Complet list of 1xpv con file
Complete list of 1xpv.con file
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 425
C A 0001 MET CA 3.784 C A 0002 ALA CA
C A 0001 MET C 2.419 C A 0002 ALA CA
C A 0001 MET C 3.223 C A 0002 ALA C
C A 0001 MET C 3.617 C A 0002 ALA CB
C A 0002 ALA CA 3.785 C A 0003 LEU CA
C A 0002 ALA C 2.420 C A 0003 LEU CA
C A 0002 ALA C 3.088 C A 0003 LEU C
C A 0002 ALA C 3.676 C A 0003 LEU CB
C A 0003 LEU CA 3.785 E A 0004 THR CA
C A 0003 LEU C 2.419 E A 0004 THR CA
C A 0003 LEU C 3.666 E A 0004 THR C
C A 0003 LEU C 3.099 E A 0004 THR CB
C A 0003 LEU CD1 3.500 H A 0072 LEU CD2
C A 0003 LEU CD2 3.750 H A 0072 LEU CD2
E A 0004 THR CA 3.784 E A 0005 LEU CA
E A 0004 THR C 2.419 E A 0005 LEU CA
E A 0004 THR C 3.408 E A 0005 LEU C
E A 0004 THR C 3.491 E A 0005 LEU CB
E A 0004 THR CG2 3.733 E A 0032 VAL CG2
E A 0005 LEU CA 3.786 E A 0006 TYR CA
E A 0005 LEU C 2.419 E A 0006 TYR CA
E A 0005 LEU C 3.059 E A 0006 TYR C
E A 0005 LEU C 3.648 E A 0006 TYR CB
E A 0005 LEU CD2 3.552 H A 0018 VAL CG2
E A 0006 TYR CA 3.784 E A 0007 GLN CA
E A 0006 TYR C 2.418 E A 0007 GLN CA
E A 0006 TYR C 3.589 E A 0007 GLN C
E A 0006 TYR C 3.318 E A 0007 GLN CB
E A 0006 TYR CG 3.395 H A 0044 TYR CE2
E A 0006 TYR CD1 3.408 H A 0044 TYR CE2
E A 0006 TYR CD2 3.374 H A 0044 TYR CE2
E A 0006 TYR CD2 3.402 H A 0044 TYR CZ
E A 0006 TYR CE1 3.415 H A 0044 TYR CE2
E A 0006 TYR CE2 3.379 H A 0044 TYR CE2
E A 0006 TYR CE2 3.302 H A 0044 TYR CZ
E A 0006 TYR CZ 3.389 H A 0044 TYR CE2
E A 0006 TYR CZ 3.719 H A 0044 TYR CZ
E A 0007 GLN CA 3.785 C A 0008 ARG CA
E A 0007 GLN C 2.419 C A 0008 ARG CA
E A 0007 GLN C 3.581 C A 0008 ARG C
E A 0007 GLN C 3.352 C A 0008 ARG CB
E A 0007 GLN CA 3.484 H A 0048 VAL CG1
E A 0007 GLN C 3.577 H A 0048 VAL CG1
C A 0008 ARG CA 3.785 C A 0009 ASP CA
C A 0008 ARG C 2.419 C A 0009 ASP CA
C A 0008 ARG C 2.823 C A 0009 ASP C
C A 0008 ARG C 3.693 C A 0009 ASP CB
C A 0008 ARG CB 3.650 H A 0048 VAL CG2
C A 0008 ARG CD 3.720 H A 0048 VAL CG2
C A 0009 ASP CA 3.785 C A 0010 ASP CA
C A 0009 ASP C 2.419 C A 0010 ASP CA
C A 0009 ASP C 2.976 C A 0010 ASP C
C A 0009 ASP C 2.957 C A 0010 ASP CB
C A 0010 ASP CA 3.785 C A 0011 CYS CA
C A 0010 ASP C 2.419 C A 0011 CYS CA
C A 0010 ASP C 3.430 C A 0011 CYS C
C A 0010 ASP C 3.488 C A 0011 CYS CB
C A 0011 CYS CA 3.785 H A 0012 HIS CA
C A 0011 CYS C 2.418 H A 0012 HIS CA
C A 0011 CYS C 3.694 H A 0012 HIS C
C A 0011 CYS C 2.983 H A 0012 HIS CB
H A 0012 HIS CA 3.785 H A 0013 LEU CA
H A 0012 HIS C 2.418 H A 0013 LEU CA
H A 0012 HIS C 3.017 H A 0013 LEU C
H A 0012 HIS C 3.694 H A 0013 LEU CB
H A 0012 HIS CA 3.632 H A 0015 ASP CB
H A 0012 HIS C 3.609 H A 0015 ASP CB
H A 0013 LEU CA 3.785 H A 0014 CYS CA
H A 0013 LEU C 2.418 H A 0014 CYS CA
H A 0013 LEU C 3.065 H A 0014 CYS C
H A 0013 LEU C 3.696 H A 0014 CYS CB
H A 0013 LEU CG 3.755 C A 0049 PRO CG
H A 0013 LEU CD2 3.323 C A 0049 PRO CG
H A 0013 LEU CD1 3.567 C A 0061 TRP CE2
H A 0013 LEU CD1 3.291 C A 0061 TRP CZ2
H A 0014 CYS CA 3.785 H A 0015 ASP CA
H A 0014 CYS C 2.418 H A 0015 ASP CA
H A 0014 CYS C 2.918 H A 0015 ASP C
H A 0014 CYS C 3.711 H A 0015 ASP CB
H A 0014 CYS C 3.782 H A 0017 ALA CB
H A 0015 ASP CA 3.784 H A 0016 GLN CA
H A 0015 ASP C 2.418 H A 0016 GLN CA
H A 0015 ASP C 2.951 H A 0016 GLN C
H A 0015 ASP C 3.712 H A 0016 GLN CB
H A 0016 GLN CA 3.785 H A 0017 ALA CA
H A 0016 GLN C 2.418 H A 0017 ALA CA
H A 0016 GLN C 2.975 H A 0017 ALA C
