Complet list of 1sfw con file
Complete list of 1sfw.con file
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 645
C A 0001 ALA CA 3.798 H A 0002 LEU CA
C A 0001 ALA C 2.470 H A 0002 LEU CA
C A 0001 ALA C 3.379 H A 0002 LEU C
C A 0001 ALA C 3.529 H A 0002 LEU CB
C A 0001 ALA CB 3.587 H A 0004 GLN CB
C A 0001 ALA CA 3.569 C A 0070 THR C
C A 0001 ALA CB 3.759 C A 0070 THR C
H A 0002 LEU C 2.493 H A 0003 TRP CA
H A 0002 LEU C 3.124 H A 0003 TRP C
H A 0002 LEU CD2 3.561 H A 0005 PHE CE1
H A 0002 LEU CD2 3.720 C A 0052 TYR CE2
H A 0002 LEU CB 3.673 C A 0069 TYR CB
H A 0002 LEU CG 3.729 C A 0069 TYR CB
H A 0002 LEU CG 3.558 C A 0069 TYR CG
H A 0002 LEU CG 3.584 C A 0069 TYR CD2
H A 0002 LEU CD1 3.722 C A 0069 TYR CD2
H A 0003 TRP C 2.486 H A 0004 GLN CA
H A 0003 TRP C 3.268 H A 0004 GLN C
H A 0003 TRP C 3.699 H A 0004 GLN CB
H A 0003 TRP CZ3 3.631 C A 0070 THR CG2
H A 0003 TRP CH2 3.667 C A 0070 THR CG2
H A 0004 GLN C 2.481 H A 0005 PHE CA
H A 0004 GLN C 3.198 H A 0005 PHE C
H A 0004 GLN C 3.741 H A 0005 PHE CB
H A 0004 GLN CB 3.702 C A 0073 TYR CB
H A 0004 GLN CG 3.724 C A 0073 TYR CB
H A 0004 GLN CD 3.682 C A 0073 TYR CB
H A 0005 PHE C 2.496 H A 0006 ARG CA
H A 0005 PHE C 3.394 H A 0006 ARG C
H A 0005 PHE C 3.671 H A 0006 ARG CB
H A 0005 PHE CD1 3.598 H A 0006 ARG CD
H A 0005 PHE CE1 3.347 H A 0006 ARG CD
H A 0005 PHE CE1 3.369 H A 0006 ARG CZ
H A 0005 PHE CZ 3.515 H A 0006 ARG CZ
H A 0005 PHE CA 3.550 H A 0008 MET CE
H A 0005 PHE CB 3.558 H A 0008 MET CE
H A 0005 PHE C 3.765 H A 0009 ILE CG1
H A 0005 PHE CD2 3.542 H A 0009 ILE CG1
H A 0005 PHE CD2 3.533 H A 0009 ILE CD1
H A 0005 PHE CE2 3.691 H A 0009 ILE CG1
H A 0005 PHE CE2 3.242 H A 0009 ILE CD1
H A 0005 PHE CE1 3.720 H A 0048 HIS CE1
H A 0005 PHE CZ 3.439 H A 0048 HIS CE1
H A 0005 PHE CB 3.435 C A 0073 TYR CE1
H A 0005 PHE CB 3.593 C A 0073 TYR CZ
H A 0005 PHE CG 3.728 H A 0099 ASP CB
H A 0005 PHE CD2 3.748 H A 0099 ASP CA
H A 0005 PHE CD2 3.569 H A 0099 ASP C
H A 0005 PHE CD2 3.536 H A 0099 ASP CB
H A 0005 PHE CE2 3.776 H A 0099 ASP C
H A 0006 ARG C 2.495 H A 0007 SER CA
H A 0006 ARG C 3.516 H A 0007 SER C
H A 0006 ARG C 3.523 H A 0007 SER CB
H A 0006 ARG CB 3.753 C A 0018 PRO CG
H A 0006 ARG CG 3.273 C A 0018 PRO CB
H A 0006 ARG CG 3.425 C A 0018 PRO CG
H A 0006 ARG CZ 3.532 C A 0019 LEU CG
H A 0007 SER CA 3.731 H A 0008 MET CA
H A 0007 SER C 2.504 H A 0008 MET CA
H A 0007 SER C 3.250 H A 0008 MET C
H A 0007 SER C 3.658 H A 0008 MET CB
H A 0008 MET C 2.530 H A 0009 ILE CA
H A 0008 MET C 3.250 H A 0009 ILE C
H A 0008 MET C 3.786 H A 0009 ILE CB
H A 0008 MET CE 3.245 C A 0073 TYR CE2
H A 0008 MET CE 3.609 C A 0073 TYR CZ
H A 0008 MET CB 3.587 C A 0075 TYR CD2
H A 0008 MET CB 3.730 C A 0075 TYR CE2
H A 0008 MET CG 3.181 C A 0075 TYR CD2
H A 0008 MET CG 3.372 C A 0075 TYR CE2
H A 0008 MET CB 3.692 C A 0082 ILE CG1
H A 0008 MET CB 3.563 C A 0082 ILE CD1
H A 0008 MET CE 3.709 H A 0100 ARG CD
H A 0009 ILE C 2.518 H A 0010 LYS CA
H A 0009 ILE C 3.406 H A 0010 LYS C
H A 0009 ILE C 3.783 H A 0010 LYS CB
H A 0009 ILE CA 3.670 H A 0012 ALA CB
H A 0009 ILE C 3.780 H A 0012 ALA CB
H A 0009 ILE CB 3.601 C A 0018 PRO CB
H A 0009 ILE CG2 3.494 C A 0018 PRO CA
H A 0009 ILE CG2 3.626 C A 0018 PRO C
H A 0009 ILE CG2 3.215 C A 0018 PRO CB
H A 0009 ILE CD1 3.523 H A 0103 ALA CA
H A 0009 ILE CD1 3.714 H A 0103 ALA CB
H A 0010 LYS C 2.469 H A 0011 CYS CA
H A 0010 LYS C 3.140 H A 0011 CYS C
H A 0010 LYS C 3.727 H A 0011 CYS CB
H A 0010 LYS CG 3.696 C A 0018 PRO CD
H A 0010 LYS CD 3.787 C A 0018 PRO CB
H A 0010 LYS CD 3.511 C A 0018 PRO CG
H A 0010 LYS CD 3.662 C A 0018 PRO CD
H A 0010 LYS CE 3.718 C A 0018 PRO CG
H A 0010 LYS CE 3.753 C A 0018 PRO CD
H A 0011 CYS C 2.516 H A 0012 ALA CA
H A 0011 CYS C 3.152 H A 0012 ALA C
H A 0011 CYS C 3.714 H A 0012 ALA CB
H A 0011 CYS CB 3.753 C A 0077 CYS CB
H A 0012 ALA C 2.480 C A 0013 ILE CA
H A 0012 ALA C 3.250 C A 0013 ILE C
H A 0012 ALA C 3.463 C A 0013 ILE CB
H A 0012 ALA C 3.725 C A 0013 ILE CG1
H A 0012 ALA C 3.777 C A 0013 ILE CD1
H A 0012 ALA C 3.728 C A 0107 SER CB
C A 0013 ILE CA 3.036 C A 0014 PRO CD
C A 0013 ILE C 2.566 C A 0014 PRO CA
C A 0013 ILE C 3.022 C A 0014 PRO C
C A 0013 ILE C 3.736 C A 0014 PRO CB
C A 0013 ILE C 3.679 C A 0014 PRO CG
C A 0013 ILE C 2.502 C A 0014 PRO CD
C A 0013 ILE C 3.391 C A 0015 GLY CA
C A 0013 ILE CG2 3.500 C A 0015 GLY CA
C A 0013 ILE CD1 3.708 H A 0106 PHE C
C A 0014 PRO CA 3.560 C A 0015 GLY CA
C A 0014 PRO C 2.426 C A 0015 GLY CA
C A 0014 PRO C 3.182 C A 0015 GLY C
C A 0015 GLY C 2.485 C A 0016 SER CA
C A 0015 GLY C 3.762 C A 0016 SER C
C A 0015 GLY C 3.159 C A 0016 SER CB
C A 0016 SER C 2.513 C A 0017 HIS CA
C A 0016 SER C 3.111 C A 0017 HIS C
C A 0017 HIS CA 3.020 C A 0018 PRO CD
C A 0017 HIS C 2.478 C A 0018 PRO CA
C A 0017 HIS C 3.155 C A 0018 PRO C
C A 0017 HIS C 3.681 C A 0018 PRO CB
C A 0017 HIS C 3.688 C A 0018 PRO CG
C A 0017 HIS C 2.506 C A 0018 PRO CD
C A 0017 HIS CB 3.588 C A 0020 MET CE
C A 0017 HIS CG 3.759 C A 0020 MET CB
C A 0017 HIS CD2 3.598 C A 0021 ASP CB
C A 0018 PRO C 2.495 C A 0019 LEU CA
C A 0018 PRO C 3.113 C A 0019 LEU C
C A 0018 PRO C 3.713 C A 0019 LEU CB
