Complet list of 1ttx con file
Complete list of 1ttx.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 438
C A 0001 MET C 2.459 C A 0002 SER CA
C A 0001 MET C 3.687 C A 0002 SER C
C A 0001 MET C 3.182 C A 0002 SER CB
C A 0002 SER C 2.466 C A 0003 ILE CA
C A 0002 SER C 3.299 C A 0003 ILE C
C A 0002 SER C 3.652 C A 0003 ILE CB
C A 0002 SER C 3.772 C A 0003 ILE CG2
C A 0002 SER CB 3.501 H A 0050 PHE CD2
C A 0002 SER CB 3.545 H A 0050 PHE CE2
C A 0003 ILE C 2.478 C A 0004 THR CA
C A 0003 ILE C 3.138 C A 0004 THR C
C A 0003 ILE C 3.663 C A 0004 THR CB
C A 0003 ILE CG2 3.445 H A 0047 VAL CG1
C A 0003 ILE CG1 3.562 H A 0071 PHE CD1
C A 0003 ILE CG1 3.583 H A 0071 PHE CE1
C A 0003 ILE CD1 3.467 H A 0071 PHE CG
C A 0003 ILE CD1 3.556 H A 0071 PHE CD1
C A 0003 ILE CD1 3.639 H A 0071 PHE CD2
C A 0004 THR C 2.466 C A 0005 ASP CA
C A 0004 THR C 3.622 C A 0005 ASP C
C A 0004 THR C 3.313 C A 0005 ASP CB
C A 0005 ASP C 2.460 C A 0006 VAL CA
C A 0005 ASP C 3.350 C A 0006 VAL C
C A 0005 ASP C 3.623 C A 0006 VAL CB
C A 0006 VAL C 2.473 H A 0007 LEU CA
C A 0006 VAL C 3.684 H A 0007 LEU C
C A 0006 VAL C 2.965 H A 0007 LEU CB
C A 0006 VAL CG1 3.724 C A 0039 MET CE
H A 0007 LEU C 2.494 H A 0008 SER CA
H A 0007 LEU C 3.033 H A 0008 SER C
H A 0007 LEU C 3.746 H A 0008 SER CB
H A 0007 LEU CD2 3.773 H A 0011 ASP CG
H A 0008 SER C 2.457 H A 0009 ALA CA
H A 0008 SER C 2.968 H A 0009 ALA C
H A 0008 SER C 3.696 H A 0009 ALA CB
H A 0009 ALA C 2.432 H A 0010 ASP CA
H A 0009 ALA C 3.035 H A 0010 ASP C
H A 0009 ALA C 3.699 H A 0010 ASP CB
H A 0009 ALA CA 3.693 H A 0012 ILE CG1
H A 0009 ALA C 3.701 H A 0012 ILE CG1
H A 0010 ASP C 2.451 H A 0011 ASP CA
H A 0010 ASP C 3.033 H A 0011 ASP C
H A 0010 ASP C 3.715 H A 0011 ASP CB
H A 0011 ASP C 2.437 H A 0012 ILE CA
H A 0011 ASP C 3.064 H A 0012 ILE C
H A 0011 ASP C 3.721 H A 0012 ILE CB
H A 0011 ASP CB 3.617 H A 0034 SER CA
H A 0011 ASP CB 3.270 H A 0034 SER C
H A 0012 ILE C 2.439 H A 0013 ALA CA
H A 0012 ILE C 2.966 H A 0013 ALA C
H A 0012 ILE C 3.730 H A 0013 ALA CB
H A 0013 ALA C 2.439 H A 0014 ALA CA
H A 0013 ALA C 3.041 H A 0014 ALA C
H A 0013 ALA C 3.724 H A 0014 ALA CB
H A 0014 ALA C 2.496 H A 0015 ALA CA
H A 0014 ALA C 2.985 H A 0015 ALA C
H A 0014 ALA C 3.743 H A 0015 ALA CB
H A 0015 ALA CA 3.800 H A 0016 LEU CA
H A 0015 ALA C 2.475 H A 0016 LEU CA
H A 0015 ALA C 2.944 H A 0016 LEU C
H A 0015 ALA C 3.718 H A 0016 LEU CB
H A 0015 ALA CA 3.707 H A 0018 GLU CG
H A 0015 ALA CA 3.626 H A 0033 THR CG2
H A 0015 ALA CB 3.506 H A 0033 THR CG2
H A 0016 LEU C 2.439 H A 0017 GLN CA
H A 0016 LEU C 3.191 H A 0017 GLN C
H A 0016 LEU C 3.669 H A 0017 GLN CB
H A 0017 GLN C 2.435 H A 0018 GLU CA
H A 0017 GLN C 3.055 H A 0018 GLU C
H A 0017 GLN C 3.696 H A 0018 GLU CB
H A 0018 GLU C 2.471 H A 0019 CYS CA
H A 0018 GLU C 3.387 H A 0019 CYS C
H A 0018 GLU C 3.594 H A 0019 CYS CB
H A 0018 GLU CD 3.786 H A 0029 LYS CE
H A 0019 CYS C 2.454 C A 0020 ARG CA
H A 0019 CYS C 3.119 C A 0020 ARG C
H A 0019 CYS C 3.740 C A 0020 ARG CB
C A 0020 ARG CA 3.783 C A 0021 ASP CA
C A 0020 ARG C 2.455 C A 0021 ASP CA
C A 0020 ARG C 3.186 C A 0021 ASP C
C A 0020 ARG C 3.670 C A 0021 ASP CB
C A 0021 ASP CA 2.928 C A 0022 PRO CD
C A 0021 ASP C 2.452 C A 0022 PRO CA
C A 0021 ASP C 3.072 C A 0022 PRO C
C A 0021 ASP C 3.666 C A 0022 PRO CB
C A 0021 ASP C 3.668 C A 0022 PRO CG
C A 0021 ASP C 2.493 C A 0022 PRO CD
C A 0021 ASP CB 3.511 C A 0022 PRO CD
C A 0022 PRO C 2.502 C A 0023 ASP CA
C A 0022 PRO C 3.200 C A 0023 ASP C
C A 0022 PRO C 3.076 C A 0023 ASP CB
C A 0022 PRO C 3.569 C A 0023 ASP CG
C A 0023 ASP C 2.487 C A 0024 THR CA
C A 0023 ASP C 3.547 C A 0024 THR C
C A 0023 ASP C 3.524 C A 0024 THR CB
C A 0023 ASP CA 3.312 H A 0082 GLU CD
C A 0023 ASP C 3.627 H A 0082 GLU CD
C A 0024 THR C 2.457 C A 0025 PHE CA
C A 0024 THR C 3.211 C A 0025 PHE C
C A 0024 THR C 3.663 C A 0025 PHE CB
C A 0025 PHE C 2.444 H A 0026 GLU CA
C A 0025 PHE C 3.067 H A 0026 GLU C
C A 0025 PHE C 3.741 H A 0026 GLU CB
C A 0025 PHE CE1 3.791 H A 0030 PHE CB
C A 0025 PHE CE1 3.456 H A 0030 PHE CG
C A 0025 PHE CE1 3.734 H A 0030 PHE CD2
C A 0025 PHE CE2 3.686 H A 0030 PHE CD1
C A 0025 PHE CZ 3.349 H A 0030 PHE CG
C A 0025 PHE CZ 3.225 H A 0030 PHE CD1
C A 0025 PHE CZ 3.795 H A 0030 PHE CD2
C A 0025 PHE CZ 3.581 H A 0030 PHE CE1
C A 0025 PHE CB 3.785 H A 0082 GLU CB
C A 0025 PHE CB 3.373 H A 0082 GLU CD
H A 0026 GLU CA 2.911 H A 0027 PRO CD
H A 0026 GLU C 2.445 H A 0027 PRO CA
H A 0026 GLU C 3.126 H A 0027 PRO C
H A 0026 GLU C 3.652 H A 0027 PRO CB