H A 0016 GLN C 3.692 H A 0017 ALA CB
H A 0016 GLN CB 3.773 C A 0061 TRP CH2
H A 0017 ALA CA 3.785 H A 0018 VAL CA
H A 0017 ALA C 2.419 H A 0018 VAL CA
H A 0017 ALA C 2.931 H A 0018 VAL C
H A 0017 ALA C 3.699 H A 0018 VAL CB
H A 0017 ALA CA 3.785 C A 0061 TRP CZ3
H A 0017 ALA CB 3.545 C A 0061 TRP CZ3
H A 0018 VAL CA 3.785 H A 0019 GLU CA
H A 0018 VAL C 2.418 H A 0019 GLU CA
H A 0018 VAL C 2.969 H A 0019 GLU C
H A 0018 VAL C 3.711 H A 0019 GLU CB
H A 0019 GLU CA 3.785 H A 0020 ALA CA
H A 0019 GLU C 2.419 H A 0020 ALA CA
H A 0019 GLU C 2.971 H A 0020 ALA C
H A 0019 GLU C 3.692 H A 0020 ALA CB
H A 0020 ALA CA 3.785 H A 0021 LEU CA
H A 0020 ALA C 2.419 H A 0021 LEU CA
H A 0020 ALA C 2.976 H A 0021 LEU C
H A 0020 ALA C 3.701 H A 0021 LEU CB
H A 0021 LEU CA 3.784 H A 0022 ALA CA
H A 0021 LEU C 2.419 H A 0022 ALA CA
H A 0021 LEU C 2.914 H A 0022 ALA C
H A 0021 LEU C 3.694 H A 0022 ALA CB
H A 0021 LEU CD2 2.985 C A 0026 ALA CB
H A 0021 LEU CG 3.722 E A 0051 LEU CD1
H A 0021 LEU CD1 3.500 E A 0051 LEU CD1
H A 0021 LEU CA 3.596 H A 0068 LEU CD2
H A 0021 LEU CG 3.709 H A 0068 LEU CD2
H A 0022 ALA CA 3.785 H A 0023 GLN CA
H A 0022 ALA C 2.418 H A 0023 GLN CA
H A 0022 ALA C 2.958 H A 0023 GLN C
H A 0022 ALA C 3.712 H A 0023 GLN CB
H A 0023 GLN CA 3.786 H A 0024 ALA CA
H A 0023 GLN C 2.419 H A 0024 ALA CA
H A 0023 GLN C 3.010 H A 0024 ALA C
H A 0023 GLN C 3.687 H A 0024 ALA CB
H A 0024 ALA CA 3.785 H A 0025 ARG CA
H A 0024 ALA C 2.418 H A 0025 ARG CA
H A 0024 ALA C 2.989 H A 0025 ARG C
H A 0024 ALA C 2.980 H A 0025 ARG CB
H A 0024 ALA CB 3.615 H A 0068 LEU CD2
H A 0025 ARG CA 3.785 C A 0026 ALA CA
H A 0025 ARG C 2.419 C A 0026 ALA CA
H A 0025 ARG C 2.883 C A 0026 ALA C
H A 0025 ARG C 3.693 C A 0026 ALA CB
C A 0026 ALA CA 3.785 C A 0027 GLY CA
C A 0026 ALA C 2.418 C A 0027 GLY CA
C A 0026 ALA C 3.567 C A 0027 GLY C
C A 0027 GLY CA 3.785 C A 0028 ALA CA
C A 0027 GLY C 2.419 C A 0028 ALA CA
C A 0027 GLY C 3.260 C A 0028 ALA C
C A 0027 GLY C 3.597 C A 0028 ALA CB
C A 0028 ALA CA 3.785 C A 0029 PHE CA
C A 0028 ALA C 2.419 C A 0029 PHE CA
C A 0028 ALA C 3.695 C A 0029 PHE C
C A 0028 ALA C 3.057 C A 0029 PHE CB
C A 0028 ALA C 3.578 C A 0029 PHE CG
C A 0028 ALA C 3.423 C A 0029 PHE CD2
C A 0029 PHE CA 3.785 E A 0030 PHE CA
C A 0029 PHE C 2.419 E A 0030 PHE CA
C A 0029 PHE C 3.439 E A 0030 PHE C
C A 0029 PHE C 3.482 E A 0030 PHE CB
C A 0029 PHE C 3.634 E A 0030 PHE CG
C A 0029 PHE C 3.504 E A 0030 PHE CD1
E A 0030 PHE CA 3.785 E A 0031 SER CA
E A 0030 PHE C 2.419 E A 0031 SER CA
E A 0030 PHE C 3.328 E A 0031 SER C
E A 0030 PHE C 3.590 E A 0031 SER CB
E A 0031 SER CA 3.785 E A 0032 VAL CA
E A 0031 SER C 2.418 E A 0032 VAL CA
E A 0031 SER C 3.512 E A 0032 VAL C
E A 0031 SER C 3.382 E A 0032 VAL CB
E A 0031 SER C 3.338 E A 0032 VAL CG2
E A 0032 VAL CA 3.785 E A 0033 PHE CA
E A 0032 VAL C 2.418 E A 0033 PHE CA
E A 0032 VAL C 3.290 E A 0033 PHE C
E A 0032 VAL C 3.585 E A 0033 PHE CB
E A 0033 PHE CA 3.785 C A 0034 ILE CA
E A 0033 PHE C 2.419 C A 0034 ILE CA
E A 0033 PHE C 3.151 C A 0034 ILE C
E A 0033 PHE C 3.653 C A 0034 ILE CB
C A 0034 ILE CA 3.785 C A 0035 ASP CA
C A 0034 ILE C 2.418 C A 0035 ASP CA
C A 0034 ILE C 3.058 C A 0035 ASP C
C A 0034 ILE C 3.704 C A 0035 ASP CB
C A 0034 ILE CD1 3.580 H A 0041 GLU CG
C A 0034 ILE CD1 3.288 H A 0041 GLU CD
C A 0034 ILE CG1 3.495 H A 0048 VAL CG2
C A 0034 ILE CD1 2.881 H A 0048 VAL CG2
C A 0035 ASP CA 3.785 C A 0036 ASP CA