C A 0019 LEU C 2.598 C A 0020 MET CA
C A 0019 LEU C 3.283 C A 0020 MET C
C A 0019 LEU C 3.445 C A 0020 MET CB
C A 0019 LEU CB 3.759 C A 0020 MET CE
C A 0019 LEU C 3.759 C A 0021 ASP CA
C A 0019 LEU C 3.797 C A 0021 ASP C
C A 0019 LEU CD2 3.758 C A 0023 ASN CA
C A 0019 LEU CD2 3.742 C A 0030 GLY CA
C A 0019 LEU CD2 3.738 C A 0030 GLY C
C A 0019 LEU CD1 3.494 C A 0031 LEU CB
C A 0019 LEU CD2 3.504 C A 0031 LEU CB
C A 0020 MET CA 3.678 C A 0021 ASP CA
C A 0020 MET C 2.484 C A 0021 ASP CA
C A 0020 MET C 3.162 C A 0021 ASP C
C A 0020 MET C 3.756 C A 0021 ASP CB
C A 0021 ASP C 2.470 C A 0022 PHE CA
C A 0021 ASP C 3.658 C A 0022 PHE C
C A 0021 ASP C 3.294 C A 0022 PHE CB
C A 0021 ASP C 3.386 C A 0022 PHE CG
C A 0021 ASP C 3.368 C A 0022 PHE CD1
C A 0022 PHE C 2.552 C A 0023 ASN CA
C A 0022 PHE C 3.116 C A 0023 ASN C
C A 0022 PHE C 3.753 C A 0023 ASN CB
C A 0022 PHE C 3.791 C A 0025 TYR CB
C A 0022 PHE C 3.743 C A 0029 CYS C
C A 0022 PHE CE2 3.652 H A 0041 LEU CD1
C A 0022 PHE CE2 3.535 H A 0106 PHE CG
C A 0022 PHE CE2 3.373 H A 0106 PHE CD1
C A 0022 PHE CZ 3.562 H A 0106 PHE CA
C A 0022 PHE CZ 3.364 H A 0106 PHE CB
C A 0022 PHE CZ 3.614 H A 0106 PHE CG
C A 0023 ASN C 2.468 C A 0024 ASN CA
C A 0023 ASN C 3.188 C A 0024 ASN C
C A 0023 ASN C 3.675 C A 0024 ASN CB
C A 0023 ASN CG 3.724 C A 0031 LEU CG
C A 0023 ASN CG 3.564 C A 0031 LEU CD2
C A 0024 ASN C 2.534 C A 0025 TYR CA
C A 0024 ASN C 3.112 C A 0025 TYR C
C A 0024 ASN C 3.302 C A 0025 TYR CB
C A 0025 TYR C 2.528 C A 0026 GLY CA
C A 0025 TYR C 3.147 C A 0026 GLY C
C A 0025 TYR CE2 3.322 H A 0041 LEU CD1
C A 0025 TYR CE2 3.656 C A 0115 HIS CE1
C A 0025 TYR CD1 3.522 C A 0116 LYS CA
C A 0025 TYR C 3.494 C A 0118 LEU CD2
C A 0026 GLY CA 3.773 C A 0027 CYS CA
C A 0026 GLY C 2.463 C A 0027 CYS CA
C A 0026 GLY C 3.674 C A 0027 CYS C
C A 0026 GLY C 3.421 C A 0027 CYS CB
C A 0026 GLY CA 3.354 C A 0038 VAL CG1
C A 0026 GLY CA 3.749 C A 0038 VAL CG2
C A 0026 GLY C 3.194 C A 0038 VAL CG1
C A 0026 GLY CA 3.125 C A 0118 LEU CD2
C A 0026 GLY C 3.264 C A 0118 LEU CD2
C A 0027 CYS C 2.478 C A 0028 TYR CA
C A 0027 CYS C 3.103 C A 0028 TYR CB
C A 0027 CYS C 3.729 C A 0028 TYR CG
C A 0027 CYS CB 3.272 C A 0124 CYS CB
C A 0028 TYR C 2.478 C A 0029 CYS CA
C A 0028 TYR C 3.082 C A 0029 CYS C
C A 0028 TYR C 3.722 C A 0029 CYS CB
C A 0028 TYR CB 3.656 C A 0033 GLY CA
C A 0028 TYR CB 3.508 C A 0033 GLY C
C A 0028 TYR CD2 3.727 C A 0034 SER CA
C A 0028 TYR CE2 3.702 C A 0035 GLY C
C A 0028 TYR CE2 3.681 C A 0036 THR C
C A 0028 TYR CZ 3.561 C A 0036 THR C
C A 0029 CYS C 2.446 C A 0030 GLY CA
C A 0029 CYS C 3.258 C A 0030 GLY C
C A 0029 CYS CA 3.481 H A 0045 CYS CB
C A 0030 GLY C 2.462 C A 0031 LEU CA
C A 0030 GLY C 3.333 C A 0031 LEU C
C A 0030 GLY C 3.559 C A 0031 LEU CB
C A 0031 LEU CA 3.621 C A 0032 GLY CA
C A 0031 LEU C 2.396 C A 0032 GLY CA
C A 0031 LEU C 3.174 C A 0032 GLY C
C A 0032 GLY C 2.493 C A 0033 GLY CA
C A 0032 GLY C 3.294 C A 0033 GLY C
C A 0033 GLY C 2.497 C A 0034 SER CA
C A 0033 GLY C 3.793 C A 0034 SER C
C A 0033 GLY C 3.191 C A 0034 SER CB
C A 0034 SER C 2.493 C A 0035 GLY CA
C A 0034 SER C 3.667 C A 0035 GLY C
C A 0035 GLY C 2.500 C A 0036 THR CA
C A 0035 GLY C 3.660 C A 0036 THR C
C A 0035 GLY C 3.471 C A 0036 THR CB
C A 0036 THR CA 3.045 C A 0037 PRO CD
C A 0036 THR C 2.518 C A 0037 PRO CA
C A 0036 THR C 3.379 C A 0037 PRO C
C A 0036 THR C 3.581 C A 0037 PRO CB
C A 0036 THR C 3.688 C A 0037 PRO CG
C A 0036 THR C 2.511 C A 0037 PRO CD
C A 0036 THR CB 3.264 C A 0037 PRO CD
C A 0036 THR CG2 3.299 C A 0037 PRO CD
C A 0037 PRO C 2.490 C A 0038 VAL CA
C A 0037 PRO C 3.658 C A 0038 VAL C
C A 0037 PRO C 3.452 C A 0038 VAL CB
C A 0037 PRO C 3.413 C A 0038 VAL CG1
C A 0037 PRO CB 3.334 H A 0042 ASP C
C A 0037 PRO CB 3.363 H A 0042 ASP CB
C A 0037 PRO CG 3.617 H A 0043 ARG CD
C A 0037 PRO CG 3.546 H A 0043 ARG CZ
C A 0038 VAL C 2.509 C A 0039 ASP CA
C A 0038 VAL C 3.323 C A 0039 ASP C
C A 0038 VAL C 3.689 C A 0039 ASP CB
C A 0038 VAL CG2 3.558 C A 0115 HIS CG
C A 0038 VAL CG2 3.554 C A 0115 HIS CE1
C A 0039 ASP CA 3.794 H A 0040 GLU CA
C A 0039 ASP C 2.459 H A 0040 GLU CA
C A 0039 ASP C 2.969 H A 0040 GLU C
H A 0040 GLU C 2.443 H A 0041 LEU CA
H A 0040 GLU C 3.106 H A 0041 LEU C
H A 0040 GLU C 3.606 H A 0041 LEU CB
H A 0040 GLU CA 3.674 H A 0043 ARG CG
H A 0040 GLU CB 3.643 C A 0110 PRO CB
H A 0040 GLU CG 3.684 C A 0110 PRO CD
H A 0041 LEU C 2.474 H A 0042 ASP CA
H A 0041 LEU C 3.223 H A 0042 ASP C
H A 0041 LEU C 3.741 H A 0042 ASP CB
H A 0041 LEU CD2 3.621 H A 0105 CYS C
H A 0041 LEU CD2 3.625 C A 0109 ALA CB
H A 0041 LEU CG 3.556 C A 0111 TYR CD1
H A 0041 LEU CG 3.371 C A 0111 TYR CE1
H A 0041 LEU CD1 3.620 C A 0111 TYR CE1
H A 0041 LEU CD1 3.585 C A 0111 TYR CZ
H A 0041 LEU CD2 3.481 C A 0111 TYR CE1
H A 0042 ASP C 2.499 H A 0043 ARG CA
H A 0042 ASP C 3.191 H A 0043 ARG C
H A 0043 ARG C 2.472 H A 0044 CYS CA
H A 0043 ARG C 3.162 H A 0044 CYS C
H A 0043 ARG C 3.750 H A 0044 CYS CB
H A 0044 CYS C 2.489 H A 0045 CYS CA
H A 0044 CYS C 3.379 H A 0045 CYS C
H A 0044 CYS C 3.662 H A 0045 CYS CB
H A 0044 CYS CB 3.274 H A 0105 CYS CB
H A 0045 CYS C 2.493 H A 0046 GLU CA
