Complet list of 1niq con file
Complete list of 1niq.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 476
C B 0002 THR C 2.505 C B 0003 ASP CA
C B 0002 THR C 3.197 C B 0003 ASP C
C B 0002 THR C 3.699 C B 0003 ASP CB
C B 0003 ASP C 2.489 E B 0004 GLN CA
C B 0003 ASP C 3.708 E B 0004 GLN C
C B 0003 ASP C 3.361 E B 0004 GLN CB
E B 0004 GLN C 2.498 E B 0005 ALA CA
E B 0004 GLN C 3.404 E B 0005 ALA C
E B 0004 GLN C 3.618 E B 0005 ALA CB
E B 0005 ALA C 2.497 E B 0006 THR CA
E B 0005 ALA C 3.513 E B 0006 THR C
E B 0005 ALA C 3.674 E B 0006 THR CB
E B 0006 THR CA 3.050 E B 0007 PRO CD
E B 0006 THR C 2.506 E B 0007 PRO CA
E B 0006 THR C 3.304 E B 0007 PRO C
E B 0006 THR C 3.631 E B 0007 PRO CB
E B 0006 THR C 3.692 E B 0007 PRO CG
E B 0006 THR C 2.508 E B 0007 PRO CD
E B 0007 PRO C 2.492 E B 0008 ASN CA
E B 0007 PRO C 3.400 E B 0008 ASN C
E B 0007 PRO C 3.681 E B 0008 ASN CB
E B 0007 PRO CB 3.543 E B 0062 CYS CB
E B 0008 ASN C 2.494 E B 0009 LEU CA
E B 0008 ASN C 3.670 E B 0009 LEU C
E B 0008 ASN C 3.405 E B 0009 LEU CB
E B 0008 ASN C 3.502 E B 0009 LEU CG
E B 0008 ASN CG 3.729 E B 0035 TRP CH2
E B 0009 LEU CA 3.069 E B 0010 PRO CD
E B 0009 LEU C 2.511 E B 0010 PRO CA
E B 0009 LEU C 3.425 E B 0010 PRO C
E B 0009 LEU C 3.570 E B 0010 PRO CB
E B 0009 LEU C 3.694 E B 0010 PRO CG
E B 0009 LEU C 2.519 E B 0010 PRO CD
E B 0009 LEU CB 3.526 E B 0010 PRO CD
E B 0009 LEU CB 3.664 E B 0047 PHE CE2
E B 0009 LEU CD1 3.789 E B 0047 PHE CZ
E B 0009 LEU CD2 3.773 C B 0112 THR CG2
E B 0010 PRO C 2.494 E B 0011 SER CA
E B 0010 PRO C 3.659 E B 0011 SER C
E B 0010 PRO C 3.411 E B 0011 SER CB
E B 0010 PRO C 3.768 E B 0047 PHE CD2
E B 0010 PRO CD 3.778 C B 0060 PHE CG
E B 0011 SER C 2.499 C B 0012 ARG CA
E B 0011 SER C 3.277 C B 0012 ARG C
E B 0011 SER C 3.751 C B 0012 ARG CB
C B 0012 ARG C 2.516 H B 0013 ASP CA
C B 0012 ARG C 3.539 H B 0013 ASP C
C B 0012 ARG C 3.544 H B 0013 ASP CB
H B 0013 ASP C 2.498 H B 0014 PHE CA
H B 0013 ASP C 3.301 H B 0014 PHE C
H B 0013 ASP C 3.749 H B 0014 PHE CB
H B 0014 PHE C 2.494 H B 0015 ASP CA
H B 0014 PHE C 3.167 H B 0015 ASP C
H B 0014 PHE C 3.775 H B 0015 ASP CB
H B 0014 PHE CE2 3.745 C B 0033 ALA C
H B 0014 PHE CE1 3.794 E B 0049 ALA CB
H B 0015 ASP C 2.510 H B 0016 SER CA
H B 0015 ASP C 3.188 H B 0016 SER C
H B 0015 ASP C 3.759 H B 0016 SER CB
H B 0016 SER C 2.509 H B 0017 THR CA
H B 0016 SER C 3.225 H B 0017 THR C
H B 0016 SER C 3.799 H B 0017 THR CB
H B 0017 THR C 2.506 H B 0018 ALA CA
H B 0017 THR C 3.204 H B 0018 ALA C
H B 0017 THR C 3.738 H B 0018 ALA CB
H B 0018 ALA C 2.497 H B 0019 ALA CA
H B 0018 ALA C 3.198 H B 0019 ALA C
H B 0018 ALA C 3.716 H B 0019 ALA CB
H B 0019 ALA C 2.504 H B 0020 PHE CA
H B 0019 ALA C 3.166 H B 0020 PHE C
H B 0019 ALA C 3.734 H B 0020 PHE CB
H B 0020 PHE C 2.493 H B 0021 TYR CA
H B 0020 PHE C 3.284 H B 0021 TYR C
H B 0020 PHE C 3.714 H B 0021 TYR CB
H B 0020 PHE CE1 3.798 C B 0081 ILE CG1
H B 0020 PHE CE1 3.675 C B 0081 ILE CD1
H B 0020 PHE CZ 3.730 C B 0081 ILE CD1
H B 0020 PHE CE1 3.470 C B 0089 PRO CB
H B 0020 PHE CE2 3.773 C B 0108 ASP CA
H B 0020 PHE CE2 3.517 C B 0108 ASP CB
H B 0021 TYR C 2.502 H B 0022 GLU CA
H B 0021 TYR C 3.269 H B 0022 GLU C
H B 0021 TYR C 3.705 H B 0022 GLU CB
H B 0021 TYR CE2 3.471 E B 0047 PHE CZ
H B 0021 TYR CZ 3.610 E B 0047 PHE CZ
H B 0022 GLU C 2.509 H B 0023 ARG CA
H B 0022 GLU C 3.152 H B 0023 ARG C
H B 0023 ARG C 2.501 H B 0024 LEU CA
H B 0023 ARG C 3.357 H B 0024 LEU C
H B 0023 ARG C 3.704 H B 0024 LEU CB
H B 0024 LEU C 2.499 C B 0025 GLY CA
H B 0024 LEU C 3.397 C B 0025 GLY C
H B 0024 LEU CD1 3.789 C B 0081 ILE CD1
C B 0025 GLY C 2.496 C B 0026 PHE CA
C B 0025 GLY C 3.326 C B 0026 PHE C
C B 0025 GLY C 3.715 C B 0026 PHE CB
C B 0025 GLY C 3.674 E B 0040 ARG CB
C B 0025 GLY C 3.715 E B 0040 ARG CG
C B 0026 PHE C 2.478 E B 0027 GLY CA
C B 0026 PHE C 3.231 E B 0027 GLY C
C B 0026 PHE CE2 3.655 E B 0043 LEU CB
C B 0026 PHE CE2 3.798 E B 0045 LEU CG
C B 0026 PHE CE2 3.515 E B 0045 LEU CD1
E B 0027 GLY C 2.492 E B 0028 ILE CA
E B 0027 GLY C 3.236 E B 0028 ILE C
E B 0027 GLY C 3.760 E B 0028 ILE CB
E B 0028 ILE C 2.508 E B 0029 VAL CA
E B 0028 ILE C 3.291 E B 0029 VAL C
E B 0028 ILE C 3.795 E B 0029 VAL CB
E B 0028 ILE CG1 3.730 E B 0038 LEU CD2
E B 0029 VAL C 2.507 E B 0030 PHE CA
E B 0029 VAL C 3.661 E B 0030 PHE C
E B 0029 VAL C 3.347 E B 0030 PHE CB
E B 0030 PHE C 2.496 E B 0031 ARG CA
E B 0030 PHE C 3.749 E B 0031 ARG C
E B 0030 PHE C 3.219 E B 0031 ARG CB
E B 0030 PHE CZ 3.620 C B 0032 ASP CG
E B 0030 PHE CE1 3.730 E B 0035 TRP C
E B 0030 PHE CE1 3.745 E B 0035 TRP CD1
E B 0030 PHE CD1 3.780 E B 0037 ILE CG1
E B 0031 ARG C 2.497 C B 0032 ASP CA
E B 0031 ARG C 3.569 C B 0032 ASP C
E B 0031 ARG C 3.490 C B 0032 ASP CB
C B 0032 ASP C 2.520 C B 0033 ALA CA
C B 0032 ASP C 3.204 C B 0033 ALA CB
C B 0033 ALA C 2.499 C B 0034 GLY CA
C B 0033 ALA C 3.427 C B 0034 GLY C
C B 0034 GLY C 2.504 E B 0035 TRP CA
C B 0034 GLY C 3.706 E B 0035 TRP C
C B 0034 GLY C 3.322 E B 0035 TRP CB
E B 0035 TRP C 2.504 E B 0036 MET CA
E B 0035 TRP C 3.736 E B 0036 MET C
E B 0035 TRP C 3.280 E B 0036 MET CB
E B 0035 TRP CD1 3.800 E B 0037 ILE CG1
E B 0035 TRP CE3 3.640 E B 0048 PHE CB
E B 0035 TRP CZ3 3.737 E B 0048 PHE CB
E B 0036 MET C 2.497 E B 0037 ILE CA
E B 0036 MET C 3.355 E B 0037 ILE C
E B 0036 MET C 3.719 E B 0037 ILE CB
E B 0037 ILE C 2.505 E B 0038 LEU CA
E B 0037 ILE C 3.479 E B 0038 LEU C
E B 0037 ILE C 3.595 E B 0038 LEU CB
E B 0038 LEU C 2.491 E B 0039 GLN CA
E B 0038 LEU C 3.709 E B 0039 GLN C
E B 0038 LEU C 3.323 E B 0039 GLN CB
E B 0038 LEU CD1 3.793 E B 0047 PHE CD1
E B 0039 GLN C 2.501 E B 0040 ARG CA
E B 0039 GLN C 3.358 E B 0040 ARG C
E B 0039 GLN C 3.719 E B 0040 ARG CB
E B 0040 ARG C 2.488 C B 0041 GLY CA
E B 0040 ARG C 3.153 C B 0041 GLY C
C B 0041 GLY C 2.489 C B 0042 ASP CA
C B 0041 GLY C 3.422 C B 0042 ASP C
C B 0041 GLY C 3.645 C B 0042 ASP CB
C B 0042 ASP C 2.509 E B 0043 LEU CA
C B 0042 ASP C 3.468 E B 0043 LEU C
C B 0042 ASP C 3.658 E B 0043 LEU CB
E B 0043 LEU C 2.502 E B 0044 MET CA
E B 0043 LEU C 3.362 E B 0044 MET C
E B 0043 LEU C 3.694 E B 0044 MET CB
E B 0044 MET C 2.504 E B 0045 LEU CA
E B 0044 MET C 3.601 E B 0045 LEU C
E B 0044 MET C 3.542 E B 0045 LEU CB
E B 0044 MET C 3.770 E B 0045 LEU CG
E B 0045 LEU C 2.490 E B 0046 GLU CA
E B 0045 LEU C 3.417 E B 0046 GLU C
E B 0045 LEU C 3.646 E B 0046 GLU CB
E B 0046 GLU C 2.489 E B 0047 PHE CA
E B 0046 GLU C 3.436 E B 0047 PHE C
E B 0046 GLU C 3.615 E B 0047 PHE CB
E B 0047 PHE C 2.493 E B 0048 PHE CA
E B 0047 PHE C 3.365 E B 0048 PHE C
E B 0047 PHE C 3.678 E B 0048 PHE CB
E B 0048 PHE C 2.490 E B 0049 ALA CA
E B 0048 PHE C 3.205 E B 0049 ALA C
E B 0048 PHE C 3.703 E B 0049 ALA CB
E B 0048 PHE CE1 3.784 C B 0050 HIS CD2
E B 0049 ALA C 2.491 C B 0050 HIS CA
E B 0049 ALA C 3.655 C B 0050 HIS C
E B 0049 ALA C 3.376 C B 0050 HIS CB
E B 0049 ALA C 3.628 C B 0051 PRO CD
C B 0050 HIS CA 3.049 C B 0051 PRO CD
C B 0050 HIS C 2.516 C B 0051 PRO CA
C B 0050 HIS C 3.311 C B 0051 PRO C
C B 0050 HIS C 3.667 C B 0051 PRO CB
C B 0050 HIS C 3.684 C B 0051 PRO CG
C B 0050 HIS C 2.513 C B 0051 PRO CD
C B 0051 PRO C 2.492 C B 0052 GLY CA
C B 0051 PRO C 3.334 C B 0052 GLY C
C B 0052 GLY C 2.496 C B 0053 LEU CA
C B 0052 GLY C 3.613 C B 0053 LEU C
C B 0052 GLY C 3.437 C B 0053 LEU CB
C B 0053 LEU C 2.482 C B 0054 ASP CA
C B 0053 LEU C 3.322 C B 0054 ASP C
C B 0053 LEU C 3.648 C B 0054 ASP CB
C B 0054 ASP CA 3.053 C B 0055 PRO CD
C B 0054 ASP C 2.522 C B 0055 PRO CA
C B 0054 ASP C 3.247 C B 0055 PRO C
C B 0054 ASP C 3.696 C B 0055 PRO CB
C B 0054 ASP C 3.643 C B 0055 PRO CG
C B 0054 ASP C 2.507 C B 0055 PRO CD
C B 0055 PRO C 2.501 C B 0056 LEU CA
C B 0055 PRO C 3.250 C B 0056 LEU C
C B 0055 PRO C 3.753 C B 0056 LEU CB
C B 0056 LEU C 2.499 C B 0057 ALA CA
C B 0056 LEU C 3.397 C B 0057 ALA C
C B 0056 LEU C 3.653 C B 0057 ALA CB
C B 0057 ALA C 2.501 C B 0058 SER CA
C B 0057 ALA C 3.320 C B 0058 SER C
C B 0057 ALA C 3.685 C B 0058 SER CB
C B 0058 SER C 2.504 C B 0059 TRP CA
C B 0058 SER C 3.326 C B 0059 TRP C
C B 0058 SER C 3.712 C B 0059 TRP CB
C B 0059 TRP C 2.494 C B 0060 PHE CA
C B 0059 TRP C 3.646 C B 0060 PHE C
C B 0059 TRP C 3.419 C B 0060 PHE CB
C B 0059 TRP C 3.603 C B 0060 PHE CG
C B 0059 TRP C 3.719 C B 0060 PHE CD2
C B 0060 PHE C 2.494 E B 0061 SER CA
C B 0060 PHE C 3.573 E B 0061 SER C
C B 0060 PHE C 3.523 E B 0061 SER CB
E B 0061 SER C 2.498 E B 0062 CYS CA
E B 0061 SER C 3.775 E B 0062 CYS C
E B 0061 SER C 3.201 E B 0062 CYS CB
E B 0062 CYS C 2.480 E B 0063 CYS CA
E B 0062 CYS C 3.331 E B 0063 CYS C
E B 0062 CYS C 3.701 E B 0063 CYS CB
E B 0063 CYS C 2.494 E B 0064 LEU CA
E B 0063 CYS C 3.368 E B 0064 LEU C
