Complet list of 1wxu con file
Complete list of 1wxu.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 399
C A 0001 GLY CA 3.797 C A 0002 SER CA
C A 0001 GLY C 2.434 C A 0002 SER CA
C A 0001 GLY C 3.480 C A 0002 SER C
C A 0001 GLY C 3.488 C A 0002 SER CB
C A 0002 SER C 2.435 C A 0003 SER CA
C A 0002 SER C 3.570 C A 0003 SER C
C A 0002 SER C 3.388 C A 0003 SER CB
C A 0003 SER CA 3.791 C A 0004 GLY CA
C A 0003 SER C 2.418 C A 0004 GLY CA
C A 0003 SER C 3.679 C A 0004 GLY C
C A 0004 GLY CA 3.797 C A 0005 SER CA
C A 0004 GLY C 2.435 C A 0005 SER CA
C A 0004 GLY C 3.691 C A 0005 SER C
C A 0004 GLY C 3.146 C A 0005 SER CB
C A 0005 SER C 2.434 C A 0006 SER CA
C A 0005 SER C 3.550 C A 0006 SER C
C A 0005 SER C 3.412 C A 0006 SER CB
C A 0006 SER CA 3.791 C A 0007 GLY CA
C A 0006 SER C 2.417 C A 0007 GLY CA
C A 0006 SER C 3.185 C A 0007 GLY C
C A 0007 GLY CA 3.796 C A 0008 THR CA
C A 0007 GLY C 2.433 C A 0008 THR CA
C A 0007 GLY C 2.980 C A 0008 THR C
C A 0007 GLY C 3.737 C A 0008 THR CB
C A 0008 THR C 2.434 C A 0009 ASN CA
C A 0008 THR C 3.419 C A 0009 ASN C
C A 0008 THR C 3.544 C A 0009 ASN CB
C A 0008 THR CB 3.724 C A 0010 TRP CD1
C A 0009 ASN C 2.432 C A 0010 TRP CA
C A 0009 ASN C 2.983 C A 0010 TRP C
C A 0009 ASN C 3.713 C A 0010 TRP CB
C A 0009 ASN CG 3.376 C A 0012 SER CB
C A 0009 ASN C 3.733 C A 0015 ASP CB
C A 0010 TRP C 2.433 C A 0011 ALA CA
C A 0010 TRP C 2.944 C A 0011 ALA C
C A 0010 TRP C 3.705 C A 0011 ALA CB
C A 0010 TRP CE3 3.630 C A 0011 ALA CA
C A 0010 TRP CA 3.630 C A 0015 ASP CB
C A 0010 TRP CD2 3.715 C A 0045 ALA CB
C A 0010 TRP CZ2 3.513 E A 0058 LEU CD2
C A 0010 TRP CH2 3.654 E A 0058 LEU CD2
C A 0010 TRP CZ2 3.407 C A 0066 THR CG2
C A 0010 TRP CZ3 3.704 C A 0066 THR CG2
C A 0010 TRP CH2 3.508 C A 0066 THR CB
C A 0010 TRP CH2 2.962 C A 0066 THR CG2
C A 0011 ALA C 2.434 C A 0012 SER CA
C A 0011 ALA C 3.134 C A 0012 SER C
C A 0011 ALA C 3.694 C A 0012 SER CB
C A 0011 ALA CB 3.491 E A 0060 SER CB
C A 0011 ALA CB 3.731 C A 0063 GLY C
C A 0012 SER CA 3.791 C A 0013 GLY CA
C A 0012 SER C 2.418 C A 0013 GLY CA
C A 0012 SER C 3.434 C A 0013 GLY C
C A 0013 GLY CA 3.797 C A 0014 GLU CA
C A 0013 GLY C 2.433 C A 0014 GLU CA
C A 0013 GLY C 2.960 C A 0014 GLU C
C A 0013 GLY C 3.715 C A 0014 GLU CB
C A 0014 GLU C 2.434 C A 0015 ASP CA
C A 0014 GLU C 3.445 C A 0015 ASP C
C A 0014 GLU C 3.521 C A 0015 ASP CB
C A 0015 ASP C 2.434 C A 0016 ASP CA
C A 0015 ASP C 3.012 C A 0016 ASP C
C A 0015 ASP C 3.714 C A 0016 ASP CB
C A 0015 ASP C 3.609 C A 0082 GLY CA
C A 0016 ASP C 2.435 C A 0017 HIS CA
C A 0016 ASP C 3.688 C A 0017 HIS C
C A 0016 ASP C 3.158 C A 0017 HIS CB
C A 0016 ASP CG 3.614 C A 0046 LEU CD1
C A 0017 HIS C 2.434 C A 0018 VAL CA
C A 0017 HIS C 3.481 C A 0018 VAL C
C A 0017 HIS C 3.516 C A 0018 VAL CB
C A 0017 HIS C 3.476 C A 0018 VAL CG2
C A 0017 HIS CD2 3.458 E A 0043 ASN CB
C A 0018 VAL C 2.434 C A 0019 VAL CA
C A 0018 VAL C 3.453 C A 0019 VAL C
C A 0018 VAL C 3.542 C A 0019 VAL CB
C A 0018 VAL C 3.587 C A 0019 VAL CG2
C A 0018 VAL CG1 3.255 E A 0076 ILE CD1
C A 0018 VAL CG1 3.798 C A 0079 LYS CA