H A 0045 CYS C 3.072 H A 0046 GLU C
H A 0045 CYS C 3.786 H A 0046 GLU CB
H A 0046 GLU C 2.497 H A 0047 THR CA
H A 0046 GLU C 3.409 H A 0047 THR C
H A 0046 GLU C 3.608 H A 0047 THR CB
H A 0047 THR C 2.491 H A 0048 HIS CA
H A 0047 THR C 3.264 H A 0048 HIS C
H A 0047 THR C 3.737 H A 0048 HIS CB
H A 0048 HIS C 2.524 H A 0049 ASP CA
H A 0048 HIS C 3.655 H A 0049 ASP C
H A 0048 HIS C 3.139 H A 0049 ASP CB
H A 0048 HIS C 3.588 H A 0049 ASP CG
H A 0048 HIS C 3.750 C A 0052 TYR CB
H A 0048 HIS CE1 3.752 C A 0052 TYR CG
H A 0048 HIS CE1 3.422 C A 0052 TYR CD2
H A 0048 HIS CE1 3.701 C A 0052 TYR CE1
H A 0048 HIS CE1 3.244 C A 0052 TYR CE2
H A 0048 HIS CE1 3.359 C A 0052 TYR CZ
H A 0048 HIS CD2 3.530 H A 0098 CYS C
H A 0048 HIS CG 3.733 H A 0102 ALA CB
H A 0048 HIS CD2 3.514 H A 0102 ALA CB
H A 0049 ASP C 2.518 H A 0050 ASN CA
H A 0049 ASP C 3.403 H A 0050 ASN C
H A 0049 ASP C 3.761 H A 0050 ASN CB
H A 0050 ASN C 2.455 C A 0051 CYS CA
H A 0050 ASN C 3.332 C A 0051 CYS C
H A 0050 ASN C 3.680 C A 0051 CYS CB
H A 0050 ASN CA 3.778 H A 0053 ARG CD
H A 0050 ASN C 3.584 H A 0053 ARG CD
C A 0051 CYS C 2.494 C A 0052 TYR CA
C A 0051 CYS C 3.315 C A 0052 TYR C
C A 0051 CYS C 3.737 C A 0052 TYR CB
C A 0052 TYR C 2.468 H A 0053 ARG CA
C A 0052 TYR C 3.075 H A 0053 ARG C
C A 0052 TYR C 3.633 H A 0053 ARG CB
C A 0052 TYR CD2 3.713 C A 0069 TYR CD1
C A 0052 TYR CE2 3.416 C A 0069 TYR CD1
C A 0052 TYR CD1 3.702 H A 0095 ILE CG2
C A 0052 TYR CE1 3.683 H A 0095 ILE CG2
H A 0053 ARG C 2.496 H A 0054 ASP CA
H A 0053 ARG C 3.306 H A 0054 ASP C
H A 0053 ARG C 3.705 H A 0054 ASP CB
H A 0053 ARG C 3.716 C A 0056 LYS CD
H A 0053 ARG CB 3.643 C A 0056 LYS CD
H A 0053 ARG CB 3.671 C A 0056 LYS CE
H A 0053 ARG CG 3.628 C A 0056 LYS CD
H A 0053 ARG CG 3.360 C A 0056 LYS CE
H A 0054 ASP CA 3.775 H A 0055 ALA CA
H A 0054 ASP C 2.490 H A 0055 ALA CA
H A 0054 ASP C 3.063 H A 0055 ALA C
H A 0054 ASP C 3.666 H A 0055 ALA CB
H A 0055 ALA C 2.505 C A 0056 LYS CA
H A 0055 ALA C 3.162 C A 0056 LYS C
H A 0055 ALA C 3.735 C A 0056 LYS CB
H A 0055 ALA CA 3.794 C A 0058 LEU CB
H A 0055 ALA CA 3.788 C A 0058 LEU CD2
H A 0055 ALA C 3.695 C A 0066 ASP CG
H A 0055 ALA CA 3.748 H A 0095 ILE CD1
H A 0055 ALA CB 3.219 H A 0095 ILE CD1
C A 0056 LYS C 2.511 C A 0057 ASN CA
C A 0056 LYS C 3.519 C A 0057 ASN C
C A 0056 LYS C 3.593 C A 0057 ASN CB
C A 0057 ASN C 2.528 C A 0058 LEU CA
C A 0057 ASN C 3.145 C A 0058 LEU C
C A 0057 ASN C 3.717 C A 0058 LEU CB
C A 0058 LEU CA 3.775 C A 0059 ASP CA
C A 0058 LEU C 2.491 C A 0059 ASP CA
C A 0058 LEU C 3.115 C A 0059 ASP C
C A 0058 LEU C 3.695 C A 0059 ASP CB
C A 0058 LEU CD2 3.452 H A 0090 ALA C
C A 0058 LEU CD1 3.700 H A 0094 PHE CG
C A 0058 LEU CD1 3.212 H A 0094 PHE CD2
C A 0058 LEU CD1 3.221 H A 0094 PHE CE2
C A 0058 LEU CD1 3.694 H A 0094 PHE CZ
C A 0058 LEU CD2 3.716 H A 0095 ILE CD1
C A 0059 ASP C 2.478 C A 0060 SER CA
C A 0059 ASP C 3.344 C A 0060 SER C
C A 0059 ASP C 3.546 C A 0060 SER CB
C A 0060 SER C 2.477 C A 0061 CYS CA
C A 0060 SER C 3.523 C A 0061 CYS C
C A 0060 SER C 3.446 C A 0061 CYS CB
C A 0060 SER CB 3.267 H A 0090 ALA CB
C A 0061 CYS C 2.496 C A 0062 LYS CA
C A 0061 CYS C 3.234 C A 0062 LYS C
C A 0061 CYS C 3.778 C A 0062 LYS CB
C A 0062 LYS C 2.504 C A 0063 PHE CA
C A 0062 LYS C 3.136 C A 0063 PHE C
C A 0062 LYS C 3.736 C A 0063 PHE CB
C A 0063 PHE C 2.490 C A 0064 LEU CA
C A 0063 PHE C 3.144 C A 0064 LEU C
C A 0063 PHE CE2 3.777 C A 0064 LEU CD2
C A 0064 LEU CA 3.769 C A 0065 VAL CA
C A 0064 LEU C 2.473 C A 0065 VAL CA
C A 0064 LEU C 3.579 C A 0065 VAL C
C A 0064 LEU C 3.350 C A 0065 VAL CB
C A 0065 VAL CA 3.737 C A 0066 ASP CA
C A 0065 VAL C 2.491 C A 0066 ASP CA
C A 0065 VAL C 3.288 C A 0066 ASP C
C A 0065 VAL C 3.765 C A 0066 ASP CB
C A 0066 ASP C 2.518 C A 0067 ASN CA
C A 0066 ASP C 3.256 C A 0067 ASN C
C A 0066 ASP C 3.169 C A 0067 ASN CB
C A 0066 ASP C 3.676 C A 0067 ASN CG
C A 0067 ASN CA 3.060 C A 0068 PRO CD
C A 0067 ASN C 2.516 C A 0068 PRO CA
C A 0067 ASN C 3.250 C A 0068 PRO C
C A 0067 ASN C 3.714 C A 0068 PRO CB
C A 0067 ASN C 3.684 C A 0068 PRO CG
C A 0067 ASN C 2.518 C A 0068 PRO CD
C A 0068 PRO C 2.482 C A 0069 TYR CA
C A 0068 PRO C 3.469 C A 0069 TYR C
C A 0068 PRO C 3.640 C A 0069 TYR CB
C A 0068 PRO C 3.695 C A 0069 TYR CD1
C A 0069 TYR C 2.460 C A 0070 THR CA
C A 0069 TYR C 3.141 C A 0070 THR CB
C A 0069 TYR C 3.719 C A 0070 THR CG2
C A 0070 THR C 2.474 C A 0071 GLU CA
C A 0070 THR C 3.283 C A 0071 GLU C
C A 0070 THR C 3.783 C A 0071 GLU CB
C A 0071 GLU C 2.475 C A 0072 SER CA
C A 0071 GLU C 3.521 C A 0072 SER C
C A 0071 GLU C 3.514 C A 0072 SER CB
C A 0071 GLU CB 3.483 H A 0095 ILE CG1
C A 0071 GLU CG 3.613 H A 0095 ILE CG1
C A 0072 SER C 2.543 C A 0073 TYR CA
C A 0072 SER C 3.607 C A 0073 TYR C
C A 0072 SER C 3.086 C A 0073 TYR CB
C A 0072 SER C 3.760 C A 0073 TYR CG
C A 0072 SER C 3.593 C A 0073 TYR CD1
C A 0072 SER CA 3.743 H A 0092 GLU CB
C A 0072 SER CB 3.705 H A 0092 GLU CA
C A 0072 SER CB 3.603 H A 0092 GLU C
C A 0072 SER CB 3.705 H A 0092 GLU CB
C A 0072 SER CB 3.667 H A 0096 CYS CB
C A 0073 TYR C 2.534 C A 0074 SER CA
C A 0073 TYR C 3.766 C A 0074 SER C
