072 LYS NZ 2.648 H A 0016 TYR OH
H A 0072 LYS NZ 2.739 H A 0068 SER OG
AROMATIC 0.00 8.00 2
H A 0044 ARG 6.289 H A 0035 HIS
H A 0072 LYS 4.507 H A 0016 TYR
SS_BOND 1.50 2.80 4
H A 0003 CYS SG 2.024 H A 0050 CYS SG
H A 0013 CYS SG 2.024 H A 0027 CYS SG
H A 0028 CYS SG 2.024 H A 0073 CYS SG
H A 0048 CYS SG 2.018 C A 0087 CYS SG