Complet list of 1pqx con file
Complete list of 1pqx.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 395
C A 0001 MET C 2.433 C A 0002 LYS CA
C A 0001 MET C 3.706 C A 0002 LYS C
C A 0001 MET C 3.081 C A 0002 LYS CB
C A 0001 MET C 3.408 C A 0002 LYS CG
C A 0002 LYS C 2.445 C A 0003 ILE CA
C A 0002 LYS C 2.958 C A 0003 ILE C
C A 0002 LYS C 3.049 C A 0003 ILE CB
C A 0002 LYS C 3.570 C A 0003 ILE CG1
C A 0002 LYS CA 3.565 H A 0082 PHE CB
C A 0002 LYS CB 3.498 H A 0082 PHE CB
C A 0003 ILE C 2.431 C A 0004 ILE CA
C A 0003 ILE C 3.391 C A 0004 ILE C
C A 0003 ILE C 3.574 C A 0004 ILE CB
C A 0003 ILE C 3.587 C A 0004 ILE CG1
C A 0003 ILE C 3.510 C A 0004 ILE CD1
C A 0003 ILE CD1 3.788 H A 0082 PHE CD1
C A 0004 ILE C 2.430 C A 0005 SER CA
C A 0004 ILE C 3.724 C A 0005 SER C
C A 0004 ILE C 3.026 C A 0005 SER CB
C A 0004 ILE CG1 3.607 C A 0019 LEU C
C A 0005 SER C 2.438 C A 0006 ILE CA
C A 0005 SER C 3.280 C A 0006 ILE C
C A 0005 SER C 3.637 C A 0006 ILE CB
C A 0005 SER C 3.742 C A 0006 ILE CG1
C A 0005 SER C 3.680 C A 0006 ILE CD1
C A 0006 ILE C 2.432 C A 0007 SER CA
C A 0006 ILE C 3.616 C A 0007 SER C
C A 0006 ILE C 3.310 C A 0007 SER CB
C A 0007 SER CA 3.800 C A 0008 GLU CA
C A 0007 SER C 2.434 C A 0008 GLU CA
C A 0007 SER C 3.126 C A 0008 GLU C
C A 0007 SER C 3.699 C A 0008 GLU CB
C A 0007 SER C 3.563 C A 0008 GLU CD
C A 0007 SER CB 3.524 E A 0016 LYS CG
C A 0007 SER CB 3.292 E A 0016 LYS CD
C A 0008 GLU CA 3.793 C A 0009 THR CA
C A 0008 GLU C 2.430 C A 0009 THR CA
C A 0008 GLU C 3.637 C A 0009 THR C
C A 0008 GLU C 3.232 C A 0009 THR CB
C A 0008 GLU C 3.530 C A 0009 THR CG2
C A 0009 THR CA 2.878 C A 0010 PRO CD
C A 0009 THR C 2.448 C A 0010 PRO CA
C A 0009 THR C 2.950 C A 0010 PRO C
C A 0009 THR C 3.642 C A 0010 PRO CB
C A 0009 THR C 3.609 C A 0010 PRO CG
C A 0009 THR C 2.471 C A 0010 PRO CD
C A 0009 THR CB 3.463 C A 0010 PRO CD
C A 0010 PRO C 2.436 C A 0011 ASN CA
C A 0010 PRO C 3.296 C A 0011 ASN C
C A 0010 PRO C 3.626 C A 0011 ASN CB
C A 0011 ASN C 2.433 C A 0012 HIS CA
C A 0011 ASN C 3.614 C A 0012 HIS C
C A 0011 ASN C 3.312 C A 0012 HIS CB
C A 0012 HIS C 2.433 C A 0013 ASN CA
C A 0012 HIS C 3.231 C A 0013 ASN C
C A 0012 HIS C 3.652 C A 0013 ASN CB
C A 0012 HIS CD2 3.488 H A 0071 TRP CD1
C A 0013 ASN C 2.431 E A 0014 THR CA
C A 0013 ASN C 3.660 E A 0014 THR C
C A 0013 ASN C 3.231 E A 0014 THR CB
E A 0014 THR C 2.435 E A 0015 MET CA
E A 0014 THR C 3.463 E A 0015 MET C
E A 0014 THR C 3.505 E A 0015 MET CB
E A 0014 THR CB 3.761 E A 0063 VAL C
E A 0014 THR CB 3.365 E A 0064 ASP CA
E A 0014 THR CB 3.430 E A 0064 ASP CB