C A 0073 TYR C 2.999 C A 0074 SER CB
C A 0073 TYR CD2 3.638 C A 0075 TYR CB
C A 0073 TYR CD2 3.792 C A 0075 TYR CG
C A 0073 TYR CE1 3.513 H A 0099 ASP CB
C A 0073 TYR CE1 3.717 H A 0099 ASP CG
C A 0073 TYR CZ 3.774 H A 0099 ASP CB
C A 0074 SER C 2.488 C A 0075 TYR CA
C A 0074 SER C 3.511 C A 0075 TYR C
C A 0074 SER C 3.471 C A 0075 TYR CB
C A 0074 SER CB 3.776 C A 0085 ASN CA
C A 0075 TYR CA 3.788 C A 0076 SER CA
C A 0075 TYR C 2.502 C A 0076 SER CA
C A 0075 TYR C 3.792 C A 0076 SER C
C A 0075 TYR C 3.065 C A 0076 SER CB
C A 0075 TYR CB 3.689 C A 0082 ILE CG2
C A 0075 TYR CD2 3.756 C A 0082 ILE CG2
C A 0076 SER C 2.515 C A 0077 CYS CA
C A 0076 SER C 3.758 C A 0077 CYS C
C A 0076 SER C 3.080 C A 0077 CYS CB
C A 0076 SER C 3.708 C A 0082 ILE CG2
C A 0076 SER CB 3.797 C A 0082 ILE CA
C A 0076 SER CB 3.642 C A 0082 ILE C
C A 0076 SER CB 3.505 C A 0083 THR CG2
C A 0077 CYS C 2.478 C A 0078 SER CA
C A 0077 CYS C 3.550 C A 0078 SER C
C A 0077 CYS C 3.376 C A 0078 SER CB
C A 0077 CYS CA 3.666 C A 0082 ILE CG1
C A 0077 CYS CB 3.506 C A 0082 ILE CG1
C A 0078 SER C 2.518 C A 0079 ASN CA
C A 0078 SER C 3.163 C A 0079 ASN C
C A 0078 SER C 3.693 C A 0079 ASN CB
C A 0079 ASN C 2.542 C A 0080 THR CA
C A 0079 ASN C 3.130 C A 0080 THR CB
C A 0079 ASN C 3.549 C A 0080 THR CG2
C A 0080 THR C 2.519 C A 0081 GLU CA
C A 0080 THR C 3.584 C A 0081 GLU C
C A 0080 THR C 3.598 C A 0081 GLU CB
C A 0080 THR C 3.710 C A 0081 GLU CG
C A 0081 GLU CA 3.798 C A 0082 ILE CA
C A 0081 GLU C 2.460 C A 0082 ILE CA
C A 0081 GLU C 3.478 C A 0082 ILE C
C A 0081 GLU C 3.360 C A 0082 ILE CB
C A 0081 GLU C 3.406 C A 0082 ILE CG1
C A 0082 ILE C 2.520 C A 0083 THR CA
C A 0082 ILE C 3.726 C A 0083 THR C
C A 0082 ILE C 3.212 C A 0083 THR CB
C A 0082 ILE CB 3.722 H A 0100 ARG CZ
C A 0083 THR C 2.531 C A 0084 CYS CA
C A 0083 THR C 3.755 C A 0084 CYS C
C A 0083 THR C 3.208 C A 0084 CYS CB
C A 0083 THR C 3.731 H A 0100 ARG CD
C A 0084 CYS C 2.500 C A 0085 ASN CA
C A 0084 CYS C 3.712 C A 0085 ASN C
C A 0084 CYS C 3.282 C A 0085 ASN CB
C A 0084 CYS CB 3.263 H A 0100 ARG CG
C A 0085 ASN C 2.484 C A 0086 SER CA
C A 0085 ASN C 3.715 C A 0086 SER C
C A 0085 ASN C 3.277 C A 0086 SER CB
C A 0086 SER C 2.492 C A 0087 LYS CA
C A 0086 SER C 3.780 C A 0087 LYS C
C A 0086 SER C 3.178 C A 0087 LYS CB
C A 0086 SER C 3.791 C A 0087 LYS CG
C A 0086 SER C 3.711 C A 0087 LYS CD
C A 0087 LYS C 2.500 C A 0088 ASN CA
C A 0087 LYS C 3.314 C A 0088 ASN C
C A 0087 LYS C 3.373 C A 0088 ASN CB
C A 0087 LYS C 3.516 C A 0088 ASN CG
C A 0087 LYS CG 3.522 H A 0092 GLU CD
C A 0088 ASN CA 3.747 C A 0089 ASN CA
C A 0088 ASN C 2.479 C A 0089 ASN CA
C A 0088 ASN C 3.366 C A 0089 ASN C
C A 0088 ASN C 3.665 C A 0089 ASN CB
C A 0088 ASN CA 3.710 H A 0093 ALA CB
C A 0088 ASN CB 3.405 H A 0093 ALA CB
C A 0089 ASN C 2.483 H A 0090 ALA CA
C A 0089 ASN C 3.106 H A 0090 ALA C
C A 0089 ASN C 3.756 H A 0090 ALA CB
H A 0090 ALA C 2.510 H A 0091 CYS CA
H A 0090 ALA C 3.049 H A 0091 CYS C
H A 0090 ALA C 3.558 H A 0091 CYS CB
H A 0090 ALA CB 3.509 H A 0094 PHE CB
H A 0091 CYS C 2.498 H A 0092 GLU CA
H A 0091 CYS C 3.358 H A 0092 GLU C
H A 0091 CYS C 3.713 H A 0092 GLU CB
H A 0092 GLU C 2.479 H A 0093 ALA CA
H A 0092 GLU C 3.197 H A 0093 ALA C
H A 0092 GLU C 3.769 H A 0093 ALA CB
H A 0093 ALA C 2.470 H A 0094 PHE CA
H A 0093 ALA C 3.085 H A 0094 PHE C
H A 0093 ALA C 3.738 H A 0094 PHE CB
H A 0093 ALA CA 3.597 H A 0096 CYS CB
H A 0093 ALA C 3.746 H A 0096 CYS CB
H A 0094 PHE C 2.492 H A 0095 ILE CA
H A 0094 PHE C 3.115 H A 0095 ILE C
H A 0094 PHE CD1 3.643 H A 0095 ILE CD1
H A 0095 ILE C 2.524 H A 0096 CYS CA
H A 0095 ILE C 3.138 H A 0096 CYS C
H A 0095 ILE C 3.667 H A 0096 CYS CB
H A 0096 CYS C 2.504 H A 0097 ASN CA
H A 0096 CYS C 3.230 H A 0097 ASN C
H A 0096 CYS C 3.752 H A 0097 ASN CB
H A 0097 ASN C 2.487 H A 0098 CYS CA
H A 0097 ASN C 3.086 H A 0098 CYS C
H A 0097 ASN C 3.741 H A 0098 CYS CB
H A 0098 CYS C 2.515 H A 0099 ASP CA
H A 0098 CYS C 3.149 H A 0099 ASP C
H A 0098 CYS C 3.799 H A 0099 ASP CB
H A 0099 ASP C 2.461 H A 0100 ARG CA
H A 0099 ASP C 3.151 H A 0100 ARG C
H A 0099 ASP C 3.751 H A 0100 ARG CB
H A 0100 ARG C 2.456 H A 0101 ASN CA
H A 0100 ARG C 3.162 H A 0101 ASN C
H A 0100 ARG C 3.721 H A 0101 ASN CB
H A 0101 ASN C 2.477 H A 0102 ALA CA
H A 0101 ASN C 3.224 H A 0102 ALA C
H A 0101 ASN C 3.701 H A 0102 ALA CB
H A 0102 ALA C 2.527 H A 0103 ALA CA
H A 0102 ALA C 3.255 H A 0103 ALA C
H A 0102 ALA C 3.789 H A 0103 ALA CB
H A 0102 ALA C 3.719 H A 0106 PHE CD2
H A 0102 ALA CB 3.696 H A 0106 PHE CE2
H A 0103 ALA C 2.576 H A 0104 ILE CA
H A 0103 ALA C 3.474 H A 0104 ILE C
H A 0103 ALA C 3.629 H A 0104 ILE CB
H A 0103 ALA C 3.597 H A 0104 ILE CD1
H A 0104 ILE CA 3.769 H A 0105 CYS CA
H A 0104 ILE C 2.424 H A 0105 CYS CA
H A 0104 ILE C 3.033 H A 0105 CYS C
H A 0104 ILE C 3.679 H A 0105 CYS CB
H A 0104 ILE CA 3.517 C A 0108 LYS CE
H A 0104 ILE CB 3.772 C A 0108 LYS CE
H A 0104 ILE CG1 3.787 C A 0108 LYS CE
H A 0105 CYS C 2.468 H A 0106 PHE CA
H A 0105 CYS C 3.236 H A 0106 PHE C
H A 0105 CYS C 3.656 H A 0106 PHE CB
H A 0105 CYS C 3.792 H A 0106 PHE CD1
H A 0105 CYS C 3.783 C A 0109 ALA CB
H A 0106 PHE C 2.435 C A 0107 SER CA