C A 0018 VAL CG1 3.587 C A 0079 LYS CB
C A 0018 VAL CG2 3.792 C A 0079 LYS CG
C A 0018 VAL CG2 3.343 C A 0079 LYS CD
C A 0019 VAL C 2.433 E A 0020 ALA CA
C A 0019 VAL C 3.670 E A 0020 ALA C
C A 0019 VAL C 3.198 E A 0020 ALA CB
E A 0020 ALA C 2.433 E A 0021 ARG CA
E A 0020 ALA C 3.471 E A 0021 ARG C
E A 0020 ALA C 3.497 E A 0021 ARG CB
E A 0020 ALA CA 3.559 C A 0077 LEU CD2
E A 0020 ALA C 3.489 C A 0077 LEU CD2
E A 0021 ARG C 2.433 E A 0022 ALA CA
E A 0021 ARG C 2.890 E A 0022 ALA C
E A 0021 ARG C 3.698 E A 0022 ALA CB
E A 0021 ARG CG 3.797 C A 0039 GLY CA
E A 0021 ARG CB 3.525 C A 0041 MET CE
E A 0021 ARG CG 3.421 C A 0041 MET CE
E A 0021 ARG CB 3.396 C A 0077 LEU CD2
E A 0022 ALA C 2.434 C A 0023 GLU CA
E A 0022 ALA C 3.057 C A 0023 GLU C
E A 0022 ALA C 3.709 C A 0023 GLU CB
E A 0022 ALA CB 3.388 C A 0036 PHE CD1
E A 0022 ALA CB 3.401 C A 0036 PHE CE1
E A 0022 ALA CB 3.764 C A 0038 ALA CA
C A 0023 GLU C 2.433 C A 0024 TYR CA
C A 0023 GLU C 3.615 C A 0024 TYR C
C A 0023 GLU C 3.314 C A 0024 TYR CB
C A 0023 GLU C 3.152 C A 0024 TYR CG
C A 0023 GLU C 3.489 C A 0024 TYR CD1
C A 0023 GLU C 3.566 C A 0024 TYR CD2
C A 0023 GLU CB 3.456 C A 0024 TYR CD1
C A 0023 GLU CB 3.326 C A 0024 TYR CE1
C A 0023 GLU CB 3.741 C A 0024 TYR CZ
C A 0023 GLU CG 3.243 E A 0075 LYS CB
C A 0023 GLU CD 3.475 E A 0075 LYS CB
C A 0024 TYR C 2.434 C A 0025 ASP CA
C A 0024 TYR C 3.204 C A 0025 ASP C
C A 0024 TYR C 3.669 C A 0025 ASP CB
C A 0024 TYR CA 3.627 C A 0038 ALA CB
C A 0024 TYR C 3.583 C A 0038 ALA CB
C A 0025 ASP C 2.434 C A 0026 PHE CA
C A 0025 ASP C 3.690 C A 0026 PHE C
C A 0025 ASP C 3.151 C A 0026 PHE CB
C A 0026 PHE C 2.434 C A 0027 VAL CA
C A 0026 PHE C 3.284 C A 0027 VAL C
C A 0026 PHE C 3.658 C A 0027 VAL CB
C A 0026 PHE CD1 3.668 C A 0027 VAL C
C A 0026 PHE CE1 3.599 C A 0027 VAL C
C A 0026 PHE CE1 3.762 C A 0070 PRO CD
C A 0026 PHE CB 3.615 C A 0073 TYR CD2
C A 0027 VAL C 2.433 C A 0028 ALA CA
C A 0027 VAL C 3.319 C A 0028 ALA C
C A 0027 VAL C 3.603 C A 0028 ALA CB
C A 0028 ALA C 2.434 C A 0029 VAL CA
C A 0028 ALA C 3.043 C A 0029 VAL C
C A 0028 ALA C 3.733 C A 0029 VAL CB
C A 0028 ALA CB 3.351 C A 0033 GLU C
C A 0028 ALA CB 3.524 C A 0033 GLU CB
C A 0028 ALA CB 3.760 C A 0034 ILE CA
C A 0028 ALA CB 3.481 C A 0034 ILE C
C A 0029 VAL C 2.434 C A 0030 SER CA
C A 0029 VAL C 3.560 C A 0030 SER C
C A 0029 VAL C 3.398 C A 0030 SER CB
C A 0030 SER C 2.434 C A 0031 ASP CA
C A 0030 SER C 3.060 C A 0031 ASP C
C A 0030 SER C 3.708 C A 0031 ASP CB
C A 0031 ASP C 2.433 C A 0032 GLU CA
C A 0031 ASP C 3.013 C A 0032 GLU C
C A 0031 ASP C 3.715 C A 0032 GLU CB
C A 0032 GLU C 2.434 C A 0033 GLU CA
C A 0032 GLU C 3.158 C A 0033 GLU C
C A 0032 GLU C 3.687 C A 0033 GLU CB
C A 0032 GLU C 3.735 C A 0033 GLU CD
C A 0033 GLU C 2.433 C A 0034 ILE CA
C A 0033 GLU C 3.502 C A 0034 ILE C
C A 0033 GLU C 3.494 C A 0034 ILE CB
C A 0033 GLU C 3.650 C A 0034 ILE CG2
C A 0033 GLU CG 3.669 C A 0056 TRP CZ3
C A 0034 ILE C 2.435 C A 0035 SER CA
C A 0034 ILE C 3.318 C A 0035 SER C
C A 0034 ILE C 3.615 C A 0035 SER CB
C A 0034 ILE CG1 3.017 E A 0069 ILE CG2
C A 0034 ILE CD1 2.874 E A 0069 ILE CG2