E B 0063 CYS C 3.699 E B 0064 LEU CB
E B 0064 LEU C 2.499 C B 0065 ARG CA
E B 0064 LEU C 3.422 C B 0065 ARG C
E B 0064 LEU C 3.642 C B 0065 ARG CB
E B 0064 LEU CD1 3.693 H B 0072 PHE CE2
E B 0064 LEU CD1 3.741 E B 0116 LEU CD2
C B 0065 ARG C 2.505 C B 0066 LEU CA
C B 0065 ARG C 3.396 C B 0066 LEU C
C B 0065 ARG C 3.685 C B 0066 LEU CB
C B 0065 ARG CA 3.784 C B 0122 LEU CD2
C B 0065 ARG CZ 3.513 C B 0122 LEU CD1
C B 0066 LEU C 2.509 C B 0067 ASP CA
C B 0066 LEU C 3.240 C B 0067 ASP C
C B 0066 LEU C 3.786 C B 0067 ASP CB
C B 0066 LEU CD1 3.745 H B 0072 PHE CB
C B 0067 ASP C 2.561 H B 0068 ASP CA
C B 0067 ASP C 3.615 H B 0068 ASP C
C B 0067 ASP C 3.692 H B 0068 ASP CB
C B 0067 ASP CA 3.688 C B 0119 ASN CB
C B 0067 ASP CG 3.443 C B 0119 ASN CB
H B 0068 ASP C 2.500 H B 0069 LEU CA
H B 0068 ASP C 3.426 H B 0069 LEU C
H B 0068 ASP C 3.665 H B 0069 LEU CB
H B 0069 LEU C 2.493 H B 0070 ALA CA
H B 0069 LEU C 3.221 H B 0070 ALA C
H B 0069 LEU C 3.728 H B 0070 ALA CB
H B 0069 LEU CD1 3.749 E B 0116 LEU C
H B 0069 LEU CD1 3.603 E B 0116 LEU CB
H B 0070 ALA C 2.517 H B 0071 GLU CA
H B 0070 ALA C 3.108 H B 0071 GLU C
H B 0070 ALA C 3.788 H B 0071 GLU CB
H B 0071 GLU C 2.488 H B 0072 PHE CA
H B 0071 GLU C 3.222 H B 0072 PHE C
H B 0071 GLU C 3.730 H B 0072 PHE CB
H B 0072 PHE C 2.486 H B 0073 TYR CA
H B 0072 PHE C 3.248 H B 0073 TYR C
H B 0072 PHE C 3.737 H B 0073 TYR CB
H B 0072 PHE CE2 3.761 E B 0116 LEU CD2
H B 0073 TYR C 2.504 H B 0074 ARG CA
H B 0073 TYR C 3.189 H B 0074 ARG C
H B 0073 TYR C 3.763 H B 0074 ARG CB
H B 0073 TYR CZ 3.741 E B 0092 HIS C
H B 0073 TYR CZ 3.792 E B 0093 ALA CA
H B 0074 ARG C 2.510 H B 0075 GLN CA
H B 0074 ARG C 3.130 H B 0075 GLN C
H B 0074 ARG C 3.740 H B 0075 GLN CB
H B 0075 GLN C 2.505 H B 0076 CYS CA
H B 0075 GLN C 3.174 H B 0076 CYS C
H B 0075 GLN C 3.742 H B 0076 CYS CB
H B 0076 CYS C 2.502 H B 0077 LYS CA
H B 0076 CYS C 3.216 H B 0077 LYS C
H B 0076 CYS C 3.779 H B 0077 LYS CB
H B 0077 LYS C 2.508 H B 0078 SER CA
H B 0077 LYS C 3.360 H B 0078 SER C
H B 0077 LYS C 3.721 H B 0078 SER CB
H B 0077 LYS CG 3.623 E B 0091 ILE CD1
H B 0078 SER C 2.510 H B 0079 VAL CA
H B 0078 SER C 3.250 H B 0079 VAL C
H B 0079 VAL C 2.501 H B 0080 GLY CA
H B 0079 VAL C 3.697 H B 0080 GLY C
H B 0080 GLY C 2.501 C B 0081 ILE CA
H B 0080 GLY C 3.619 C B 0081 ILE C
H B 0080 GLY C 3.476 C B 0081 ILE CB
H B 0080 GLY C 3.451 C B 0081 ILE CG1
C B 0081 ILE C 2.488 C B 0082 GLN CA
C B 0081 ILE C 3.334 C B 0082 GLN C
C B 0081 ILE C 3.706 C B 0082 GLN CB
C B 0082 GLN C 2.500 C B 0083 GLU CA
C B 0082 GLN C 3.265 C B 0083 GLU C
C B 0082 GLN C 3.680 C B 0083 GLU CB
C B 0083 GLU C 2.500 C B 0084 THR CA
C B 0083 GLU C 3.756 C B 0084 THR C
C B 0083 GLU C 3.307 C B 0084 THR CB
C B 0083 GLU CA 3.796 E B 0091 ILE CG1
C B 0084 THR C 2.492 C B 0085 SER CA
C B 0084 THR C 3.226 C B 0085 SER C
C B 0084 THR C 3.737 C B 0085 SER CB
C B 0084 THR CG2 3.639 E B 0090 ARG CB
C B 0085 SER C 2.497 C B 0086 SER CA
C B 0085 SER C 3.459 C B 0086 SER C
C B 0085 SER C 3.605 C B 0086 SER CB
C B 0086 SER C 2.489 C B 0087 GLY CA
C B 0086 SER C 3.774 C B 0087 GLY C
C B 0087 GLY C 2.486 C B 0088 TYR CA
C B 0087 GLY C 3.727 C B 0088 TYR C
C B 0087 GLY C 3.283 C B 0088 TYR CB
C B 0088 TYR CA 3.089 C B 0089 PRO CA
C B 0088 TYR CA 3.462 C B 0089 PRO C
C B 0088 TYR C 2.536 C B 0089 PRO CA
C B 0088 TYR C 3.365 C B 0089 PRO C
C B 0088 TYR C 3.658 C B 0089 PRO CB
C B 0088 TYR C 3.673 C B 0089 PRO CG
C B 0088 TYR C 2.483 C B 0089 PRO CD
C B 0089 PRO C 2.504 E B 0090 ARG CA
C B 0089 PRO C 3.755 E B 0090 ARG C
C B 0089 PRO C 3.332 E B 0090 ARG CB
E B 0090 ARG C 2.514 E B 0091 ILE CA
E B 0090 ARG C 3.680 E B 0091 ILE C
E B 0090 ARG C 3.489 E B 0091 ILE CB
E B 0090 ARG C 3.642 E B 0091 ILE CG2
E B 0090 ARG CD 3.776 E B 0092 HIS CE1
E B 0091 ILE C 2.511 E B 0092 HIS CA
E B 0091 ILE C 3.678 E B 0092 HIS C
E B 0091 ILE C 3.488 E B 0092 HIS CB
E B 0091 ILE C 3.572 E B 0092 HIS CG
E B 0091 ILE C 3.682 E B 0092 HIS CD2
E B 0091 ILE CG2 3.530 E B 0106 LEU CD1
E B 0092 HIS C 2.492 E B 0093 ALA CA
E B 0092 HIS C 3.357 E B 0093 ALA C
E B 0092 HIS C 3.655 E B 0093 ALA CB
E B 0093 ALA CA 3.050 E B 0094 PRO CD
E B 0093 ALA C 2.525 E B 0094 PRO CA
E B 0093 ALA C 3.293 E B 0094 PRO C
E B 0093 ALA C 3.695 E B 0094 PRO CB
E B 0093 ALA C 3.623 E B 0094 PRO CG
E B 0093 ALA C 2.511 E B 0094 PRO CD
E B 0093 ALA CB 3.570 E B 0094 PRO CD
E B 0093 ALA C 3.744 E B 0104 ALA CB
E B 0094 PRO C 2.514 E B 0095 GLU CA
E B 0094 PRO C 3.686 E B 0095 GLU C
E B 0094 PRO C 3.471 E B 0095 GLU CB
E B 0094 PRO C 3.687 E B 0095 GLU CG
E B 0095 GLU C 2.544 C B 0096 LEU CA
E B 0095 GLU C 3.717 C B 0096 LEU C
E B 0095 GLU C 3.493 C B 0096 LEU CB
E B 0095 GLU C 3.623 C B 0096 LEU CG
C B 0096 LEU C 2.531 C B 0097 GLN CA
C B 0096 LEU C 3.127 C B 0097 GLN CB
C B 0096 LEU C 3.219 C B 0097 GLN CG
C B 0096 LEU CD2 3.780 C B 0125 ILE CD1
C B 0097 GLN C 2.604 C B 0098 GLU CA
C B 0097 GLN CA 3.760 C B 0125 ILE CG2
C B 0097 GLN C 3.331 C B 0125 ILE CG2
C B 0097 GLN CB 3.365 C B 0125 ILE C
C B 0097 GLN C 3.783 C B 0126 SER C
C B 0098 GLU C 2.605 C B 0099 TRP CA
C B 0098 GLU C 3.593 C B 0099 TRP CB
C B 0098 GLU C 3.789 C B 0099 TRP CD1
C B 0098 GLU CA 3.274 C B 0125 ILE CG2
C B 0098 GLU C 3.673 C B 0125 ILE CG2
C B 0098 GLU CA 3.702 C B 0126 SER C
C B 0099 TRP C 2.551 C B 0100 GLY CA
C B 0099 TRP CE3 3.589 C B 0123 ALA C
C B 0099 TRP CZ3 3.615 C B 0123 ALA C
C B 0099 TRP C 3.737 C B 0125 ILE CG1
C B 0099 TRP CD1 3.670 C B 0126 SER CB
C B 0100 GLY C 2.550 C B 0101 GLY CA
C B 0100 GLY C 3.797 C B 0101 GLY C
C B 0100 GLY C 3.680 C B 0123 ALA CB
C B 0100 GLY CA 3.592 C B 0125 ILE CG1
C B 0100 GLY C 3.310 C B 0125 ILE CG1
C B 0100 GLY C 3.580 C B 0125 ILE CD1
C B 0101 GLY C 2.526 C B 0102 THR CA
C B 0101 GLY C 3.783 C B 0102 THR C
C B 0101 GLY C 3.406 C B 0102 THR CB
C B 0101 GLY CA 3.790 C B 0123 ALA C
C B 0101 GLY C 3.790 C B 0124 GLY CA
C B 0101 GLY CA 3.765 C B 0125 ILE CD1
C B 0101 GLY C 3.733 C B 0125 ILE CG1
C B 0101 GLY C 3.721 C B 0125 ILE CD1
C B 0102 THR C 2.529 E B 0103 MET CA
C B 0102 THR C 3.798 E B 0103 MET C
C B 0102 THR C 3.328 E B 0103 MET CB
E B 0103 MET C 2.526 E B 0104 ALA CA
E B 0103 MET C 3.684 E B 0104 ALA C
E B 0103 MET C 3.445 E B 0104 ALA CB
E B 0104 ALA C 2.515 E B 0105 ALA CA
E B 0104 ALA C 3.746 E B 0105 ALA C
E B 0104 ALA C 3.397 E B 0105 ALA CB
E B 0105 ALA C 2.519 E B 0106 LEU CA
E B 0105 ALA C 3.723 E B 0106 LEU C
E B 0105 ALA C 3.345 E B 0106 LEU CB
E B 0106 LEU C 2.512 E B 0107 VAL CA
E B 0106 LEU C 3.569 E B 0107 VAL C
E B 0106 LEU C 3.558 E B 0107 VAL CB
E B 0106 LEU C 3.665 E B 0107 VAL CG2
E B 0107 VAL C 2.507 C B 0108 ASP CA
E B 0107 VAL C 3.490 C B 0108 ASP C
E B 0107 VAL C 3.574 C B 0108 ASP CB
C B 0108 ASP CA 3.073 C B 0109 PRO CD
C B 0108 ASP C 2.526 C B 0109 PRO CA
C B 0108 ASP C 3.270 C B 0109 PRO C
C B 0108 ASP C 3.703 C B 0109 PRO CB
C B 0108 ASP C 3.632 C B 0109 PRO CG
C B 0108 ASP C 2.516 C B 0109 PRO CD
C B 0108 ASP CB 3.274 C B 0109 PRO CD
C B 0108 ASP CG 3.539 C B 0112 THR CB
C B 0109 PRO C 2.508 C B 0110 ASP CA
C B 0109 PRO C 3.318 C B 0110 ASP C
C B 0109 PRO C 3.732 C B 0110 ASP CB
C B 0110 ASP C 2.495 C B 0111 GLY CA
C B 0110 ASP C 3.490 C B 0111 GLY C
C B 0111 GLY C 2.494 C B 0112 THR CA
C B 0111 GLY C 3.490 C B 0112 THR C
C B 0111 GLY C 3.601 C B 0112 THR CB
C B 0112 THR C 2.482 E B 0113 LEU CA
C B 0112 THR C 3.388 E B 0113 LEU C
C B 0112 THR C 3.617 E B 0113 LEU CB
E B 0113 LEU C 2.487 E B 0114 LEU CA
E B 0113 LEU C 3.335 E B 0114 LEU C
E B 0113 LEU C 3.694 E B 0114 LEU CB
E B 0114 LEU C 2.498 E B 0115 ARG CA
E B 0114 LEU C 3.369 E B 0115 ARG C
E B 0114 LEU C 3.678 E B 0115 ARG CB
E B 0115 ARG C 2.492 E B 0116 LEU CA
E B 0115 ARG C 3.463 E B 0116 LEU C
E B 0115 ARG C 3.634 E B 0116 LEU CB
E B 0116 LEU C 2.502 C B 0117 ILE CA
E B 0116 LEU C 3.712 C B 0117 ILE C
E B 0116 LEU C 3.374 C B 0117 ILE CB
E B 0116 LEU C 3.346 C B 0117 ILE CG1
C B 0117 ILE C 2.551 C B 0118 GLN CA
C B 0117 ILE C 3.203 C B 0118 GLN CB
C B 0117 ILE CG2 3.723 C B 0122 LEU CB
C B 0118 GLN C 2.575 C B 0119 ASN CA
C B 0118 GLN C 3.517 C B 0119 ASN C
C B 0118 GLN C 3.758 C B 0119 ASN CB
C B 0118 GLN C 3.687 C B 0121 LEU C
C B 0118 GLN C 3.499 C B 0122 LEU CA
C B 0119 ASN C 2.571 C B 0120 GLU CA
C B 0119 ASN C 3.221 C B 0120 GLU C
C B 0119 ASN C 3.640 C B 0121 LEU CA
C B 0119 ASN C 3.726 C B 0121 LEU C
C B 0119 ASN C 3.724 C B 0121 LEU CB
C B 0119 ASN CA 3.570 C B 0122 LEU CG
C B 0119 ASN CA 3.373 C B 0122 LEU CD2
C B 0119 ASN CB 3.708 C B 0122 LEU CD2
C B 0119 ASN CG 3.773 C B 0122 LEU CD2
C B 0120 GLU CA 3.318 C B 0121 LEU CA
C B 0120 GLU CA 3.562 C B 0121 LEU C
C B 0120 GLU C 2.567 C B 0121 LEU CA