E A 0014 THR CB 3.208 E A 0064 ASP CG
E A 0015 MET C 2.431 E A 0016 LYS CA
E A 0015 MET C 3.294 E A 0016 LYS C
E A 0015 MET C 3.627 E A 0016 LYS CB
E A 0015 MET CE 3.729 H A 0071 TRP CD2
E A 0015 MET CE 3.425 H A 0071 TRP CE3
E A 0015 MET CE 3.425 H A 0071 TRP CZ3
E A 0015 MET CE 3.726 H A 0071 TRP CH2
E A 0015 MET CE 3.783 H A 0075 LEU CD1
E A 0016 LYS C 2.435 E A 0017 ILE CA
E A 0016 LYS C 3.317 E A 0017 ILE C
E A 0016 LYS C 3.618 E A 0017 ILE CB
E A 0016 LYS C 3.746 E A 0017 ILE CG1
E A 0017 ILE C 2.432 E A 0018 THR CA
E A 0017 ILE C 3.198 E A 0018 THR C
E A 0017 ILE C 3.670 E A 0018 THR CB
E A 0017 ILE CD1 3.450 E A 0063 VAL CG2
E A 0018 THR C 2.432 C A 0019 LEU CA
E A 0018 THR C 3.341 C A 0019 LEU C
E A 0018 THR C 3.596 C A 0019 LEU CB
E A 0018 THR C 3.651 C A 0019 LEU CG
E A 0018 THR C 3.696 C A 0019 LEU CD2
C A 0019 LEU C 2.434 C A 0020 SER CA
C A 0019 LEU C 3.046 C A 0020 SER C
C A 0019 LEU C 3.707 C A 0020 SER CB
C A 0019 LEU CD1 3.706 C A 0059 ASP C
C A 0020 SER CA 3.793 C A 0021 GLU CA
C A 0020 SER C 2.426 C A 0021 GLU CA
C A 0020 SER C 3.263 C A 0021 GLU C
C A 0020 SER C 3.633 C A 0021 GLU CB
C A 0021 GLU C 2.436 C A 0022 SER CA
C A 0021 GLU C 3.659 C A 0022 SER C
C A 0021 GLU C 3.229 C A 0022 SER CB
C A 0022 SER C 2.446 C A 0023 ARG CA
C A 0022 SER C 2.888 C A 0023 ARG C
C A 0022 SER C 3.140 C A 0023 ARG CB
C A 0022 SER C 3.649 C A 0023 ARG CG
C A 0023 ARG C 2.455 C A 0024 GLU CA
C A 0023 ARG C 2.849 C A 0024 GLU C
C A 0023 ARG C 3.256 C A 0024 GLU CB
C A 0024 GLU C 2.440 C A 0025 GLY CA
C A 0024 GLU C 3.581 C A 0025 GLY C
C A 0025 GLY CA 3.796 C A 0026 MET CA
C A 0025 GLY C 2.428 C A 0026 MET CA
C A 0025 GLY C 3.245 C A 0026 MET C
C A 0025 GLY C 3.641 C A 0026 MET CB
C A 0026 MET C 2.434 C A 0027 THR CA
C A 0026 MET C 3.122 C A 0027 THR C
C A 0026 MET C 3.698 C A 0027 THR CB
C A 0027 THR C 2.431 C A 0028 SER CA
C A 0027 THR C 3.682 C A 0028 SER C
C A 0027 THR C 3.155 C A 0028 SER CB
C A 0027 THR C 3.658 E A 0056 HIS CD2
C A 0028 SER C 2.437 E A 0029 ASP CA
C A 0028 SER C 3.699 E A 0029 ASP C
C A 0028 SER C 3.127 E A 0029 ASP CB
C A 0028 SER C 3.326 E A 0029 ASP CG
C A 0028 SER CA 3.667 E A 0056 HIS C
E A 0029 ASP C 2.437 E A 0030 THR CA
E A 0029 ASP C 3.356 E A 0030 THR C
E A 0029 ASP C 3.593 E A 0030 THR CB
E A 0029 ASP CB 3.443 E A 0031 TYR CE1
E A 0030 THR C 2.437 E A 0031 TYR CA
E A 0030 THR C 3.482 E A 0031 TYR C
E A 0030 THR C 3.491 E A 0031 TYR CB
E A 0030 THR C 3.403 E A 0031 TYR CG
E A 0030 THR C 3.171 E A 0031 TYR CD1
E A 0031 TYR C 2.440 C A 0032 THR CA
E A 0031 TYR C 3.527 C A 0032 THR C
E A 0031 TYR C 3.454 C A 0032 THR CB