C A 0035 SER C 2.434 C A 0036 PHE CA
C A 0035 SER C 3.605 C A 0036 PHE C
C A 0035 SER C 3.334 C A 0036 PHE CB
C A 0035 SER C 3.788 C A 0061 LEU CD1
C A 0036 PHE C 2.434 C A 0037 ARG CA
C A 0036 PHE C 3.383 C A 0037 ARG C
C A 0036 PHE C 3.571 C A 0037 ARG CB
C A 0036 PHE CD2 3.542 C A 0042 LEU CD2
C A 0036 PHE CA 3.709 C A 0061 LEU CD1
C A 0036 PHE CB 3.583 C A 0061 LEU CG
C A 0036 PHE CB 3.352 C A 0061 LEU CD1
C A 0036 PHE CE2 3.775 C A 0070 PRO CD
C A 0036 PHE CZ 3.781 C A 0070 PRO CG
C A 0036 PHE CZ 3.796 C A 0070 PRO CD
C A 0037 ARG C 2.433 C A 0038 ALA CA
C A 0037 ARG C 3.011 C A 0038 ALA C
C A 0037 ARG C 3.706 C A 0038 ALA CB
C A 0038 ALA CA 3.791 C A 0039 GLY CA
C A 0038 ALA C 2.418 C A 0039 GLY CA
C A 0038 ALA C 3.493 C A 0039 GLY C
C A 0039 GLY CA 3.796 C A 0040 ASP CA
C A 0039 GLY C 2.434 C A 0040 ASP CA
C A 0039 GLY C 3.517 C A 0040 ASP C
C A 0039 GLY C 3.450 C A 0040 ASP CB
C A 0039 GLY C 3.637 C A 0040 ASP CG
C A 0040 ASP C 2.434 C A 0041 MET CA
C A 0040 ASP C 3.303 C A 0041 MET C
C A 0040 ASP C 3.624 C A 0041 MET CB
C A 0040 ASP C 3.714 C A 0041 MET CE
C A 0041 MET C 2.434 C A 0042 LEU CA
C A 0041 MET C 3.414 C A 0042 LEU C
C A 0041 MET C 3.548 C A 0042 LEU CB
C A 0041 MET C 3.772 C A 0042 LEU CG
C A 0042 LEU C 2.435 E A 0043 ASN CA
C A 0042 LEU C 3.240 E A 0043 ASN C
C A 0042 LEU C 3.656 E A 0043 ASN CB
C A 0042 LEU CD2 3.797 E A 0069 ILE CG2
C A 0042 LEU CD2 3.571 E A 0069 ILE CD1
E A 0043 ASN C 2.434 E A 0044 LEU CA
E A 0043 ASN C 3.342 E A 0044 LEU C
E A 0043 ASN C 3.599 E A 0044 LEU CB
E A 0043 ASN C 3.780 E A 0044 LEU CG
E A 0043 ASN C 3.480 E A 0059 ALA CB
E A 0044 LEU C 2.434 C A 0045 ALA CA
E A 0044 LEU C 3.115 C A 0045 ALA C
E A 0044 LEU C 3.690 C A 0045 ALA CB
E A 0044 LEU CD2 3.211 E A 0059 ALA CB
E A 0044 LEU CD2 3.354 E A 0069 ILE CD1
E A 0044 LEU CD1 3.492 E A 0076 ILE CD1
C A 0045 ALA C 2.434 C A 0046 LEU CA
C A 0045 ALA C 3.016 C A 0046 LEU C
C A 0045 ALA C 3.713 C A 0046 LEU CB
C A 0046 LEU C 2.434 C A 0047 LYS CA
C A 0046 LEU C 2.839 C A 0047 LYS C
C A 0046 LEU C 3.688 C A 0047 LYS CB
C A 0046 LEU C 3.709 C A 0050 GLN CG
C A 0047 LYS C 2.434 C A 0048 GLU CA
C A 0047 LYS C 2.897 C A 0048 GLU C
C A 0047 LYS C 3.708 C A 0048 GLU CB
C A 0047 LYS CA 3.698 C A 0050 GLN CB
C A 0047 LYS CA 3.512 C A 0050 GLN CG
C A 0048 GLU C 2.434 C A 0049 GLN CA
C A 0048 GLU C 3.201 C A 0049 GLN C
C A 0048 GLU C 3.670 C A 0049 GLN CB
C A 0049 GLN C 2.433 C A 0050 GLN CA
C A 0049 GLN C 2.821 C A 0050 GLN C
C A 0049 GLN C 3.680 C A 0050 GLN CB
C A 0050 GLN CA 2.867 C A 0051 PRO CD
C A 0050 GLN C 2.464 C A 0051 PRO CA
C A 0050 GLN C 3.136 C A 0051 PRO C
C A 0050 GLN C 3.646 C A 0051 PRO CB
C A 0050 GLN C 3.635 C A 0051 PRO CG
C A 0050 GLN C 2.498 C A 0051 PRO CD
C A 0050 GLN CB 3.532 C A 0051 PRO CD
C A 0051 PRO C 2.434 C A 0052 LYS CA
C A 0051 PRO C 3.129 C A 0052 LYS C
C A 0051 PRO C 3.695 C A 0052 LYS CB
C A 0051 PRO CG 3.483 C A 0053 VAL CG1
C A 0051 PRO CD 3.564 E A 0058 LEU CB
C A 0052 LYS C 2.433 C A 0053 VAL CA
C A 0052 LYS C 2.860 C A 0053 VAL C
C A 0052 LYS C 3.716 C A 0053 VAL CB