C B 0120 GLU C 3.478 C B 0121 LEU C
C B 0120 GLU C 3.475 C B 0121 LEU CB
C B 0120 GLU C 3.727 C B 0121 LEU CD2
C B 0120 GLU CD 3.739 C B 0122 LEU CB
C B 0121 LEU C 2.567 C B 0122 LEU CA
C B 0121 LEU C 3.066 C B 0122 LEU C
C B 0122 LEU C 2.554 C B 0123 ALA CA
C B 0122 LEU C 3.292 C B 0123 ALA C
C B 0122 LEU C 3.644 C B 0123 ALA CB
C B 0123 ALA C 2.502 C B 0124 GLY CA
C B 0123 ALA C 3.108 C B 0124 GLY C
C B 0124 GLY C 2.493 C B 0125 ILE CA
C B 0124 GLY C 2.990 C B 0125 ILE C
C B 0125 ILE C 2.543 C B 0126 SER CA
C B 0125 ILE C 3.597 C B 0126 SER C
C B 0125 ILE C 3.706 C B 0126 SER CB
CHARGE_ATTR 2.00 12.00 90
H B 0013 ASP OD1 11.49 C B 0012 ARG NH1
H B 0013 ASP OD1 10.90 C B 0012 ARG NH2
H B 0013 ASP OD2 11.08 C B 0012 ARG NH1
H B 0013 ASP OD2 10.10 C B 0012 ARG NH2
H B 0013 ASP OD1 8.183 E B 0031 ARG NH1
H B 0013 ASP OD1 6.486 E B 0031 ARG NH2
H B 0013 ASP OD2 7.902 E B 0031 ARG NH1
H B 0013 ASP OD2 6.704 E B 0031 ARG NH2
H B 0015 ASP OD1 2.990 E B 0031 ARG NH1
H B 0015 ASP OD1 3.857 E B 0031 ARG NH2
H B 0015 ASP OD2 3.449 E B 0031 ARG NH1
H B 0015 ASP OD2 2.898 E B 0031 ARG NH2
H B 0022 GLU OE1 11.81 H B 0023 ARG NH2
H B 0022 GLU OE1 7.611 E B 0031 ARG NH1
H B 0022 GLU OE1 9.749 E B 0031 ARG NH2
H B 0022 GLU OE2 8.287 E B 0031 ARG NH1
H B 0022 GLU OE2 10.45 E B 0031 ARG NH2
C B 0032 ASP OD1 10.54 E B 0031 ARG NH1
C B 0032 ASP OD1 9.851 E B 0031 ARG NH2
C B 0032 ASP OD2 11.64 E B 0031 ARG NH2
C B 0042 ASP OD1 10.02 E B 0040 ARG NH1
C B 0042 ASP OD1 10.30 E B 0040 ARG NH2
C B 0042 ASP OD2 11.47 E B 0040 ARG NH1
C B 0054 ASP OD1 6.996 C B 0012 ARG NH1
C B 0054 ASP OD1 8.544 C B 0012 ARG NH2
C B 0054 ASP OD2 8.519 C B 0012 ARG NH1
C B 0054 ASP OD2 9.872 C B 0012 ARG NH2
C B 0054 ASP OD1 11.42 C B 0050 HIS ND1
C B 0054 ASP OD1 11.04 C B 0050 HIS NE2
C B 0054 ASP OD2 11.38 C B 0050 HIS ND1
C B 0054 ASP OD2 10.56 C B 0050 HIS NE2
C B 0054 ASP OD1 11.58 E B 0090 ARG NH1
C B 0054 ASP OD2 11.25 E B 0090 ARG NH1
C B 0054 ASP OD2 11.63 E B 0090 ARG NH2
C B 0067 ASP OD1 10.71 E B 0040 ARG NH1
C B 0067 ASP OD1 11.84 E B 0040 ARG NH2
C B 0067 ASP OD1 9.921 C B 0065 ARG NH1
C B 0067 ASP OD1 11.56 C B 0065 ARG NH2
C B 0067 ASP OD2 10.91 C B 0065 ARG NH1
H B 0068 ASP OD1 10.64 E B 0040 ARG NH1
H B 0068 ASP OD1 11.40 E B 0040 ARG NH2
H B 0068 ASP OD2 9.523 E B 0040 ARG NH1
H B 0068 ASP OD2 9.933 E B 0040 ARG NH2
H B 0068 ASP OD1 7.980 H B 0074 ARG NH1
H B 0068 ASP OD1 9.838 H B 0074 ARG NH2
H B 0068 ASP OD2 6.182 H B 0074 ARG NH1
H B 0068 ASP OD2 8.090 H B 0074 ARG NH2
H B 0071 GLU OE1 2.997 E B 0040 ARG NH1
H B 0071 GLU OE1 3.067 E B 0040 ARG NH2
H B 0071 GLU OE2 4.355 E B 0040 ARG NH1
H B 0071 GLU OE2 3.711 E B 0040 ARG NH2
H B 0071 GLU OE1 7.371 H B 0074 ARG NH1
H B 0071 GLU OE1 9.321 H B 0074 ARG NH2
H B 0071 GLU OE2 6.131 H B 0074 ARG NH1
H B 0071 GLU OE2 7.832 H B 0074 ARG NH2
C B 0083 GLU OE1 3.105 H B 0077 LYS NZ
C B 0083 GLU OE2 3.624 H B 0077 LYS NZ
C B 0083 GLU OE1 9.453 E B 0092 HIS ND1
C B 0083 GLU OE1 8.754 E B 0092 HIS NE2
C B 0083 GLU OE2 8.313 E B 0092 HIS ND1
C B 0083 GLU OE2 8.112 E B 0092 HIS NE2
E B 0095 GLU OE2 11.79 H B 0077 LYS NZ
E B 0095 GLU OE1 9.123 E B 0092 HIS ND1
E B 0095 GLU OE1 9.998 E B 0092 HIS NE2
E B 0095 GLU OE2 7.042 E B 0092 HIS ND1
E B 0095 GLU OE2 8.031 E B 0092 HIS NE2
C B 0108 ASP OD1 9.481 C B 0012 ARG NH1
C B 0108 ASP OD1 7.917 C B 0012 ARG NH2
C B 0108 ASP OD2 10.88 C B 0012 ARG NH1
C B 0108 ASP OD2 9.277 C B 0012 ARG NH2
C B 0108 ASP OD1 11.00 H B 0023 ARG NH2
C B 0108 ASP OD2 10.64 H B 0023 ARG NH2
C B 0108 ASP OD1 11.88 C B 0050 HIS NE2
C B 0108 ASP OD1 9.065 E B 0090 ARG NH1
C B 0108 ASP OD1 9.617 E B 0090 ARG NH2
C B 0108 ASP OD2 11.02 E B 0090 ARG NH1
C B 0108 ASP OD2 11.44 E B 0090 ARG NH2
C B 0110 ASP OD1 6.383 C B 0012 ARG NH1
C B 0110 ASP OD1 5.427 C B 0012 ARG NH2
C B 0110 ASP OD2 7.854 C B 0012 ARG NH1
C B 0110 ASP OD2 6.384 C B 0012 ARG NH2
C B 0110 ASP OD2 11.73 H B 0023 ARG NH2
C B 0110 ASP OD1 8.290 C B 0050 HIS ND1
C B 0110 ASP OD1 8.775 C B 0050 HIS NE2
C B 0110 ASP OD2 10.22 C B 0050 HIS ND1
C B 0110 ASP OD2 10.52 C B 0050 HIS NE2
C B 0120 GLU OE1 4.301 C B 0065 ARG NH1
C B 0120 GLU OE1 5.783 C B 0065 ARG NH2
C B 0120 GLU OE2 5.791 C B 0065 ARG NH1
C B 0120 GLU OE2 6.669 C B 0065 ARG NH2
CHARGE_REPU 2.00 12.00 66
C B 0003 ASP OD1 11.58 E B 0046 GLU OE1
C B 0012 ARG NH1 9.867 C B 0050 HIS ND1
C B 0012 ARG NH1 10.53 C B 0050 HIS NE2
C B 0012 ARG NH2 10.88 C B 0050 HIS ND1
C B 0012 ARG NH2 11.43 C B 0050 HIS NE2
C B 0012 ARG NH2 11.31 E B 0090 ARG NH1
H B 0013 ASP OD1 7.661 H B 0015 ASP OD1
H B 0013 ASP OD1 6.045 H B 0015 ASP OD2
H B 0013 ASP OD2 6.801 H B 0015 ASP OD1
H B 0013 ASP OD2 5.676 H B 0015 ASP OD2
H B 0013 ASP OD1 9.613 C B 0110 ASP OD1
H B 0013 ASP OD1 9.957 C B 0110 ASP OD2
H B 0013 ASP OD2 9.068 C B 0110 ASP OD1
H B 0013 ASP OD2 9.023 C B 0110 ASP OD2
H B 0015 ASP OD1 7.350 H B 0022 GLU OE1
H B 0015 ASP OD1 8.742 H B 0022 GLU OE2
H B 0015 ASP OD2 9.477 H B 0022 GLU OE1
H B 0015 ASP OD2 10.74 H B 0022 GLU OE2
C B 0032 ASP OD1 11.61 E B 0046 GLU OE1
C B 0032 ASP OD1 9.988 E B 0046 GLU OE2
C B 0032 ASP OD2 11.72 E B 0046 GLU OE1
C B 0032 ASP OD2 10.00 E B 0046 GLU OE2
E B 0040 ARG NH1 10.18 H B 0074 ARG NH1
E B 0040 ARG NH2 9.753 H B 0074 ARG NH1
E B 0040 ARG NH2 11.42 H B 0074 ARG NH2
C B 0042 ASP OD1 8.928 C B 0067 ASP OD1
C B 0042 ASP OD1 10.34 C B 0067 ASP OD2
C B 0042 ASP OD2 8.483 C B 0067 ASP OD1
C B 0042 ASP OD2 9.892 C B 0067 ASP OD2
C B 0042 ASP OD1 11.77 H B 0071 GLU OE1
C B 0054 ASP OD1 11.61 C B 0110 ASP OD1
C B 0065 ARG NH2 10.93 E B 0115 ARG NH1
C B 0065 ARG NH2 11.51 E B 0115 ARG NH2
C B 0067 ASP OD1 10.22 H B 0068 ASP OD1
C B 0067 ASP OD1 10.72 H B 0068 ASP OD2
C B 0067 ASP OD2 10.18 H B 0068 ASP OD1
C B 0067 ASP OD2 10.78 H B 0068 ASP OD2
C B 0067 ASP OD1 10.88 H B 0071 GLU OE1
C B 0067 ASP OD1 9.057 C B 0120 GLU OE1
C B 0067 ASP OD1 10.45 C B 0120 GLU OE2
C B 0067 ASP OD2 9.191 C B 0120 GLU OE1
C B 0067 ASP OD2 10.39 C B 0120 GLU OE2
H B 0068 ASP OD1 8.436 H B 0071 GLU OE1
H B 0068 ASP OD1 9.336 H B 0071 GLU OE2
H B 0068 ASP OD2 6.968 H B 0071 GLU OE1
H B 0068 ASP OD2 7.623 H B 0071 GLU OE2
H B 0074 ARG NH1 11.68 H B 0077 LYS NZ
H B 0074 ARG NH2 11.81 H B 0077 LYS NZ
H B 0077 LYS NZ 11.79 E B 0092 HIS ND1
H B 0077 LYS NZ 11.32 E B 0092 HIS NE2
C B 0083 GLU OE1 10.82 E B 0095 GLU OE1
C B 0083 GLU OE1 9.439 E B 0095 GLU OE2
C B 0083 GLU OE2 10.15 E B 0095 GLU OE1
C B 0083 GLU OE2 8.553 E B 0095 GLU OE2
E B 0090 ARG NH1 7.008 E B 0092 HIS ND1
E B 0090 ARG NH1 6.388 E B 0092 HIS NE2
E B 0090 ARG NH2 5.955 E B 0092 HIS ND1
E B 0090 ARG NH2 5.937 E B 0092 HIS NE2
E B 0090 ARG NH2 10.95 E B 0115 ARG NH1
E B 0090 ARG NH2 10.90 E B 0115 ARG NH2
E B 0092 HIS ND1 10.47 E B 0115 ARG NH1
E B 0092 HIS ND1 11.49 E B 0115 ARG NH2
C B 0108 ASP OD1 5.757 C B 0110 ASP OD1
C B 0108 ASP OD1 4.549 C B 0110 ASP OD2
C B 0108 ASP OD2 5.980 C B 0110 ASP OD1
C B 0108 ASP OD2 4.312 C B 0110 ASP OD2
HB_MM 2.00 3.20 175
C B 0003 ASP N 2.267 C B 0002 THR O
E B 0004 GLN N 2.242 C B 0003 ASP O
E B 0005 ALA N 2.256 E B 0004 GLN O
E B 0006 THR N 2.248 E B 0005 ALA O
E B 0007 PRO N 2.240 E B 0006 THR O
E B 0008 ASN N 2.252 E B 0007 PRO O
E B 0009 LEU N 2.248 E B 0008 ASN O
E B 0009 LEU N 2.839 E B 0046 GLU O
E B 0010 PRO N 2.234 E B 0009 LEU O
E B 0011 SER N 2.246 E B 0010 PRO O
E B 0011 SER N 2.947 E B 0048 PHE O
C B 0012 ARG N 2.250 E B 0011 SER O
H B 0013 ASP N 2.258 C B 0012 ARG O
H B 0014 PHE N 2.245 H B 0013 ASP O
H B 0015 ASP N 2.246 H B 0014 PHE O
H B 0016 SER N 2.252 H B 0015 ASP O
H B 0017 THR N 3.105 H B 0013 ASP O
H B 0017 THR N 2.253 H B 0016 SER O
H B 0018 ALA N 3.000 H B 0014 PHE O
H B 0018 ALA N 2.251 H B 0017 THR O
H B 0019 ALA N 3.107 H B 0015 ASP O
H B 0019 ALA N 2.252 H B 0018 ALA O
H B 0020 PHE N 2.246 H B 0019 ALA O
H B 0021 TYR N 3.174 H B 0018 ALA O
H B 0021 TYR N 2.249 H B 0020 PHE O
H B 0022 GLU N 2.899 H B 0018 ALA O
H B 0022 GLU N 2.244 H B 0021 TYR O
H B 0023 ARG N 2.242 H B 0022 GLU O
H B 0024 LEU N 3.061 H B 0021 TYR O
H B 0024 LEU N 2.249 H B 0023 ARG O
C B 0025 GLY N 2.237 H B 0024 LEU O
C B 0026 PHE N 3.012 H B 0021 TYR O
C B 0026 PHE N 2.243 C B 0025 GLY O
E B 0027 GLY N 3.179 C B 0025 GLY O
E B 0027 GLY N 2.257 C B 0026 PHE O
E B 0028 ILE N 2.260 E B 0027 GLY O
E B 0029 VAL N 3.015 E B 0027 GLY O
E B 0029 VAL N 2.244 E B 0028 ILE O
E B 0030 PHE N 2.249 E B 0029 VAL O
E B 0031 ARG N 2.255 E B 0030 PHE O
C B 0032 ASP N 2.260 E B 0031 ARG O
C B 0033 ALA N 2.242 C B 0032 ASP O
C B 0034 GLY N 2.251 C B 0033 ALA O
E B 0035 TRP N 2.251 C B 0034 GLY O
E B 0036 MET N 2.242 E B 0035 TRP O
E B 0036 MET N 2.931 E B 0047 PHE O
E B 0037 ILE N 2.243 E B 0036 MET O