E A 0031 TYR C 3.741 C A 0032 THR CG2
E A 0031 TYR CD1 3.641 C A 0036 ASP CB
E A 0031 TYR CE1 3.660 C A 0036 ASP CB
E A 0031 TYR CD1 3.585 C A 0038 GLN CG
E A 0031 TYR CE1 3.378 C A 0038 GLN CG
E A 0031 TYR CZ 3.625 C A 0038 GLN CG
E A 0031 TYR CB 3.657 H A 0046 LEU CD1
E A 0031 TYR CD2 3.785 E A 0054 ILE CG2
E A 0031 TYR CE2 3.722 E A 0056 HIS CB
C A 0032 THR C 2.434 C A 0033 LYS CA
C A 0032 THR C 3.672 C A 0033 LYS C
C A 0032 THR C 3.196 C A 0033 LYS CB
C A 0032 THR C 3.622 C A 0033 LYS CG
C A 0033 LYS C 2.445 C A 0034 VAL CA
C A 0033 LYS C 2.938 C A 0034 VAL C
C A 0033 LYS C 3.072 C A 0034 VAL CB
C A 0033 LYS C 3.483 C A 0034 VAL CG2
C A 0034 VAL C 2.439 C A 0035 ASP CA
C A 0034 VAL C 3.022 C A 0035 ASP C
C A 0034 VAL C 2.986 C A 0035 ASP CB
C A 0034 VAL CG1 3.470 H A 0043 ASN CG
C A 0035 ASP C 2.442 C A 0036 ASP CA
C A 0035 ASP C 3.710 C A 0036 ASP C
C A 0035 ASP C 2.957 C A 0036 ASP CB
C A 0035 ASP C 3.518 C A 0036 ASP CG
C A 0035 ASP C 3.675 C A 0038 GLN CD
C A 0036 ASP C 2.452 C A 0037 SER CA
C A 0036 ASP C 3.145 C A 0037 SER C
C A 0036 ASP C 2.920 C A 0037 SER CB
C A 0036 ASP CA 3.683 C A 0038 GLN CD
C A 0036 ASP C 3.762 C A 0038 GLN CG
C A 0036 ASP CB 3.597 C A 0038 GLN CG
C A 0036 ASP CB 3.509 C A 0038 GLN CD
C A 0037 SER C 2.435 C A 0038 GLN CA
C A 0037 SER C 3.189 C A 0038 GLN C
C A 0037 SER C 3.694 C A 0038 GLN CB
C A 0038 GLN CA 2.877 H A 0039 PRO CD
C A 0038 GLN C 2.453 H A 0039 PRO CA
C A 0038 GLN C 3.141 H A 0039 PRO C
C A 0038 GLN C 3.647 H A 0039 PRO CB
C A 0038 GLN C 3.611 H A 0039 PRO CG
C A 0038 GLN C 2.469 H A 0039 PRO CD
C A 0038 GLN CB 3.036 H A 0039 PRO CD
H A 0039 PRO C 2.432 H A 0040 ALA CA
H A 0039 PRO C 2.877 H A 0040 ALA C
H A 0039 PRO C 3.705 H A 0040 ALA CB
H A 0040 ALA C 2.434 H A 0041 PHE CA
H A 0040 ALA C 2.949 H A 0041 PHE C
H A 0040 ALA C 3.713 H A 0041 PHE CB
H A 0040 ALA CA 3.727 H A 0043 ASN CG
H A 0041 PHE C 2.439 H A 0042 ILE CA
H A 0041 PHE C 3.139 H A 0042 ILE C
H A 0041 PHE C 3.701 H A 0042 ILE CB
H A 0041 PHE C 3.525 H A 0081 VAL CG1
H A 0041 PHE CB 3.124 H A 0081 VAL CG1
H A 0041 PHE CD1 3.486 C A 0084 LEU CD2
H A 0042 ILE CA 3.798 H A 0043 ASN CA
H A 0042 ILE C 2.419 H A 0043 ASN CA
H A 0042 ILE C 2.930 H A 0043 ASN C
H A 0042 ILE C 3.712 H A 0043 ASN CB
H A 0042 ILE CD1 3.342 H A 0045 ILE CD1
H A 0043 ASN CA 3.788 H A 0044 ASP CA
H A 0043 ASN C 2.432 H A 0044 ASP CA
H A 0043 ASN C 2.951 H A 0044 ASP C
H A 0043 ASN C 3.714 H A 0044 ASP CB
H A 0044 ASP C 2.444 H A 0045 ILE CA
H A 0044 ASP C 2.931 H A 0045 ILE C
H A 0044 ASP C 3.715 H A 0045 ILE CB
H A 0044 ASP C 3.446 H A 0048 VAL CG2