C A 0035 ASP C 2.418 C A 0036 ASP CA
C A 0035 ASP C 3.683 C A 0036 ASP C
C A 0035 ASP C 2.907 C A 0036 ASP CB
C A 0035 ASP C 3.242 C A 0036 ASP CG
C A 0036 ASP CA 3.785 H A 0037 ASP CA
C A 0036 ASP C 2.419 H A 0037 ASP CA
C A 0036 ASP C 3.420 H A 0037 ASP C
C A 0036 ASP C 3.532 H A 0037 ASP CB
H A 0037 ASP CA 3.784 H A 0038 ALA CA
H A 0037 ASP C 2.418 H A 0038 ALA CA
H A 0037 ASP C 2.942 H A 0038 ALA C
H A 0037 ASP C 3.694 H A 0038 ALA CB
H A 0037 ASP CB 3.784 H A 0040 LEU CG
H A 0037 ASP CB 3.476 H A 0040 LEU CD1
H A 0038 ALA CA 3.785 H A 0039 ALA CA
H A 0038 ALA C 2.418 H A 0039 ALA CA
H A 0038 ALA C 2.915 H A 0039 ALA C
H A 0038 ALA C 3.694 H A 0039 ALA CB
H A 0039 ALA CA 3.785 H A 0040 LEU CA
H A 0039 ALA C 2.419 H A 0040 LEU CA
H A 0039 ALA C 3.041 H A 0040 LEU C
H A 0039 ALA C 3.689 H A 0040 LEU CB
H A 0040 LEU CA 3.785 H A 0041 GLU CA
H A 0040 LEU C 2.419 H A 0041 GLU CA
H A 0040 LEU C 2.987 H A 0041 GLU C
H A 0040 LEU C 3.709 H A 0041 GLU CB
H A 0041 GLU CA 3.785 H A 0042 SER CA
H A 0041 GLU C 2.419 H A 0042 SER CA
H A 0041 GLU C 3.046 H A 0042 SER C
H A 0041 GLU C 3.703 H A 0042 SER CB
H A 0041 GLU C 3.723 H A 0045 GLY CA
H A 0042 SER CA 3.785 H A 0043 ALA CA
H A 0042 SER C 2.419 H A 0043 ALA CA
H A 0042 SER C 3.019 H A 0043 ALA C
H A 0042 SER C 3.685 H A 0043 ALA CB
H A 0043 ALA CA 3.785 H A 0044 TYR CA
H A 0043 ALA C 2.418 H A 0044 TYR CA
H A 0043 ALA C 3.336 H A 0044 TYR C
H A 0043 ALA C 3.549 H A 0044 TYR CB
H A 0044 TYR CA 3.785 H A 0045 GLY CA
H A 0044 TYR C 2.418 H A 0045 GLY CA
H A 0044 TYR C 2.994 H A 0045 GLY C
H A 0044 TYR CE1 3.705 C A 0050 VAL CB
H A 0044 TYR CE1 3.537 C A 0050 VAL CG1
H A 0045 GLY CA 3.785 H A 0046 LEU CA
H A 0045 GLY C 2.419 H A 0046 LEU CA
H A 0045 GLY C 3.162 H A 0046 LEU C
H A 0045 GLY C 3.649 H A 0046 LEU CB
H A 0046 LEU CA 3.785 H A 0047 ARG CA
H A 0046 LEU C 2.418 H A 0047 ARG CA
H A 0046 LEU C 3.238 H A 0047 ARG C
H A 0046 LEU C 3.646 H A 0047 ARG CB
H A 0047 ARG CA 3.785 H A 0048 VAL CA
H A 0047 ARG C 2.419 H A 0048 VAL CA
H A 0047 ARG C 2.889 H A 0048 VAL C
H A 0047 ARG C 3.700 H A 0048 VAL CB
H A 0047 ARG C 3.223 C A 0049 PRO CD
H A 0047 ARG C 3.611 C A 0050 VAL CG2
H A 0047 ARG CB 3.497 C A 0050 VAL CG2
H A 0048 VAL CA 2.872 C A 0049 PRO CD
H A 0048 VAL C 2.448 C A 0049 PRO CA
H A 0048 VAL C 3.136 C A 0049 PRO C
H A 0048 VAL C 3.642 C A 0049 PRO CB
H A 0048 VAL C 3.683 C A 0049 PRO CG
H A 0048 VAL C 2.513 C A 0049 PRO CD
H A 0048 VAL CB 3.196 C A 0049 PRO CD
H A 0048 VAL CG1 3.452 C A 0049 PRO CD
C A 0049 PRO CA 3.785 C A 0050 VAL CA
C A 0049 PRO C 2.419 C A 0050 VAL CA
C A 0049 PRO C 3.446 C A 0050 VAL C
C A 0049 PRO C 3.455 C A 0050 VAL CB
C A 0049 PRO C 3.666 C A 0050 VAL CG2
C A 0049 PRO CB 3.613 C A 0061 TRP CE3
C A 0050 VAL CA 3.785 E A 0051 LEU CA
C A 0050 VAL C 2.419 E A 0051 LEU CA
C A 0050 VAL C 3.246 E A 0051 LEU C
C A 0050 VAL C 3.607 E A 0051 LEU CB
C A 0050 VAL CG1 3.028 E A 0058 GLU CD
E A 0051 LEU CA 3.786 E A 0052 ARG CA
E A 0051 LEU C 2.420 E A 0052 ARG CA
E A 0051 LEU C 3.442 E A 0052 ARG C
E A 0051 LEU C 3.512 E A 0052 ARG CB
E A 0051 LEU CD1 3.079 H A 0068 LEU CD1
E A 0052 ARG CA 3.784 C A 0053 ASP CA
E A 0052 ARG C 2.418 C A 0053 ASP CA
E A 0052 ARG C 3.438 C A 0053 ASP C
E A 0052 ARG C 3.517 C A 0053 ASP CB
E A 0052 ARG CG 3.712 E A 0058 GLU CG
C A 0053 ASP CA 2.871 C A 0054 PRO CD
C A 0053 ASP C 2.449 C A 0054 PRO CA
C A 0053 ASP C 3.137 C A 0054 PRO C