E B 0038 LEU N 2.254 E B 0037 ILE O
E B 0038 LEU N 2.926 E B 0045 LEU O
E B 0039 GLN N 3.091 E B 0027 GLY O
E B 0039 GLN N 2.245 E B 0038 LEU O
E B 0040 ARG N 2.249 E B 0039 GLN O
E B 0040 ARG N 3.150 E B 0043 LEU O
C B 0041 GLY N 2.255 E B 0040 ARG O
C B 0042 ASP N 2.969 E B 0040 ARG O
C B 0042 ASP N 2.271 C B 0041 GLY O
E B 0043 LEU N 3.061 E B 0040 ARG O
E B 0043 LEU N 2.236 C B 0042 ASP O
E B 0044 MET N 2.242 E B 0043 LEU O
E B 0045 LEU N 3.024 E B 0038 LEU O
E B 0045 LEU N 2.250 E B 0044 MET O
E B 0046 GLU N 2.248 E B 0045 LEU O
E B 0047 PHE N 2.899 E B 0036 MET O
E B 0047 PHE N 2.237 E B 0046 GLU O
E B 0048 PHE N 2.905 E B 0009 LEU O
E B 0048 PHE N 2.244 E B 0047 PHE O
E B 0049 ALA N 2.965 C B 0034 GLY O
E B 0049 ALA N 2.250 E B 0048 PHE O
C B 0050 HIS N 2.882 E B 0011 SER O
C B 0050 HIS N 3.142 E B 0048 PHE O
C B 0050 HIS N 2.252 E B 0049 ALA O
C B 0051 PRO N 2.244 C B 0050 HIS O
C B 0052 GLY N 2.248 C B 0051 PRO O
C B 0053 LEU N 3.188 C B 0051 PRO O
C B 0053 LEU N 2.262 C B 0052 GLY O
C B 0054 ASP N 2.256 C B 0053 LEU O
C B 0055 PRO N 2.250 C B 0054 ASP O
C B 0056 LEU N 2.254 C B 0055 PRO O
C B 0057 ALA N 2.248 C B 0056 LEU O
C B 0058 SER N 2.240 C B 0057 ALA O
C B 0059 TRP N 3.118 C B 0057 ALA O
C B 0059 TRP N 2.247 C B 0058 SER O
C B 0060 PHE N 3.019 C B 0058 SER O
C B 0060 PHE N 2.245 C B 0059 TRP O
E B 0061 SER N 2.251 C B 0060 PHE O
E B 0062 CYS N 2.250 E B 0061 SER O
E B 0062 CYS N 3.150 E B 0113 LEU O
E B 0063 CYS N 2.237 E B 0062 CYS O
E B 0064 LEU N 2.249 E B 0063 CYS O
E B 0064 LEU N 2.955 E B 0115 ARG O
C B 0065 ARG N 2.253 E B 0064 LEU O
C B 0066 LEU N 2.251 C B 0065 ARG O
C B 0067 ASP N 2.237 C B 0066 LEU O
H B 0068 ASP N 2.240 C B 0067 ASP O
H B 0069 LEU N 2.247 H B 0068 ASP O
H B 0070 ALA N 2.245 H B 0069 LEU O
H B 0071 GLU N 2.256 H B 0070 ALA O
H B 0072 PHE N 2.249 H B 0071 GLU O
H B 0073 TYR N 2.240 H B 0072 PHE O
H B 0074 ARG N 3.067 H B 0070 ALA O
H B 0074 ARG N 2.245 H B 0073 TYR O
H B 0075 GLN N 2.831 H B 0071 GLU O
H B 0075 GLN N 2.246 H B 0074 ARG O
H B 0076 CYS N 3.113 H B 0072 PHE O
H B 0076 CYS N 2.251 H B 0075 GLN O
H B 0077 LYS N 2.250 H B 0076 CYS O
H B 0078 SER N 2.990 H B 0074 ARG O
H B 0078 SER N 2.249 H B 0077 LYS O
H B 0079 VAL N 2.931 H B 0075 GLN O
H B 0079 VAL N 2.243 H B 0078 SER O
H B 0080 GLY N 2.254 H B 0079 VAL O
C B 0081 ILE N 3.150 H B 0076 CYS O
C B 0081 ILE N 2.258 H B 0080 GLY O
C B 0082 GLN N 2.247 C B 0081 ILE O
C B 0083 GLU N 2.256 C B 0082 GLN O
C B 0084 THR N 2.248 C B 0083 GLU O
C B 0085 SER N 2.244 C B 0084 THR O
C B 0086 SER N 2.250 C B 0085 SER O
C B 0087 GLY N 2.252 C B 0086 SER O
C B 0088 TYR N 2.239 C B 0087 GLY O
C B 0089 PRO N 2.245 C B 0088 TYR O
E B 0090 ARG N 2.253 C B 0089 PRO O
E B 0090 ARG N 3.121 E B 0107 VAL O
E B 0091 ILE N 2.244 E B 0090 ARG O
E B 0092 HIS N 2.254 E B 0091 ILE O
E B 0093 ALA N 2.251 E B 0092 HIS O
E B 0094 PRO N 2.248 E B 0093 ALA O
E B 0095 GLU N 2.258 E B 0094 PRO O
E B 0095 GLU N 3.045 E B 0103 MET O
C B 0096 LEU N 2.261 E B 0095 GLU O
C B 0097 GLN N 2.234 C B 0096 LEU O
C B 0098 GLU N 2.237 C B 0097 GLN O
C B 0099 TRP N 2.229 C B 0098 GLU O
C B 0100 GLY N 2.244 C B 0099 TRP O
C B 0100 GLY N 2.919 C B 0123 ALA O
C B 0101 GLY N 2.235 C B 0100 GLY O
C B 0101 GLY N 3.083 C B 0123 ALA O
C B 0102 THR N 2.207 C B 0101 GLY O
E B 0103 MET N 2.256 C B 0102 THR O
E B 0104 ALA N 2.255 E B 0103 MET O
E B 0104 ALA N 2.913 E B 0116 LEU O
E B 0105 ALA N 3.019 E B 0092 HIS O
E B 0105 ALA N 2.243 E B 0104 ALA O
E B 0106 LEU N 2.256 E B 0105 ALA O
E B 0106 LEU N 2.967 E B 0114 LEU O
E B 0107 VAL N 2.839 E B 0090 ARG O
E B 0107 VAL N 2.245 E B 0106 LEU O
C B 0108 ASP N 2.254 E B 0107 VAL O
C B 0109 PRO N 2.240 C B 0108 ASP O
C B 0110 ASP N 2.252 C B 0109 PRO O
C B 0111 GLY N 2.241 C B 0110 ASP O
C B 0112 THR N 2.257 C B 0111 GLY O
E B 0113 LEU N 2.958 C B 0060 PHE O
E B 0113 LEU N 2.234 C B 0112 THR O
E B 0114 LEU N 2.861 E B 0106 LEU O
E B 0114 LEU N 2.243 E B 0113 LEU O
E B 0115 ARG N 3.106 E B 0062 CYS O
E B 0115 ARG N 2.249 E B 0114 LEU O
E B 0116 LEU N 2.884 E B 0104 ALA O
E B 0116 LEU N 2.226 E B 0115 ARG O
C B 0117 ILE N 3.083 E B 0064 LEU O
C B 0117 ILE N 2.249 E B 0116 LEU O
C B 0118 GLN N 2.227 C B 0117 ILE O
C B 0119 ASN N 2.741 C B 0066 LEU O
C B 0119 ASN N 2.169 C B 0118 GLN O
C B 0120 GLU N 2.251 C B 0119 ASN O
C B 0121 LEU N 2.127 C B 0120 GLU O
C B 0122 LEU N 2.881 C B 0118 GLN O
C B 0122 LEU N 2.251 C B 0121 LEU O
C B 0123 ALA N 3.167 C B 0121 LEU O
C B 0123 ALA N 2.308 C B 0122 LEU O
C B 0124 GLY N 2.587 C B 0122 LEU O
C B 0124 GLY N 2.223 C B 0123 ALA O
C B 0125 ILE N 2.261 C B 0124 GLY O
C B 0126 SER N 2.200 C B 0125 ILE O
HB_MS 2.00 3.20 23
C B 0002 THR O 3.192 E B 0004 GLN NE2
C B 0012 ARG N 2.823 C B 0110 ASP OD1
E B 0028 ILE N 2.986 H B 0022 GLU OE2
C B 0033 ALA N 2.737 C B 0032 ASP OD1
E B 0035 TRP N 2.943 C B 0032 ASP OD1
C B 0057 ALA N 3.037 C B 0054 ASP OD2
H B 0069 LEU N 3.078 H B 0068 ASP OD1
H B 0069 LEU N 3.143 C B 0118 GLN OE1
H B 0070 ALA N 3.001 H B 0068 ASP OD1
H B 0071 GLU N 3.134 H B 0068 ASP OD2
H B 0074 ARG O 2.700 H B 0078 SER OG
H B 0080 GLY O 3.182 H B 0023 ARG NH1
C B 0084 THR O 2.956 E B 0092 HIS NE2
C B 0086 SER O 2.754 C B 0084 THR OG1
C B 0086 SER N 3.188 C B 0085 SER OG
C B 0087 GLY O 2.975 E B 0090 ARG NH1
E B 0095 GLU O 2.772 C B 0102 THR OG1
E B 0103 MET N 3.076 C B 0102 THR OG1
C B 0109 PRO O 3.151 C B 0012 ARG NH2
C B 0111 GLY O 2.694 C B 0058 SER OG
C B 0111 GLY N 2.938 C B 0108 ASP OD1
C B 0112 THR N 2.872 C B 0108 ASP OD1
C B 0120 GLU N 3.038 C B 0119 ASN OD1
HB_SS 2.00 3.20 12
H B 0013 ASP OD2 2.605 H B 0016 SER OG
E B 0046 GLU OE1 2.491 E B 0006 THR OG1
E B 0046 GLU OE2 2.897 E B 0035 TRP NE1
C B 0067 ASP OD1 2.943 C B 0119 ASN ND2
H B 0071 GLU OE2 2.960 H B 0075 GLN NE2
C B 0083 GLU OE2 2.513 H B 0073 TYR OH
C B 0099 TRP NE1 2.966 C B 0126 SER OG
C B 0108 ASP OD2 2.546 H B 0021 TYR OH
C B 0108 ASP OD1 2.953 C B 0112 THR OG1
C B 0108 ASP OD2 2.821 C B 0112 THR OG1
C B 0110 ASP OD2 2.528 H B 0017 THR OG1
E B 0115 ARG NH2 3.057 E B 0061 SER OG
AROMATIC 0.00 8.00 12
H B 0023 ARG 4.675 H B 0020 PHE
E B 0048 PHE 5.425 C B 0050 HIS
H B 0020 PHE 5.254 H B 0021 TYR
E B 0040 ARG 4.950 H B 0072 PHE
E B 0090 ARG 6.458 E B 0092 HIS
H B 0077 LYS 6.179 H B 0073 TYR
E B 0031 ARG 5.954 H B 0014 PHE
H B 0021 TYR 5.952 C B 0026 PHE
C B 0012 ARG 5.513 C B 0088 TYR
E B 0090 ARG 6.420 C B 0088 TYR
C B 0065 ARG 6.233 C B 0099 TRP
E B 0115 ARG 7.738 C B 0059 TRP
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "C"
HYDROPHOBIC 2.00 3.80 18
C B 0002 THR CG2 3.766 C C 0042 ASP CG
C B 0003 ASP C 3.608 E C 0043 LEU CD2
C B 0003 ASP CG 3.792 E C 0043 LEU CG
C B 0003 ASP CG 3.762 E C 0043 LEU CD2
E B 0004 GLN CA 3.788 E C 0043 LEU CD2
E B 0004 GLN C 3.511 E C 0043 LEU CD2
E B 0008 ASN CG 3.771 E C 0061 SER C
C B 0042 ASP CA 3.799 C C 0126 SER CA
C B 0042 ASP CA 3.523 C C 0126 SER C
C B 0042 ASP CA 3.715 C C 0126 SER CB
C B 0042 ASP C 3.663 C C 0126 SER CB
C B 0042 ASP CB 3.702 C C 0126 SER C
C B 0042 ASP CG 3.526 C C 0126 SER C
E B 0043 LEU CG 3.781 C C 0003 ASP CG
E B 0043 LEU CD2 3.690 C C 0003 ASP CG
E B 0043 LEU CD2 3.524 C C 0004 GLN C
E B 0061 SER C 3.741 E C 0008 ASN CG
C B 0065 ARG CD 3.752 E C 0006 THR CG2
CHARGE_ATTR 2.00 12.00 40
C B 0003 ASP OD1 6.995 E C 0040 ARG NH1
C B 0003 ASP OD1 8.674 E C 0040 ARG NH2
C B 0003 ASP OD2 5.312 E C 0040 ARG NH1
C B 0003 ASP OD2 6.733 E C 0040 ARG NH2
C B 0003 ASP OD1 9.702 E C 0065 ARG NH1
C B 0003 ASP OD1 11.13 E C 0065 ARG NH2
C B 0003 ASP OD2 11.86 E C 0065 ARG NH1
C B 0032 ASP OD1 10.63 E C 0065 ARG NH2
C B 0032 ASP OD2 11.47 E C 0065 ARG NH1
C B 0032 ASP OD2 10.06 E C 0065 ARG NH2
C B 0032 ASP OD1 11.30 E C 0115 ARG NH1
C B 0032 ASP OD2 11.41 E C 0115 ARG NH1
E B 0040 ARG NH1 7.204 C C 0003 ASP OD1
E B 0040 ARG NH1 5.565 C C 0003 ASP OD2
E B 0040 ARG NH2 8.948 C C 0003 ASP OD1
E B 0040 ARG NH2 7.054 C C 0003 ASP OD2
E B 0046 GLU OE1 6.109 E C 0065 ARG NH1
E B 0046 GLU OE1 4.442 E C 0065 ARG NH2
E B 0046 GLU OE2 5.065 E C 0065 ARG NH1
E B 0046 GLU OE2 2.973 E C 0065 ARG NH2
E B 0046 GLU OE1 8.842 E C 0115 ARG NH1
E B 0046 GLU OE1 8.776 E C 0115 ARG NH2
E B 0046 GLU OE2 9.472 E C 0115 ARG NH1
E B 0046 GLU OE2 9.729 E C 0115 ARG NH2
C B 0065 ARG NH1 9.960 C C 0003 ASP OD1
C B 0065 ARG NH2 10.81 C C 0003 ASP OD1
C B 0065 ARG NH1 11.77 C C 0032 ASP OD2
C B 0065 ARG NH2 10.76 C C 0032 ASP OD1
C B 0065 ARG NH2 10.35 C C 0032 ASP OD2
C B 0065 ARG NH1 11.93 C C 0042 ASP OD1
C B 0065 ARG NH1 5.874 E C 0046 GLU OE1
C B 0065 ARG NH1 4.757 E C 0046 GLU OE2
C B 0065 ARG NH2 4.259 E C 0046 GLU OE1
C B 0065 ARG NH2 2.822 E C 0046 GLU OE2
E B 0115 ARG NH1 11.44 C C 0032 ASP OD1