H A 0106 PHE C 3.130 C A 0107 SER C
H A 0106 PHE C 3.727 C A 0107 SER CB
C A 0107 SER C 2.455 C A 0108 LYS CA
C A 0107 SER C 3.654 C A 0108 LYS C
C A 0107 SER C 3.323 C A 0108 LYS CB
C A 0107 SER C 3.548 C A 0108 LYS CG
C A 0107 SER CB 3.737 C A 0108 LYS CG
C A 0108 LYS C 2.527 C A 0109 ALA CA
C A 0108 LYS C 3.098 C A 0109 ALA C
C A 0108 LYS C 3.422 C A 0109 ALA CB
C A 0108 LYS C 3.724 C A 0111 TYR CD1
C A 0109 ALA CA 3.028 C A 0110 PRO CD
C A 0109 ALA C 2.523 C A 0110 PRO CA
C A 0109 ALA C 3.290 C A 0110 PRO C
C A 0109 ALA C 3.615 C A 0110 PRO CB
C A 0109 ALA C 3.343 C A 0110 PRO CG
C A 0109 ALA C 2.410 C A 0110 PRO CD
C A 0109 ALA CB 3.298 C A 0110 PRO CD
C A 0110 PRO CA 3.767 C A 0111 TYR CA
C A 0110 PRO C 2.471 C A 0111 TYR CA
C A 0110 PRO C 3.180 C A 0111 TYR C
C A 0110 PRO C 3.733 C A 0111 TYR CB
C A 0111 TYR C 2.468 C A 0112 ASN CA
C A 0111 TYR C 3.658 C A 0112 ASN C
C A 0111 TYR C 3.325 C A 0112 ASN CB
C A 0111 TYR C 3.521 C A 0112 ASN CG
C A 0112 ASN C 2.512 C A 0113 LYS CA
C A 0112 ASN C 3.539 C A 0113 LYS C
C A 0112 ASN C 3.448 C A 0113 LYS CB
C A 0112 ASN C 3.786 C A 0114 GLU CB
C A 0113 LYS CA 3.625 C A 0114 GLU CA
C A 0113 LYS CA 3.687 C A 0114 GLU CB
C A 0113 LYS C 2.453 C A 0114 GLU CA
C A 0113 LYS C 3.631 C A 0114 GLU C
C A 0113 LYS C 2.897 C A 0114 GLU CB
C A 0114 GLU C 2.487 C A 0115 HIS CA
C A 0114 GLU C 3.272 C A 0115 HIS C
C A 0114 GLU C 3.691 C A 0115 HIS CB
C A 0115 HIS C 2.466 C A 0116 LYS CA
C A 0115 HIS C 3.278 C A 0116 LYS C
C A 0115 HIS C 3.458 C A 0116 LYS CB
C A 0115 HIS CA 3.248 C A 0118 LEU CD1
C A 0115 HIS C 3.305 C A 0118 LEU CD1
C A 0115 HIS CB 3.366 C A 0118 LEU CD1
C A 0116 LYS CA 3.773 C A 0117 ASN CA
C A 0116 LYS C 2.481 C A 0117 ASN CA
C A 0116 LYS C 3.350 C A 0117 ASN C
C A 0116 LYS C 2.927 C A 0117 ASN CB
C A 0116 LYS CG 3.671 C A 0117 ASN CB
C A 0116 LYS C 3.647 C A 0118 LEU CD1
C A 0117 ASN C 2.521 C A 0118 LEU CA
C A 0117 ASN C 3.122 C A 0118 LEU C
C A 0117 ASN C 3.407 C A 0118 LEU CB
C A 0118 LEU CA 3.700 C A 0119 ASP CA
C A 0118 LEU C 2.500 C A 0119 ASP CA
C A 0118 LEU C 3.642 C A 0119 ASP C
C A 0118 LEU C 2.925 C A 0119 ASP CB
C A 0118 LEU CB 3.757 C A 0123 TYR CD2
C A 0118 LEU CG 3.211 C A 0123 TYR CG
C A 0118 LEU CG 3.523 C A 0123 TYR CD1
C A 0118 LEU CG 3.296 C A 0123 TYR CD2
C A 0118 LEU CG 3.680 C A 0123 TYR CE2
C A 0118 LEU CD2 3.371 C A 0123 TYR CB
C A 0118 LEU CD2 3.174 C A 0123 TYR CG
C A 0118 LEU CD2 3.459 C A 0123 TYR CD1
C A 0118 LEU CD2 3.793 C A 0123 TYR CD2
C A 0119 ASP C 2.494 C A 0120 THR CA
C A 0119 ASP C 3.636 C A 0120 THR C
C A 0119 ASP C 3.337 C A 0120 THR CB
C A 0119 ASP C 3.200 C A 0120 THR CG2
C A 0119 ASP CB 3.771 C A 0121 LYS CG
C A 0119 ASP CB 3.692 C A 0121 LYS CE
C A 0119 ASP CG 3.754 C A 0121 LYS CG
C A 0119 ASP CG 3.563 C A 0121 LYS CE
C A 0119 ASP C 3.672 C A 0123 TYR CB
C A 0119 ASP CB 3.560 C A 0123 TYR CD2
C A 0120 THR C 2.505 C A 0121 LYS CA
C A 0120 THR C 3.716 C A 0121 LYS C
C A 0120 THR C 3.289 C A 0121 LYS CB
C A 0120 THR C 3.613 C A 0121 LYS CG
C A 0120 THR CA 3.691 C A 0124 CYS CA
C A 0120 THR CA 3.689 C A 0124 CYS C
C A 0120 THR C 3.792 C A 0124 CYS CA
C A 0120 THR C 3.295 C A 0124 CYS C
C A 0121 LYS CA 3.786 C A 0122 LYS CA
C A 0121 LYS C 2.501 C A 0122 LYS CA
C A 0121 LYS C 3.200 C A 0122 LYS C
C A 0121 LYS C 3.600 C A 0122 LYS CB
C A 0122 LYS C 2.558 C A 0123 TYR CA
C A 0122 LYS C 3.358 C A 0123 TYR C
C A 0122 LYS C 3.486 C A 0123 TYR CB
C A 0122 LYS C 3.776 C A 0123 TYR CG
C A 0122 LYS CB 3.448 C A 0123 TYR CG
C A 0122 LYS CB 3.511 C A 0123 TYR CD1
C A 0122 LYS CB 3.510 C A 0123 TYR CD2
C A 0122 LYS CB 3.590 C A 0123 TYR CE1
C A 0122 LYS CB 3.644 C A 0123 TYR CE2
C A 0122 LYS CB 3.707 C A 0123 TYR CZ
C A 0122 LYS CD 3.618 C A 0123 TYR CE2
C A 0122 LYS CD 3.371 C A 0123 TYR CZ
C A 0123 TYR C 2.506 C A 0124 CYS CA
C A 0123 TYR C 3.779 C A 0124 CYS C
C A 0123 TYR C 3.113 C A 0124 CYS CB
CHARGE_ATTR 2.00 12.00 114
C A 0021 ASP OD1 10.25 H A 0006 ARG NH2
C A 0021 ASP OD2 10.40 H A 0006 ARG NH1
C A 0021 ASP OD2 8.439 H A 0006 ARG NH2
C A 0021 ASP OD1 7.169 C A 0017 HIS ND1
C A 0021 ASP OD1 4.819 C A 0017 HIS NE2
C A 0021 ASP OD2 8.041 C A 0017 HIS ND1
C A 0021 ASP OD2 5.899 C A 0017 HIS NE2
C A 0021 ASP OD1 9.198 C A 0113 LYS NZ
C A 0021 ASP OD2 9.942 C A 0113 LYS NZ
C A 0021 ASP OD1 9.547 C A 0115 HIS ND1
C A 0021 ASP OD1 9.660 C A 0115 HIS NE2
C A 0021 ASP OD2 9.823 C A 0115 HIS ND1
C A 0021 ASP OD2 9.803 C A 0115 HIS NE2
C A 0021 ASP OD1 4.036 C A 0116 LYS NZ
C A 0021 ASP OD2 5.913 C A 0116 LYS NZ
C A 0039 ASP OD1 10.07 H A 0043 ARG NH1
C A 0039 ASP OD1 11.77 H A 0043 ARG NH2
C A 0039 ASP OD2 10.25 H A 0043 ARG NH1
C A 0039 ASP OD2 11.62 H A 0043 ARG NH2
C A 0039 ASP OD1 9.895 C A 0113 LYS NZ
C A 0039 ASP OD2 9.769 C A 0113 LYS NZ
C A 0039 ASP OD1 5.241 C A 0115 HIS ND1
C A 0039 ASP OD1 3.351 C A 0115 HIS NE2
C A 0039 ASP OD2 6.208 C A 0115 HIS ND1
C A 0039 ASP OD2 4.467 C A 0115 HIS NE2
H A 0040 GLU OE1 8.588 H A 0043 ARG NH1
H A 0040 GLU OE1 9.407 H A 0043 ARG NH2
H A 0040 GLU OE2 6.773 H A 0043 ARG NH1
H A 0040 GLU OE2 7.296 H A 0043 ARG NH2
H A 0040 GLU OE1 11.46 C A 0115 HIS NE2