C A 0053 ASP C 3.642 C A 0054 PRO CB
C A 0053 ASP C 3.683 C A 0054 PRO CG
C A 0053 ASP C 2.513 C A 0054 PRO CD
C A 0053 ASP CB 3.165 C A 0054 PRO CD
C A 0053 ASP CG 3.494 C A 0057 ARG CA
C A 0053 ASP CG 3.305 C A 0057 ARG C
C A 0053 ASP CG 3.383 C A 0057 ARG CB
C A 0053 ASP CG 3.695 H A 0071 TRP CZ2
C A 0053 ASP CG 3.622 H A 0071 TRP CH2
C A 0054 PRO CA 3.785 C A 0055 MET CA
C A 0054 PRO C 2.418 C A 0055 MET CA
C A 0054 PRO C 3.025 C A 0055 MET C
C A 0054 PRO C 3.692 C A 0055 MET CB
C A 0055 MET CA 3.784 C A 0056 GLY CA
C A 0055 MET C 2.419 C A 0056 GLY CA
C A 0055 MET C 3.510 C A 0056 GLY C
C A 0056 GLY CA 3.785 C A 0057 ARG CA
C A 0056 GLY C 2.419 C A 0057 ARG CA
C A 0056 GLY C 3.615 C A 0057 ARG C
C A 0056 GLY C 3.296 C A 0057 ARG CB
C A 0056 GLY C 3.088 C A 0057 ARG CG
C A 0057 ARG CA 3.785 E A 0058 GLU CA
C A 0057 ARG C 2.419 E A 0058 GLU CA
C A 0057 ARG C 3.580 E A 0058 GLU C
C A 0057 ARG C 3.330 E A 0058 GLU CB
C A 0057 ARG C 3.379 E A 0058 GLU CG
E A 0058 GLU CA 3.784 E A 0059 LEU CA
E A 0058 GLU C 2.418 E A 0059 LEU CA
E A 0058 GLU C 3.492 E A 0059 LEU C
E A 0058 GLU C 3.404 E A 0059 LEU CB
E A 0058 GLU CA 3.587 H A 0071 TRP CZ2
E A 0058 GLU C 3.775 H A 0071 TRP CE2
E A 0058 GLU C 3.203 H A 0071 TRP CZ2
E A 0059 LEU CA 3.785 C A 0060 ASP CA
E A 0059 LEU C 2.419 C A 0060 ASP CA
E A 0059 LEU C 2.940 C A 0060 ASP C
E A 0059 LEU C 3.713 C A 0060 ASP CB
E A 0059 LEU CD2 3.773 H A 0068 LEU CA
E A 0059 LEU CD2 3.596 H A 0068 LEU CD1
E A 0059 LEU CB 3.540 H A 0071 TRP CD2
E A 0059 LEU CB 3.444 H A 0071 TRP CE2
E A 0059 LEU CB 3.631 H A 0071 TRP CZ2
E A 0059 LEU CG 3.775 H A 0071 TRP CD2
E A 0059 LEU CD1 3.472 H A 0071 TRP CG
E A 0059 LEU CD1 3.398 H A 0071 TRP CD1
E A 0059 LEU CD2 3.636 H A 0071 TRP CB
E A 0059 LEU CD2 3.558 H A 0071 TRP CG
E A 0059 LEU CD2 3.474 H A 0071 TRP CD2
E A 0059 LEU CD2 3.458 H A 0071 TRP CE3
C A 0060 ASP CA 3.785 C A 0061 TRP CA
C A 0060 ASP C 2.419 C A 0061 TRP CA
C A 0060 ASP C 2.908 C A 0061 TRP C
C A 0060 ASP C 3.712 C A 0061 TRP CB
C A 0060 ASP C 3.411 C A 0062 PRO CD
C A 0060 ASP CB 3.742 C A 0062 PRO CD
C A 0060 ASP C 3.762 C A 0063 PHE CD2
C A 0061 TRP CA 2.871 C A 0062 PRO CD
C A 0061 TRP C 2.449 C A 0062 PRO CA
C A 0061 TRP C 3.137 C A 0062 PRO C
C A 0061 TRP C 3.642 C A 0062 PRO CB
C A 0061 TRP C 3.683 C A 0062 PRO CG
C A 0061 TRP C 2.513 C A 0062 PRO CD
C A 0061 TRP CB 3.128 C A 0062 PRO CD
C A 0061 TRP CG 3.328 C A 0062 PRO CD
C A 0061 TRP CD1 3.552 C A 0062 PRO CD
C A 0061 TRP C 3.697 C A 0063 PHE CD2
C A 0061 TRP C 3.621 C A 0063 PHE CE2
C A 0061 TRP C 3.725 C A 0063 PHE CZ
C A 0061 TRP CE3 3.695 C A 0063 PHE CE1
C A 0061 TRP CE3 3.599 C A 0063 PHE CZ
C A 0061 TRP CZ3 3.637 C A 0063 PHE CE1
C A 0062 PRO CA 3.785 C A 0063 PHE CA
C A 0062 PRO C 2.418 C A 0063 PHE CA
C A 0062 PRO C 3.655 C A 0063 PHE C
C A 0062 PRO C 3.181 C A 0063 PHE CB
C A 0062 PRO C 3.452 C A 0063 PHE CG
C A 0062 PRO C 3.762 C A 0063 PHE CD1
C A 0063 PHE CA 3.785 H A 0064 ASP CA
C A 0063 PHE C 2.419 H A 0064 ASP CA
C A 0063 PHE C 3.512 H A 0064 ASP C
C A 0063 PHE C 3.442 H A 0064 ASP CB
C A 0063 PHE C 3.483 H A 0064 ASP CG
C A 0063 PHE CG 3.617 H A 0068 LEU CD1
C A 0063 PHE CD2 3.294 H A 0068 LEU CD1
C A 0063 PHE CE2 3.475 H A 0068 LEU CD1
H A 0064 ASP CA 3.786 H A 0065 ALA CA
H A 0064 ASP C 2.418 H A 0065 ALA CA
H A 0064 ASP C 3.101 H A 0065 ALA C
H A 0064 ASP C 3.665 H A 0065 ALA CB
H A 0064 ASP C 3.586 H A 0066 PRO CD