E B 0115 ARG NH1 11.64 C C 0032 ASP OD2
E B 0115 ARG NH1 8.767 E C 0046 GLU OE1
E B 0115 ARG NH1 9.162 E C 0046 GLU OE2
E B 0115 ARG NH2 8.604 E C 0046 GLU OE1
E B 0115 ARG NH2 9.350 E C 0046 GLU OE2
CHARGE_REPU 2.00 12.00 57
C B 0003 ASP OD1 8.898 C C 0042 ASP OD1
C B 0003 ASP OD1 7.878 C C 0042 ASP OD2
C B 0003 ASP OD2 8.542 C C 0042 ASP OD1
C B 0003 ASP OD2 7.121 C C 0042 ASP OD2
C B 0003 ASP OD1 7.394 C C 0067 ASP OD1
C B 0003 ASP OD1 6.496 C C 0067 ASP OD2
C B 0003 ASP OD2 8.659 C C 0067 ASP OD1
C B 0003 ASP OD2 7.422 C C 0067 ASP OD2
C B 0003 ASP OD1 11.02 C C 0068 ASP OD1
C B 0003 ASP OD1 10.80 C C 0068 ASP OD2
C B 0003 ASP OD2 11.04 C C 0068 ASP OD1
C B 0003 ASP OD2 10.39 C C 0068 ASP OD2
C B 0003 ASP OD1 8.672 H C 0071 GLU OE1
C B 0003 ASP OD1 10.79 H C 0071 GLU OE2
C B 0003 ASP OD2 7.152 H C 0071 GLU OE1
C B 0003 ASP OD2 9.285 H C 0071 GLU OE2
C B 0032 ASP OD1 11.65 C C 0120 GLU OE2
C B 0032 ASP OD2 10.91 C C 0120 GLU OE1
C B 0032 ASP OD2 9.915 C C 0120 GLU OE2
C B 0042 ASP OD1 7.729 C C 0003 ASP OD1
C B 0042 ASP OD1 6.553 C C 0003 ASP OD2
C B 0042 ASP OD2 7.717 C C 0003 ASP OD1
C B 0042 ASP OD2 7.132 C C 0003 ASP OD2
C B 0042 ASP OD1 11.10 C C 0042 ASP OD1
C B 0042 ASP OD2 8.915 C C 0042 ASP OD1
C B 0042 ASP OD2 10.66 C C 0042 ASP OD2
E B 0046 GLU OE1 10.07 C C 0120 GLU OE1
E B 0046 GLU OE1 10.72 C C 0120 GLU OE2
E B 0046 GLU OE2 8.702 C C 0120 GLU OE1
E B 0046 GLU OE2 9.374 C C 0120 GLU OE2
C B 0050 HIS ND1 11.49 E C 0115 ARG NH1
C B 0050 HIS ND1 10.14 E C 0115 ARG NH2
C B 0050 HIS NE2 11.20 E C 0115 ARG NH1
C B 0050 HIS NE2 9.512 E C 0115 ARG NH2
C B 0067 ASP OD1 5.597 C C 0003 ASP OD1
C B 0067 ASP OD1 6.201 C C 0003 ASP OD2
C B 0067 ASP OD2 7.747 C C 0003 ASP OD1
C B 0067 ASP OD2 8.199 C C 0003 ASP OD2
C B 0067 ASP OD1 11.95 C C 0042 ASP OD1
H B 0068 ASP OD1 11.27 C C 0003 ASP OD1
H B 0068 ASP OD1 11.17 C C 0003 ASP OD2
H B 0068 ASP OD2 11.41 C C 0003 ASP OD1
H B 0068 ASP OD2 10.90 C C 0003 ASP OD2
H B 0071 GLU OE1 8.697 C C 0003 ASP OD1
H B 0071 GLU OE1 7.211 C C 0003 ASP OD2
H B 0071 GLU OE2 10.79 C C 0003 ASP OD1
H B 0071 GLU OE2 9.288 C C 0003 ASP OD2
E B 0115 ARG NH1 11.59 C C 0050 HIS ND1
E B 0115 ARG NH1 11.27 C C 0050 HIS NE2
E B 0115 ARG NH2 10.28 C C 0050 HIS ND1
E B 0115 ARG NH2 9.625 C C 0050 HIS NE2
C B 0120 GLU OE1 11.22 C C 0003 ASP OD1
C B 0120 GLU OE2 11.14 C C 0032 ASP OD2
C B 0120 GLU OE1 9.932 E C 0046 GLU OE1
C B 0120 GLU OE1 8.571 E C 0046 GLU OE2
C B 0120 GLU OE2 10.86 E C 0046 GLU OE1
C B 0120 GLU OE2 9.319 E C 0046 GLU OE2
HB_MM 2.00 3.20 4
E B 0004 GLN O 3.063 E C 0065 ARG N
E B 0006 THR N 2.961 E C 0063 CYS O
E B 0063 CYS O 3.024 E C 0006 THR N
C B 0065 ARG N 3.033 C C 0004 GLN O
HB_MS 2.00 3.20 2
C B 0042 ASP O 2.963 C C 0126 SER OG
E B 0063 CYS N 3.149 E C 0006 THR OG1
HB_SS 2.00 3.20 3
E B 0004 GLN OE1 3.167 C C 0126 SER OG
E B 0008 ASN OD1 2.789 E C 0061 SER OG
E B 0061 SER OG 2.746 E C 0008 ASN OD1
AROMATIC 0.00 8.00 10
C B 0059 TRP 4.817 C C 0050 HIS
C B 0065 ARG 7.048 E C 0030 PHE
E B 0030 PHE 6.968 E C 0065 ARG
E B 0035 TRP 7.042 E C 0065 ARG
E B 0035 TRP 5.468 E C 0115 ARG
E B 0048 PHE 5.198 E C 0115 ARG
C B 0065 ARG 6.982 E C 0035 TRP
E B 0115 ARG 5.494 E C 0035 TRP
E B 0115 ARG 5.309 E C 0048 PHE
C B 0050 HIS 4.814 C C 0059 TRP
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "C"
AND
CHAIN(S) "C"
HYDROPHOBIC 2.00 3.80 449
C C 0002 THR C 2.500 C C 0003 ASP CA
C C 0002 THR C 3.151 C C 0003 ASP C
C C 0002 THR C 3.715 C C 0003 ASP CB
C C 0003 ASP C 2.479 C C 0004 GLN CA
C C 0003 ASP C 3.792 C C 0004 GLN C
C C 0003 ASP C 3.188 C C 0004 GLN CB
C C 0004 GLN C 2.494 E C 0005 ALA CA
C C 0004 GLN C 3.393 E C 0005 ALA C
C C 0004 GLN C 3.616 E C 0005 ALA CB
E C 0005 ALA C 2.495 E C 0006 THR CA
E C 0005 ALA C 3.524 E C 0006 THR C
E C 0005 ALA C 3.663 E C 0006 THR CB
E C 0006 THR CA 3.044 E C 0007 PRO CD
E C 0006 THR C 2.505 E C 0007 PRO CA
E C 0006 THR C 3.307 E C 0007 PRO C
E C 0006 THR C 3.627 E C 0007 PRO CB
E C 0006 THR C 3.690 E C 0007 PRO CG
E C 0006 THR C 2.506 E C 0007 PRO CD
E C 0007 PRO C 2.492 E C 0008 ASN CA
E C 0007 PRO C 3.396 E C 0008 ASN C
E C 0007 PRO C 3.684 E C 0008 ASN CB
E C 0007 PRO CB 3.489 E C 0062 CYS CB
E C 0008 ASN C 2.495 E C 0009 LEU CA
E C 0008 ASN C 3.674 E C 0009 LEU C
E C 0008 ASN C 3.401 E C 0009 LEU CB
E C 0008 ASN C 3.494 E C 0009 LEU CG
E C 0008 ASN CG 3.742 E C 0035 TRP CH2
E C 0009 LEU CA 3.068 E C 0010 PRO CD
E C 0009 LEU C 2.511 E C 0010 PRO CA
E C 0009 LEU C 3.430 E C 0010 PRO C
E C 0009 LEU C 3.567 E C 0010 PRO CB
E C 0009 LEU C 3.693 E C 0010 PRO CG
E C 0009 LEU C 2.518 E C 0010 PRO CD
E C 0009 LEU CB 3.526 E C 0010 PRO CD
E C 0009 LEU CB 3.671 E C 0047 PHE CE1
E C 0009 LEU CD1 3.793 E C 0047 PHE CZ
E C 0009 LEU CD2 3.762 C C 0112 THR CG2
E C 0010 PRO C 2.494 E C 0011 SER CA
E C 0010 PRO C 3.659 E C 0011 SER C
E C 0010 PRO C 3.414 E C 0011 SER CB
E C 0010 PRO C 3.768 E C 0047 PHE CD1
E C 0010 PRO CD 3.777 C C 0060 PHE CG
E C 0011 SER C 2.499 C C 0012 ARG CA
E C 0011 SER C 3.278 C C 0012 ARG C
E C 0011 SER C 3.750 C C 0012 ARG CB
C C 0012 ARG C 2.516 H C 0013 ASP CA
C C 0012 ARG C 3.539 H C 0013 ASP C
C C 0012 ARG C 3.546 H C 0013 ASP CB
H C 0013 ASP C 2.499 H C 0014 PHE CA
H C 0013 ASP C 3.300 H C 0014 PHE C
H C 0013 ASP C 3.750 H C 0014 PHE CB
H C 0014 PHE C 2.494 H C 0015 ASP CA
H C 0014 PHE C 3.168 H C 0015 ASP C
H C 0014 PHE C 3.775 H C 0015 ASP CB
H C 0014 PHE CE2 3.739 C C 0033 ALA C
H C 0014 PHE CE1 3.798 E C 0049 ALA CB
H C 0015 ASP C 2.511 H C 0016 SER CA
H C 0015 ASP C 3.187 H C 0016 SER C
H C 0015 ASP C 3.759 H C 0016 SER CB
H C 0016 SER C 2.509 H C 0017 THR CA
H C 0016 SER C 3.228 H C 0017 THR C
H C 0016 SER C 3.798 H C 0017 THR CB
H C 0017 THR C 2.507 H C 0018 ALA CA
H C 0017 THR C 3.205 H C 0018 ALA C
H C 0017 THR C 3.738 H C 0018 ALA CB
H C 0018 ALA C 2.496 H C 0019 ALA CA
H C 0018 ALA C 3.198 H C 0019 ALA C
H C 0018 ALA C 3.715 H C 0019 ALA CB
H C 0019 ALA C 2.504 H C 0020 PHE CA
H C 0019 ALA C 3.172 H C 0020 PHE C
H C 0019 ALA C 3.732 H C 0020 PHE CB
H C 0020 PHE C 2.496 H C 0021 TYR CA
H C 0020 PHE C 3.297 H C 0021 TYR C
H C 0020 PHE C 3.714 H C 0021 TYR CB
H C 0020 PHE CE1 3.680 C C 0081 ILE CD1
H C 0020 PHE CZ 3.740 C C 0081 ILE CD1
H C 0020 PHE CE1 3.476 C C 0089 PRO CB
H C 0020 PHE CE2 3.781 C C 0108 ASP CA
H C 0020 PHE CE2 3.520 C C 0108 ASP CB
H C 0021 TYR C 2.501 H C 0022 GLU CA
H C 0021 TYR C 3.271 H C 0022 GLU C
H C 0021 TYR C 3.704 H C 0022 GLU CB
H C 0021 TYR CE2 3.467 E C 0047 PHE CZ
H C 0021 TYR CZ 3.608 E C 0047 PHE CZ
H C 0022 GLU C 2.509 H C 0023 ARG CA
H C 0022 GLU C 3.153 H C 0023 ARG C
H C 0023 ARG C 2.503 H C 0024 LEU CA
H C 0023 ARG C 3.384 H C 0024 LEU C
H C 0023 ARG C 3.691 H C 0024 LEU CB
H C 0024 LEU C 2.499 C C 0025 GLY CA
H C 0024 LEU C 3.398 C C 0025 GLY C
C C 0025 GLY C 2.496 C C 0026 PHE CA
C C 0025 GLY C 3.339 C C 0026 PHE C
C C 0025 GLY C 3.708 C C 0026 PHE CB
C C 0025 GLY C 3.755 E C 0040 ARG CB
C C 0025 GLY C 3.781 E C 0040 ARG CG
C C 0026 PHE C 2.478 E C 0027 GLY CA
C C 0026 PHE C 3.236 E C 0027 GLY C
C C 0026 PHE CE2 3.716 E C 0043 LEU CB
C C 0026 PHE CD2 3.783 E C 0045 LEU CD1
C C 0026 PHE CE2 3.792 E C 0045 LEU CG
C C 0026 PHE CE2 3.521 E C 0045 LEU CD1
E C 0027 GLY C 2.492 E C 0028 ILE CA
E C 0027 GLY C 3.235 E C 0028 ILE C
E C 0027 GLY C 3.759 E C 0028 ILE CB
E C 0028 ILE C 2.508 E C 0029 VAL CA
E C 0028 ILE C 3.301 E C 0029 VAL C
E C 0028 ILE C 3.788 E C 0029 VAL CB
E C 0028 ILE CG1 3.728 E C 0038 LEU CD2
E C 0029 VAL C 2.507 E C 0030 PHE CA
E C 0029 VAL C 3.658 E C 0030 PHE C
E C 0029 VAL C 3.358 E C 0030 PHE CB
E C 0029 VAL CG2 3.770 E C 0037 ILE CG2
E C 0030 PHE C 2.495 E C 0031 ARG CA
E C 0030 PHE C 3.749 E C 0031 ARG C
E C 0030 PHE C 3.225 E C 0031 ARG CB
E C 0030 PHE CZ 3.646 C C 0032 ASP CG
E C 0030 PHE CE1 3.736 E C 0035 TRP C
E C 0030 PHE CE1 3.745 E C 0035 TRP CD1
E C 0030 PHE CD1 3.793 E C 0037 ILE CG1
E C 0031 ARG C 2.496 C C 0032 ASP CA
E C 0031 ARG C 3.588 C C 0032 ASP C
E C 0031 ARG C 3.468 C C 0032 ASP CB
C C 0032 ASP C 2.518 C C 0033 ALA CA
C C 0032 ASP C 3.201 C C 0033 ALA CB
C C 0033 ALA C 2.497 C C 0034 GLY CA
C C 0033 ALA C 3.410 C C 0034 GLY C
C C 0034 GLY C 2.502 E C 0035 TRP CA
C C 0034 GLY C 3.702 E C 0035 TRP C
C C 0034 GLY C 3.317 E C 0035 TRP CB
E C 0035 TRP C 2.504 E C 0036 MET CA
E C 0035 TRP C 3.731 E C 0036 MET C
E C 0035 TRP C 3.289 E C 0036 MET CB
E C 0035 TRP CD1 3.787 E C 0037 ILE CG1
E C 0035 TRP CZ2 3.720 E C 0046 GLU CD
E C 0035 TRP CE3 3.612 E C 0048 PHE CB
E C 0035 TRP CZ3 3.704 E C 0048 PHE CB
E C 0036 MET C 2.494 E C 0037 ILE CA
E C 0036 MET C 3.352 E C 0037 ILE C
E C 0036 MET C 3.713 E C 0037 ILE CB
E C 0037 ILE C 2.502 E C 0038 LEU CA