C A 0052 LYS CD 3.711 C A 0053 VAL CA
C A 0053 VAL C 2.434 C A 0054 ARG CA
C A 0053 VAL C 3.456 C A 0054 ARG C
C A 0053 VAL C 3.512 C A 0054 ARG CB
C A 0053 VAL C 3.787 C A 0054 ARG CG
C A 0054 ARG CA 3.792 C A 0055 GLY CA
C A 0054 ARG C 2.418 C A 0055 GLY CA
C A 0054 ARG C 3.343 C A 0055 GLY C
C A 0055 GLY CA 3.796 C A 0056 TRP CA
C A 0055 GLY C 2.433 C A 0056 TRP CA
C A 0055 GLY C 3.320 C A 0056 TRP C
C A 0055 GLY C 3.610 C A 0056 TRP CB
C A 0055 GLY C 3.551 C A 0056 TRP CD1
C A 0056 TRP C 2.435 E A 0057 LEU CA
C A 0056 TRP C 3.344 E A 0057 LEU C
C A 0056 TRP C 3.598 E A 0057 LEU CB
C A 0056 TRP CE3 3.673 E A 0068 LEU CB
E A 0057 LEU C 2.435 E A 0058 LEU CA
E A 0057 LEU C 3.129 E A 0058 LEU C
E A 0057 LEU C 3.694 E A 0058 LEU CB
E A 0058 LEU C 2.434 E A 0059 ALA CA
E A 0058 LEU C 3.643 E A 0059 ALA C
E A 0058 LEU C 3.258 E A 0059 ALA CB
E A 0059 ALA C 2.434 E A 0060 SER CA
E A 0059 ALA C 3.435 E A 0060 SER C
E A 0059 ALA C 3.530 E A 0060 SER CB
E A 0059 ALA CB 3.653 E A 0069 ILE CD1
E A 0060 SER C 2.435 C A 0061 LEU CA
E A 0060 SER C 2.941 C A 0061 LEU C
E A 0060 SER C 3.713 C A 0061 LEU CB
E A 0060 SER CB 3.643 C A 0065 THR C
E A 0060 SER CB 3.791 C A 0066 THR CA
E A 0060 SER CB 3.459 C A 0066 THR CG2
C A 0061 LEU C 2.434 C A 0062 ASP CA
C A 0061 LEU C 3.031 C A 0062 ASP C
C A 0061 LEU C 3.711 C A 0062 ASP CB
C A 0062 ASP CA 3.792 C A 0063 GLY CA
C A 0062 ASP C 2.419 C A 0063 GLY CA
C A 0062 ASP C 3.646 C A 0063 GLY C
C A 0063 GLY CA 3.796 C A 0064 GLN CA
C A 0063 GLY C 2.434 C A 0064 GLN CA
C A 0063 GLY C 3.311 C A 0064 GLN C
C A 0063 GLY C 3.617 C A 0064 GLN CB
C A 0064 GLN C 2.434 C A 0065 THR CA
C A 0064 GLN C 3.308 C A 0065 THR C
C A 0064 GLN C 3.646 C A 0065 THR CB
C A 0065 THR C 2.433 C A 0066 THR CA
C A 0065 THR C 3.440 C A 0066 THR C
C A 0065 THR C 3.552 C A 0066 THR CB
C A 0065 THR C 3.636 C A 0066 THR CG2
C A 0066 THR CA 3.791 E A 0067 GLY CA
C A 0066 THR C 2.418 E A 0067 GLY CA
C A 0066 THR C 3.650 E A 0067 GLY C
E A 0067 GLY CA 3.797 E A 0068 LEU CA
E A 0067 GLY C 2.434 E A 0068 LEU CA
E A 0067 GLY C 3.247 E A 0068 LEU C
E A 0067 GLY C 3.651 E A 0068 LEU CB
E A 0068 LEU C 2.433 E A 0069 ILE CA
E A 0068 LEU C 3.524 E A 0069 ILE C
E A 0068 LEU C 3.470 E A 0069 ILE CB
E A 0068 LEU C 3.447 E A 0069 ILE CG2
E A 0069 ILE CA 2.866 C A 0070 PRO CD
E A 0069 ILE C 2.464 C A 0070 PRO CA
E A 0069 ILE C 3.136 C A 0070 PRO C
E A 0069 ILE C 3.646 C A 0070 PRO CB
E A 0069 ILE C 3.635 C A 0070 PRO CG
E A 0069 ILE C 2.498 C A 0070 PRO CD
E A 0069 ILE CB 3.394 C A 0070 PRO CD
C A 0070 PRO C 2.434 C A 0071 ALA CA
C A 0070 PRO C 3.333 C A 0071 ALA C
C A 0070 PRO C 3.596 C A 0071 ALA CB
C A 0070 PRO CB 3.721 C A 0073 TYR CB
C A 0070 PRO CG 3.460 C A 0073 TYR CB
C A 0071 ALA C 2.434 C A 0072 ASN CA
C A 0071 ALA C 2.930 C A 0072 ASN C
C A 0071 ALA C 3.712 C A 0072 ASN CB
C A 0071 ALA CA 3.637 E A 0074 VAL CG2
C A 0071 ALA C 3.569 E A 0074 VAL CG2
C A 0072 ASN C 2.433 C A 0073 TYR CA
C A 0072 ASN C 3.010 C A 0073 TYR C
C A 0072 ASN C 3.713 C A 0073 TYR CB
C A 0073 TYR C 2.434 E A 0074 VAL CA
C A 0073 TYR C 3.457 E A 0074 VAL C