H A 0064 ASP CB 3.495 H A 0066 PRO CD
H A 0064 ASP CB 3.714 H A 0067 ARG CB
H A 0065 ALA CA 2.872 H A 0066 PRO CD
H A 0065 ALA C 2.449 H A 0066 PRO CA
H A 0065 ALA C 3.136 H A 0066 PRO C
H A 0065 ALA C 3.642 H A 0066 PRO CB
H A 0065 ALA C 3.683 H A 0066 PRO CG
H A 0065 ALA C 2.513 H A 0066 PRO CD
H A 0065 ALA CB 3.164 H A 0066 PRO CD
H A 0066 PRO CA 3.785 H A 0067 ARG CA
H A 0066 PRO C 2.419 H A 0067 ARG CA
H A 0066 PRO C 3.144 H A 0067 ARG C
H A 0066 PRO C 3.684 H A 0067 ARG CB
H A 0067 ARG CA 3.785 H A 0068 LEU CA
H A 0067 ARG C 2.419 H A 0068 LEU CA
H A 0067 ARG C 3.123 H A 0068 LEU C
H A 0067 ARG C 3.664 H A 0068 LEU CB
H A 0068 LEU CA 3.785 H A 0069 ARG CA
H A 0068 LEU C 2.418 H A 0069 ARG CA
H A 0068 LEU C 3.044 H A 0069 ARG C
H A 0068 LEU C 3.706 H A 0069 ARG CB
H A 0068 LEU C 3.631 H A 0072 LEU CD1
H A 0068 LEU CD2 3.666 H A 0072 LEU CD1
H A 0069 ARG CA 3.785 H A 0070 ALA CA
H A 0069 ARG C 2.418 H A 0070 ALA CA
H A 0069 ARG C 2.909 H A 0070 ALA C
H A 0069 ARG C 3.694 H A 0070 ALA CB
H A 0069 ARG CA 3.598 H A 0072 LEU CD1
H A 0070 ALA CA 3.786 H A 0071 TRP CA
H A 0070 ALA C 2.419 H A 0071 TRP CA
H A 0070 ALA C 3.060 H A 0071 TRP C
H A 0070 ALA C 3.687 H A 0071 TRP CB
H A 0071 TRP CA 3.785 H A 0072 LEU CA
H A 0071 TRP C 2.418 H A 0072 LEU CA
H A 0071 TRP C 3.002 H A 0072 LEU C
H A 0071 TRP C 3.697 H A 0072 LEU CB
H A 0071 TRP C 3.696 H A 0074 ALA CB
H A 0072 LEU CA 3.785 H A 0073 ASP CA
H A 0072 LEU C 2.419 H A 0073 ASP CA
H A 0072 LEU C 2.887 H A 0073 ASP C
H A 0072 LEU C 3.708 H A 0073 ASP CB
H A 0073 ASP CA 3.785 H A 0074 ALA CA
H A 0073 ASP C 2.418 H A 0074 ALA CA
H A 0073 ASP C 2.890 H A 0074 ALA C
H A 0073 ASP C 3.693 H A 0074 ALA CB
H A 0074 ALA CA 3.785 C A 0075 ALA CA
H A 0074 ALA C 2.419 C A 0075 ALA CA
H A 0074 ALA C 3.507 C A 0075 ALA C
H A 0074 ALA C 3.391 C A 0075 ALA CB
C A 0075 ALA CA 2.872 C A 0076 PRO CD
C A 0075 ALA C 2.449 C A 0076 PRO CA
C A 0075 ALA C 3.137 C A 0076 PRO C
C A 0075 ALA C 3.643 C A 0076 PRO CB
C A 0075 ALA C 3.684 C A 0076 PRO CG
C A 0075 ALA C 2.513 C A 0076 PRO CD
C A 0075 ALA CB 3.173 C A 0076 PRO CD
C A 0076 PRO CA 3.785 C A 0077 HIS CA
C A 0076 PRO C 2.418 C A 0077 HIS CA
C A 0076 PRO C 3.581 C A 0077 HIS C
C A 0076 PRO C 3.299 C A 0077 HIS CB
C A 0076 PRO C 3.787 C A 0077 HIS CG
C A 0076 PRO C 3.700 C A 0077 HIS CD2
C A 0077 HIS CA 3.784 C A 0078 ALA CA
C A 0077 HIS C 2.418 C A 0078 ALA CA
C A 0077 HIS C 3.679 C A 0078 ALA C
C A 0077 HIS C 3.046 C A 0078 ALA CB
CHARGE_ATTR 2.00 12.00 68
C A 0009 ASP OD1 8.801 C A 0008 ARG NH1
C A 0009 ASP OD1 8.103 C A 0008 ARG NH2
C A 0009 ASP OD2 8.881 C A 0008 ARG NH1
C A 0009 ASP OD2 7.679 C A 0008 ARG NH2
C A 0010 ASP OD1 6.943 C A 0008 ARG NH1
C A 0010 ASP OD1 6.401 C A 0008 ARG NH2
C A 0010 ASP OD2 5.126 C A 0008 ARG NH1
C A 0010 ASP OD2 4.602 C A 0008 ARG NH2
C A 0010 ASP OD1 6.924 H A 0012 HIS ND1
C A 0010 ASP OD1 7.941 H A 0012 HIS NE2
C A 0010 ASP OD2 5.638 H A 0012 HIS ND1
C A 0010 ASP OD2 7.081 H A 0012 HIS NE2
H A 0015 ASP OD2 10.98 C A 0008 ARG NH1
H A 0015 ASP OD1 8.287 H A 0012 HIS ND1
H A 0015 ASP OD1 7.983 H A 0012 HIS NE2
H A 0015 ASP OD2 8.041 H A 0012 HIS ND1
H A 0015 ASP OD2 8.089 H A 0012 HIS NE2
H A 0019 GLU OE1 11.33 H A 0012 HIS NE2
H A 0019 GLU OE2 9.903 H A 0025 ARG NH1
H A 0019 GLU OE2 11.56 H A 0025 ARG NH2
C A 0035 ASP OD1 9.954 C A 0008 ARG NH1
C A 0035 ASP OD1 9.133 C A 0008 ARG NH2