H A 0026 GLU C 3.684 H A 0027 PRO CG
H A 0026 GLU C 2.482 H A 0027 PRO CD
H A 0026 GLU CB 3.581 H A 0027 PRO CD
H A 0026 GLU CB 3.381 H A 0029 LYS CB
H A 0027 PRO C 2.462 H A 0028 GLN CA
H A 0027 PRO C 2.971 H A 0028 GLN C
H A 0027 PRO C 3.731 H A 0028 GLN CB
H A 0027 PRO C 3.639 H A 0031 PHE CD2
H A 0027 PRO CB 3.395 H A 0089 ALA CB
H A 0027 PRO CG 3.230 H A 0089 ALA CB
H A 0028 GLN C 2.451 H A 0029 LYS CA
H A 0028 GLN C 2.918 H A 0029 LYS C
H A 0028 GLN C 3.726 H A 0029 LYS CB
H A 0029 LYS C 2.439 H A 0030 PHE CA
H A 0029 LYS C 2.990 H A 0030 PHE C
H A 0029 LYS C 3.724 H A 0030 PHE CB
H A 0030 PHE C 2.455 H A 0031 PHE CA
H A 0030 PHE C 3.023 H A 0031 PHE C
H A 0030 PHE C 3.737 H A 0031 PHE CB
H A 0030 PHE CE1 3.556 H A 0034 SER CB
H A 0030 PHE CZ 3.563 H A 0034 SER CB
H A 0030 PHE CZ 3.627 H A 0068 LEU CD1
H A 0031 PHE C 2.443 H A 0032 GLN CA
H A 0031 PHE C 3.061 H A 0032 GLN C
H A 0031 PHE C 3.704 H A 0032 GLN CB
H A 0031 PHE CE1 3.685 H A 0086 LEU CD2
H A 0031 PHE CZ 3.379 H A 0086 LEU CD2
H A 0031 PHE CE2 3.718 H A 0106 MET CB
H A 0031 PHE CD1 3.545 H A 0107 VAL CG2
H A 0031 PHE CE1 3.548 H A 0107 VAL CG2
H A 0032 GLN CA 3.795 H A 0033 THR CA
H A 0032 GLN C 2.446 H A 0033 THR CA
H A 0032 GLN C 3.072 H A 0033 THR C
H A 0032 GLN C 3.702 H A 0033 THR CB
H A 0033 THR C 2.490 H A 0034 SER CA
H A 0033 THR C 3.287 H A 0034 SER C
H A 0033 THR C 3.677 H A 0034 SER CB
H A 0034 SER C 2.456 C A 0035 GLY CA
H A 0034 SER C 3.251 C A 0035 GLY C
C A 0035 GLY C 2.472 C A 0036 LEU CA
C A 0035 GLY C 3.018 C A 0036 LEU C
C A 0035 GLY C 3.703 C A 0036 LEU CB
C A 0036 LEU C 2.461 C A 0037 SER CA
C A 0036 LEU C 3.154 C A 0037 SER C
C A 0036 LEU C 3.689 C A 0037 SER CB
C A 0036 LEU C 3.416 H A 0107 VAL CG1
C A 0036 LEU CB 3.790 H A 0107 VAL CG1
C A 0037 SER C 2.454 C A 0038 LYS CA
C A 0037 SER C 3.255 C A 0038 LYS C
C A 0037 SER C 3.661 C A 0038 LYS CB
C A 0038 LYS C 2.446 C A 0039 MET CA
C A 0038 LYS C 3.004 C A 0039 MET C
C A 0038 LYS C 3.724 C A 0039 MET CB
C A 0039 MET C 2.448 H A 0040 SER CA
C A 0039 MET C 3.157 H A 0040 SER C
C A 0039 MET C 3.689 H A 0040 SER CB
C A 0039 MET CB 3.722 H A 0044 VAL CG2
H A 0040 SER C 2.488 H A 0041 ALA CA
H A 0040 SER C 2.963 H A 0041 ALA C
H A 0040 SER C 3.713 H A 0041 ALA CB
H A 0041 ALA C 2.461 H A 0042 ASN CA
H A 0041 ALA C 2.978 H A 0042 ASN C
H A 0041 ALA C 3.737 H A 0042 ASN CB
H A 0042 ASN C 2.454 H A 0043 GLN CA
H A 0042 ASN C 3.000 H A 0043 GLN C
H A 0042 ASN C 3.740 H A 0043 GLN CB
H A 0043 GLN C 2.444 H A 0044 VAL CA
H A 0043 GLN C 2.975 H A 0044 VAL C
H A 0043 GLN C 3.673 H A 0044 VAL CB
H A 0044 VAL C 2.437 H A 0045 LYS CA
H A 0044 VAL C 3.032 H A 0045 LYS C
H A 0044 VAL C 3.700 H A 0045 LYS CB
H A 0044 VAL CA 3.752 H A 0047 VAL CG2
H A 0044 VAL C 3.727 H A 0047 VAL CG2
H A 0044 VAL CG1 3.726 H A 0048 PHE CE1
H A 0044 VAL CG1 3.490 H A 0048 PHE CE2
H A 0044 VAL CG1 3.032 H A 0048 PHE CZ
H A 0044 VAL CG1 3.527 H A 0107 VAL CG1
H A 0044 VAL CG2 3.537 H A 0107 VAL CG1
H A 0045 LYS C 2.454 H A 0046 ASP CA
H A 0045 LYS C 2.949 H A 0046 ASP C
H A 0045 LYS C 3.747 H A 0046 ASP CB
H A 0046 ASP C 2.425 H A 0047 VAL CA
H A 0046 ASP C 2.942 H A 0047 VAL C
H A 0046 ASP C 3.762 H A 0047 VAL CB
H A 0046 ASP C 3.646 H A 0050 PHE CE2
H A 0047 VAL C 2.446 H A 0048 PHE CA
H A 0047 VAL C 2.999 H A 0048 PHE C
H A 0047 VAL C 3.753 H A 0048 PHE CB
H A 0047 VAL CA 3.663 H A 0050 PHE CD2
H A 0048 PHE C 2.433 H A 0049 ARG CA
H A 0048 PHE C 2.949 H A 0049 ARG C
H A 0048 PHE C 3.752 H A 0049 ARG CB
H A 0048 PHE CE2 3.713 H A 0103 PHE C
H A 0048 PHE CE2 3.547 H A 0103 PHE CB
H A 0048 PHE CZ 3.546 H A 0103 PHE C
H A 0048 PHE CZ 3.404 H A 0103 PHE CB
H A 0048 PHE CE2 3.644 H A 0104 GLN CA
H A 0049 ARG C 2.429 H A 0050 PHE CA
H A 0049 ARG C 3.066 H A 0050 PHE C
H A 0049 ARG C 3.712 H A 0050 PHE CB
H A 0050 PHE C 2.457 H A 0051 ILE CA
H A 0050 PHE C 3.057 H A 0051 ILE C
H A 0050 PHE C 3.769 H A 0051 ILE CB
H A 0051 ILE C 2.465 H A 0052 ASP CA
H A 0051 ILE C 3.143 H A 0052 ASP C
H A 0051 ILE C 3.766 H A 0052 ASP CB
H A 0051 ILE CG2 3.565 C A 0059 LEU CD1
H A 0051 ILE CG2 3.446 H A 0067 PHE CD2
H A 0051 ILE CD1 3.498 H A 0071 PHE CE1
H A 0051 ILE CD1 3.715 H A 0071 PHE CZ
H A 0052 ASP C 2.484 C A 0053 ASN CA
H A 0052 ASP C 2.971 C A 0053 ASN C
H A 0052 ASP C 3.700 C A 0053 ASN CB
H A 0052 ASP CB 3.700 C A 0059 LEU CD1
C A 0053 ASN C 2.486 C A 0054 ASP CA
C A 0053 ASN C 3.130 C A 0054 ASP C
C A 0053 ASN C 3.715 C A 0054 ASP CB
C A 0054 ASP C 2.509 C A 0055 GLN CA
C A 0054 ASP C 3.149 C A 0055 GLN C
C A 0054 ASP C 3.207 C A 0055 GLN CB