E C 0037 ILE C 3.475 E C 0038 LEU C
E C 0037 ILE C 3.589 E C 0038 LEU CB
E C 0037 ILE CG2 3.651 E C 0044 MET CG
E C 0038 LEU C 2.493 E C 0039 GLN CA
E C 0038 LEU C 3.694 E C 0039 GLN C
E C 0038 LEU C 3.365 E C 0039 GLN CB
E C 0038 LEU CD1 3.783 E C 0047 PHE CD2
E C 0039 GLN C 2.499 E C 0040 ARG CA
E C 0039 GLN C 3.361 E C 0040 ARG C
E C 0039 GLN C 3.688 E C 0040 ARG CB
E C 0040 ARG C 2.491 C C 0041 GLY CA
E C 0040 ARG C 3.217 C C 0041 GLY C
C C 0041 GLY C 2.492 C C 0042 ASP CA
C C 0041 GLY C 3.365 C C 0042 ASP C
C C 0041 GLY C 3.681 C C 0042 ASP CB
C C 0042 ASP C 2.512 E C 0043 LEU CA
C C 0042 ASP C 3.289 E C 0043 LEU C
C C 0042 ASP C 3.760 E C 0043 LEU CB
E C 0043 LEU C 2.494 E C 0044 MET CA
E C 0043 LEU C 3.319 E C 0044 MET C
E C 0043 LEU C 3.696 E C 0044 MET CB
E C 0044 MET C 2.500 E C 0045 LEU CA
E C 0044 MET C 3.567 E C 0045 LEU C
E C 0044 MET C 3.558 E C 0045 LEU CB
E C 0045 LEU C 2.487 E C 0046 GLU CA
E C 0045 LEU C 3.401 E C 0046 GLU C
E C 0045 LEU C 3.648 E C 0046 GLU CB
E C 0046 GLU C 2.486 E C 0047 PHE CA
E C 0046 GLU C 3.417 E C 0047 PHE C
E C 0046 GLU C 3.619 E C 0047 PHE CB
E C 0047 PHE C 2.493 E C 0048 PHE CA
E C 0047 PHE C 3.353 E C 0048 PHE C
E C 0047 PHE C 3.684 E C 0048 PHE CB
E C 0048 PHE C 2.489 E C 0049 ALA CA
E C 0048 PHE C 3.204 E C 0049 ALA C
E C 0048 PHE C 3.702 E C 0049 ALA CB
E C 0048 PHE CE1 3.778 C C 0050 HIS CD2
E C 0049 ALA C 2.492 C C 0050 HIS CA
E C 0049 ALA C 3.653 C C 0050 HIS C
E C 0049 ALA C 3.380 C C 0050 HIS CB
E C 0049 ALA C 3.619 C C 0051 PRO CD
C C 0050 HIS CA 3.048 C C 0051 PRO CD
C C 0050 HIS C 2.517 C C 0051 PRO CA
C C 0050 HIS C 3.312 C C 0051 PRO C
C C 0050 HIS C 3.669 C C 0051 PRO CB
C C 0050 HIS C 3.685 C C 0051 PRO CG
C C 0050 HIS C 2.513 C C 0051 PRO CD
C C 0051 PRO C 2.492 C C 0052 GLY CA
C C 0051 PRO C 3.334 C C 0052 GLY C
C C 0052 GLY C 2.496 C C 0053 LEU CA
C C 0052 GLY C 3.612 C C 0053 LEU C
C C 0052 GLY C 3.437 C C 0053 LEU CB
C C 0053 LEU C 2.481 C C 0054 ASP CA
C C 0053 LEU C 3.322 C C 0054 ASP C
C C 0053 LEU C 3.649 C C 0054 ASP CB
C C 0054 ASP CA 3.052 C C 0055 PRO CD
C C 0054 ASP C 2.522 C C 0055 PRO CA
C C 0054 ASP C 3.248 C C 0055 PRO C
C C 0054 ASP C 3.696 C C 0055 PRO CB
C C 0054 ASP C 3.642 C C 0055 PRO CG
C C 0054 ASP C 2.507 C C 0055 PRO CD
C C 0055 PRO C 2.501 C C 0056 LEU CA
C C 0055 PRO C 3.250 C C 0056 LEU C
C C 0055 PRO C 3.752 C C 0056 LEU CB
C C 0055 PRO CG 3.796 C C 0088 TYR CE2
C C 0056 LEU C 2.500 C C 0057 ALA CA
C C 0056 LEU C 3.396 C C 0057 ALA C
C C 0056 LEU C 3.653 C C 0057 ALA CB
C C 0057 ALA C 2.502 C C 0058 SER CA
C C 0057 ALA C 3.319 C C 0058 SER C
C C 0057 ALA C 3.685 C C 0058 SER CB
C C 0058 SER C 2.503 C C 0059 TRP CA
C C 0058 SER C 3.324 C C 0059 TRP C
C C 0058 SER C 3.714 C C 0059 TRP CB
C C 0059 TRP C 2.492 C C 0060 PHE CA
C C 0059 TRP C 3.639 C C 0060 PHE C
C C 0059 TRP C 3.421 C C 0060 PHE CB
C C 0059 TRP C 3.606 C C 0060 PHE CG
C C 0059 TRP C 3.720 C C 0060 PHE CD2
C C 0060 PHE C 2.491 E C 0061 SER CA
C C 0060 PHE C 3.545 E C 0061 SER C
C C 0060 PHE C 3.543 E C 0061 SER CB
E C 0061 SER C 2.495 E C 0062 CYS CA
E C 0061 SER C 3.759 E C 0062 CYS C
E C 0061 SER C 3.213 E C 0062 CYS CB
E C 0062 CYS C 2.473 E C 0063 CYS CA
E C 0062 CYS C 3.311 E C 0063 CYS C
E C 0062 CYS C 3.702 E C 0063 CYS CB
E C 0063 CYS C 2.484 E C 0064 LEU CA
E C 0063 CYS C 3.310 E C 0064 LEU C
E C 0063 CYS C 3.712 E C 0064 LEU CB
E C 0063 CYS CB 3.730 E C 0117 ILE CD1
E C 0064 LEU C 2.494 E C 0065 ARG CA
E C 0064 LEU C 3.357 E C 0065 ARG C
E C 0064 LEU C 3.680 E C 0065 ARG CB
E C 0064 LEU CD1 3.713 H C 0072 PHE CE2
E C 0064 LEU CD1 3.736 E C 0116 LEU CD2
E C 0065 ARG C 2.490 E C 0066 LEU CA
E C 0065 ARG C 3.398 E C 0066 LEU C
E C 0065 ARG C 3.637 E C 0066 LEU CB
E C 0066 LEU C 2.491 C C 0067 ASP CA
E C 0066 LEU C 3.291 C C 0067 ASP C
E C 0066 LEU C 3.728 C C 0067 ASP CB
C C 0067 ASP C 2.560 C C 0068 ASP CA
C C 0067 ASP C 3.616 C C 0068 ASP C
C C 0067 ASP C 3.696 C C 0068 ASP CB
C C 0068 ASP C 2.497 H C 0069 LEU CA
C C 0068 ASP C 3.417 H C 0069 LEU C
C C 0068 ASP C 3.655 H C 0069 LEU CB
H C 0069 LEU C 2.496 H C 0070 ALA CA
H C 0069 LEU C 3.256 H C 0070 ALA C
H C 0069 LEU C 3.724 H C 0070 ALA CB
H C 0069 LEU CD1 3.636 E C 0116 LEU CB
H C 0070 ALA C 2.515 H C 0071 GLU CA
H C 0070 ALA C 3.113 H C 0071 GLU C
H C 0070 ALA C 3.799 H C 0071 GLU CB
H C 0071 GLU C 2.487 H C 0072 PHE CA
H C 0071 GLU C 3.213 H C 0072 PHE C
H C 0071 GLU C 3.731 H C 0072 PHE CB
H C 0072 PHE C 2.486 H C 0073 TYR CA
H C 0072 PHE C 3.256 H C 0073 TYR C
H C 0072 PHE C 3.737 H C 0073 TYR CB
H C 0072 PHE CE2 3.719 E C 0116 LEU CD2
H C 0073 TYR C 2.503 H C 0074 ARG CA
H C 0073 TYR C 3.183 H C 0074 ARG C
H C 0073 TYR C 3.758 H C 0074 ARG CB
H C 0073 TYR CZ 3.752 E C 0092 HIS C
H C 0073 TYR CZ 3.741 E C 0093 ALA CA
H C 0073 TYR CD1 3.774 E C 0104 ALA CB
H C 0074 ARG C 2.512 H C 0075 GLN CA
H C 0074 ARG C 3.133 H C 0075 GLN C
H C 0074 ARG C 3.735 H C 0075 GLN CB
H C 0075 GLN C 2.504 H C 0076 CYS CA
H C 0075 GLN C 3.175 H C 0076 CYS C
H C 0075 GLN C 3.741 H C 0076 CYS CB
H C 0076 CYS C 2.502 H C 0077 LYS CA
H C 0076 CYS C 3.215 H C 0077 LYS C
H C 0076 CYS C 3.782 H C 0077 LYS CB
H C 0077 LYS C 2.507 H C 0078 SER CA
H C 0077 LYS C 3.359 H C 0078 SER C
H C 0077 LYS C 3.721 H C 0078 SER CB
H C 0077 LYS CG 3.636 E C 0091 ILE CD1
H C 0078 SER C 2.510 H C 0079 VAL CA
H C 0078 SER C 3.250 H C 0079 VAL C
H C 0079 VAL C 2.501 H C 0080 GLY CA
H C 0079 VAL C 3.697 H C 0080 GLY C
H C 0080 GLY C 2.502 C C 0081 ILE CA
H C 0080 GLY C 3.621 C C 0081 ILE C
H C 0080 GLY C 3.474 C C 0081 ILE CB
H C 0080 GLY C 3.447 C C 0081 ILE CG1
C C 0081 ILE C 2.488 C C 0082 GLN CA
C C 0081 ILE C 3.336 C C 0082 GLN C
C C 0081 ILE C 3.706 C C 0082 GLN CB
C C 0082 GLN C 2.498 C C 0083 GLU CA
C C 0082 GLN C 3.266 C C 0083 GLU C
C C 0082 GLN C 3.680 C C 0083 GLU CB
C C 0082 GLN C 3.791 E C 0091 ILE CG1
C C 0083 GLU C 2.499 C C 0084 THR CA
C C 0083 GLU C 3.758 C C 0084 THR C
C C 0083 GLU C 3.302 C C 0084 THR CB
C C 0083 GLU CA 3.798 E C 0091 ILE CG1
C C 0084 THR C 2.493 C C 0085 SER CA
C C 0084 THR C 3.223 C C 0085 SER C
C C 0084 THR C 3.738 C C 0085 SER CB
C C 0084 THR CG2 3.632 E C 0090 ARG CB
C C 0085 SER C 2.496 C C 0086 SER CA
C C 0085 SER C 3.458 C C 0086 SER C
C C 0085 SER C 3.604 C C 0086 SER CB
C C 0086 SER C 2.490 C C 0087 GLY CA
C C 0086 SER C 3.776 C C 0087 GLY C
C C 0087 GLY C 2.487 C C 0088 TYR CA
C C 0087 GLY C 3.731 C C 0088 TYR C
C C 0087 GLY C 3.281 C C 0088 TYR CB
C C 0088 TYR CA 3.087 C C 0089 PRO CA
C C 0088 TYR CA 3.454 C C 0089 PRO C
C C 0088 TYR C 2.534 C C 0089 PRO CA
C C 0088 TYR C 3.357 C C 0089 PRO C
C C 0088 TYR C 3.660 C C 0089 PRO CB
C C 0088 TYR C 3.674 C C 0089 PRO CG
C C 0088 TYR C 2.484 C C 0089 PRO CD
C C 0089 PRO C 2.502 E C 0090 ARG CA
C C 0089 PRO C 3.743 E C 0090 ARG C
C C 0089 PRO C 3.348 E C 0090 ARG CB
E C 0090 ARG C 2.509 E C 0091 ILE CA
E C 0090 ARG C 3.656 E C 0091 ILE C
E C 0090 ARG C 3.502 E C 0091 ILE CB
E C 0090 ARG C 3.657 E C 0091 ILE CG2
E C 0090 ARG CD 3.784 E C 0092 HIS CE1
E C 0091 ILE C 2.508 E C 0092 HIS CA
E C 0091 ILE C 3.653 E C 0092 HIS C
E C 0091 ILE C 3.503 E C 0092 HIS CB
E C 0091 ILE C 3.609 E C 0092 HIS CG
E C 0091 ILE C 3.702 E C 0092 HIS CD2
E C 0091 ILE CG2 3.582 E C 0106 LEU CD1
E C 0092 HIS C 2.491 E C 0093 ALA CA
E C 0092 HIS C 3.298 E C 0093 ALA C
E C 0092 HIS C 3.674 E C 0093 ALA CB
E C 0093 ALA CA 3.054 E C 0094 PRO CD
E C 0093 ALA C 2.522 E C 0094 PRO CA
E C 0093 ALA C 3.251 E C 0094 PRO C
E C 0093 ALA C 3.698 E C 0094 PRO CB
E C 0093 ALA C 3.632 E C 0094 PRO CG
E C 0093 ALA C 2.513 E C 0094 PRO CD
E C 0093 ALA CB 3.633 E C 0094 PRO CD
E C 0094 PRO C 2.492 E C 0095 GLU CA
E C 0094 PRO C 3.404 E C 0095 GLU C
E C 0094 PRO C 3.655 E C 0095 GLU CB
E C 0095 GLU C 2.497 E C 0096 LEU CA
E C 0095 GLU C 3.253 E C 0096 LEU C
E C 0095 GLU C 3.755 E C 0096 LEU CB
E C 0096 LEU C 2.485 C C 0097 GLN CA
E C 0096 LEU C 3.590 C C 0097 GLN C
E C 0096 LEU C 3.480 C C 0097 GLN CB
E C 0096 LEU C 3.744 C C 0097 GLN CG
C C 0097 GLN C 2.499 C C 0098 GLU CA
C C 0097 GLN C 3.365 C C 0098 GLU C
C C 0097 GLN CB 3.660 C C 0099 TRP CE2
C C 0097 GLN CG 3.732 C C 0099 TRP CZ2
C C 0098 GLU C 2.508 C C 0099 TRP CA
C C 0098 GLU C 3.788 C C 0099 TRP C
C C 0098 GLU C 3.202 C C 0099 TRP CB
C C 0098 GLU C 3.609 C C 0099 TRP CG
C C 0098 GLU C 3.492 C C 0099 TRP CD1
C C 0099 TRP C 2.488 C C 0100 GLY CA
C C 0099 TRP C 3.729 C C 0100 GLY C
C C 0100 GLY C 2.483 C C 0101 GLY CA
C C 0100 GLY C 3.575 C C 0101 GLY C
C C 0101 GLY C 2.496 E C 0102 THR CA
C C 0101 GLY C 3.767 E C 0102 THR C
C C 0101 GLY C 3.276 E C 0102 THR CB
E C 0102 THR C 2.497 E C 0103 MET CA
E C 0102 THR C 3.690 E C 0103 MET C