C A 0035 ASP OD2 11.03 C A 0008 ARG NH1
C A 0035 ASP OD2 10.41 C A 0008 ARG NH2
H A 0041 GLU OE1 8.952 C A 0008 ARG NH1
H A 0041 GLU OE1 8.661 C A 0008 ARG NH2
H A 0041 GLU OE2 8.124 C A 0008 ARG NH1
H A 0041 GLU OE2 8.107 C A 0008 ARG NH2
C A 0053 ASP OD1 7.183 E A 0052 ARG NH1
C A 0053 ASP OD1 7.628 E A 0052 ARG NH2
C A 0053 ASP OD2 6.990 E A 0052 ARG NH1
C A 0053 ASP OD2 6.790 E A 0052 ARG NH2
C A 0053 ASP OD1 7.600 C A 0057 ARG NH1
C A 0053 ASP OD1 8.293 C A 0057 ARG NH2
C A 0053 ASP OD2 6.981 C A 0057 ARG NH1
C A 0053 ASP OD2 7.679 C A 0057 ARG NH2
C A 0053 ASP OD1 11.93 H A 0069 ARG NH1
E A 0058 GLU OE1 9.481 H A 0047 ARG NH1
E A 0058 GLU OE1 9.173 H A 0047 ARG NH2
E A 0058 GLU OE2 11.17 H A 0047 ARG NH1
E A 0058 GLU OE2 11.14 H A 0047 ARG NH2
E A 0058 GLU OE1 5.299 E A 0052 ARG NH1
E A 0058 GLU OE1 7.558 E A 0052 ARG NH2
E A 0058 GLU OE2 4.285 E A 0052 ARG NH1
E A 0058 GLU OE2 6.463 E A 0052 ARG NH2
E A 0058 GLU OE1 11.71 C A 0057 ARG NH1
E A 0058 GLU OE1 10.81 C A 0057 ARG NH2
E A 0058 GLU OE2 11.71 C A 0057 ARG NH2
C A 0060 ASP OD1 9.501 H A 0047 ARG NH1
C A 0060 ASP OD1 7.911 H A 0047 ARG NH2
C A 0060 ASP OD2 10.68 H A 0047 ARG NH1
C A 0060 ASP OD2 9.105 H A 0047 ARG NH2
C A 0060 ASP OD1 11.65 C A 0057 ARG NH2
C A 0060 ASP OD1 11.10 H A 0067 ARG NH1
C A 0060 ASP OD2 9.530 H A 0067 ARG NH1
C A 0060 ASP OD2 11.59 H A 0067 ARG NH2
H A 0064 ASP OD1 5.732 H A 0067 ARG NH1
H A 0064 ASP OD1 7.085 H A 0067 ARG NH2
H A 0064 ASP OD2 4.507 H A 0067 ARG NH1
H A 0064 ASP OD2 5.270 H A 0067 ARG NH2
H A 0073 ASP OD1 6.313 H A 0069 ARG NH1
H A 0073 ASP OD1 6.240 H A 0069 ARG NH2
H A 0073 ASP OD2 4.557 H A 0069 ARG NH1
H A 0073 ASP OD2 4.187 H A 0069 ARG NH2
H A 0073 ASP OD1 8.980 C A 0077 HIS ND1
H A 0073 ASP OD1 7.089 C A 0077 HIS NE2
H A 0073 ASP OD2 8.247 C A 0077 HIS ND1
H A 0073 ASP OD2 6.579 C A 0077 HIS NE2
CHARGE_REPU 2.00 12.00 81
C A 0008 ARG NH1 7.100 H A 0012 HIS ND1
C A 0008 ARG NH1 9.247 H A 0012 HIS NE2
C A 0008 ARG NH2 7.989 H A 0012 HIS ND1
C A 0008 ARG NH2 10.00 H A 0012 HIS NE2
C A 0009 ASP OD1 8.733 C A 0010 ASP OD1
C A 0009 ASP OD1 9.087 C A 0010 ASP OD2
C A 0009 ASP OD2 7.789 C A 0010 ASP OD1
C A 0009 ASP OD2 8.258 C A 0010 ASP OD2
C A 0009 ASP OD1 3.858 C A 0035 ASP OD1
C A 0009 ASP OD1 3.341 C A 0035 ASP OD2
C A 0009 ASP OD2 4.895 C A 0035 ASP OD1
C A 0009 ASP OD2 4.904 C A 0035 ASP OD2
C A 0009 ASP OD1 8.466 C A 0036 ASP OD1
C A 0009 ASP OD1 9.259 C A 0036 ASP OD2
C A 0009 ASP OD2 10.47 C A 0036 ASP OD1
C A 0009 ASP OD2 11.30 C A 0036 ASP OD2
C A 0009 ASP OD1 9.020 H A 0041 GLU OE1
C A 0009 ASP OD1 7.415 H A 0041 GLU OE2
C A 0009 ASP OD2 9.849 H A 0041 GLU OE1
C A 0009 ASP OD2 8.606 H A 0041 GLU OE2
C A 0010 ASP OD1 9.918 H A 0015 ASP OD1
C A 0010 ASP OD1 8.153 H A 0015 ASP OD2
C A 0010 ASP OD2 10.38 H A 0015 ASP OD1
C A 0010 ASP OD2 8.889 H A 0015 ASP OD2
C A 0010 ASP OD1 11.80 C A 0035 ASP OD1
C A 0010 ASP OD2 11.62 C A 0035 ASP OD1
C A 0010 ASP OD2 11.91 H A 0041 GLU OE2
H A 0015 ASP OD1 7.055 H A 0019 GLU OE1
H A 0015 ASP OD1 7.885 H A 0019 GLU OE2
H A 0015 ASP OD2 9.274 H A 0019 GLU OE1
H A 0015 ASP OD2 10.01 H A 0019 GLU OE2
H A 0019 GLU OE1 10.72 H A 0064 ASP OD1
H A 0019 GLU OE2 11.35 H A 0064 ASP OD1
H A 0025 ARG NH1 11.08 H A 0069 ARG NH1
H A 0025 ARG NH1 10.76 H A 0069 ARG NH2
H A 0025 ARG NH2 11.76 H A 0069 ARG NH1
H A 0025 ARG NH2 11.00 H A 0069 ARG NH2
C A 0035 ASP OD1 6.479 C A 0036 ASP OD1
C A 0035 ASP OD1 7.736 C A 0036 ASP OD2