C A 0054 ASP C 3.649 C A 0055 GLN CG
C A 0055 GLN C 2.467 C A 0056 SER CA
C A 0055 GLN C 3.182 C A 0056 SER C
C A 0055 GLN C 3.695 C A 0056 SER CB
C A 0056 SER C 2.452 C A 0057 GLY CA
C A 0056 SER C 3.255 C A 0057 GLY C
C A 0057 GLY C 2.498 C A 0058 TYR CA
C A 0057 GLY C 3.660 C A 0058 TYR C
C A 0057 GLY C 3.184 C A 0058 TYR CB
C A 0057 GLY C 3.637 C A 0058 TYR CG
C A 0058 TYR C 2.459 C A 0059 LEU CA
C A 0058 TYR C 3.331 C A 0059 LEU C
C A 0058 TYR C 3.599 C A 0059 LEU CB
C A 0058 TYR C 3.527 C A 0059 LEU CD2
C A 0058 TYR CD1 3.760 C A 0097 LYS C
C A 0058 TYR CD1 3.791 C A 0097 LYS CB
C A 0058 TYR CE1 3.770 C A 0097 LYS CG
C A 0058 TYR CZ 3.658 C A 0097 LYS CD
C A 0058 TYR CD1 3.683 C A 0098 ILE C
C A 0059 LEU C 2.478 H A 0060 ASP CA
C A 0059 LEU C 3.041 H A 0060 ASP C
C A 0059 LEU C 3.714 H A 0060 ASP CB
C A 0059 LEU CB 3.579 H A 0103 PHE CE2
C A 0059 LEU CG 3.753 H A 0103 PHE CE2
H A 0060 ASP C 2.475 H A 0061 GLU CA
H A 0060 ASP C 2.978 H A 0061 GLU C
H A 0060 ASP C 3.756 H A 0061 GLU CB
H A 0061 GLU C 2.422 H A 0062 GLU CA
H A 0061 GLU C 3.089 H A 0062 GLU C
H A 0061 GLU C 3.693 H A 0062 GLU CB
H A 0062 GLU C 2.444 H A 0063 GLU CA
H A 0062 GLU C 3.136 H A 0063 GLU C
H A 0062 GLU C 3.704 H A 0063 GLU CB
H A 0063 GLU C 2.467 H A 0064 LEU CA
H A 0063 GLU C 2.995 H A 0064 LEU C
H A 0063 GLU C 3.735 H A 0064 LEU CB
H A 0063 GLU CA 3.680 H A 0066 PHE CE2
H A 0063 GLU CA 3.686 H A 0066 PHE CZ
H A 0064 LEU C 2.465 H A 0065 LYS CA
H A 0064 LEU C 3.034 H A 0065 LYS C
H A 0064 LEU C 3.745 H A 0065 LYS CB
H A 0064 LEU CD1 3.596 H A 0067 PHE CB
H A 0064 LEU CD1 3.752 H A 0086 LEU CD1
H A 0065 LYS C 2.467 H A 0066 PHE CA
H A 0065 LYS C 3.602 H A 0066 PHE C
H A 0065 LYS C 3.412 H A 0066 PHE CB
H A 0065 LYS C 3.610 C A 0077 GLU CB
H A 0066 PHE C 2.469 H A 0067 PHE CA
H A 0066 PHE C 3.026 H A 0067 PHE C
H A 0066 PHE C 3.731 H A 0067 PHE CB
H A 0066 PHE CA 3.607 H A 0069 GLN CG
H A 0067 PHE C 2.460 H A 0068 LEU CA
H A 0067 PHE C 3.270 H A 0068 LEU C
H A 0067 PHE C 3.670 H A 0068 LEU CB
H A 0067 PHE CE2 3.723 H A 0103 PHE CZ
H A 0068 LEU C 2.487 H A 0069 GLN CA
H A 0068 LEU C 3.045 H A 0069 GLN C
H A 0068 LEU C 3.764 H A 0069 GLN CB
H A 0068 LEU CD1 3.288 H A 0071 PHE CD2
H A 0068 LEU CD1 3.643 H A 0071 PHE CE2
H A 0068 LEU CB 3.629 C A 0075 ALA CB
H A 0068 LEU CA 3.695 C A 0077 GLU CD
H A 0068 LEU CB 3.190 C A 0077 GLU CD
H A 0069 GLN C 2.453 H A 0070 LYS CA
H A 0069 GLN C 3.230 H A 0070 LYS C
H A 0069 GLN C 3.678 H A 0070 LYS CB
H A 0069 GLN CG 3.730 C A 0077 GLU CG
H A 0070 LYS C 2.476 H A 0071 PHE CA
H A 0070 LYS C 3.361 H A 0071 PHE C
H A 0070 LYS C 3.643 H A 0071 PHE CB
H A 0070 LYS C 3.584 H A 0071 PHE CD1
H A 0071 PHE C 2.489 C A 0072 GLU CA
H A 0071 PHE C 3.424 C A 0072 GLU C
H A 0071 PHE C 3.572 C A 0072 GLU CB
C A 0072 GLU C 2.454 C A 0073 SER CA
C A 0072 GLU C 3.236 C A 0073 SER C
C A 0072 GLU C 3.664 C A 0073 SER CB
C A 0073 SER C 2.473 C A 0074 GLY CA
C A 0073 SER C 3.460 C A 0074 GLY C
C A 0074 GLY CA 3.796 C A 0075 ALA CA
C A 0074 GLY C 2.439 C A 0075 ALA CA
C A 0074 GLY C 3.119 C A 0075 ALA C
C A 0074 GLY C 3.678 C A 0075 ALA CB
C A 0075 ALA C 2.448 C A 0076 ARG CA
C A 0075 ALA C 3.285 C A 0076 ARG C
C A 0075 ALA C 3.644 C A 0076 ARG CB
C A 0076 ARG C 2.492 C A 0077 GLU CA
C A 0076 ARG C 3.026 C A 0077 GLU C
C A 0076 ARG C 3.729 C A 0077 GLU CB
C A 0077 GLU C 2.468 C A 0078 LEU CA
C A 0077 GLU C 2.998 C A 0078 LEU C
C A 0077 GLU C 3.753 C A 0078 LEU CB
C A 0078 LEU C 2.454 H A 0079 THR CA
C A 0078 LEU C 3.078 H A 0079 THR C
C A 0078 LEU C 3.756 H A 0079 THR CB
H A 0079 THR CA 3.799 H A 0080 GLU CA
H A 0079 THR C 2.438 H A 0080 GLU CA
H A 0079 THR C 2.977 H A 0080 GLU C
H A 0079 THR C 3.742 H A 0080 GLU CB
H A 0079 THR CB 3.791 H A 0082 GLU CG
H A 0079 THR CG2 3.522 H A 0082 GLU CG
H A 0080 GLU C 2.462 H A 0081 SER CA
H A 0080 GLU C 2.994 H A 0081 SER C
H A 0080 GLU C 3.715 H A 0081 SER CB
H A 0081 SER C 2.460 H A 0082 GLU CA
H A 0081 SER C 3.018 H A 0082 GLU C
H A 0081 SER C 3.714 H A 0082 GLU CB
H A 0082 GLU C 2.449 H A 0083 THR CA
H A 0082 GLU C 2.966 H A 0083 THR C
H A 0082 GLU C 3.734 H A 0083 THR CB
H A 0083 THR C 2.462 H A 0084 LYS CA
H A 0083 THR C 3.166 H A 0084 LYS C
H A 0083 THR C 3.710 H A 0084 LYS CB
H A 0084 LYS C 2.452 H A 0085 SER CA
H A 0084 LYS C 3.016 H A 0085 SER C
H A 0084 LYS C 3.721 H A 0085 SER CB
H A 0085 SER C 2.452 H A 0086 LEU CA
H A 0085 SER C 2.999 H A 0086 LEU C
H A 0085 SER C 3.718 H A 0086 LEU CB
H A 0086 LEU C 2.465 H A 0087 MET CA
H A 0086 LEU C 2.949 H A 0087 MET C