H A 0040 GLU OE2 11.48 C A 0115 HIS NE2
H A 0042 ASP OD1 11.54 H A 0006 ARG NH2
H A 0042 ASP OD2 11.64 H A 0006 ARG NH1
H A 0042 ASP OD2 10.75 H A 0006 ARG NH2
H A 0042 ASP OD1 9.470 H A 0043 ARG NH1
H A 0042 ASP OD1 10.55 H A 0043 ARG NH2
H A 0042 ASP OD2 9.733 H A 0043 ARG NH1
H A 0042 ASP OD2 10.53 H A 0043 ARG NH2
H A 0042 ASP OD1 3.725 C A 0115 HIS ND1
H A 0042 ASP OD1 4.353 C A 0115 HIS NE2
H A 0042 ASP OD2 4.756 C A 0115 HIS ND1
H A 0042 ASP OD2 6.185 C A 0115 HIS NE2
H A 0042 ASP OD1 11.69 C A 0116 LYS NZ
H A 0042 ASP OD2 11.48 C A 0116 LYS NZ
H A 0046 GLU OE1 8.431 H A 0043 ARG NH1
H A 0046 GLU OE1 6.926 H A 0043 ARG NH2
H A 0046 GLU OE2 6.833 H A 0043 ARG NH1
H A 0046 GLU OE2 5.541 H A 0043 ARG NH2
H A 0046 GLU OE1 10.99 H A 0048 HIS ND1
H A 0046 GLU OE1 6.801 H A 0053 ARG NH1
H A 0046 GLU OE1 6.889 H A 0053 ARG NH2
H A 0046 GLU OE2 8.762 H A 0053 ARG NH1
H A 0046 GLU OE2 8.447 H A 0053 ARG NH2
H A 0049 ASP OD1 8.579 H A 0006 ARG NH1
H A 0049 ASP OD1 9.824 H A 0006 ARG NH2
H A 0049 ASP OD2 9.941 H A 0006 ARG NH1
H A 0049 ASP OD2 10.79 H A 0006 ARG NH2
H A 0049 ASP OD2 11.49 H A 0043 ARG NH1
H A 0049 ASP OD2 10.37 H A 0043 ARG NH2
H A 0049 ASP OD1 6.599 H A 0048 HIS ND1
H A 0049 ASP OD1 8.216 H A 0048 HIS NE2
H A 0049 ASP OD2 7.925 H A 0048 HIS ND1
H A 0049 ASP OD2 9.536 H A 0048 HIS NE2
H A 0049 ASP OD1 6.473 H A 0053 ARG NH1
H A 0049 ASP OD1 8.335 H A 0053 ARG NH2
H A 0049 ASP OD2 6.715 H A 0053 ARG NH1
H A 0049 ASP OD2 8.088 H A 0053 ARG NH2
H A 0049 ASP OD1 11.15 C A 0056 LYS NZ
H A 0054 ASP OD1 7.134 H A 0053 ARG NH1
H A 0054 ASP OD1 6.693 H A 0053 ARG NH2
H A 0054 ASP OD2 9.013 H A 0053 ARG NH1
H A 0054 ASP OD2 8.843 H A 0053 ARG NH2
H A 0054 ASP OD1 7.367 C A 0056 LYS NZ
H A 0054 ASP OD2 8.945 C A 0056 LYS NZ
H A 0054 ASP OD1 10.84 C A 0062 LYS NZ
H A 0054 ASP OD2 9.647 C A 0062 LYS NZ
C A 0059 ASP OD1 5.423 C A 0062 LYS NZ
C A 0059 ASP OD2 6.496 C A 0062 LYS NZ
C A 0066 ASP OD1 8.301 C A 0056 LYS NZ
C A 0066 ASP OD2 9.835 C A 0056 LYS NZ
C A 0066 ASP OD1 11.08 C A 0062 LYS NZ
C A 0066 ASP OD2 11.96 C A 0062 LYS NZ
C A 0071 GLU OE2 11.76 C A 0056 LYS NZ
C A 0081 GLU OE1 8.144 H A 0100 ARG NH1
C A 0081 GLU OE1 7.369 H A 0100 ARG NH2
C A 0081 GLU OE2 6.359 H A 0100 ARG NH1
C A 0081 GLU OE2 5.722 H A 0100 ARG NH2
C A 0081 GLU OE1 5.769 C A 0108 LYS NZ
C A 0081 GLU OE2 4.167 C A 0108 LYS NZ
H A 0092 GLU OE1 5.414 C A 0087 LYS NZ
H A 0092 GLU OE2 6.217 C A 0087 LYS NZ
H A 0099 ASP OD1 6.574 H A 0006 ARG NH1
H A 0099 ASP OD1 7.507 H A 0006 ARG NH2
H A 0099 ASP OD2 8.813 H A 0006 ARG NH1
H A 0099 ASP OD2 9.741 H A 0006 ARG NH2
H A 0099 ASP OD1 4.506 H A 0048 HIS ND1
H A 0099 ASP OD1 3.278 H A 0048 HIS NE2
H A 0099 ASP OD2 6.022 H A 0048 HIS ND1
H A 0099 ASP OD2 4.113 H A 0048 HIS NE2
H A 0099 ASP OD1 10.59 H A 0100 ARG NH1
H A 0099 ASP OD1 10.49 H A 0100 ARG NH2
H A 0099 ASP OD2 10.54 H A 0100 ARG NH1
H A 0099 ASP OD2 10.92 H A 0100 ARG NH2
C A 0114 GLU OE1 6.351 C A 0113 LYS NZ
C A 0114 GLU OE2 7.808 C A 0113 LYS NZ
C A 0114 GLU OE1 8.373 C A 0115 HIS ND1
C A 0114 GLU OE1 6.938 C A 0115 HIS NE2
C A 0114 GLU OE2 7.087 C A 0115 HIS ND1
C A 0114 GLU OE2 6.242 C A 0115 HIS NE2
C A 0114 GLU OE2 11.73 C A 0122 LYS NZ
C A 0119 ASP OD1 4.725 C A 0121 LYS NZ
C A 0119 ASP OD2 3.975 C A 0121 LYS NZ
C A 0119 ASP OD1 8.374 C A 0122 LYS NZ
C A 0119 ASP OD2 7.468 C A 0122 LYS NZ
CHARGE_REPU 2.00 12.00 97
H A 0006 ARG NH1 11.37 H A 0010 LYS NZ
H A 0006 ARG NH2 11.00 H A 0010 LYS NZ
H A 0006 ARG NH1 11.95 C A 0017 HIS NE2
H A 0006 ARG NH2 11.32 C A 0017 HIS ND1
H A 0006 ARG NH2 10.72 C A 0017 HIS NE2
H A 0006 ARG NH1 4.813 H A 0048 HIS ND1
H A 0006 ARG NH1 6.626 H A 0048 HIS NE2
H A 0006 ARG NH2 5.639 H A 0048 HIS ND1
H A 0006 ARG NH2 7.305 H A 0048 HIS NE2
H A 0006 ARG NH2 11.75 H A 0100 ARG NH2
H A 0006 ARG NH2 11.77 C A 0116 LYS NZ
H A 0010 LYS NZ 10.15 C A 0017 HIS ND1
H A 0010 LYS NZ 11.18 C A 0017 HIS NE2
C A 0017 HIS ND1 5.139 C A 0116 LYS NZ
C A 0017 HIS NE2 3.406 C A 0116 LYS NZ
C A 0021 ASP OD1 11.91 C A 0039 ASP OD1
C A 0021 ASP OD1 11.05 C A 0039 ASP OD2
C A 0021 ASP OD2 11.55 C A 0039 ASP OD1
C A 0021 ASP OD2 10.31 C A 0039 ASP OD2
C A 0021 ASP OD1 9.817 H A 0042 ASP OD1
C A 0021 ASP OD1 10.22 H A 0042 ASP OD2
C A 0021 ASP OD2 9.224 H A 0042 ASP OD1
C A 0021 ASP OD2 9.661 H A 0042 ASP OD2
C A 0021 ASP OD1 11.88 C A 0114 GLU OE2
C A 0039 ASP OD1 8.296 H A 0040 GLU OE1
C A 0039 ASP OD1 8.604 H A 0040 GLU OE2
C A 0039 ASP OD2 7.407 H A 0040 GLU OE1
C A 0039 ASP OD2 7.676 H A 0040 GLU OE2
C A 0039 ASP OD1 5.247 H A 0042 ASP OD1
C A 0039 ASP OD1 7.456 H A 0042 ASP OD2
C A 0039 ASP OD2 5.025 H A 0042 ASP OD1
C A 0039 ASP OD2 7.298 H A 0042 ASP OD2
C A 0039 ASP OD1 8.203 C A 0114 GLU OE1
C A 0039 ASP OD1 8.215 C A 0114 GLU OE2
C A 0039 ASP OD2 9.558 C A 0114 GLU OE1
C A 0039 ASP OD2 9.768 C A 0114 GLU OE2
H A 0040 GLU OE1 10.73 H A 0042 ASP OD1
H A 0040 GLU OE2 9.926 H A 0042 ASP OD1
H A 0040 GLU OE2 11.29 H A 0042 ASP OD2
H A 0042 ASP OD1 11.79 H A 0046 GLU OE1
H A 0042 ASP OD1 11.50 H A 0046 GLU OE2
H A 0042 ASP OD2 10.46 H A 0046 GLU OE1
H A 0042 ASP OD2 10.33 H A 0046 GLU OE2
H A 0042 ASP OD1 11.24 H A 0049 ASP OD2