H A 0045 ILE C 2.430 H A 0046 LEU CA
H A 0045 ILE C 3.009 H A 0046 LEU C
H A 0045 ILE C 3.712 H A 0046 LEU CB
H A 0045 ILE CG2 3.677 E A 0054 ILE CD1
H A 0045 ILE CG1 3.483 H A 0081 VAL CG2
H A 0045 ILE CD1 3.600 H A 0081 VAL CG2
H A 0046 LEU C 2.435 H A 0047 LYS CA
H A 0046 LEU C 3.205 H A 0047 LYS C
H A 0046 LEU C 3.670 H A 0047 LYS CB
H A 0046 LEU CD2 3.568 E A 0054 ILE CG1
H A 0046 LEU CD2 3.437 E A 0054 ILE CD1
H A 0047 LYS C 2.432 H A 0048 VAL CA
H A 0047 LYS C 3.116 H A 0048 VAL C
H A 0047 LYS C 3.703 H A 0048 VAL CB
H A 0048 VAL C 2.436 C A 0049 GLU CA
H A 0048 VAL C 2.931 C A 0049 GLU C
H A 0048 VAL C 3.715 C A 0049 GLU CB
C A 0049 GLU C 2.435 C A 0050 GLY CA
C A 0049 GLU C 3.445 C A 0050 GLY C
C A 0050 GLY C 2.434 E A 0051 VAL CA
C A 0050 GLY C 3.152 E A 0051 VAL C
C A 0050 GLY C 3.686 E A 0051 VAL CB
C A 0050 GLY CA 3.671 C A 0069 ALA CB
E A 0051 VAL C 2.432 E A 0052 LYS CA
E A 0051 VAL C 3.354 E A 0052 LYS C
E A 0051 VAL C 3.586 E A 0052 LYS CB
E A 0052 LYS C 2.434 E A 0053 SER CA
E A 0052 LYS C 3.712 E A 0053 SER C
E A 0052 LYS C 3.058 E A 0053 SER CB
E A 0053 SER C 2.438 E A 0054 ILE CA
E A 0053 SER C 3.602 E A 0054 ILE C
E A 0053 SER C 3.341 E A 0054 ILE CB
E A 0053 SER C 3.282 E A 0054 ILE CG1
E A 0054 ILE C 2.434 E A 0055 PHE CA
E A 0054 ILE C 3.596 E A 0055 PHE C
E A 0054 ILE C 3.326 E A 0055 PHE CB
E A 0054 ILE CG2 3.496 E A 0061 ILE CG2
E A 0055 PHE C 2.434 E A 0056 HIS CA
E A 0055 PHE C 3.284 E A 0056 HIS C
E A 0055 PHE C 3.628 E A 0056 HIS CB
E A 0055 PHE CE2 3.704 E A 0057 VAL CB
E A 0055 PHE CE2 3.478 E A 0057 VAL CG1
E A 0055 PHE CZ 3.320 E A 0057 VAL CB
E A 0055 PHE CZ 3.635 E A 0057 VAL CG1
E A 0055 PHE CZ 3.700 E A 0057 VAL CG2
E A 0056 HIS C 2.436 E A 0057 VAL CA
E A 0056 HIS C 3.703 E A 0057 VAL C
E A 0056 HIS C 3.093 E A 0057 VAL CB
E A 0056 HIS CG 3.703 E A 0061 ILE CG1
E A 0056 HIS CD2 3.731 E A 0061 ILE CG1
E A 0056 HIS CE1 3.401 E A 0061 ILE CG1
E A 0056 HIS CE1 3.126 E A 0061 ILE CD1
E A 0057 VAL C 2.439 C A 0058 MET CA
E A 0057 VAL C 2.874 C A 0058 MET C
E A 0057 VAL C 3.137 C A 0058 MET CB
E A 0057 VAL CG1 3.407 E A 0060 PHE CE1
E A 0057 VAL CG1 3.572 E A 0060 PHE CE2
E A 0057 VAL CG1 3.001 E A 0060 PHE CZ
C A 0058 MET C 2.436 C A 0059 ASP CA
C A 0058 MET C 3.377 C A 0059 ASP C
C A 0058 MET C 3.583 C A 0059 ASP CB
C A 0058 MET CB 3.722 E A 0060 PHE CD2
C A 0058 MET CB 3.510 E A 0060 PHE CE2
C A 0059 ASP C 2.436 E A 0060 PHE CA
C A 0059 ASP C 3.696 E A 0060 PHE C
C A 0059 ASP C 3.162 E A 0060 PHE CB
E A 0060 PHE C 2.438 E A 0061 ILE CA
E A 0060 PHE C 3.607 E A 0061 ILE C
E A 0060 PHE C 3.349 E A 0061 ILE CB