C A 0073 TYR C 3.539 E A 0074 VAL CB
C A 0073 TYR C 3.599 E A 0074 VAL CG1
E A 0074 VAL C 2.434 E A 0075 LYS CA
E A 0074 VAL C 3.516 E A 0075 LYS C
E A 0074 VAL C 3.453 E A 0075 LYS CB
E A 0075 LYS C 2.433 E A 0076 ILE CA
E A 0075 LYS C 3.137 E A 0076 ILE C
E A 0075 LYS C 3.715 E A 0076 ILE CB
E A 0076 ILE C 2.434 C A 0077 LEU CA
E A 0076 ILE C 3.387 C A 0077 LEU C
E A 0076 ILE C 3.569 C A 0077 LEU CB
E A 0076 ILE C 3.687 C A 0077 LEU CD1
C A 0077 LEU CA 3.792 C A 0078 GLY CA
C A 0077 LEU C 2.418 C A 0078 GLY CA
C A 0077 LEU C 3.707 C A 0078 GLY C
C A 0078 GLY CA 3.797 C A 0079 LYS CA
C A 0078 GLY C 2.434 C A 0079 LYS CA
C A 0078 GLY C 2.930 C A 0079 LYS C
C A 0078 GLY C 3.712 C A 0079 LYS CB
C A 0079 LYS C 2.434 C A 0080 ARG CA
C A 0079 LYS C 3.575 C A 0080 ARG C
C A 0079 LYS C 3.379 C A 0080 ARG CB
C A 0079 LYS C 3.585 C A 0080 ARG CG
C A 0080 ARG C 2.434 C A 0081 ARG CA
C A 0080 ARG C 3.286 C A 0081 ARG C
C A 0080 ARG C 3.632 C A 0081 ARG CB
C A 0081 ARG CA 3.793 C A 0082 GLY CA
C A 0081 ARG C 2.418 C A 0082 GLY CA
C A 0081 ARG C 2.901 C A 0082 GLY C
C A 0082 GLY CA 3.797 C A 0083 ARG CA
C A 0082 GLY C 2.434 C A 0083 ARG CA
C A 0082 GLY C 3.263 C A 0083 ARG C
C A 0082 GLY C 3.644 C A 0083 ARG CB
C A 0082 GLY C 3.371 C A 0085 THR CG2
C A 0083 ARG C 2.435 C A 0084 LYS CA
C A 0083 ARG C 2.916 C A 0084 LYS C
C A 0083 ARG C 3.711 C A 0084 LYS CB
C A 0083 ARG CA 3.480 C A 0086 ILE CD1
C A 0083 ARG C 3.670 C A 0086 ILE CG1
C A 0083 ARG C 3.526 C A 0086 ILE CD1
C A 0083 ARG CG 3.498 C A 0086 ILE CD1
C A 0084 LYS C 2.434 C A 0085 THR CA
C A 0084 LYS C 2.889 C A 0085 THR C
C A 0084 LYS C 3.726 C A 0085 THR CB
C A 0085 THR C 2.433 C A 0086 ILE CA
C A 0085 THR C 3.020 C A 0086 ILE C
C A 0085 THR C 3.735 C A 0086 ILE CB
C A 0085 THR C 3.792 C A 0088 SER CB
C A 0086 ILE C 2.433 C A 0087 GLU CA
C A 0086 ILE C 2.911 C A 0087 GLU C
C A 0086 ILE C 3.098 C A 0087 GLU CB
C A 0087 GLU C 2.434 C A 0088 SER CA
C A 0087 GLU C 3.300 C A 0088 SER C
C A 0087 GLU C 3.625 C A 0088 SER CB
C A 0088 SER CA 3.792 C A 0089 GLY CA
C A 0088 SER C 2.418 C A 0089 GLY CA
C A 0088 SER C 3.614 C A 0089 GLY C
C A 0089 GLY CA 2.866 C A 0090 PRO CD
C A 0089 GLY C 2.464 C A 0090 PRO CA
C A 0089 GLY C 3.136 C A 0090 PRO C
C A 0089 GLY C 3.646 C A 0090 PRO CB
C A 0089 GLY C 3.636 C A 0090 PRO CG
C A 0089 GLY C 2.498 C A 0090 PRO CD
C A 0090 PRO C 2.435 C A 0091 SER CA
C A 0090 PRO C 3.683 C A 0091 SER C
C A 0090 PRO C 3.171 C A 0091 SER CB
C A 0091 SER C 2.434 C A 0092 SER CA
C A 0091 SER C 3.006 C A 0092 SER C
C A 0091 SER C 3.715 C A 0092 SER CB
C A 0092 SER CA 3.792 C A 0093 GLY CA
C A 0092 SER C 2.419 C A 0093 GLY CA
C A 0092 SER C 2.963 C A 0093 GLY C
CHARGE_ATTR 2.00 12.00 54
C A 0014 GLU OE1 10.95 C A 0017 HIS ND1
C A 0014 GLU OE2 11.25 C A 0017 HIS ND1
C A 0014 GLU OE1 4.546 C A 0083 ARG NH1
C A 0014 GLU OE1 6.214 C A 0083 ARG NH2
C A 0014 GLU OE2 6.587 C A 0083 ARG NH1
C A 0014 GLU OE2 8.101 C A 0083 ARG NH2
C A 0014 GLU OE1 4.065 C A 0084 LYS NZ
C A 0014 GLU OE2 3.388 C A 0084 LYS NZ
C A 0015 ASP OD1 8.522 C A 0017 HIS ND1
C A 0015 ASP OD1 10.41 C A 0017 HIS NE2