H A 0042 ASP OD2 10.80 H A 0049 ASP OD1
H A 0042 ASP OD2 9.457 H A 0049 ASP OD2
H A 0042 ASP OD1 11.27 C A 0114 GLU OE1
H A 0042 ASP OD1 10.43 C A 0114 GLU OE2
H A 0042 ASP OD2 11.82 C A 0114 GLU OE2
H A 0043 ARG NH1 11.73 C A 0115 HIS ND1
H A 0043 ARG NH1 11.84 C A 0115 HIS NE2
H A 0046 GLU OE1 6.391 H A 0049 ASP OD1
H A 0046 GLU OE1 4.378 H A 0049 ASP OD2
H A 0046 GLU OE2 8.449 H A 0049 ASP OD1
H A 0046 GLU OE2 6.268 H A 0049 ASP OD2
H A 0048 HIS ND1 10.66 H A 0053 ARG NH1
H A 0048 HIS NE2 10.97 H A 0053 ARG NH1
H A 0048 HIS NE2 11.40 H A 0100 ARG NH1
H A 0048 HIS NE2 11.24 H A 0100 ARG NH2
H A 0049 ASP OD1 10.42 H A 0099 ASP OD1
H A 0049 ASP OD1 11.43 H A 0099 ASP OD2
H A 0053 ARG NH1 6.077 C A 0056 LYS NZ
H A 0053 ARG NH2 6.524 C A 0056 LYS NZ
H A 0054 ASP OD1 10.12 C A 0059 ASP OD1
H A 0054 ASP OD1 8.140 C A 0059 ASP OD2
H A 0054 ASP OD2 8.306 C A 0059 ASP OD1
H A 0054 ASP OD2 6.212 C A 0059 ASP OD2
H A 0054 ASP OD1 10.04 C A 0066 ASP OD1
H A 0054 ASP OD1 10.61 C A 0066 ASP OD2
H A 0054 ASP OD2 9.607 C A 0066 ASP OD1
H A 0054 ASP OD2 9.845 C A 0066 ASP OD2
H A 0054 ASP OD2 11.89 C A 0071 GLU OE1
C A 0066 ASP OD1 5.380 C A 0071 GLU OE1
C A 0066 ASP OD1 5.330 C A 0071 GLU OE2
C A 0066 ASP OD2 3.170 C A 0071 GLU OE1
C A 0066 ASP OD2 3.536 C A 0071 GLU OE2
C A 0066 ASP OD2 11.23 H A 0092 GLU OE1
C A 0066 ASP OD2 10.76 H A 0092 GLU OE2
C A 0066 ASP OD2 11.04 H A 0099 ASP OD2
C A 0071 GLU OE1 8.310 H A 0092 GLU OE1
C A 0071 GLU OE1 8.024 H A 0092 GLU OE2
C A 0071 GLU OE2 9.706 H A 0092 GLU OE1
C A 0071 GLU OE2 9.806 H A 0092 GLU OE2
C A 0071 GLU OE1 11.47 H A 0099 ASP OD1
C A 0071 GLU OE1 9.851 H A 0099 ASP OD2
C A 0071 GLU OE2 10.79 H A 0099 ASP OD1
C A 0071 GLU OE2 9.551 H A 0099 ASP OD2
H A 0092 GLU OE1 10.28 H A 0099 ASP OD2
H A 0092 GLU OE2 11.81 H A 0099 ASP OD2
H A 0100 ARG NH1 8.079 C A 0108 LYS NZ
H A 0100 ARG NH2 7.253 C A 0108 LYS NZ
C A 0113 LYS NZ 10.63 C A 0115 HIS ND1
C A 0113 LYS NZ 8.950 C A 0115 HIS NE2
C A 0113 LYS NZ 11.78 C A 0116 LYS NZ
C A 0115 HIS ND1 10.74 C A 0116 LYS NZ
C A 0115 HIS NE2 11.54 C A 0116 LYS NZ
C A 0121 LYS NZ 3.915 C A 0122 LYS NZ
HB_MM 2.00 3.20 180
H A 0002 LEU N 2.257 C A 0001 ALA O
H A 0003 TRP N 2.256 H A 0002 LEU O
H A 0004 GLN N 2.276 H A 0003 TRP O
H A 0005 PHE N 3.110 C A 0001 ALA O
H A 0005 PHE N 2.291 H A 0004 GLN O
H A 0006 ARG N 2.839 H A 0002 LEU O
H A 0006 ARG N 2.253 H A 0005 PHE O
H A 0007 SER N 2.251 H A 0006 ARG O
H A 0008 MET N 2.250 H A 0007 SER O
H A 0009 ILE N 2.865 H A 0005 PHE O
H A 0009 ILE N 2.241 H A 0008 MET O
H A 0010 LYS N 2.249 H A 0009 ILE O
H A 0011 CYS N 2.243 H A 0010 LYS O
H A 0012 ALA N 2.835 H A 0008 MET O
H A 0012 ALA N 2.284 H A 0011 CYS O
C A 0013 ILE N 3.079 H A 0009 ILE O
C A 0013 ILE N 2.238 H A 0012 ALA O
C A 0014 PRO N 2.266 C A 0013 ILE O
C A 0015 GLY N 2.279 C A 0014 PRO O
C A 0016 SER N 2.286 C A 0015 GLY O
C A 0017 HIS N 2.266 C A 0016 SER O
C A 0018 PRO N 2.241 C A 0017 HIS O
C A 0019 LEU N 2.285 C A 0018 PRO O
C A 0020 MET N 2.297 C A 0019 LEU O
C A 0021 ASP N 2.558 C A 0019 LEU O
C A 0021 ASP N 2.265 C A 0020 MET O
C A 0022 PHE N 2.871 C A 0019 LEU O
C A 0022 PHE N 2.248 C A 0021 ASP O
C A 0023 ASN N 2.270 C A 0022 PHE O
C A 0023 ASN N 3.140 C A 0029 CYS O
C A 0024 ASN N 3.096 C A 0022 PHE O
C A 0024 ASN N 2.272 C A 0023 ASN O
C A 0025 TYR N 2.284 C A 0024 ASN O
C A 0026 GLY N 2.262 C A 0025 TYR O
C A 0026 GLY N 3.141 C A 0115 HIS O
C A 0027 CYS N 3.050 C A 0025 TYR O
C A 0027 CYS N 2.263 C A 0026 GLY O
C A 0028 TYR N 3.058 C A 0024 ASN O
C A 0028 TYR N 2.267 C A 0027 CYS O
C A 0029 CYS N 2.971 C A 0022 PHE O
C A 0029 CYS N 2.251 C A 0028 TYR O
C A 0030 GLY N 2.232 C A 0029 CYS O
C A 0031 LEU N 3.025 C A 0029 CYS O
C A 0031 LEU N 2.276 C A 0030 GLY O
C A 0032 GLY N 3.070 C A 0023 ASN O
C A 0032 GLY N 3.120 C A 0028 TYR O
C A 0032 GLY N 2.287 C A 0031 LEU O
C A 0033 GLY N 2.267 C A 0032 GLY O
C A 0034 SER N 2.271 C A 0033 GLY O
C A 0035 GLY N 2.274 C A 0034 SER O
C A 0036 THR N 2.270 C A 0035 GLY O
C A 0037 PRO N 2.229 C A 0036 THR O
C A 0038 VAL N 2.269 C A 0037 PRO O
C A 0039 ASP N 2.281 C A 0038 VAL O
H A 0040 GLU N 2.286 C A 0039 ASP O
H A 0041 LEU N 2.270 H A 0040 GLU O
H A 0042 ASP N 2.262 H A 0041 LEU O
H A 0043 ARG N 3.023 C A 0039 ASP O
H A 0043 ARG N 3.163 H A 0040 GLU O
H A 0043 ARG N 2.248 H A 0042 ASP O
H A 0044 CYS N 2.277 H A 0043 ARG O
H A 0045 CYS N 2.258 H A 0044 CYS O
H A 0046 GLU N 3.188 H A 0042 ASP O
H A 0046 GLU N 3.034 H A 0043 ARG O
H A 0046 GLU N 2.273 H A 0045 CYS O
H A 0047 THR N 3.157 H A 0043 ARG O
H A 0047 THR N 2.267 H A 0046 GLU O
H A 0048 HIS N 2.801 H A 0044 CYS O
H A 0048 HIS N 2.238 H A 0047 THR O
H A 0049 ASP N 3.153 H A 0047 THR O
H A 0049 ASP N 2.286 H A 0048 HIS O
H A 0050 ASN N 3.025 H A 0046 GLU O
H A 0050 ASN N 2.281 H A 0049 ASP O
C A 0051 CYS N 2.798 H A 0047 THR O
C A 0051 CYS N 2.248 H A 0050 ASN O
C A 0052 TYR N 2.280 C A 0051 CYS O
H A 0053 ARG N 3.143 H A 0049 ASP O
H A 0053 ARG N 2.270 C A 0052 TYR O
H A 0054 ASP N 2.282 H A 0053 ARG O
H A 0055 ALA N 2.870 H A 0053 ARG O
H A 0055 ALA N 2.265 H A 0054 ASP O
C A 0056 LYS N 2.852 H A 0053 ARG O