E A 0060 PHE C 3.198 E A 0061 ILE CG1
E A 0061 ILE C 2.436 E A 0062 SER CA
E A 0061 ILE C 3.339 E A 0062 SER C
E A 0061 ILE C 3.598 E A 0062 SER CB
E A 0062 SER C 2.435 E A 0063 VAL CA
E A 0062 SER C 3.355 E A 0063 VAL C
E A 0062 SER C 3.588 E A 0063 VAL CB
E A 0062 SER C 3.703 E A 0063 VAL CG2
E A 0063 VAL C 2.438 E A 0064 ASP CA
E A 0063 VAL C 3.387 E A 0064 ASP C
E A 0063 VAL C 3.586 E A 0064 ASP CB
E A 0063 VAL C 3.622 E A 0064 ASP CG
E A 0064 ASP C 2.438 E A 0065 LYS CA
E A 0064 ASP C 3.497 E A 0065 LYS C
E A 0064 ASP C 3.473 E A 0065 LYS CB
E A 0065 LYS C 2.428 C A 0066 GLU CA
E A 0065 LYS C 3.292 C A 0066 GLU C
E A 0065 LYS C 3.618 C A 0066 GLU CB
E A 0065 LYS C 3.751 C A 0066 GLU CG
E A 0065 LYS CD 3.722 H A 0070 ASN C
E A 0065 LYS CG 3.720 H A 0071 TRP CZ2
E A 0065 LYS CD 3.643 H A 0071 TRP CE2
C A 0066 GLU C 2.435 C A 0067 ASN CA
C A 0066 GLU C 2.918 C A 0067 ASN C
C A 0066 GLU C 3.714 C A 0067 ASN CB
C A 0067 ASN C 2.435 C A 0068 ASP CA
C A 0067 ASN C 3.091 C A 0068 ASP C
C A 0067 ASN C 3.701 C A 0068 ASP CB
C A 0068 ASP C 2.438 C A 0069 ALA CA
C A 0068 ASP C 3.232 C A 0069 ALA C
C A 0068 ASP C 3.661 C A 0069 ALA CB
C A 0069 ALA C 2.440 H A 0070 ASN CA
C A 0069 ALA C 3.583 H A 0070 ASN C
C A 0069 ALA C 3.389 H A 0070 ASN CB
C A 0069 ALA C 3.224 H A 0070 ASN CG
H A 0070 ASN C 2.434 H A 0071 TRP CA
H A 0070 ASN C 3.321 H A 0071 TRP C
H A 0070 ASN C 3.611 H A 0071 TRP CB
H A 0070 ASN C 3.441 H A 0073 THR CG2
H A 0070 ASN CB 3.771 H A 0073 THR CG2
H A 0071 TRP C 2.443 H A 0072 GLU CA
H A 0071 TRP C 2.963 H A 0072 GLU C
H A 0071 TRP C 3.724 H A 0072 GLU CB
H A 0071 TRP CE3 3.650 H A 0074 VAL CG1
H A 0071 TRP CZ3 3.699 H A 0074 VAL CG1
H A 0071 TRP CE3 3.615 H A 0075 LEU CD1
H A 0072 GLU C 2.435 H A 0073 THR CA
H A 0072 GLU C 3.212 H A 0073 THR C
H A 0072 GLU C 3.668 H A 0073 THR CB
H A 0072 GLU C 3.566 H A 0076 PRO CD
H A 0073 THR CA 3.795 H A 0074 VAL CA
H A 0073 THR C 2.437 H A 0074 VAL CA
H A 0073 THR C 3.185 H A 0074 VAL C
H A 0073 THR C 3.668 H A 0074 VAL CB
H A 0073 THR C 3.722 H A 0076 PRO CG
H A 0073 THR C 3.668 H A 0076 PRO CD
H A 0074 VAL C 2.445 H A 0075 LEU CA
H A 0074 VAL C 2.941 H A 0075 LEU C
H A 0074 VAL C 3.719 H A 0075 LEU CB
H A 0074 VAL C 3.490 H A 0076 PRO CD
H A 0074 VAL CG1 3.586 H A 0078 VAL CG2
H A 0075 LEU CA 2.915 H A 0076 PRO CD
H A 0075 LEU C 2.460 H A 0076 PRO CA
H A 0075 LEU C 2.948 H A 0076 PRO C
H A 0075 LEU C 3.648 H A 0076 PRO CB
H A 0075 LEU C 3.604 H A 0076 PRO CG
H A 0075 LEU C 2.479 H A 0076 PRO CD
H A 0075 LEU CB 3.063 H A 0076 PRO CD
H A 0076 PRO C 2.434 H A 0077 LYS CA