H A 0086 LEU C 3.740 H A 0087 MET CB
H A 0086 LEU CD1 3.673 H A 0103 PHE CE1
H A 0086 LEU CD1 3.643 H A 0103 PHE CZ
H A 0087 MET C 2.484 H A 0088 ALA CA
H A 0087 MET C 3.005 H A 0088 ALA C
H A 0087 MET C 3.725 H A 0088 ALA CB
H A 0087 MET CG 3.546 C A 0098 ILE CD1
H A 0088 ALA C 2.435 H A 0089 ALA CA
H A 0088 ALA C 3.158 H A 0089 ALA C
H A 0088 ALA C 3.669 H A 0089 ALA CB
H A 0089 ALA C 2.450 H A 0090 ALA CA
H A 0089 ALA C 2.979 H A 0090 ALA C
H A 0089 ALA C 3.709 H A 0090 ALA CB
H A 0089 ALA C 3.769 H A 0106 MET CG
H A 0090 ALA C 2.446 H A 0091 ASP CA
H A 0090 ALA C 3.165 H A 0091 ASP C
H A 0090 ALA C 3.695 H A 0091 ASP CB
H A 0090 ALA CB 3.720 H A 0103 PHE CE1
H A 0091 ASP C 2.452 C A 0092 ASN CA
H A 0091 ASP C 3.188 C A 0092 ASN C
H A 0091 ASP C 3.704 C A 0092 ASN CB
H A 0091 ASP CG 3.518 C A 0096 GLY CA
H A 0091 ASP CB 3.743 C A 0098 ILE CG1
C A 0092 ASN C 2.500 C A 0093 ASP CA
C A 0092 ASN C 3.547 C A 0093 ASP C
C A 0092 ASN C 3.548 C A 0093 ASP CB
C A 0093 ASP CA 3.777 C A 0094 GLY CA
C A 0093 ASP C 2.457 C A 0094 GLY CA
C A 0093 ASP C 3.285 C A 0094 GLY C
C A 0093 ASP CB 3.689 C A 0095 ASP CG
C A 0094 GLY C 2.483 C A 0095 ASP CA
C A 0094 GLY C 3.562 C A 0095 ASP C
C A 0094 GLY C 3.473 C A 0095 ASP CB
C A 0095 ASP C 2.474 C A 0096 GLY CA
C A 0095 ASP C 3.499 C A 0096 GLY C
C A 0095 ASP CG 3.495 C A 0097 LYS CG
C A 0096 GLY C 2.447 C A 0097 LYS CA
C A 0096 GLY C 3.034 C A 0097 LYS C
C A 0096 GLY C 3.723 C A 0097 LYS CB
C A 0097 LYS C 2.463 C A 0098 ILE CA
C A 0097 LYS C 3.375 C A 0098 ILE C
C A 0097 LYS C 3.589 C A 0098 ILE CB
C A 0097 LYS C 3.752 C A 0098 ILE CG1
C A 0098 ILE C 2.444 H A 0099 GLY CA
C A 0098 ILE C 3.141 H A 0099 GLY C
C A 0098 ILE CA 3.756 H A 0102 GLU CD
C A 0098 ILE CG2 3.730 H A 0103 PHE CG
C A 0098 ILE CG2 3.233 H A 0103 PHE CD2
C A 0098 ILE CG2 3.442 H A 0103 PHE CE2
H A 0099 GLY C 2.453 H A 0100 ALA CA
H A 0099 GLY C 2.971 H A 0100 ALA C
H A 0099 GLY C 3.726 H A 0100 ALA CB
H A 0100 ALA C 2.463 H A 0101 GLU CA
H A 0100 ALA C 2.997 H A 0101 GLU C
H A 0100 ALA C 3.730 H A 0101 GLU CB
H A 0101 GLU C 2.468 H A 0102 GLU CA
H A 0101 GLU C 2.972 H A 0102 GLU C
H A 0101 GLU C 3.728 H A 0102 GLU CB
H A 0102 GLU C 2.425 H A 0103 PHE CA
H A 0102 GLU C 3.012 H A 0103 PHE C
H A 0102 GLU C 3.724 H A 0103 PHE CB
H A 0103 PHE C 2.461 H A 0104 GLN CA
H A 0103 PHE C 2.967 H A 0104 GLN C
H A 0103 PHE C 3.748 H A 0104 GLN CB
H A 0104 GLN C 2.464 H A 0105 GLU CA
H A 0104 GLN C 2.932 H A 0105 GLU C
H A 0104 GLN C 3.727 H A 0105 GLU CB
H A 0105 GLU C 2.423 H A 0106 MET CA
H A 0105 GLU C 3.002 H A 0106 MET C
H A 0105 GLU C 3.723 H A 0106 MET CB
H A 0106 MET C 2.440 H A 0107 VAL CA
H A 0106 MET C 3.051 H A 0107 VAL C
H A 0106 MET C 3.710 H A 0107 VAL CB
H A 0107 VAL C 2.469 H A 0108 HIS CA
H A 0107 VAL C 3.080 H A 0108 HIS C
H A 0107 VAL C 3.722 H A 0108 HIS CB
H A 0108 HIS C 2.453 H A 0109 SER CA
H A 0108 HIS C 3.115 H A 0109 SER C
H A 0108 HIS C 3.720 H A 0109 SER CB
CHARGE_ATTR 2.00 12.00 91
H A 0010 ASP OD2 11.61 C A 0038 LYS NZ
H A 0011 ASP OD2 11.95 H A 0029 LYS NZ
H A 0011 ASP OD1 10.03 C A 0038 LYS NZ
H A 0011 ASP OD2 8.241 C A 0038 LYS NZ
H A 0018 GLU OE1 3.811 H A 0029 LYS NZ
H A 0018 GLU OE2 5.359 H A 0029 LYS NZ
H A 0018 GLU OE1 11.81 C A 0076 ARG NH1
H A 0018 GLU OE1 9.587 C A 0076 ARG NH2
H A 0018 GLU OE2 10.12 C A 0076 ARG NH1
H A 0018 GLU OE2 7.982 C A 0076 ARG NH2
C A 0021 ASP OD1 7.181 C A 0020 ARG NH1
C A 0021 ASP OD1 6.423 C A 0020 ARG NH2
C A 0021 ASP OD2 7.671 C A 0020 ARG NH1
C A 0021 ASP OD2 6.979 C A 0020 ARG NH2
C A 0021 ASP OD1 7.980 C A 0076 ARG NH1
C A 0021 ASP OD1 7.231 C A 0076 ARG NH2
C A 0021 ASP OD2 8.378 C A 0076 ARG NH1
C A 0021 ASP OD2 7.034 C A 0076 ARG NH2
C A 0023 ASP OD1 6.646 C A 0076 ARG NH1
C A 0023 ASP OD1 8.061 C A 0076 ARG NH2
C A 0023 ASP OD2 6.601 C A 0076 ARG NH1
C A 0023 ASP OD2 7.969 C A 0076 ARG NH2
C A 0023 ASP OD1 10.68 H A 0084 LYS NZ
H A 0026 GLU OE1 6.853 H A 0029 LYS NZ
H A 0026 GLU OE2 8.767 H A 0029 LYS NZ
H A 0026 GLU OE1 12.00 C A 0076 ARG NH2
H A 0046 ASP OD1 8.894 H A 0045 LYS NZ
H A 0046 ASP OD2 11.03 H A 0045 LYS NZ
H A 0046 ASP OD1 6.932 H A 0049 ARG NH1
H A 0046 ASP OD1 7.772 H A 0049 ARG NH2
H A 0046 ASP OD2 8.038 H A 0049 ARG NH1
H A 0046 ASP OD2 8.338 H A 0049 ARG NH2
H A 0052 ASP OD2 11.90 H A 0045 LYS NZ
H A 0052 ASP OD1 10.18 H A 0049 ARG NH1
H A 0052 ASP OD1 10.55 H A 0049 ARG NH2
H A 0052 ASP OD2 9.296 H A 0049 ARG NH1
H A 0052 ASP OD2 10.04 H A 0049 ARG NH2
H A 0052 ASP OD1 8.902 H A 0070 LYS NZ
H A 0052 ASP OD2 10.44 H A 0070 LYS NZ