C A 0035 ASP OD2 5.993 C A 0036 ASP OD1
C A 0035 ASP OD2 6.662 C A 0036 ASP OD2
C A 0035 ASP OD1 10.03 H A 0037 ASP OD1
C A 0035 ASP OD1 11.28 H A 0037 ASP OD2
C A 0035 ASP OD2 9.800 H A 0037 ASP OD1
C A 0035 ASP OD2 11.08 H A 0037 ASP OD2
C A 0035 ASP OD1 6.328 H A 0041 GLU OE1
C A 0035 ASP OD1 5.171 H A 0041 GLU OE2
C A 0035 ASP OD2 8.207 H A 0041 GLU OE1
C A 0035 ASP OD2 6.708 H A 0041 GLU OE2
C A 0036 ASP OD1 4.567 H A 0037 ASP OD1
C A 0036 ASP OD1 5.256 H A 0037 ASP OD2
C A 0036 ASP OD2 4.648 H A 0037 ASP OD1
C A 0036 ASP OD2 5.465 H A 0037 ASP OD2
C A 0036 ASP OD1 8.008 H A 0041 GLU OE1
C A 0036 ASP OD1 6.464 H A 0041 GLU OE2
C A 0036 ASP OD2 10.18 H A 0041 GLU OE1
C A 0036 ASP OD2 8.607 H A 0041 GLU OE2
H A 0037 ASP OD1 10.25 H A 0041 GLU OE1
H A 0037 ASP OD1 9.511 H A 0041 GLU OE2
H A 0037 ASP OD2 10.73 H A 0041 GLU OE1
H A 0037 ASP OD2 9.907 H A 0041 GLU OE2
E A 0052 ARG NH1 11.64 C A 0057 ARG NH1
E A 0052 ARG NH1 10.86 C A 0057 ARG NH2
E A 0052 ARG NH2 11.74 C A 0057 ARG NH1
E A 0052 ARG NH2 11.12 C A 0057 ARG NH2
C A 0053 ASP OD1 7.662 E A 0058 GLU OE1
C A 0053 ASP OD1 6.971 E A 0058 GLU OE2
C A 0053 ASP OD2 8.753 E A 0058 GLU OE1
C A 0053 ASP OD2 8.047 E A 0058 GLU OE2
C A 0053 ASP OD1 11.41 C A 0060 ASP OD1
E A 0058 GLU OE1 8.119 C A 0060 ASP OD1
E A 0058 GLU OE1 10.21 C A 0060 ASP OD2
E A 0058 GLU OE2 9.844 C A 0060 ASP OD1
E A 0058 GLU OE2 11.81 C A 0060 ASP OD2
C A 0060 ASP OD1 11.53 H A 0064 ASP OD1
C A 0060 ASP OD2 9.951 H A 0064 ASP OD1
C A 0060 ASP OD2 10.99 H A 0064 ASP OD2
H A 0069 ARG NH1 6.908 C A 0077 HIS ND1
H A 0069 ARG NH1 6.431 C A 0077 HIS NE2
H A 0069 ARG NH2 6.460 C A 0077 HIS ND1
H A 0069 ARG NH2 5.755 C A 0077 HIS NE2
HB_MM 2.00 3.20 128
C A 0002 ALA N 2.261 C A 0001 MET O
C A 0003 LEU N 2.262 C A 0002 ALA O
E A 0004 THR N 2.262 C A 0003 LEU O
E A 0004 THR N 3.003 E A 0052 ARG O
E A 0005 LEU N 2.262 E A 0004 THR O
E A 0006 TYR N 2.262 E A 0005 LEU O
E A 0007 GLN N 2.262 E A 0006 TYR O
E A 0007 GLN N 3.022 E A 0032 VAL O
C A 0008 ARG N 2.262 E A 0007 GLN O
C A 0009 ASP N 2.261 C A 0008 ARG O
C A 0010 ASP N 2.262 C A 0009 ASP O
C A 0011 CYS N 2.262 C A 0010 ASP O
H A 0012 HIS N 2.261 C A 0011 CYS O
H A 0013 LEU N 2.262 H A 0012 HIS O
H A 0014 CYS N 2.261 H A 0013 LEU O
H A 0015 ASP N 2.262 H A 0014 CYS O
H A 0016 GLN N 3.196 H A 0012 HIS O
H A 0016 GLN N 2.262 H A 0015 ASP O
H A 0017 ALA N 2.952 H A 0014 CYS O
H A 0017 ALA N 3.146 H A 0015 ASP O
H A 0017 ALA N 2.262 H A 0016 GLN O
H A 0018 VAL N 2.853 H A 0014 CYS O
H A 0018 VAL N 3.032 H A 0015 ASP O
H A 0018 VAL N 2.262 H A 0017 ALA O
H A 0019 GLU N 2.975 H A 0015 ASP O
H A 0019 GLU N 3.145 H A 0016 GLN O
H A 0019 GLU N 3.154 H A 0017 ALA O
H A 0019 GLU N 2.261 H A 0018 VAL O
H A 0020 ALA N 3.049 H A 0016 GLN O
H A 0020 ALA N 3.016 H A 0017 ALA O
H A 0020 ALA N 2.262 H A 0019 GLU O
H A 0021 LEU N 2.931 H A 0017 ALA O
H A 0021 LEU N 3.108 H A 0018 VAL O
H A 0021 LEU N 2.262 H A 0020 ALA O
H A 0022 ALA N 2.724 H A 0018 VAL O
H A 0022 ALA N 2.261 H A 0021 LEU O
H A 0023 GLN N 2.744 H A 0019 GLU O
H A 0023 GLN N 2.261 H A 0022 ALA O
H A 0024 ALA N 2.677 H A 0020 ALA O
H A 0024 ALA N 3.033 H A 0021 LEU O
H A 0024 ALA N 2.262 H A 0023 GLN O
H A 0025 ARG N 2.826 H A 0021 LEU O
H A 0025 ARG N 2.776 H A 0022 ALA O
H A 0025 ARG N 3.003 H A 0023 GLN O
H A 0025 ARG N 2.261 H A 0024 ALA O
C A 0026 ALA N 3.071 H A 0021 LEU O