H A 0076 PRO C 3.172 H A 0077 LYS C
H A 0076 PRO C 3.683 H A 0077 LYS CB
H A 0077 LYS C 2.440 H A 0078 VAL CA
H A 0077 LYS C 3.009 H A 0078 VAL C
H A 0077 LYS C 3.717 H A 0078 VAL CB
H A 0078 VAL C 2.435 H A 0079 GLU CA
H A 0078 VAL C 2.941 H A 0079 GLU C
H A 0078 VAL C 3.711 H A 0079 GLU CB
H A 0078 VAL CA 3.754 H A 0081 VAL CG2
H A 0078 VAL C 3.681 H A 0081 VAL CG2
H A 0079 GLU C 2.440 H A 0080 ALA CA
H A 0079 GLU C 2.977 H A 0080 ALA C
H A 0079 GLU C 3.713 H A 0080 ALA CB
H A 0080 ALA C 2.438 H A 0081 VAL CA
H A 0080 ALA C 2.976 H A 0081 VAL C
H A 0080 ALA C 3.720 H A 0081 VAL CB
H A 0081 VAL C 2.437 H A 0082 PHE CA
H A 0081 VAL C 3.203 H A 0082 PHE C
H A 0081 VAL C 3.679 H A 0082 PHE CB
H A 0081 VAL C 3.797 H A 0082 PHE CG
H A 0081 VAL CB 3.782 H A 0082 PHE CD1
H A 0082 PHE C 2.435 C A 0083 GLU CA
H A 0082 PHE C 3.685 C A 0083 GLU C
H A 0082 PHE C 3.143 C A 0083 GLU CB
C A 0083 GLU C 2.435 C A 0084 LEU CA
C A 0083 GLU C 3.705 C A 0084 LEU C
C A 0083 GLU C 3.107 C A 0084 LEU CB
C A 0083 GLU C 3.323 C A 0084 LEU CG
C A 0084 LEU C 2.448 C A 0085 GLU CA
C A 0084 LEU C 3.201 C A 0085 GLU C
C A 0084 LEU C 2.862 C A 0085 GLU CB
C A 0085 GLU C 2.438 C A 0086 HIS CA
C A 0085 GLU C 3.415 C A 0086 HIS C
C A 0085 GLU C 3.548 C A 0086 HIS CB
C A 0085 GLU CG 3.468 C A 0087 HIS CD2
C A 0086 HIS C 2.441 C A 0087 HIS CA
C A 0086 HIS C 3.668 C A 0087 HIS C
C A 0086 HIS C 3.232 C A 0087 HIS CB
C A 0086 HIS C 3.179 C A 0087 HIS CG
C A 0086 HIS C 3.758 C A 0087 HIS CD2
C A 0087 HIS C 2.436 C A 0088 HIS CA
C A 0087 HIS C 3.497 C A 0088 HIS C
C A 0087 HIS C 3.465 C A 0088 HIS CB
C A 0088 HIS C 2.442 C A 0089 HIS CA
C A 0088 HIS C 2.888 C A 0089 HIS C
C A 0088 HIS C 3.712 C A 0089 HIS CB
C A 0089 HIS C 2.432 C A 0090 HIS CA
C A 0089 HIS C 3.678 C A 0090 HIS C
C A 0089 HIS C 3.171 C A 0090 HIS CB
C A 0090 HIS C 2.443 C A 0091 HIS CA
C A 0090 HIS C 3.028 C A 0091 HIS C
C A 0090 HIS C 2.988 C A 0091 HIS CB
CHARGE_ATTR 2.00 12.00 88
C A 0008 GLU OE1 8.173 C A 0012 HIS ND1
C A 0008 GLU OE1 7.406 C A 0012 HIS NE2
C A 0008 GLU OE2 9.948 C A 0012 HIS ND1
C A 0008 GLU OE2 8.870 C A 0012 HIS NE2
C A 0008 GLU OE1 11.55 E A 0016 LYS NZ
C A 0008 GLU OE2 10.55 E A 0016 LYS NZ
C A 0021 GLU OE1 11.80 E A 0056 HIS ND1
C A 0021 GLU OE1 9.787 E A 0056 HIS NE2
C A 0021 GLU OE2 10.95 E A 0056 HIS NE2
C A 0024 GLU OE1 11.41 C A 0023 ARG NH1
C A 0024 GLU OE2 10.29 C A 0023 ARG NH1
C A 0024 GLU OE2 10.99 C A 0023 ARG NH2
E A 0029 ASP OD1 10.98 C A 0033 LYS NZ
E A 0029 ASP OD1 8.955 E A 0056 HIS ND1
E A 0029 ASP OD1 9.837 E A 0056 HIS NE2
E A 0029 ASP OD2 7.902 E A 0056 HIS ND1