C A 0054 ASP OD1 11.31 H A 0065 LYS NZ
C A 0054 ASP OD2 10.89 H A 0065 LYS NZ
C A 0054 ASP OD1 8.134 H A 0070 LYS NZ
C A 0054 ASP OD2 9.918 H A 0070 LYS NZ
H A 0060 ASP OD1 9.476 C A 0097 LYS NZ
H A 0060 ASP OD2 8.202 C A 0097 LYS NZ
H A 0061 GLU OE1 10.43 H A 0065 LYS NZ
H A 0061 GLU OE2 11.49 H A 0065 LYS NZ
H A 0061 GLU OE1 4.099 H A 0084 LYS NZ
H A 0061 GLU OE2 4.928 H A 0084 LYS NZ
H A 0062 GLU OE1 5.809 H A 0065 LYS NZ
H A 0062 GLU OE2 3.828 H A 0065 LYS NZ
H A 0062 GLU OE1 10.47 H A 0084 LYS NZ
H A 0062 GLU OE2 10.07 H A 0084 LYS NZ
H A 0063 GLU OE1 11.92 H A 0065 LYS NZ
H A 0063 GLU OE2 11.93 H A 0065 LYS NZ
H A 0063 GLU OE1 10.62 H A 0070 LYS NZ
H A 0063 GLU OE2 11.41 H A 0070 LYS NZ
C A 0072 GLU OE1 11.22 C A 0020 ARG NH1
C A 0072 GLU OE2 11.15 C A 0020 ARG NH1
C A 0077 GLU OE1 11.57 H A 0065 LYS NZ
C A 0077 GLU OE1 11.14 H A 0070 LYS NZ
C A 0077 GLU OE1 10.22 C A 0076 ARG NH1
C A 0077 GLU OE1 10.72 C A 0076 ARG NH2
C A 0077 GLU OE2 8.462 C A 0076 ARG NH1
C A 0077 GLU OE2 8.971 C A 0076 ARG NH2
H A 0080 GLU OE1 9.323 H A 0065 LYS NZ
H A 0080 GLU OE2 7.941 H A 0065 LYS NZ
H A 0080 GLU OE1 2.588 H A 0084 LYS NZ
H A 0080 GLU OE2 4.718 H A 0084 LYS NZ
H A 0082 GLU OE2 10.09 C A 0020 ARG NH1
H A 0082 GLU OE2 11.37 C A 0020 ARG NH2
H A 0082 GLU OE1 4.586 C A 0076 ARG NH1
H A 0082 GLU OE1 4.900 C A 0076 ARG NH2
H A 0082 GLU OE2 2.566 C A 0076 ARG NH1
H A 0082 GLU OE2 3.096 C A 0076 ARG NH2
H A 0091 ASP OD1 6.882 C A 0097 LYS NZ
H A 0091 ASP OD2 7.714 C A 0097 LYS NZ
C A 0093 ASP OD1 6.250 C A 0097 LYS NZ
C A 0093 ASP OD2 5.210 C A 0097 LYS NZ
C A 0095 ASP OD1 4.617 C A 0097 LYS NZ
C A 0095 ASP OD2 2.597 C A 0097 LYS NZ
H A 0101 GLU OE1 5.994 H A 0045 LYS NZ
H A 0101 GLU OE2 7.540 H A 0045 LYS NZ
H A 0101 GLU OE1 11.69 C A 0097 LYS NZ
H A 0102 GLU OE1 7.227 C A 0097 LYS NZ
H A 0102 GLU OE2 5.834 C A 0097 LYS NZ
H A 0105 GLU OE2 11.92 H A 0045 LYS NZ
H A 0105 GLU OE1 8.713 H A 0108 HIS ND1
H A 0105 GLU OE1 7.917 H A 0108 HIS NE2
H A 0105 GLU OE2 6.647 H A 0108 HIS ND1
H A 0105 GLU OE2 5.827 H A 0108 HIS NE2
CHARGE_REPU 2.00 12.00 180
C A 0005 ASP OD1 11.26 H A 0010 ASP OD1
C A 0005 ASP OD1 11.11 H A 0011 ASP OD1
H A 0010 ASP OD1 6.403 H A 0011 ASP OD1
H A 0010 ASP OD1 7.524 H A 0011 ASP OD2
H A 0010 ASP OD2 5.025 H A 0011 ASP OD1
H A 0010 ASP OD2 5.648 H A 0011 ASP OD2
H A 0011 ASP OD2 11.10 H A 0018 GLU OE1
H A 0011 ASP OD2 10.96 H A 0018 GLU OE2
H A 0018 GLU OE1 10.17 C A 0021 ASP OD2
H A 0018 GLU OE2 11.77 C A 0021 ASP OD1
H A 0018 GLU OE2 10.04 C A 0021 ASP OD2
H A 0018 GLU OE1 8.083 H A 0026 GLU OE1
H A 0018 GLU OE1 9.917 H A 0026 GLU OE2
H A 0018 GLU OE2 7.802 H A 0026 GLU OE1
H A 0018 GLU OE2 9.314 H A 0026 GLU OE2
H A 0018 GLU OE1 11.28 H A 0082 GLU OE1
H A 0018 GLU OE1 11.15 H A 0082 GLU OE2
H A 0018 GLU OE2 9.481 H A 0082 GLU OE1
H A 0018 GLU OE2 9.441 H A 0082 GLU OE2
C A 0020 ARG NH1 7.861 C A 0076 ARG NH1
C A 0020 ARG NH1 7.699 C A 0076 ARG NH2
C A 0020 ARG NH2 9.404 C A 0076 ARG NH1
C A 0020 ARG NH2 9.036 C A 0076 ARG NH2
C A 0021 ASP OD1 10.79 C A 0023 ASP OD1
C A 0021 ASP OD1 9.221 C A 0023 ASP OD2
C A 0021 ASP OD2 11.79 C A 0023 ASP OD1
C A 0021 ASP OD2 10.52 C A 0023 ASP OD2
C A 0021 ASP OD1 10.36 H A 0082 GLU OE1
C A 0021 ASP OD1 8.528 H A 0082 GLU OE2
C A 0021 ASP OD2 10.42 H A 0082 GLU OE1
C A 0021 ASP OD2 8.751 H A 0082 GLU OE2
C A 0023 ASP OD1 10.01 H A 0080 GLU OE1
C A 0023 ASP OD1 10.80 H A 0080 GLU OE2
C A 0023 ASP OD2 11.65 H A 0080 GLU OE1
C A 0023 ASP OD1 5.093 H A 0082 GLU OE1
C A 0023 ASP OD1 5.218 H A 0082 GLU OE2
C A 0023 ASP OD2 6.276 H A 0082 GLU OE1
C A 0023 ASP OD2 5.669 H A 0082 GLU OE2
H A 0026 GLU OE1 10.11 H A 0082 GLU OE1
H A 0026 GLU OE1 11.34 H A 0082 GLU OE2
H A 0026 GLU OE2 10.17 H A 0082 GLU OE1
H A 0026 GLU OE2 11.75 H A 0082 GLU OE2
H A 0045 LYS NZ 7.269 H A 0049 ARG NH1
H A 0045 LYS NZ 9.525 H A 0049 ARG NH2
H A 0045 LYS NZ 11.81 H A 0108 HIS ND1
H A 0052 ASP OD1 3.848 C A 0054 ASP OD1
H A 0052 ASP OD1 5.394 C A 0054 ASP OD2
H A 0052 ASP OD2 5.877 C A 0054 ASP OD1
H A 0052 ASP OD2 7.218 C A 0054 ASP OD2
H A 0052 ASP OD1 5.959 H A 0060 ASP OD1
H A 0052 ASP OD1 8.151 H A 0060 ASP OD2
H A 0052 ASP OD2 5.492 H A 0060 ASP OD1
H A 0052 ASP OD2 7.595 H A 0060 ASP OD2
H A 0052 ASP OD1 3.425 H A 0063 GLU OE1
H A 0052 ASP OD1 3.773 H A 0063 GLU OE2
H A 0052 ASP OD2 4.004 H A 0063 GLU OE1
H A 0052 ASP OD2 4.590 H A 0063 GLU OE2
H A 0052 ASP OD2 11.01 H A 0102 GLU OE2
C A 0054 ASP OD1 7.205 H A 0060 ASP OD1
C A 0054 ASP OD1 9.110 H A 0060 ASP OD2