C A 0015 ASP OD2 8.854 C A 0017 HIS ND1
C A 0015 ASP OD2 10.86 C A 0017 HIS NE2
C A 0015 ASP OD1 9.491 C A 0083 ARG NH1
C A 0015 ASP OD1 10.03 C A 0083 ARG NH2
C A 0015 ASP OD2 11.57 C A 0083 ARG NH1
C A 0015 ASP OD2 11.93 C A 0083 ARG NH2
C A 0015 ASP OD1 6.684 C A 0084 LYS NZ
C A 0015 ASP OD2 8.607 C A 0084 LYS NZ
C A 0016 ASP OD1 7.130 C A 0017 HIS ND1
C A 0016 ASP OD1 9.135 C A 0017 HIS NE2
C A 0016 ASP OD2 8.185 C A 0017 HIS ND1
C A 0016 ASP OD2 10.26 C A 0017 HIS NE2
C A 0016 ASP OD1 9.827 C A 0079 LYS NZ
C A 0016 ASP OD2 10.01 C A 0079 LYS NZ
C A 0016 ASP OD1 11.90 C A 0081 ARG NH1
C A 0016 ASP OD1 11.63 C A 0081 ARG NH2
C A 0016 ASP OD2 10.38 C A 0081 ARG NH1
C A 0016 ASP OD2 10.21 C A 0081 ARG NH2
C A 0016 ASP OD2 11.79 C A 0084 LYS NZ
C A 0023 GLU OE1 10.03 E A 0021 ARG NH1
C A 0023 GLU OE1 11.65 E A 0021 ARG NH2
C A 0023 GLU OE2 8.293 E A 0021 ARG NH1
C A 0023 GLU OE2 10.08 E A 0021 ARG NH2
C A 0023 GLU OE1 6.532 E A 0075 LYS NZ
C A 0023 GLU OE2 6.439 E A 0075 LYS NZ
C A 0025 ASP OD1 9.426 C A 0037 ARG NH1
C A 0025 ASP OD1 10.48 C A 0037 ARG NH2
C A 0025 ASP OD2 7.981 C A 0037 ARG NH1
C A 0025 ASP OD2 9.377 C A 0037 ARG NH2
C A 0032 GLU OE1 9.129 C A 0052 LYS NZ
C A 0032 GLU OE2 8.582 C A 0052 LYS NZ
C A 0033 GLU OE1 10.51 C A 0052 LYS NZ
C A 0033 GLU OE2 11.51 C A 0052 LYS NZ
C A 0040 ASP OD1 10.69 E A 0021 ARG NH1
C A 0040 ASP OD1 9.350 E A 0021 ARG NH2
C A 0040 ASP OD2 10.85 E A 0021 ARG NH1
C A 0040 ASP OD2 9.684 E A 0021 ARG NH2
C A 0040 ASP OD1 8.772 C A 0037 ARG NH1
C A 0040 ASP OD1 8.285 C A 0037 ARG NH2
C A 0040 ASP OD2 7.784 C A 0037 ARG NH1
C A 0040 ASP OD2 7.738 C A 0037 ARG NH2
C A 0048 GLU OE1 8.829 C A 0047 LYS NZ
C A 0048 GLU OE2 9.264 C A 0047 LYS NZ
C A 0048 GLU OE1 10.38 C A 0079 LYS NZ
CHARGE_REPU 2.00 12.00 59
C A 0014 GLU OE1 6.580 C A 0015 ASP OD1
C A 0014 GLU OE1 8.767 C A 0015 ASP OD2
C A 0014 GLU OE2 5.136 C A 0015 ASP OD1
C A 0014 GLU OE2 7.236 C A 0015 ASP OD2
C A 0014 GLU OE2 11.30 C A 0016 ASP OD1
C A 0014 GLU OE2 11.39 C A 0016 ASP OD2
C A 0015 ASP OD1 6.302 C A 0016 ASP OD1
C A 0015 ASP OD1 6.555 C A 0016 ASP OD2
C A 0015 ASP OD2 4.768 C A 0016 ASP OD1
C A 0015 ASP OD2 5.113 C A 0016 ASP OD2
C A 0015 ASP OD1 11.90 C A 0048 GLU OE1
C A 0015 ASP OD2 9.840 C A 0048 GLU OE1
C A 0015 ASP OD2 10.84 C A 0048 GLU OE2
C A 0016 ASP OD1 6.506 C A 0048 GLU OE1
C A 0016 ASP OD1 8.228 C A 0048 GLU OE2
C A 0016 ASP OD2 6.386 C A 0048 GLU OE1
C A 0016 ASP OD2 8.011 C A 0048 GLU OE2
C A 0017 HIS ND1 10.04 C A 0079 LYS NZ
C A 0017 HIS NE2 10.59 C A 0079 LYS NZ
C A 0017 HIS ND1 7.168 C A 0080 ARG NH1
C A 0017 HIS ND1 7.734 C A 0080 ARG NH2
C A 0017 HIS NE2 5.777 C A 0080 ARG NH1
C A 0017 HIS NE2 6.881 C A 0080 ARG NH2
C A 0017 HIS ND1 10.04 C A 0083 ARG NH1
C A 0017 HIS ND1 8.680 C A 0083 ARG NH2
C A 0017 HIS NE2 10.44 C A 0083 ARG NH1
C A 0017 HIS NE2 8.701 C A 0083 ARG NH2
E A 0021 ARG NH2 11.24 C A 0037 ARG NH2
E A 0021 ARG NH1 11.01 E A 0075 LYS NZ
C A 0023 GLU OE1 11.68 C A 0025 ASP OD1
C A 0025 ASP OD1 10.45 C A 0040 ASP OD2
C A 0025 ASP OD2 10.27 C A 0040 ASP OD2