E A 0029 ASP OD2 8.668 E A 0056 HIS NE2
C A 0035 ASP OD1 8.541 C A 0033 LYS NZ
C A 0035 ASP OD2 6.920 C A 0033 LYS NZ
C A 0035 ASP OD1 9.489 H A 0047 LYS NZ
C A 0035 ASP OD2 10.98 H A 0047 LYS NZ
C A 0036 ASP OD1 6.489 C A 0033 LYS NZ
C A 0036 ASP OD2 7.203 C A 0033 LYS NZ
C A 0036 ASP OD1 11.26 E A 0056 HIS ND1
C A 0036 ASP OD2 9.702 E A 0056 HIS ND1
C A 0036 ASP OD2 11.43 E A 0056 HIS NE2
H A 0044 ASP OD1 7.858 H A 0047 LYS NZ
H A 0044 ASP OD2 9.279 H A 0047 LYS NZ
H A 0044 ASP OD1 9.141 H A 0077 LYS NZ
H A 0044 ASP OD2 7.595 H A 0077 LYS NZ
C A 0049 GLU OE1 9.240 H A 0077 LYS NZ
C A 0049 GLU OE2 10.77 H A 0077 LYS NZ
C A 0059 ASP OD1 8.200 E A 0016 LYS NZ
C A 0059 ASP OD2 9.389 E A 0016 LYS NZ
C A 0059 ASP OD1 9.656 C A 0023 ARG NH1
C A 0059 ASP OD1 10.24 C A 0023 ARG NH2
C A 0059 ASP OD2 8.456 C A 0023 ARG NH1
C A 0059 ASP OD2 9.417 C A 0023 ARG NH2
C A 0059 ASP OD1 10.83 E A 0056 HIS ND1
C A 0059 ASP OD1 8.887 E A 0056 HIS NE2
C A 0059 ASP OD2 11.20 E A 0056 HIS ND1
C A 0059 ASP OD2 9.148 E A 0056 HIS NE2
E A 0064 ASP OD2 11.79 C A 0012 HIS NE2
E A 0064 ASP OD1 10.28 E A 0016 LYS NZ
E A 0064 ASP OD2 9.982 E A 0016 LYS NZ
E A 0064 ASP OD1 8.612 E A 0052 LYS NZ
E A 0064 ASP OD2 8.402 E A 0052 LYS NZ
E A 0064 ASP OD1 11.30 E A 0056 HIS ND1
E A 0064 ASP OD1 10.69 E A 0065 LYS NZ
E A 0064 ASP OD2 10.23 E A 0065 LYS NZ
C A 0066 GLU OE1 7.498 E A 0052 LYS NZ
C A 0066 GLU OE2 5.469 E A 0052 LYS NZ
C A 0066 GLU OE1 8.073 E A 0065 LYS NZ
C A 0066 GLU OE2 8.930 E A 0065 LYS NZ
C A 0068 ASP OD1 8.154 E A 0065 LYS NZ
C A 0068 ASP OD2 8.734 E A 0065 LYS NZ
H A 0072 GLU OE1 8.629 C A 0012 HIS ND1
H A 0072 GLU OE1 8.412 C A 0012 HIS NE2
H A 0072 GLU OE2 6.818 C A 0012 HIS ND1
H A 0072 GLU OE2 6.349 C A 0012 HIS NE2
H A 0072 GLU OE1 8.556 E A 0065 LYS NZ
H A 0072 GLU OE2 7.339 E A 0065 LYS NZ
H A 0079 GLU OE1 11.85 C A 0002 LYS NZ
H A 0079 GLU OE2 10.75 C A 0002 LYS NZ
H A 0079 GLU OE1 9.951 H A 0077 LYS NZ
H A 0079 GLU OE2 11.73 H A 0077 LYS NZ
C A 0083 GLU OE1 4.859 C A 0002 LYS NZ
C A 0083 GLU OE2 5.078 C A 0002 LYS NZ
C A 0083 GLU OE1 11.26 C A 0086 HIS ND1
C A 0083 GLU OE1 11.80 C A 0086 HIS NE2
C A 0083 GLU OE2 10.19 C A 0086 HIS ND1
C A 0083 GLU OE2 10.99 C A 0086 HIS NE2
C A 0083 GLU OE2 11.30 C A 0087 HIS ND1
C A 0083 GLU OE2 10.24 C A 0087 HIS NE2
C A 0085 GLU OE1 10.50 C A 0002 LYS NZ
C A 0085 GLU OE2 9.022 C A 0002 LYS NZ
C A 0085 GLU OE1 9.635 C A 0086 HIS ND1
C A 0085 GLU OE1 11.34 C A 0086 HIS NE2
C A 0085 GLU OE2 8.177 C A 0086 HIS ND1
C A 0085 GLU OE2 9.661 C A 0086 HIS NE2
C A 0085 GLU OE1 7.138 C A 0087 HIS ND1