E C 0102 THR C 3.371 E C 0103 MET CB
E C 0102 THR CG2 3.557 E C 0118 GLN CB
E C 0103 MET C 2.495 E C 0104 ALA CA
E C 0103 MET C 3.475 E C 0104 ALA C
E C 0103 MET C 3.566 E C 0104 ALA CB
E C 0104 ALA C 2.495 E C 0105 ALA CA
E C 0104 ALA C 3.591 E C 0105 ALA C
E C 0104 ALA C 3.509 E C 0105 ALA CB
E C 0105 ALA C 2.503 E C 0106 LEU CA
E C 0105 ALA C 3.674 E C 0106 LEU C
E C 0105 ALA C 3.364 E C 0106 LEU CB
E C 0106 LEU C 2.505 E C 0107 VAL CA
E C 0106 LEU C 3.493 E C 0107 VAL C
E C 0106 LEU C 3.606 E C 0107 VAL CB
E C 0106 LEU C 3.763 E C 0107 VAL CG2
E C 0107 VAL C 2.503 C C 0108 ASP CA
E C 0107 VAL C 3.472 C C 0108 ASP C
E C 0107 VAL C 3.576 C C 0108 ASP CB
C C 0108 ASP CA 3.073 C C 0109 PRO CD
C C 0108 ASP C 2.524 C C 0109 PRO CA
C C 0108 ASP C 3.264 C C 0109 PRO C
C C 0108 ASP C 3.701 C C 0109 PRO CB
C C 0108 ASP C 3.631 C C 0109 PRO CG
C C 0108 ASP C 2.516 C C 0109 PRO CD
C C 0108 ASP CB 3.274 C C 0109 PRO CD
C C 0108 ASP CG 3.541 C C 0112 THR CB
C C 0109 PRO C 2.508 C C 0110 ASP CA
C C 0109 PRO C 3.320 C C 0110 ASP C
C C 0109 PRO C 3.733 C C 0110 ASP CB
C C 0110 ASP C 2.494 C C 0111 GLY CA
C C 0110 ASP C 3.486 C C 0111 GLY C
C C 0111 GLY C 2.494 C C 0112 THR CA
C C 0111 GLY C 3.479 C C 0112 THR C
C C 0111 GLY C 3.610 C C 0112 THR CB
C C 0112 THR C 2.480 E C 0113 LEU CA
C C 0112 THR C 3.363 E C 0113 LEU C
C C 0112 THR C 3.631 E C 0113 LEU CB
E C 0113 LEU C 2.484 E C 0114 LEU CA
E C 0113 LEU C 3.288 E C 0114 LEU C
E C 0113 LEU C 3.715 E C 0114 LEU CB
E C 0114 LEU C 2.494 E C 0115 ARG CA
E C 0114 LEU C 3.322 E C 0115 ARG C
E C 0114 LEU C 3.701 E C 0115 ARG CB
E C 0115 ARG C 2.484 E C 0116 LEU CA
E C 0115 ARG C 3.332 E C 0116 LEU C
E C 0115 ARG C 3.679 E C 0116 LEU CB
E C 0116 LEU C 2.500 E C 0117 ILE CA
E C 0116 LEU C 3.341 E C 0117 ILE C
E C 0116 LEU C 3.720 E C 0117 ILE CB
E C 0117 ILE C 2.491 E C 0118 GLN CA
E C 0117 ILE C 3.269 E C 0118 GLN C
E C 0117 ILE C 3.694 E C 0118 GLN CB
E C 0117 ILE CG2 3.787 E C 0118 GLN C
E C 0118 GLN C 2.491 C C 0119 ASN CA
E C 0118 GLN C 3.259 C C 0119 ASN C
E C 0118 GLN C 3.733 C C 0119 ASN CB
C C 0119 ASN C 2.496 C C 0120 GLU CA
C C 0119 ASN C 3.548 C C 0120 GLU C
C C 0119 ASN C 3.544 C C 0120 GLU CB
C C 0119 ASN C 3.743 C C 0120 GLU CG
C C 0120 GLU C 2.511 C C 0121 LEU CA
C C 0120 GLU C 3.251 C C 0121 LEU C
C C 0121 LEU C 2.486 C C 0122 LEU CA
C C 0121 LEU C 3.284 C C 0122 LEU C
C C 0121 LEU C 3.725 C C 0122 LEU CB
C C 0122 LEU C 2.489 C C 0123 ALA CA
C C 0122 LEU C 3.242 C C 0123 ALA C
C C 0122 LEU C 3.679 C C 0123 ALA CB
C C 0123 ALA C 2.487 C C 0124 GLY CA
C C 0123 ALA C 3.250 C C 0124 GLY C
C C 0124 GLY C 2.491 C C 0125 ILE CA
C C 0124 GLY C 3.123 C C 0125 ILE C
C C 0124 GLY C 3.786 C C 0125 ILE CB
C C 0125 ILE C 2.470 C C 0126 SER CA
C C 0125 ILE C 3.241 C C 0126 SER C
C C 0125 ILE C 3.667 C C 0126 SER CB
CHARGE_ATTR 2.00 12.00 89
H C 0013 ASP OD1 11.49 C C 0012 ARG NH1
H C 0013 ASP OD1 10.91 C C 0012 ARG NH2
H C 0013 ASP OD2 11.08 C C 0012 ARG NH1
H C 0013 ASP OD2 10.11 C C 0012 ARG NH2
H C 0013 ASP OD1 8.211 E C 0031 ARG NH1
H C 0013 ASP OD1 6.521 E C 0031 ARG NH2
H C 0013 ASP OD2 7.923 E C 0031 ARG NH1
H C 0013 ASP OD2 6.730 E C 0031 ARG NH2
H C 0015 ASP OD1 2.989 E C 0031 ARG NH1
H C 0015 ASP OD1 3.853 E C 0031 ARG NH2
H C 0015 ASP OD2 3.454 E C 0031 ARG NH1
H C 0015 ASP OD2 2.898 E C 0031 ARG NH2
H C 0022 GLU OE1 11.81 H C 0023 ARG NH2
H C 0022 GLU OE1 7.572 E C 0031 ARG NH1
H C 0022 GLU OE1 9.712 E C 0031 ARG NH2
H C 0022 GLU OE2 8.269 E C 0031 ARG NH1
H C 0022 GLU OE2 10.43 E C 0031 ARG NH2
C C 0032 ASP OD1 10.56 E C 0031 ARG NH1
C C 0032 ASP OD1 9.857 E C 0031 ARG NH2
C C 0032 ASP OD2 11.61 E C 0031 ARG NH2
C C 0042 ASP OD2 10.86 E C 0040 ARG NH1
C C 0042 ASP OD2 11.21 E C 0040 ARG NH2
C C 0054 ASP OD1 6.995 C C 0012 ARG NH1
C C 0054 ASP OD1 8.544 C C 0012 ARG NH2
C C 0054 ASP OD2 8.518 C C 0012 ARG NH1
C C 0054 ASP OD2 9.873 C C 0012 ARG NH2
C C 0054 ASP OD1 11.42 C C 0050 HIS ND1
C C 0054 ASP OD1 11.04 C C 0050 HIS NE2
C C 0054 ASP OD2 11.38 C C 0050 HIS ND1
C C 0054 ASP OD2 10.56 C C 0050 HIS NE2
C C 0054 ASP OD1 11.57 E C 0090 ARG NH1
C C 0054 ASP OD2 11.24 E C 0090 ARG NH1
C C 0054 ASP OD2 11.63 E C 0090 ARG NH2
C C 0067 ASP OD2 11.90 E C 0040 ARG NH1
C C 0067 ASP OD1 7.886 E C 0065 ARG NH1
C C 0067 ASP OD1 10.07 E C 0065 ARG NH2
C C 0067 ASP OD2 9.245 E C 0065 ARG NH1
C C 0067 ASP OD2 11.32 E C 0065 ARG NH2
C C 0068 ASP OD1 10.86 E C 0040 ARG NH1
C C 0068 ASP OD1 11.62 E C 0040 ARG NH2
C C 0068 ASP OD2 9.510 E C 0040 ARG NH1
C C 0068 ASP OD2 9.963 E C 0040 ARG NH2
C C 0068 ASP OD1 8.064 H C 0074 ARG NH1
C C 0068 ASP OD1 9.885 H C 0074 ARG NH2
C C 0068 ASP OD2 6.437 H C 0074 ARG NH1
C C 0068 ASP OD2 8.340 H C 0074 ARG NH2
H C 0071 GLU OE1 3.104 E C 0040 ARG NH1
H C 0071 GLU OE1 3.064 E C 0040 ARG NH2
H C 0071 GLU OE2 4.673 E C 0040 ARG NH1
H C 0071 GLU OE2 4.078 E C 0040 ARG NH2
H C 0071 GLU OE1 7.206 H C 0074 ARG NH1
H C 0071 GLU OE1 9.126 H C 0074 ARG NH2
H C 0071 GLU OE2 5.886 H C 0074 ARG NH1
H C 0071 GLU OE2 7.554 H C 0074 ARG NH2
C C 0083 GLU OE1 3.121 H C 0077 LYS NZ
C C 0083 GLU OE2 3.599 H C 0077 LYS NZ
C C 0083 GLU OE1 9.458 E C 0092 HIS ND1
C C 0083 GLU OE1 8.768 E C 0092 HIS NE2
C C 0083 GLU OE2 8.353 E C 0092 HIS ND1
C C 0083 GLU OE2 8.160 E C 0092 HIS NE2
E C 0095 GLU OE2 11.78 H C 0077 LYS NZ
E C 0095 GLU OE1 9.216 E C 0092 HIS ND1
E C 0095 GLU OE1 10.07 E C 0092 HIS NE2
E C 0095 GLU OE2 7.090 E C 0092 HIS ND1
E C 0095 GLU OE2 8.015 E C 0092 HIS NE2
C C 0108 ASP OD1 9.473 C C 0012 ARG NH1
C C 0108 ASP OD1 7.911 C C 0012 ARG NH2
C C 0108 ASP OD2 10.87 C C 0012 ARG NH1
C C 0108 ASP OD2 9.275 C C 0012 ARG NH2
C C 0108 ASP OD1 10.99 H C 0023 ARG NH2
C C 0108 ASP OD2 10.63 H C 0023 ARG NH2
C C 0108 ASP OD1 11.87 C C 0050 HIS NE2
C C 0108 ASP OD1 9.089 E C 0090 ARG NH1
C C 0108 ASP OD1 9.643 E C 0090 ARG NH2
C C 0108 ASP OD2 11.05 E C 0090 ARG NH1
C C 0108 ASP OD2 11.46 E C 0090 ARG NH2
C C 0110 ASP OD1 6.382 C C 0012 ARG NH1
C C 0110 ASP OD1 5.428 C C 0012 ARG NH2
C C 0110 ASP OD2 7.858 C C 0012 ARG NH1
C C 0110 ASP OD2 6.393 C C 0012 ARG NH2
C C 0110 ASP OD2 11.74 H C 0023 ARG NH2
C C 0110 ASP OD1 8.290 C C 0050 HIS ND1
C C 0110 ASP OD1 8.774 C C 0050 HIS NE2
C C 0110 ASP OD2 10.21 C C 0050 HIS ND1
C C 0110 ASP OD2 10.51 C C 0050 HIS NE2
C C 0120 GLU OE1 4.467 E C 0065 ARG NH1
C C 0120 GLU OE1 5.840 E C 0065 ARG NH2
C C 0120 GLU OE2 5.918 E C 0065 ARG NH1
C C 0120 GLU OE2 6.819 E C 0065 ARG NH2
CHARGE_REPU 2.00 12.00 63
C C 0003 ASP OD1 11.22 E C 0046 GLU OE1
C C 0012 ARG NH1 9.866 C C 0050 HIS ND1
C C 0012 ARG NH1 10.52 C C 0050 HIS NE2
C C 0012 ARG NH2 10.88 C C 0050 HIS ND1
C C 0012 ARG NH2 11.43 C C 0050 HIS NE2
C C 0012 ARG NH2 11.32 E C 0090 ARG NH1
H C 0013 ASP OD1 7.666 H C 0015 ASP OD1
H C 0013 ASP OD1 6.047 H C 0015 ASP OD2
H C 0013 ASP OD2 6.804 H C 0015 ASP OD1
H C 0013 ASP OD2 5.678 H C 0015 ASP OD2
H C 0013 ASP OD1 9.610 C C 0110 ASP OD1
H C 0013 ASP OD1 9.958 C C 0110 ASP OD2
H C 0013 ASP OD2 9.066 C C 0110 ASP OD1
H C 0013 ASP OD2 9.025 C C 0110 ASP OD2
H C 0015 ASP OD1 7.344 H C 0022 GLU OE1
H C 0015 ASP OD1 8.754 H C 0022 GLU OE2
H C 0015 ASP OD2 9.467 H C 0022 GLU OE1
H C 0015 ASP OD2 10.74 H C 0022 GLU OE2
C C 0032 ASP OD1 11.80 E C 0046 GLU OE1
C C 0032 ASP OD1 10.02 E C 0046 GLU OE2
C C 0032 ASP OD2 12.00 E C 0046 GLU OE1
C C 0032 ASP OD2 10.13 E C 0046 GLU OE2
E C 0040 ARG NH1 10.19 H C 0074 ARG NH1
E C 0040 ARG NH2 9.825 H C 0074 ARG NH1
E C 0040 ARG NH2 11.50 H C 0074 ARG NH2
C C 0042 ASP OD1 10.73 C C 0067 ASP OD2
C C 0042 ASP OD2 11.74 C C 0067 ASP OD1
C C 0042 ASP OD2 9.738 C C 0067 ASP OD2
C C 0054 ASP OD1 11.61 C C 0110 ASP OD1
E C 0065 ARG NH2 10.94 E C 0115 ARG NH1
E C 0065 ARG NH2 11.66 E C 0115 ARG NH2
C C 0067 ASP OD1 9.933 C C 0068 ASP OD1
C C 0067 ASP OD1 10.70 C C 0068 ASP OD2
C C 0067 ASP OD2 10.53 C C 0068 ASP OD1
C C 0067 ASP OD2 10.87 C C 0068 ASP OD2
C C 0067 ASP OD1 7.876 C C 0120 GLU OE1
C C 0067 ASP OD1 9.658 C C 0120 GLU OE2
C C 0067 ASP OD2 9.903 C C 0120 GLU OE1
C C 0067 ASP OD2 11.72 C C 0120 GLU OE2
C C 0068 ASP OD1 8.799 H C 0071 GLU OE1
C C 0068 ASP OD1 9.578 H C 0071 GLU OE2
C C 0068 ASP OD2 7.115 H C 0071 GLU OE1
C C 0068 ASP OD2 7.759 H C 0071 GLU OE2
H C 0074 ARG NH1 11.70 H C 0077 LYS NZ
H C 0074 ARG NH2 11.83 H C 0077 LYS NZ
H C 0077 LYS NZ 11.81 E C 0092 HIS ND1
H C 0077 LYS NZ 11.34 E C 0092 HIS NE2
C C 0083 GLU OE1 10.76 E C 0095 GLU OE1
C C 0083 GLU OE1 9.371 E C 0095 GLU OE2
C C 0083 GLU OE2 10.16 E C 0095 GLU OE1
C C 0083 GLU OE2 8.591 E C 0095 GLU OE2
E C 0090 ARG NH1 6.994 E C 0092 HIS ND1
E C 0090 ARG NH1 6.382 E C 0092 HIS NE2
E C 0090 ARG NH2 5.938 E C 0092 HIS ND1