C A 0054 ASP OD2 7.493 H A 0060 ASP OD1
C A 0054 ASP OD2 9.047 H A 0060 ASP OD2
C A 0054 ASP OD1 10.38 H A 0062 GLU OE1
C A 0054 ASP OD1 11.17 H A 0062 GLU OE2
C A 0054 ASP OD2 9.387 H A 0062 GLU OE1
C A 0054 ASP OD2 10.32 H A 0062 GLU OE2
C A 0054 ASP OD1 4.288 H A 0063 GLU OE1
C A 0054 ASP OD1 3.857 H A 0063 GLU OE2
C A 0054 ASP OD2 5.394 H A 0063 GLU OE1
C A 0054 ASP OD2 4.091 H A 0063 GLU OE2
H A 0060 ASP OD1 10.76 H A 0061 GLU OE1
H A 0060 ASP OD1 10.21 H A 0061 GLU OE2
H A 0060 ASP OD2 10.22 H A 0061 GLU OE1
H A 0060 ASP OD2 9.245 H A 0061 GLU OE2
H A 0060 ASP OD1 9.547 H A 0062 GLU OE1
H A 0060 ASP OD1 11.26 H A 0062 GLU OE2
H A 0060 ASP OD2 9.152 H A 0062 GLU OE1
H A 0060 ASP OD2 11.08 H A 0062 GLU OE2
H A 0060 ASP OD1 3.475 H A 0063 GLU OE1
H A 0060 ASP OD1 3.484 H A 0063 GLU OE2
H A 0060 ASP OD2 5.589 H A 0063 GLU OE1
H A 0060 ASP OD2 5.334 H A 0063 GLU OE2
H A 0060 ASP OD1 10.10 H A 0091 ASP OD1
H A 0060 ASP OD2 9.521 H A 0091 ASP OD1
H A 0060 ASP OD2 11.21 H A 0091 ASP OD2
H A 0060 ASP OD1 11.76 C A 0093 ASP OD2
H A 0060 ASP OD2 11.09 C A 0093 ASP OD2
H A 0060 ASP OD1 10.18 C A 0095 ASP OD1
H A 0060 ASP OD1 10.16 C A 0095 ASP OD2
H A 0060 ASP OD2 9.137 C A 0095 ASP OD1
H A 0060 ASP OD2 8.925 C A 0095 ASP OD2
H A 0060 ASP OD1 11.00 H A 0102 GLU OE1
H A 0060 ASP OD1 9.583 H A 0102 GLU OE2
H A 0060 ASP OD2 10.84 H A 0102 GLU OE1
H A 0060 ASP OD2 9.449 H A 0102 GLU OE2
H A 0061 GLU OE1 9.212 H A 0062 GLU OE1
H A 0061 GLU OE1 9.413 H A 0062 GLU OE2
H A 0061 GLU OE2 9.105 H A 0062 GLU OE1
H A 0061 GLU OE2 9.740 H A 0062 GLU OE2
H A 0061 GLU OE1 11.37 H A 0063 GLU OE1
H A 0061 GLU OE2 11.50 H A 0063 GLU OE1
H A 0061 GLU OE1 11.33 C A 0077 GLU OE1
H A 0061 GLU OE1 5.734 H A 0080 GLU OE1
H A 0061 GLU OE1 7.361 H A 0080 GLU OE2
H A 0061 GLU OE2 6.946 H A 0080 GLU OE1
H A 0061 GLU OE2 8.567 H A 0080 GLU OE2
H A 0061 GLU OE1 9.731 H A 0091 ASP OD1
H A 0061 GLU OE1 10.15 H A 0091 ASP OD2
H A 0061 GLU OE2 8.922 H A 0091 ASP OD1
H A 0061 GLU OE2 9.204 H A 0091 ASP OD2
H A 0061 GLU OE1 10.90 C A 0095 ASP OD1
H A 0061 GLU OE2 9.593 C A 0095 ASP OD1
H A 0061 GLU OE2 10.90 C A 0095 ASP OD2
H A 0061 GLU OE2 11.90 H A 0102 GLU OE1
H A 0062 GLU OE1 9.819 H A 0063 GLU OE1
H A 0062 GLU OE1 9.226 H A 0063 GLU OE2
H A 0062 GLU OE2 11.04 H A 0063 GLU OE1
H A 0062 GLU OE2 10.66 H A 0063 GLU OE2
H A 0062 GLU OE1 10.13 H A 0080 GLU OE1
H A 0062 GLU OE1 9.587 H A 0080 GLU OE2
H A 0062 GLU OE2 9.193 H A 0080 GLU OE1
H A 0062 GLU OE2 8.237 H A 0080 GLU OE2
H A 0063 GLU OE1 11.78 C A 0077 GLU OE1
H A 0063 GLU OE1 11.90 H A 0091 ASP OD1
H A 0063 GLU OE1 11.33 H A 0102 GLU OE2
H A 0065 LYS NZ 10.85 H A 0084 LYS NZ
C A 0072 GLU OE1 10.23 C A 0077 GLU OE1
C A 0072 GLU OE1 8.697 C A 0077 GLU OE2
C A 0072 GLU OE2 11.75 C A 0077 GLU OE1
C A 0072 GLU OE2 10.18 C A 0077 GLU OE2
C A 0077 GLU OE1 10.38 H A 0082 GLU OE1
C A 0077 GLU OE1 10.69 H A 0082 GLU OE2
C A 0077 GLU OE2 9.444 H A 0082 GLU OE1
C A 0077 GLU OE2 9.327 H A 0082 GLU OE2
H A 0080 GLU OE1 11.94 H A 0082 GLU OE1
H A 0091 ASP OD1 5.975 C A 0093 ASP OD1
H A 0091 ASP OD1 4.058 C A 0093 ASP OD2
H A 0091 ASP OD2 5.734 C A 0093 ASP OD1
H A 0091 ASP OD2 4.479 C A 0093 ASP OD2
H A 0091 ASP OD1 2.686 C A 0095 ASP OD1
H A 0091 ASP OD1 4.741 C A 0095 ASP OD2
H A 0091 ASP OD2 3.119 C A 0095 ASP OD1
H A 0091 ASP OD2 5.197 C A 0095 ASP OD2
H A 0091 ASP OD1 3.165 H A 0102 GLU OE1
H A 0091 ASP OD1 4.074 H A 0102 GLU OE2
H A 0091 ASP OD2 4.453 H A 0102 GLU OE1
H A 0091 ASP OD2 5.756 H A 0102 GLU OE2
H A 0091 ASP OD1 11.78 H A 0105 GLU OE1
H A 0091 ASP OD2 11.97 H A 0105 GLU OE1
C A 0093 ASP OD1 4.869 C A 0095 ASP OD1
C A 0093 ASP OD1 4.780 C A 0095 ASP OD2
C A 0093 ASP OD2 3.172 C A 0095 ASP OD1
C A 0093 ASP OD2 3.514 C A 0095 ASP OD2
C A 0093 ASP OD1 10.49 H A 0101 GLU OE1
C A 0093 ASP OD1 9.634 H A 0101 GLU OE2
C A 0093 ASP OD2 10.20 H A 0101 GLU OE1
C A 0093 ASP OD2 9.733 H A 0101 GLU OE2
C A 0093 ASP OD1 4.811 H A 0102 GLU OE1
C A 0093 ASP OD1 5.155 H A 0102 GLU OE2
C A 0093 ASP OD2 3.053 H A 0102 GLU OE1
C A 0093 ASP OD2 3.188 H A 0102 GLU OE2
C A 0093 ASP OD1 9.937 H A 0105 GLU OE1
C A 0093 ASP OD1 11.77 H A 0105 GLU OE2
C A 0093 ASP OD2 10.32 H A 0105 GLU OE1
C A 0095 ASP OD1 4.396 H A 0102 GLU OE1
C A 0095 ASP OD1 4.432 H A 0102 GLU OE2
C A 0095 ASP OD2 5.637 H A 0102 GLU OE1
C A 0095 ASP OD2 4.956 H A 0102 GLU OE2
H A 0101 GLU OE1 9.755 H A 0102 GLU OE1
H A 0101 GLU OE1 8.667 H A 0102 GLU OE2
H A 0101 GLU OE2 9.426 H A 0102 GLU OE1
H A 0101 GLU OE2 8.745 H A 0102 GLU OE2
H A 0101 GLU OE1 9.960 H A 0105 GLU OE1