C A 0031 ASP OD1 8.296 C A 0032 GLU OE1
C A 0031 ASP OD1 8.775 C A 0032 GLU OE2
C A 0031 ASP OD2 7.049 C A 0032 GLU OE1
C A 0031 ASP OD2 7.377 C A 0032 GLU OE2
C A 0031 ASP OD1 7.966 C A 0033 GLU OE1
C A 0031 ASP OD1 8.479 C A 0033 GLU OE2
C A 0031 ASP OD2 7.889 C A 0033 GLU OE1
C A 0031 ASP OD2 8.554 C A 0033 GLU OE2
C A 0032 GLU OE1 4.390 C A 0033 GLU OE1
C A 0032 GLU OE1 5.333 C A 0033 GLU OE2
C A 0032 GLU OE2 5.493 C A 0033 GLU OE1
C A 0032 GLU OE2 6.997 C A 0033 GLU OE2
C A 0040 ASP OD1 9.042 C A 0062 ASP OD1
C A 0040 ASP OD1 10.83 C A 0062 ASP OD2
C A 0040 ASP OD2 10.24 C A 0062 ASP OD1
C A 0040 ASP OD2 11.77 C A 0062 ASP OD2
C A 0047 LYS NZ 10.83 C A 0079 LYS NZ
C A 0052 LYS NZ 9.497 C A 0054 ARG NH1
C A 0052 LYS NZ 7.774 C A 0054 ARG NH2
C A 0079 LYS NZ 9.677 C A 0081 ARG NH1
C A 0079 LYS NZ 8.222 C A 0081 ARG NH2
C A 0080 ARG NH1 11.08 C A 0083 ARG NH1
C A 0080 ARG NH1 9.157 C A 0083 ARG NH2
C A 0080 ARG NH2 10.05 C A 0083 ARG NH1
C A 0080 ARG NH2 8.417 C A 0083 ARG NH2
C A 0083 ARG NH1 7.082 C A 0084 LYS NZ
C A 0083 ARG NH2 8.955 C A 0084 LYS NZ
HB_MM 2.00 3.20 125
C A 0002 SER N 2.251 C A 0001 GLY O
C A 0003 SER N 2.250 C A 0002 SER O
C A 0004 GLY N 2.250 C A 0003 SER O
C A 0005 SER N 2.250 C A 0004 GLY O
C A 0006 SER N 2.250 C A 0005 SER O
C A 0007 GLY N 2.250 C A 0006 SER O
C A 0008 THR N 3.109 C A 0006 SER O
C A 0008 THR N 2.250 C A 0007 GLY O
C A 0009 ASN N 2.553 C A 0007 GLY O
C A 0009 ASN N 2.249 C A 0008 THR O
C A 0010 TRP N 2.249 C A 0009 ASN O
C A 0011 ALA N 2.249 C A 0010 TRP O
C A 0012 SER N 3.093 C A 0009 ASN O
C A 0012 SER N 3.151 C A 0010 TRP O
C A 0012 SER N 2.251 C A 0011 ALA O
C A 0013 GLY N 3.037 C A 0009 ASN O
C A 0013 GLY N 2.832 C A 0010 TRP O
C A 0013 GLY N 2.250 C A 0012 SER O
C A 0014 GLU N 2.251 C A 0013 GLY O
C A 0015 ASP N 2.955 C A 0013 GLY O
C A 0015 ASP N 2.250 C A 0014 GLU O
C A 0016 ASP N 2.249 C A 0015 ASP O
C A 0017 HIS N 2.251 C A 0016 ASP O
C A 0018 VAL N 2.250 C A 0017 HIS O
C A 0018 VAL N 2.823 E A 0044 LEU O
C A 0019 VAL N 2.250 C A 0018 VAL O
E A 0020 ALA N 2.251 C A 0019 VAL O
E A 0021 ARG N 2.250 E A 0020 ALA O
E A 0021 ARG N 2.749 E A 0075 LYS O
E A 0022 ALA N 2.250 E A 0021 ARG O
C A 0023 GLU N 2.901 E A 0021 ARG O
C A 0023 GLU N 2.251 E A 0022 ALA O
C A 0023 GLU N 2.683 C A 0073 TYR O
C A 0024 TYR N 2.250 C A 0023 GLU O
C A 0025 ASP N 2.250 C A 0024 TYR O
C A 0026 PHE N 2.250 C A 0025 ASP O
C A 0027 VAL N 2.250 C A 0026 PHE O
C A 0028 ALA N 2.250 C A 0027 VAL O
C A 0029 VAL N 2.249 C A 0028 ALA O
C A 0030 SER N 2.250 C A 0029 VAL O
C A 0031 ASP N 2.250 C A 0030 SER O
C A 0032 GLU N 2.250 C A 0031 ASP O
C A 0033 GLU N 2.250 C A 0032 GLU O
C A 0034 ILE N 2.251 C A 0033 GLU O
C A 0035 SER N 2.250 C A 0034 ILE O
C A 0036 PHE N 3.191 C A 0026 PHE O
C A 0036 PHE N 2.250 C A 0035 SER O
C A 0037 ARG N 2.250 C A 0036 PHE O
C A 0038 ALA N 2.250 C A 0037 ARG O
C A 0039 GLY N 3.159 E A 0022 ALA O
C A 0039 GLY N 2.989 C A 0037 ARG O
C A 0039 GLY N 2.249 C A 0038 ALA O
C A 0040 ASP N 2.249 C A 0039 GLY O
C A 0041 MET N 2.250 C A 0040 ASP O
C A 0042 LEU N 2.250 C A 0041 MET O