C A 0056 LYS N 2.278 H A 0055 ALA O
C A 0057 ASN N 3.130 H A 0054 ASP O
C A 0057 ASN N 2.282 C A 0056 LYS O
C A 0058 LEU N 2.866 H A 0054 ASP O
C A 0058 LEU N 2.278 C A 0057 ASN O
C A 0059 ASP N 2.285 C A 0058 LEU O
C A 0060 SER N 2.281 C A 0059 ASP O
C A 0061 CYS N 2.291 C A 0060 SER O
C A 0062 LYS N 2.271 C A 0061 CYS O
C A 0063 PHE N 2.270 C A 0062 LYS O
C A 0064 LEU N 2.276 C A 0063 PHE O
C A 0065 VAL N 2.283 C A 0064 LEU O
C A 0066 ASP N 2.283 C A 0065 VAL O
C A 0067 ASN N 2.284 C A 0066 ASP O
C A 0068 PRO N 2.255 C A 0067 ASN O
C A 0069 TYR N 3.004 C A 0067 ASN O
C A 0069 TYR N 2.261 C A 0068 PRO O
C A 0070 THR N 2.270 C A 0069 TYR O
C A 0071 GLU N 2.242 C A 0070 THR O
C A 0072 SER N 2.257 C A 0071 GLU O
C A 0073 TYR N 2.290 C A 0072 SER O
C A 0074 SER N 2.307 C A 0073 TYR O
C A 0074 SER N 2.967 C A 0084 CYS O
C A 0075 TYR N 2.250 C A 0074 SER O
C A 0076 SER N 2.276 C A 0075 TYR O
C A 0077 CYS N 2.281 C A 0076 SER O
C A 0078 SER N 2.270 C A 0077 CYS O
C A 0078 SER N 2.800 C A 0081 GLU O
C A 0079 ASN N 2.261 C A 0078 SER O
C A 0080 THR N 3.112 C A 0078 SER O
C A 0080 THR N 2.281 C A 0079 ASN O
C A 0081 GLU N 2.268 C A 0080 THR O
C A 0082 ILE N 2.247 C A 0081 GLU O
C A 0083 THR N 2.264 C A 0082 ILE O
C A 0084 CYS N 2.268 C A 0083 THR O
C A 0085 ASN N 2.281 C A 0084 CYS O
C A 0086 SER N 2.257 C A 0085 ASN O
C A 0087 LYS N 2.270 C A 0086 SER O
C A 0088 ASN N 2.262 C A 0087 LYS O
C A 0089 ASN N 2.265 C A 0088 ASN O
H A 0090 ALA N 2.247 C A 0089 ASN O
H A 0091 CYS N 2.237 H A 0090 ALA O
H A 0092 GLU N 3.098 C A 0089 ASN O
H A 0092 GLU N 3.044 H A 0090 ALA O
H A 0092 GLU N 2.277 H A 0091 CYS O
H A 0093 ALA N 2.967 C A 0089 ASN O
H A 0093 ALA N 2.263 H A 0092 GLU O
H A 0094 PHE N 2.798 H A 0090 ALA O
H A 0094 PHE N 3.197 H A 0092 GLU O
H A 0094 PHE N 2.271 H A 0093 ALA O
H A 0095 ILE N 2.961 H A 0092 GLU O
H A 0095 ILE N 2.276 H A 0094 PHE O
H A 0096 CYS N 2.998 H A 0092 GLU O
H A 0096 CYS N 2.276 H A 0095 ILE O
H A 0097 ASN N 3.159 H A 0093 ALA O
H A 0097 ASN N 2.276 H A 0096 CYS O
H A 0098 CYS N 3.132 H A 0095 ILE O
H A 0098 CYS N 2.267 H A 0097 ASN O
H A 0099 ASP N 2.887 H A 0095 ILE O
H A 0099 ASP N 2.272 H A 0098 CYS O
H A 0100 ARG N 3.047 H A 0096 CYS O
H A 0100 ARG N 2.243 H A 0099 ASP O
H A 0101 ASN N 3.133 H A 0097 ASN O
H A 0101 ASN N 2.255 H A 0100 ARG O
H A 0102 ALA N 3.099 H A 0098 CYS O
H A 0102 ALA N 3.189 H A 0099 ASP O
H A 0102 ALA N 2.262 H A 0101 ASN O
H A 0103 ALA N 2.788 H A 0099 ASP O
H A 0103 ALA N 2.975 H A 0100 ARG O
H A 0103 ALA N 2.240 H A 0102 ALA O
H A 0104 ILE N 3.180 H A 0100 ARG O
H A 0104 ILE N 2.261 H A 0103 ALA O
H A 0105 CYS N 3.195 H A 0101 ASN O
H A 0105 CYS N 2.223 H A 0104 ILE O
H A 0106 PHE N 2.752 H A 0102 ALA O
H A 0106 PHE N 2.243 H A 0105 CYS O
C A 0107 SER N 2.861 H A 0103 ALA O
C A 0107 SER N 2.258 H A 0106 PHE O
C A 0108 LYS N 2.276 C A 0107 SER O
C A 0109 ALA N 3.181 H A 0104 ILE O
C A 0109 ALA N 2.991 H A 0105 CYS O
C A 0109 ALA N 2.281 C A 0108 LYS O
C A 0110 PRO N 2.226 C A 0109 ALA O
C A 0111 TYR N 2.281 C A 0110 PRO O
C A 0112 ASN N 2.258 C A 0111 TYR O
C A 0113 LYS N 2.271 C A 0112 ASN O
C A 0114 GLU N 2.274 C A 0113 LYS O
C A 0115 HIS N 2.275 C A 0114 GLU O
C A 0116 LYS N 2.207 C A 0115 HIS O
C A 0117 ASN N 2.278 C A 0116 LYS O
C A 0118 LEU N 2.930 C A 0116 LYS O
C A 0118 LEU N 2.312 C A 0117 ASN O
C A 0119 ASP N 2.276 C A 0118 LEU O
C A 0120 THR N 2.256 C A 0119 ASP O
C A 0121 LYS N 2.255 C A 0120 THR O
C A 0122 LYS N 2.268 C A 0121 LYS O
C A 0123 TYR N 2.282 C A 0122 LYS O
C A 0124 CYS N 2.277 C A 0123 TYR O
HB_MS 2.00 3.20 20
C A 0001 ALA N 3.094 C A 0072 SER OG
C A 0001 ALA N 3.168 H A 0099 ASP OD2
H A 0002 LEU N 3.052 C A 0052 TYR OH
H A 0011 CYS O 2.747 C A 0080 THR OG1
H A 0012 ALA O 2.969 C A 0080 THR OG1
H A 0012 ALA O 2.781 C A 0107 SER OG
C A 0017 HIS N 3.121 C A 0016 SER OG
C A 0031 LEU O 2.784 C A 0069 TYR OH
C A 0035 GLY N 3.174 C A 0034 SER OG
H A 0046 GLU O 3.034 H A 0050 ASN ND2
H A 0049 ASP O 3.117 H A 0053 ARG NH1
C A 0066 ASP O 2.900 C A 0070 THR OG1
C A 0067 ASN O 2.939 C A 0070 THR OG1
C A 0069 TYR O 2.787 C A 0070 THR OG1
C A 0075 TYR O 3.106 C A 0076 SER OG
C A 0079 ASN N 3.010 C A 0078 SER OG
C A 0083 THR O 3.061 H A 0100 ARG NH1
H A 0090 ALA N 3.134 C A 0060 SER OG
C A 0112 ASN O 2.750 C A 0025 TYR OH
C A 0112 ASN O 3.016 C A 0115 HIS NE2
HB_SS 2.00 3.20 4
H A 0046 GLU OE2 3.194 C A 0028 TYR OH
H A 0046 GLU OE1 3.128 H A 0050 ASN ND2
H A 0053 ARG NH2 3.110 H A 0050 ASN OD1
H A 0099 ASP OD1 2.957 C A 0052 TYR OH
AROMATIC 0.00 8.00 10
C A 0113 LYS 7.932 C A 0111 TYR
H A 0006 ARG 5.171 C A 0022 PHE
C A 0121 LYS 5.919 C A 0123 TYR
H A 0006 ARG 4.643 H A 0005 PHE
C A 0025 TYR 5.219 C A 0115 HIS
C A 0116 LYS 7.192 C A 0025 TYR
H A 0006 ARG 4.505 H A 0106 PHE
C A 0116 LYS 4.418 C A 0017 HIS
H A 0006 ARG 6.006 H A 0048 HIS
H A 0006 ARG 6.541 C A 0069 TYR
SS_BOND 1.50 2.80 7
H A 0011 CYS SG 1.985 C A 0077 CYS SG
C A 0027 CYS SG 1.973 C A 0124 CYS SG
C A 0029 CYS SG 1.990 H A 0045 CYS SG
H A 0044 CYS SG 1.992 H A 0105 CYS SG
C A 0051 CYS SG 2.009 H A 0098 CYS SG
C A 0061 CYS SG 2.017 H A 0091 CYS SG
C A 0084 CYS SG 1.977 H A 0096 CYS SG