H A 0101 GLU OE1 9.762 H A 0105 GLU OE2
H A 0101 GLU OE2 8.213 H A 0105 GLU OE1
H A 0101 GLU OE2 8.126 H A 0105 GLU OE2
H A 0102 GLU OE1 9.072 H A 0105 GLU OE1
H A 0102 GLU OE1 10.55 H A 0105 GLU OE2
H A 0102 GLU OE2 10.24 H A 0105 GLU OE1
H A 0102 GLU OE2 11.49 H A 0105 GLU OE2
HB_MM 2.00 3.20 205
C A 0002 SER N 2.249 C A 0001 MET O
C A 0003 ILE N 2.249 C A 0002 SER O
C A 0004 THR N 2.254 C A 0003 ILE O
C A 0005 ASP N 3.054 C A 0003 ILE O
C A 0005 ASP N 2.260 C A 0004 THR O
C A 0006 VAL N 3.113 C A 0003 ILE O
C A 0006 VAL N 2.246 C A 0005 ASP O
H A 0007 LEU N 2.261 C A 0006 VAL O
H A 0008 SER N 2.273 H A 0007 LEU O
H A 0009 ALA N 2.760 H A 0007 LEU O
H A 0009 ALA N 2.234 H A 0008 SER O
H A 0010 ASP N 2.885 H A 0007 LEU O
H A 0010 ASP N 2.245 H A 0009 ALA O
H A 0011 ASP N 2.986 H A 0008 SER O
H A 0011 ASP N 2.245 H A 0010 ASP O
H A 0012 ILE N 2.746 H A 0008 SER O
H A 0012 ILE N 2.234 H A 0011 ASP O
H A 0013 ALA N 3.003 H A 0009 ALA O
H A 0013 ALA N 3.136 H A 0010 ASP O
H A 0013 ALA N 2.244 H A 0012 ILE O
H A 0014 ALA N 2.895 H A 0010 ASP O
H A 0014 ALA N 3.166 H A 0011 ASP O
H A 0014 ALA N 2.246 H A 0013 ALA O
H A 0015 ALA N 2.790 H A 0011 ASP O
H A 0015 ALA N 3.162 H A 0012 ILE O
H A 0015 ALA N 2.253 H A 0014 ALA O
H A 0016 LEU N 2.770 H A 0012 ILE O
H A 0016 LEU N 3.118 H A 0014 ALA O
H A 0016 LEU N 2.261 H A 0015 ALA O
H A 0017 GLN N 2.802 H A 0014 ALA O
H A 0017 GLN N 2.251 H A 0016 LEU O
H A 0018 GLU N 2.832 H A 0014 ALA O
H A 0018 GLU N 2.244 H A 0017 GLN O
H A 0019 CYS N 2.844 H A 0015 ALA O
H A 0019 CYS N 2.248 H A 0018 GLU O
C A 0020 ARG N 3.124 H A 0017 GLN O
C A 0020 ARG N 2.247 H A 0019 CYS O
C A 0021 ASP N 2.257 C A 0020 ARG O
C A 0022 PRO N 2.258 C A 0021 ASP O
C A 0023 ASP N 2.267 C A 0022 PRO O
C A 0024 THR N 2.253 C A 0023 ASP O
C A 0025 PHE N 2.228 C A 0024 THR O
H A 0026 GLU N 2.889 C A 0024 THR O
H A 0026 GLU N 2.242 C A 0025 PHE O
H A 0027 PRO N 2.247 H A 0026 GLU O
H A 0028 GLN N 2.245 H A 0027 PRO O
H A 0029 LYS N 2.261 H A 0028 GLN O
H A 0030 PHE N 2.852 H A 0026 GLU O
H A 0030 PHE N 2.977 H A 0027 PRO O
H A 0030 PHE N 2.249 H A 0029 LYS O
H A 0031 PHE N 2.803 H A 0027 PRO O
H A 0031 PHE N 2.232 H A 0030 PHE O
H A 0032 GLN N 2.929 H A 0028 GLN O
H A 0032 GLN N 3.164 H A 0029 LYS O
H A 0032 GLN N 3.153 H A 0030 PHE O
H A 0032 GLN N 2.251 H A 0031 PHE O
H A 0033 THR N 2.803 H A 0029 LYS O
H A 0033 THR N 3.116 H A 0030 PHE O
H A 0033 THR N 2.248 H A 0032 GLN O
H A 0034 SER N 2.723 H A 0030 PHE O
H A 0034 SER N 3.102 H A 0032 GLN O
H A 0034 SER N 2.260 H A 0033 THR O
C A 0035 GLY N 2.852 H A 0032 GLN O
C A 0035 GLY N 2.242 H A 0034 SER O
C A 0036 LEU N 3.188 H A 0034 SER O
C A 0036 LEU N 2.240 C A 0035 GLY O
C A 0037 SER N 2.872 H A 0031 PHE O
C A 0037 SER N 2.241 C A 0036 LEU O
C A 0038 LYS N 2.760 C A 0035 GLY O
C A 0038 LYS N 2.238 C A 0037 SER O
C A 0039 MET N 2.833 C A 0035 GLY O
C A 0039 MET N 2.253 C A 0038 LYS O
H A 0040 SER N 2.246 C A 0039 MET O
H A 0041 ALA N 2.261 H A 0040 SER O
H A 0042 ASN N 2.996 H A 0040 SER O
H A 0042 ASN N 2.252 H A 0041 ALA O
H A 0043 GLN N 2.880 H A 0040 SER O
H A 0043 GLN N 2.252 H A 0042 ASN O
H A 0044 VAL N 2.895 H A 0040 SER O
H A 0044 VAL N 2.241 H A 0043 GLN O
H A 0045 LYS N 2.798 H A 0041 ALA O
H A 0045 LYS N 3.166 H A 0042 ASN O
H A 0045 LYS N 2.235 H A 0044 VAL O
H A 0046 ASP N 2.903 H A 0042 ASN O
H A 0046 ASP N 3.115 H A 0043 GLN O
H A 0046 ASP N 2.251 H A 0045 LYS O
H A 0047 VAL N 2.822 H A 0043 GLN O
H A 0047 VAL N 2.248 H A 0046 ASP O
H A 0048 PHE N 3.024 H A 0044 VAL O
H A 0048 PHE N 3.044 H A 0045 LYS O
H A 0048 PHE N 2.248 H A 0047 VAL O
H A 0049 ARG N 2.983 H A 0045 LYS O
H A 0049 ARG N 2.866 H A 0046 ASP O
H A 0049 ARG N 2.249 H A 0048 PHE O
H A 0050 PHE N 3.147 H A 0046 ASP O
H A 0050 PHE N 2.833 H A 0047 VAL O
H A 0050 PHE N 2.246 H A 0049 ARG O
H A 0051 ILE N 2.806 H A 0047 VAL O
H A 0051 ILE N 2.990 H A 0048 PHE O
H A 0051 ILE N 2.253 H A 0050 PHE O
H A 0052 ASP N 2.855 H A 0048 PHE O
H A 0052 ASP N 2.258 H A 0051 ILE O
C A 0053 ASN N 2.702 H A 0051 ILE O
C A 0053 ASN N 2.252 H A 0052 ASP O
C A 0054 ASP N 3.178 H A 0052 ASP O
C A 0054 ASP N 2.255 C A 0053 ASN O
C A 0055 GLN N 2.818 H A 0052 ASP O
C A 0055 GLN N 2.251 C A 0054 ASP O
C A 0056 SER N 2.959 C A 0054 ASP O
C A 0056 SER N 2.242 C A 0055 GLN O
C A 0057 GLY N 3.100 C A 0055 GLN O
C A 0057 GLY N 2.243 C A 0056 SER O
C A 0058 TYR N 2.253 C A 0057 GLY O
C A 0059 LEU N 2.256 C A 0058 TYR O
C A 0059 LEU N 2.824 C A 0098 ILE O
H A 0060 ASP N 2.252 C A 0059 LEU O