C A 0026 ALA N 2.262 H A 0025 ARG O
C A 0027 GLY N 2.262 C A 0026 ALA O
C A 0028 ALA N 2.261 C A 0027 GLY O
C A 0029 PHE N 2.262 C A 0028 ALA O
E A 0030 PHE N 2.261 C A 0029 PHE O
E A 0031 SER N 2.262 E A 0030 PHE O
E A 0032 VAL N 2.261 E A 0031 SER O
E A 0033 PHE N 2.262 E A 0032 VAL O
C A 0034 ILE N 3.167 E A 0007 GLN O
C A 0034 ILE N 2.262 E A 0033 PHE O
C A 0035 ASP N 2.262 C A 0034 ILE O
C A 0036 ASP N 2.652 C A 0034 ILE O
C A 0036 ASP N 2.262 C A 0035 ASP O
H A 0037 ASP N 3.087 C A 0034 ILE O
H A 0037 ASP N 2.261 C A 0036 ASP O
H A 0038 ALA N 2.261 H A 0037 ASP O
H A 0039 ALA N 3.152 H A 0037 ASP O
H A 0039 ALA N 2.262 H A 0038 ALA O
H A 0040 LEU N 2.963 H A 0037 ASP O
H A 0040 LEU N 2.262 H A 0039 ALA O
H A 0041 GLU N 2.924 H A 0037 ASP O
H A 0041 GLU N 2.964 H A 0038 ALA O
H A 0041 GLU N 2.262 H A 0040 LEU O
H A 0042 SER N 2.601 H A 0038 ALA O
H A 0042 SER N 2.262 H A 0041 GLU O
H A 0043 ALA N 2.884 H A 0039 ALA O
H A 0043 ALA N 2.261 H A 0042 SER O
H A 0044 TYR N 2.614 H A 0040 LEU O
H A 0044 TYR N 2.262 H A 0043 ALA O
H A 0045 GLY N 2.494 H A 0041 GLU O
H A 0045 GLY N 2.262 H A 0044 TYR O
H A 0046 LEU N 2.519 H A 0044 TYR O
H A 0046 LEU N 2.261 H A 0045 GLY O
H A 0047 ARG N 2.939 H A 0044 TYR O
H A 0047 ARG N 2.262 H A 0046 LEU O
H A 0048 VAL N 3.129 H A 0046 LEU O
H A 0048 VAL N 2.261 H A 0047 ARG O
C A 0049 PRO N 2.292 H A 0048 VAL O
C A 0050 VAL N 2.758 H A 0048 VAL O
C A 0050 VAL N 2.262 C A 0049 PRO O
E A 0051 LEU N 2.262 C A 0050 VAL O
E A 0052 ARG N 2.841 E A 0004 THR O
E A 0052 ARG N 2.262 E A 0051 LEU O
C A 0053 ASP N 2.262 E A 0052 ARG O
C A 0053 ASP N 2.905 C A 0057 ARG O
C A 0054 PRO N 2.293 C A 0053 ASP O
C A 0055 MET N 2.261 C A 0054 PRO O
C A 0056 GLY N 2.263 C A 0055 MET O
C A 0057 ARG N 2.262 C A 0056 GLY O
E A 0058 GLU N 2.261 C A 0057 ARG O
E A 0059 LEU N 2.748 E A 0051 LEU O
E A 0059 LEU N 2.262 E A 0058 GLU O
C A 0060 ASP N 2.261 E A 0059 LEU O
C A 0061 TRP N 2.262 C A 0060 ASP O
C A 0062 PRO N 2.293 C A 0061 TRP O
C A 0063 PHE N 2.261 C A 0062 PRO O
H A 0064 ASP N 2.262 C A 0063 PHE O
H A 0065 ALA N 2.263 H A 0064 ASP O
H A 0066 PRO N 2.293 H A 0065 ALA O
H A 0067 ARG N 2.261 H A 0066 PRO O
H A 0068 LEU N 2.969 H A 0064 ASP O
H A 0068 LEU N 2.262 H A 0067 ARG O
H A 0069 ARG N 2.951 H A 0065 ALA O
H A 0069 ARG N 2.261 H A 0068 LEU O
H A 0070 ALA N 3.000 H A 0066 PRO O
H A 0070 ALA N 2.262 H A 0069 ARG O
H A 0071 TRP N 3.002 H A 0069 ARG O
H A 0071 TRP N 2.262 H A 0070 ALA O
H A 0072 LEU N 2.912 H A 0068 LEU O
H A 0072 LEU N 2.670 H A 0069 ARG O
H A 0072 LEU N 2.261 H A 0071 TRP O
H A 0073 ASP N 2.695 H A 0069 ARG O
H A 0073 ASP N 2.261 H A 0072 LEU O
H A 0074 ALA N 3.181 H A 0071 TRP O
H A 0074 ALA N 2.892 H A 0072 LEU O
H A 0074 ALA N 2.261 H A 0073 ASP O
C A 0075 ALA N 2.616 H A 0072 LEU O
C A 0075 ALA N 2.818 H A 0073 ASP O
C A 0075 ALA N 2.261 H A 0074 ALA O
C A 0076 PRO N 2.293 C A 0075 ALA O
C A 0077 HIS N 2.262 C A 0076 PRO O
C A 0078 ALA N 2.262 C A 0077 HIS O
HB_MS 2.00 3.20 4
C A 0003 LEU O 2.431 E A 0004 THR OG1
C A 0011 CYS N 3.137 C A 0010 ASP OD1
H A 0037 ASP N 2.745 C A 0036 ASP OD1
C A 0057 ARG N 2.496 C A 0053 ASP OD2
HB_SS 2.00 3.20 3
H A 0019 GLU OE2 3.036 H A 0023 GLN NE2
E A 0031 SER OG 2.832 E A 0007 GLN OE1
E A 0058 GLU OE2 2.928 H A 0044 TYR OH
AROMATIC 0.00 8.00 4
C A 0061 TRP 5.353 C A 0063 PHE
E A 0052 ARG 7.969 H A 0044 TYR
E A 0052 ARG 7.594 E A 0006 TYR
H A 0069 ARG 6.044 C A 0077 HIS