E C 0090 ARG NH2 5.933 E C 0092 HIS NE2
E C 0090 ARG NH2 11.02 E C 0115 ARG NH1
E C 0090 ARG NH2 10.95 E C 0115 ARG NH2
E C 0092 HIS ND1 10.59 E C 0115 ARG NH1
E C 0092 HIS ND1 11.59 E C 0115 ARG NH2
C C 0108 ASP OD1 5.747 C C 0110 ASP OD1
C C 0108 ASP OD1 4.536 C C 0110 ASP OD2
C C 0108 ASP OD2 5.975 C C 0110 ASP OD1
C C 0108 ASP OD2 4.300 C C 0110 ASP OD2
HB_MM 2.00 3.20 177
C C 0003 ASP N 2.265 C C 0002 THR O
C C 0004 GLN N 2.232 C C 0003 ASP O
E C 0005 ALA N 2.254 C C 0004 GLN O
E C 0006 THR N 2.247 E C 0005 ALA O
E C 0007 PRO N 2.239 E C 0006 THR O
E C 0008 ASN N 2.253 E C 0007 PRO O
E C 0009 LEU N 2.246 E C 0008 ASN O
E C 0009 LEU N 2.822 E C 0046 GLU O
E C 0010 PRO N 2.234 E C 0009 LEU O
E C 0011 SER N 2.246 E C 0010 PRO O
E C 0011 SER N 2.946 E C 0048 PHE O
C C 0012 ARG N 2.250 E C 0011 SER O
H C 0013 ASP N 2.259 C C 0012 ARG O
H C 0014 PHE N 2.246 H C 0013 ASP O
H C 0015 ASP N 2.246 H C 0014 PHE O
H C 0016 SER N 2.252 H C 0015 ASP O
H C 0017 THR N 3.109 H C 0013 ASP O
H C 0017 THR N 2.253 H C 0016 SER O
H C 0018 ALA N 2.997 H C 0014 PHE O
H C 0018 ALA N 2.251 H C 0017 THR O
H C 0019 ALA N 3.113 H C 0015 ASP O
H C 0019 ALA N 2.252 H C 0018 ALA O
H C 0020 PHE N 2.246 H C 0019 ALA O
H C 0021 TYR N 3.171 H C 0018 ALA O
H C 0021 TYR N 2.247 H C 0020 PHE O
H C 0022 GLU N 2.914 H C 0018 ALA O
H C 0022 GLU N 2.245 H C 0021 TYR O
H C 0023 ARG N 2.243 H C 0022 GLU O
H C 0024 LEU N 3.048 H C 0021 TYR O
H C 0024 LEU N 2.249 H C 0023 ARG O
C C 0025 GLY N 2.236 H C 0024 LEU O
C C 0026 PHE N 3.045 H C 0021 TYR O
C C 0026 PHE N 2.244 C C 0025 GLY O
E C 0027 GLY N 2.255 C C 0026 PHE O
E C 0028 ILE N 2.259 E C 0027 GLY O
E C 0029 VAL N 3.002 E C 0027 GLY O
E C 0029 VAL N 2.244 E C 0028 ILE O
E C 0030 PHE N 2.248 E C 0029 VAL O
E C 0031 ARG N 2.253 E C 0030 PHE O
C C 0032 ASP N 2.260 E C 0031 ARG O
C C 0033 ALA N 2.242 C C 0032 ASP O
C C 0034 GLY N 2.251 C C 0033 ALA O
E C 0035 TRP N 2.252 C C 0034 GLY O
E C 0036 MET N 2.241 E C 0035 TRP O
E C 0036 MET N 2.953 E C 0047 PHE O
E C 0037 ILE N 3.152 E C 0030 PHE O
E C 0037 ILE N 2.242 E C 0036 MET O
E C 0038 LEU N 2.254 E C 0037 ILE O
E C 0038 LEU N 2.949 E C 0045 LEU O
E C 0039 GLN N 3.087 E C 0027 GLY O
E C 0039 GLN N 2.246 E C 0038 LEU O
E C 0040 ARG N 2.250 E C 0039 GLN O
C C 0041 GLY N 2.252 E C 0040 ARG O
C C 0042 ASP N 3.179 E C 0040 ARG O
C C 0042 ASP N 2.257 C C 0041 GLY O
E C 0043 LEU N 2.242 C C 0042 ASP O
E C 0044 MET N 2.988 C C 0042 ASP O
E C 0044 MET N 2.242 E C 0043 LEU O
E C 0045 LEU N 3.036 E C 0038 LEU O
E C 0045 LEU N 2.253 E C 0044 MET O
E C 0046 GLU N 2.250 E C 0045 LEU O
E C 0047 PHE N 2.895 E C 0036 MET O
E C 0047 PHE N 2.237 E C 0046 GLU O
E C 0048 PHE N 2.918 E C 0009 LEU O
E C 0048 PHE N 2.244 E C 0047 PHE O
E C 0049 ALA N 2.982 C C 0034 GLY O
E C 0049 ALA N 2.251 E C 0048 PHE O
C C 0050 HIS N 2.883 E C 0011 SER O
C C 0050 HIS N 3.126 E C 0048 PHE O
C C 0050 HIS N 2.253 E C 0049 ALA O
C C 0051 PRO N 2.245 C C 0050 HIS O
C C 0052 GLY N 2.248 C C 0051 PRO O
C C 0053 LEU N 3.188 C C 0051 PRO O
C C 0053 LEU N 2.262 C C 0052 GLY O
C C 0054 ASP N 2.256 C C 0053 LEU O
C C 0055 PRO N 2.250 C C 0054 ASP O
C C 0056 LEU N 2.254 C C 0055 PRO O
C C 0057 ALA N 2.248 C C 0056 LEU O
C C 0058 SER N 2.239 C C 0057 ALA O
C C 0059 TRP N 3.114 C C 0057 ALA O
C C 0059 TRP N 2.246 C C 0058 SER O
C C 0060 PHE N 3.014 C C 0058 SER O
C C 0060 PHE N 2.245 C C 0059 TRP O
E C 0061 SER N 2.251 C C 0060 PHE O
E C 0062 CYS N 2.249 E C 0061 SER O
E C 0062 CYS N 3.177 E C 0113 LEU O
E C 0063 CYS N 2.239 E C 0062 CYS O
E C 0064 LEU N 2.248 E C 0063 CYS O
E C 0064 LEU N 3.056 E C 0115 ARG O
E C 0065 ARG N 2.257 E C 0064 LEU O
E C 0066 LEU N 2.258 E C 0065 ARG O
E C 0066 LEU N 3.025 E C 0117 ILE O
C C 0067 ASP N 2.248 E C 0066 LEU O
C C 0068 ASP N 2.239 C C 0067 ASP O
H C 0069 LEU N 2.242 C C 0068 ASP O
H C 0070 ALA N 2.242 H C 0069 LEU O
H C 0071 GLU N 2.258 H C 0070 ALA O
H C 0072 PHE N 2.249 H C 0071 GLU O
H C 0073 TYR N 2.241 H C 0072 PHE O
H C 0074 ARG N 3.135 H C 0070 ALA O
H C 0074 ARG N 2.246 H C 0073 TYR O
H C 0075 GLN N 2.825 H C 0071 GLU O
H C 0075 GLN N 2.246 H C 0074 ARG O
H C 0076 CYS N 3.138 H C 0072 PHE O
H C 0076 CYS N 2.249 H C 0075 GLN O
H C 0077 LYS N 2.251 H C 0076 CYS O
H C 0078 SER N 3.002 H C 0074 ARG O
H C 0078 SER N 2.250 H C 0077 LYS O
H C 0079 VAL N 2.928 H C 0075 GLN O
H C 0079 VAL N 2.244 H C 0078 SER O
H C 0080 GLY N 2.254 H C 0079 VAL O
C C 0081 ILE N 3.157 H C 0076 CYS O
C C 0081 ILE N 2.258 H C 0080 GLY O
C C 0082 GLN N 2.247 C C 0081 ILE O
C C 0083 GLU N 2.258 C C 0082 GLN O
C C 0084 THR N 2.249 C C 0083 GLU O
C C 0085 SER N 2.245 C C 0084 THR O
C C 0086 SER N 2.250 C C 0085 SER O
C C 0087 GLY N 2.252 C C 0086 SER O
C C 0088 TYR N 2.239 C C 0087 GLY O
C C 0089 PRO N 2.245 C C 0088 TYR O
E C 0090 ARG N 2.253 C C 0089 PRO O
E C 0090 ARG N 3.109 E C 0107 VAL O
E C 0091 ILE N 2.247 E C 0090 ARG O
E C 0092 HIS N 2.250 E C 0091 ILE O
E C 0093 ALA N 2.254 E C 0092 HIS O
E C 0094 PRO N 2.251 E C 0093 ALA O
E C 0095 GLU N 2.990 E C 0093 ALA O
E C 0095 GLU N 2.250 E C 0094 PRO O
E C 0096 LEU N 2.244 E C 0095 GLU O
C C 0097 GLN N 2.247 E C 0096 LEU O
C C 0097 GLN N 3.081 C C 0101 GLY O
C C 0098 GLU N 2.247 C C 0097 GLN O
C C 0099 TRP N 3.059 C C 0097 GLN O
C C 0099 TRP N 2.254 C C 0098 GLU O
C C 0100 GLY N 2.253 C C 0099 TRP O
C C 0101 GLY N 2.257 C C 0100 GLY O
E C 0102 THR N 2.252 C C 0101 GLY O
E C 0103 MET N 2.252 E C 0102 THR O
E C 0104 ALA N 2.254 E C 0103 MET O
E C 0104 ALA N 3.039 E C 0116 LEU O
E C 0105 ALA N 3.043 E C 0092 HIS O
E C 0105 ALA N 2.237 E C 0104 ALA O
E C 0106 LEU N 2.255 E C 0105 ALA O
E C 0106 LEU N 3.028 E C 0114 LEU O
E C 0107 VAL N 2.871 E C 0090 ARG O
E C 0107 VAL N 2.248 E C 0106 LEU O
C C 0108 ASP N 2.254 E C 0107 VAL O
C C 0109 PRO N 2.240 C C 0108 ASP O
C C 0110 ASP N 2.251 C C 0109 PRO O
C C 0111 GLY N 2.241 C C 0110 ASP O
C C 0112 THR N 2.256 C C 0111 GLY O
E C 0113 LEU N 2.959 C C 0060 PHE O
E C 0113 LEU N 2.235 C C 0112 THR O
E C 0114 LEU N 2.905 E C 0106 LEU O
E C 0114 LEU N 2.244 E C 0113 LEU O
E C 0115 ARG N 3.072 E C 0062 CYS O
E C 0115 ARG N 2.253 E C 0114 LEU O
E C 0116 LEU N 2.832 E C 0104 ALA O
E C 0116 LEU N 2.228 E C 0115 ARG O
E C 0117 ILE N 3.052 E C 0064 LEU O
E C 0117 ILE N 2.244 E C 0116 LEU O
E C 0118 GLN N 2.973 E C 0102 THR O
E C 0118 GLN N 2.250 E C 0117 ILE O
C C 0119 ASN N 3.183 E C 0066 LEU O
C C 0119 ASN N 2.254 E C 0118 GLN O
C C 0120 GLU N 2.261 C C 0119 ASN O
C C 0121 LEU N 2.234 C C 0120 GLU O
C C 0122 LEU N 2.251 C C 0121 LEU O
C C 0123 ALA N 3.174 C C 0121 LEU O
C C 0123 ALA N 2.252 C C 0122 LEU O
C C 0124 GLY N 2.965 C C 0122 LEU O
C C 0124 GLY N 2.254 C C 0123 ALA O
C C 0125 ILE N 3.037 C C 0123 ALA O
C C 0125 ILE N 2.268 C C 0124 GLY O
C C 0126 SER N 3.129 C C 0124 GLY O
C C 0126 SER N 2.266 C C 0125 ILE O
HB_MS 2.00 3.20 25
C C 0002 THR O 2.975 C C 0004 GLN NE2
C C 0004 GLN N 3.160 C C 0003 ASP OD1
C C 0012 ARG N 2.821 C C 0110 ASP OD1
E C 0028 ILE N 2.987 H C 0022 GLU OE2
C C 0033 ALA N 2.749 C C 0032 ASP OD1
E C 0035 TRP N 3.012 C C 0032 ASP OD1
C C 0041 GLY O 2.908 E C 0039 GLN NE2
C C 0057 ALA N 3.037 C C 0054 ASP OD2
E C 0065 ARG O 3.189 C C 0119 ASN ND2
C C 0067 ASP O 2.951 E C 0118 GLN NE2
H C 0069 LEU N 3.070 E C 0118 GLN OE1
H C 0070 ALA N 3.009 C C 0068 ASP OD1
H C 0074 ARG O 2.707 H C 0078 SER OG
H C 0080 GLY O 3.188 H C 0023 ARG NH1
C C 0084 THR O 2.943 E C 0092 HIS NE2
C C 0086 SER O 2.753 C C 0084 THR OG1
C C 0086 SER N 3.188 C C 0085 SER OG
C C 0087 GLY O 2.980 E C 0090 ARG NH1
E C 0095 GLU O 2.691 E C 0102 THR OG1
C C 0101 GLY N 2.857 C C 0120 GLU OE2
E C 0103 MET N 3.169 E C 0102 THR OG1
C C 0109 PRO O 3.136 C C 0012 ARG NH2
C C 0111 GLY O 2.692 C C 0058 SER OG
C C 0111 GLY N 2.946 C C 0108 ASP OD1
C C 0112 THR N 2.870 C C 0108 ASP OD1
HB_SS 2.00 3.20 13
H C 0013 ASP OD2 2.607 H C 0016 SER OG
E C 0046 GLU OE1 2.464 E C 0006 THR OG1
E C 0046 GLU OE1 3.086 E C 0008 ASN ND2
E C 0046 GLU OE2 2.810 E C 0035 TRP NE1
C C 0067 ASP OD1 2.923 C C 0119 ASN ND2
H C 0071 GLU OE2 2.946 H C 0075 GLN NE2
C C 0083 GLU OE2 2.513 H C 0073 TYR OH
C C 0099 TRP NE1 3.113 C C 0097 GLN OE1
C C 0108 ASP OD2 2.544 H C 0021 TYR OH
C C 0108 ASP OD1 2.950 C C 0112 THR OG1
C C 0108 ASP OD2 2.821 C C 0112 THR OG1
C C 0110 ASP OD2 2.528 H C 0017 THR OG1
E C 0115 ARG NH2 3.109 E C 0061 SER OG
AROMATIC 0.00 8.00 10
H C 0023 ARG 4.667 H C 0020 PHE
E C 0048 PHE 5.418 C C 0050 HIS
H C 0020 PHE 5.249 H C 0021 TYR
E C 0040 ARG 4.978 H C 0072 PHE
E C 0090 ARG 6.444 E C 0092 HIS
H C 0077 LYS 6.150 H C 0073 TYR
E C 0031 ARG 5.944 H C 0014 PHE
C C 0012 ARG 5.510 C C 0088 TYR
E C 0090 ARG 6.427 C C 0088 TYR
E C 0115 ARG 7.642 C C 0059 TRP