H A 0061 GLU N 2.250 H A 0060 ASP O
H A 0062 GLU N 3.113 H A 0060 ASP O
H A 0062 GLU N 2.243 H A 0061 GLU O
H A 0063 GLU N 2.846 H A 0060 ASP O
H A 0063 GLU N 2.246 H A 0062 GLU O
H A 0064 LEU N 2.889 H A 0060 ASP O
H A 0064 LEU N 2.953 H A 0061 GLU O
H A 0064 LEU N 2.243 H A 0063 GLU O
H A 0065 LYS N 2.831 H A 0061 GLU O
H A 0065 LYS N 3.069 H A 0063 GLU O
H A 0065 LYS N 2.238 H A 0064 LEU O
H A 0066 PHE N 2.800 H A 0063 GLU O
H A 0066 PHE N 2.861 H A 0064 LEU O
H A 0066 PHE N 2.238 H A 0065 LYS O
H A 0067 PHE N 2.810 H A 0064 LEU O
H A 0067 PHE N 2.243 H A 0066 PHE O
H A 0068 LEU N 2.238 H A 0067 PHE O
H A 0069 GLN N 2.253 H A 0068 LEU O
H A 0070 LYS N 2.998 H A 0068 LEU O
H A 0070 LYS N 2.237 H A 0069 GLN O
H A 0071 PHE N 2.808 H A 0068 LEU O
H A 0071 PHE N 2.254 H A 0070 LYS O
C A 0072 GLU N 2.912 H A 0068 LEU O
C A 0072 GLU N 2.261 H A 0071 PHE O
C A 0073 SER N 2.229 C A 0072 GLU O
C A 0074 GLY N 2.241 C A 0073 SER O
C A 0075 ALA N 2.257 C A 0074 GLY O
C A 0076 ARG N 2.241 C A 0075 ALA O
C A 0077 GLU N 2.255 C A 0076 ARG O
C A 0078 LEU N 2.930 C A 0076 ARG O
C A 0078 LEU N 2.248 C A 0077 GLU O
H A 0079 THR N 2.730 C A 0076 ARG O
H A 0079 THR N 2.242 C A 0078 LEU O
H A 0080 GLU N 3.051 C A 0078 LEU O
H A 0080 GLU N 2.256 H A 0079 THR O
H A 0081 SER N 2.239 H A 0080 GLU O
H A 0082 GLU N 2.245 H A 0081 SER O
H A 0083 THR N 2.969 H A 0079 THR O
H A 0083 THR N 2.254 H A 0082 GLU O
H A 0084 LYS N 2.673 H A 0080 GLU O
H A 0084 LYS N 3.112 H A 0081 SER O
H A 0084 LYS N 2.235 H A 0083 THR O
H A 0085 SER N 2.768 H A 0081 SER O
H A 0085 SER N 3.105 H A 0082 GLU O
H A 0085 SER N 2.230 H A 0084 LYS O
H A 0086 LEU N 2.999 H A 0082 GLU O
H A 0086 LEU N 2.251 H A 0085 SER O
H A 0087 MET N 2.813 H A 0083 THR O
H A 0087 MET N 2.261 H A 0086 LEU O
H A 0088 ALA N 2.729 H A 0084 LYS O
H A 0088 ALA N 2.245 H A 0087 MET O
H A 0089 ALA N 2.247 H A 0088 ALA O
H A 0090 ALA N 2.957 H A 0086 LEU O
H A 0090 ALA N 3.131 H A 0087 MET O
H A 0090 ALA N 2.252 H A 0089 ALA O
H A 0091 ASP N 2.752 H A 0087 MET O
H A 0091 ASP N 2.250 H A 0090 ALA O
C A 0092 ASN N 2.919 H A 0090 ALA O
C A 0092 ASN N 2.234 H A 0091 ASP O
C A 0093 ASP N 2.801 H A 0091 ASP O
C A 0093 ASP N 2.257 C A 0092 ASN O
C A 0094 GLY N 2.257 C A 0093 ASP O
C A 0095 ASP N 2.259 C A 0094 GLY O
C A 0096 GLY N 2.245 C A 0095 ASP O
C A 0097 LYS N 2.246 C A 0096 GLY O
C A 0098 ILE N 2.249 C A 0097 LYS O
H A 0099 GLY N 2.246 C A 0098 ILE O
H A 0100 ALA N 2.246 H A 0099 GLY O
H A 0101 GLU N 2.256 H A 0100 ALA O
H A 0102 GLU N 3.184 H A 0099 GLY O
H A 0102 GLU N 2.255 H A 0101 GLU O
H A 0103 PHE N 2.997 H A 0099 GLY O
H A 0103 PHE N 2.246 H A 0102 GLU O
H A 0104 GLN N 2.758 H A 0100 ALA O
H A 0104 GLN N 3.025 H A 0101 GLU O
H A 0104 GLN N 2.242 H A 0103 PHE O
H A 0105 GLU N 2.833 H A 0101 GLU O
H A 0105 GLU N 2.249 H A 0104 GLN O
H A 0106 MET N 3.001 H A 0102 GLU O
H A 0106 MET N 3.193 H A 0103 PHE O
H A 0106 MET N 2.247 H A 0105 GLU O
H A 0107 VAL N 2.818 H A 0103 PHE O
H A 0107 VAL N 2.244 H A 0106 MET O
H A 0108 HIS N 2.669 H A 0104 GLN O
H A 0108 HIS N 3.051 H A 0105 GLU O
H A 0108 HIS N 2.241 H A 0107 VAL O
H A 0109 SER N 3.181 H A 0105 GLU O
H A 0109 SER N 3.174 H A 0107 VAL O
H A 0109 SER N 2.264 H A 0108 HIS O
HB_MS 2.00 3.20 25
C A 0001 MET O 2.615 C A 0002 SER OG
C A 0003 ILE O 2.858 H A 0008 SER OG
H A 0019 CYS O 2.659 C A 0076 ARG NH2
C A 0021 ASP O 2.834 C A 0024 THR OG1
C A 0021 ASP O 2.641 C A 0076 ARG NH2
C A 0023 ASP N 2.653 H A 0082 GLU OE2
C A 0024 THR N 3.032 H A 0082 GLU OE1
C A 0024 THR N 2.805 H A 0082 GLU OE2
C A 0025 PHE N 2.679 H A 0082 GLU OE1
H A 0041 ALA N 3.050 H A 0040 SER OG
H A 0050 PHE O 2.666 H A 0070 LYS NZ
C A 0055 GLN N 3.032 H A 0052 ASP OD1
H A 0068 LEU N 2.709 C A 0077 GLU OE1
C A 0073 SER O 3.041 H A 0069 GLN NE2
C A 0073 SER N 2.600 C A 0072 GLU OE1
C A 0074 GLY N 2.713 C A 0072 GLU OE1
C A 0076 ARG N 2.798 C A 0077 GLU OE2
C A 0077 GLU O 3.077 H A 0083 THR OG1
H A 0081 SER O 2.820 H A 0085 SER OG
C A 0094 GLY N 2.717 H A 0091 ASP OD2
C A 0095 ASP N 2.738 H A 0091 ASP OD2
C A 0096 GLY N 3.065 H A 0091 ASP OD1
C A 0096 GLY N 3.036 H A 0091 ASP OD2
C A 0096 GLY N 2.678 C A 0095 ASP OD1
H A 0099 GLY N 2.778 H A 0102 GLU OE2
HB_SS 2.00 3.20 4
C A 0023 ASP OD1 2.601 H A 0081 SER OG
H A 0032 GLN NE2 2.782 C A 0037 SER OG
H A 0063 GLU OE2 2.701 C A 0056 SER OG
C A 0097 LYS NZ 2.743 C A 0058 TYR OH
AROMATIC 0.00 8.00 4
H A 0070 LYS 7.236 H A 0050 PHE
C A 0076 ARG 6.083 C A 0025 PHE
H A 0065 LYS 7.941 H A 0066 PHE
C A 0097 LYS 4.707 C A 0058 TYR