E A 0043 ASN N 2.250 C A 0042 LEU O
E A 0044 LEU N 3.084 C A 0018 VAL O
E A 0044 LEU N 2.250 E A 0043 ASN O
C A 0045 ALA N 2.250 E A 0044 LEU O
C A 0046 LEU N 2.251 C A 0045 ALA O
C A 0047 LYS N 2.250 C A 0046 LEU O
C A 0048 GLU N 2.727 C A 0046 LEU O
C A 0048 GLU N 2.251 C A 0047 LYS O
C A 0049 GLN N 2.582 C A 0046 LEU O
C A 0049 GLN N 3.057 C A 0047 LYS O
C A 0049 GLN N 2.250 C A 0048 GLU O
C A 0050 GLN N 2.937 C A 0046 LEU O
C A 0050 GLN N 3.052 C A 0047 LYS O
C A 0050 GLN N 2.250 C A 0049 GLN O
C A 0051 PRO N 2.253 C A 0050 GLN O
C A 0052 LYS N 2.250 C A 0051 PRO O
C A 0053 VAL N 2.251 C A 0052 LYS O
C A 0054 ARG N 2.250 C A 0053 VAL O
C A 0055 GLY N 2.249 C A 0054 ARG O
C A 0056 TRP N 2.250 C A 0055 GLY O
E A 0057 LEU N 2.249 C A 0056 TRP O
E A 0057 LEU N 2.947 E A 0069 ILE O
E A 0058 LEU N 2.250 E A 0057 LEU O
E A 0059 ALA N 2.250 E A 0058 LEU O
E A 0059 ALA N 3.038 E A 0067 GLY O
E A 0060 SER N 2.250 E A 0059 ALA O
C A 0061 LEU N 2.251 E A 0060 SER O
C A 0062 ASP N 2.250 C A 0061 LEU O
C A 0063 GLY N 2.250 C A 0062 ASP O
C A 0064 GLN N 2.251 C A 0063 GLY O
C A 0065 THR N 2.251 C A 0064 GLN O
C A 0066 THR N 2.250 C A 0065 THR O
E A 0067 GLY N 2.951 E A 0059 ALA O
E A 0067 GLY N 2.250 C A 0066 THR O
E A 0068 LEU N 2.249 E A 0067 GLY O
E A 0069 ILE N 3.126 E A 0057 LEU O
E A 0069 ILE N 2.250 E A 0068 LEU O
C A 0070 PRO N 2.253 E A 0069 ILE O
C A 0071 ALA N 2.249 C A 0070 PRO O
C A 0072 ASN N 2.250 C A 0071 ALA O
C A 0073 TYR N 3.086 C A 0071 ALA O
C A 0073 TYR N 2.249 C A 0072 ASN O
E A 0074 VAL N 2.655 C A 0071 ALA O
E A 0074 VAL N 3.056 C A 0072 ASN O
E A 0074 VAL N 2.251 C A 0073 TYR O
E A 0075 LYS N 3.152 E A 0021 ARG O
E A 0075 LYS N 2.250 E A 0074 VAL O
E A 0076 ILE N 2.251 E A 0075 LYS O
C A 0077 LEU N 2.250 E A 0076 ILE O
C A 0078 GLY N 2.250 C A 0077 LEU O
C A 0079 LYS N 2.249 C A 0078 GLY O
C A 0080 ARG N 2.251 C A 0079 LYS O
C A 0081 ARG N 2.250 C A 0080 ARG O
C A 0082 GLY N 2.250 C A 0081 ARG O
C A 0083 ARG N 2.250 C A 0082 GLY O
C A 0084 LYS N 2.250 C A 0083 ARG O
C A 0085 THR N 3.135 C A 0083 ARG O
C A 0085 THR N 2.250 C A 0084 LYS O
C A 0086 ILE N 2.733 C A 0083 ARG O
C A 0086 ILE N 2.586 C A 0084 LYS O
C A 0086 ILE N 2.251 C A 0085 THR O
C A 0087 GLU N 3.100 C A 0085 THR O
C A 0087 GLU N 2.251 C A 0086 ILE O
C A 0088 SER N 3.102 C A 0086 ILE O
C A 0088 SER N 2.250 C A 0087 GLU O
C A 0089 GLY N 2.249 C A 0088 SER O
C A 0090 PRO N 2.253 C A 0089 GLY O
C A 0091 SER N 2.251 C A 0090 PRO O
C A 0092 SER N 2.250 C A 0091 SER O
C A 0093 GLY N 2.249 C A 0092 SER O
HB_MS 2.00 3.20 13
C A 0004 GLY O 2.713 C A 0005 SER OG
C A 0011 ALA O 2.852 E A 0043 ASN ND2
C A 0030 SER N 3.094 C A 0033 GLU OE2
C A 0031 ASP N 2.888 C A 0030 SER OG
C A 0037 ARG N 2.903 C A 0040 ASP OD2
C A 0045 ALA O 2.689 C A 0050 GLN NE2
E A 0058 LEU N 2.690 C A 0050 GLN OE1
C A 0063 GLY N 2.730 E A 0060 SER OG
C A 0065 THR O 2.664 E A 0060 SER OG
C A 0066 THR N 3.124 C A 0065 THR OG1
E A 0076 ILE O 3.115 E A 0075 LYS NZ
C A 0090 PRO O 2.733 C A 0091 SER OG
C A 0093 GLY N 3.172 C A 0092 SER OG
AROMATIC 0.00 8.00 1
C A 0080 ARG 6.868 C A 0017 HIS