C A 0085 GLU OE1 5.119 C A 0087 HIS NE2
C A 0085 GLU OE2 5.747 C A 0087 HIS ND1
C A 0085 GLU OE2 3.931 C A 0087 HIS NE2
C A 0085 GLU OE1 10.53 C A 0089 HIS ND1
C A 0085 GLU OE1 8.409 C A 0089 HIS NE2
C A 0085 GLU OE2 10.52 C A 0089 HIS ND1
C A 0085 GLU OE2 8.469 C A 0089 HIS NE2
CHARGE_REPU 2.00 12.00 92
C A 0002 LYS NZ 9.080 C A 0086 HIS ND1
C A 0002 LYS NZ 8.798 C A 0086 HIS NE2
C A 0002 LYS NZ 11.45 C A 0087 HIS ND1
C A 0002 LYS NZ 11.22 C A 0087 HIS NE2
C A 0012 HIS ND1 7.126 E A 0065 LYS NZ
C A 0012 HIS NE2 7.269 E A 0065 LYS NZ
E A 0016 LYS NZ 11.48 E A 0056 HIS NE2
C A 0021 GLU OE1 6.513 C A 0024 GLU OE1
C A 0021 GLU OE1 6.539 C A 0024 GLU OE2
C A 0021 GLU OE2 8.229 C A 0024 GLU OE1
C A 0021 GLU OE2 7.845 C A 0024 GLU OE2
C A 0021 GLU OE1 8.740 C A 0059 ASP OD1
C A 0021 GLU OE1 8.320 C A 0059 ASP OD2
C A 0021 GLU OE2 9.473 C A 0059 ASP OD1
C A 0021 GLU OE2 9.441 C A 0059 ASP OD2
C A 0024 GLU OE1 11.44 C A 0059 ASP OD1
C A 0024 GLU OE1 9.820 C A 0059 ASP OD2
C A 0024 GLU OE2 11.39 C A 0059 ASP OD1
C A 0024 GLU OE2 9.881 C A 0059 ASP OD2
E A 0029 ASP OD1 10.65 C A 0035 ASP OD2
E A 0029 ASP OD2 11.98 C A 0035 ASP OD1
E A 0029 ASP OD2 10.55 C A 0035 ASP OD2
E A 0029 ASP OD1 5.995 C A 0036 ASP OD1
E A 0029 ASP OD1 4.982 C A 0036 ASP OD2
E A 0029 ASP OD2 6.336 C A 0036 ASP OD1
E A 0029 ASP OD2 5.568 C A 0036 ASP OD2
C A 0035 ASP OD1 6.614 C A 0036 ASP OD1
C A 0035 ASP OD1 8.226 C A 0036 ASP OD2
C A 0035 ASP OD2 4.830 C A 0036 ASP OD1
C A 0035 ASP OD2 6.667 C A 0036 ASP OD2
H A 0044 ASP OD1 11.44 C A 0049 GLU OE1
H A 0044 ASP OD1 11.26 C A 0049 GLU OE2
H A 0044 ASP OD2 10.65 C A 0049 GLU OE1
H A 0044 ASP OD2 10.79 C A 0049 GLU OE2
C A 0049 GLU OE1 9.133 C A 0066 GLU OE1
C A 0049 GLU OE1 10.65 C A 0066 GLU OE2
C A 0049 GLU OE2 9.248 C A 0066 GLU OE1
C A 0049 GLU OE2 10.43 C A 0066 GLU OE2
C A 0049 GLU OE1 10.61 C A 0068 ASP OD1
C A 0049 GLU OE2 11.64 C A 0068 ASP OD1
E A 0052 LYS NZ 11.02 E A 0065 LYS NZ
E A 0064 ASP OD1 11.20 C A 0066 GLU OE2
E A 0064 ASP OD2 11.39 C A 0066 GLU OE2
C A 0066 GLU OE1 6.279 C A 0068 ASP OD1
C A 0066 GLU OE1 6.979 C A 0068 ASP OD2
C A 0066 GLU OE2 8.092 C A 0068 ASP OD1
C A 0066 GLU OE2 8.393 C A 0068 ASP OD2
C A 0068 ASP OD1 11.73 H A 0072 GLU OE1
H A 0079 GLU OE1 7.132 C A 0083 GLU OE1
H A 0079 GLU OE1 8.259 C A 0083 GLU OE2
H A 0079 GLU OE2 6.369 C A 0083 GLU OE1
H A 0079 GLU OE2 7.922 C A 0083 GLU OE2
C A 0083 GLU OE1 9.429 C A 0085 GLU OE1
C A 0083 GLU OE1 8.919 C A 0085 GLU OE2
C A 0083 GLU OE2 7.303 C A 0085 GLU OE1
C A 0083 GLU OE2 6.803 C A 0085 GLU OE2
C A 0086 HIS ND1 5.731 C A 0087 HIS ND1
C A 0086 HIS ND1 7.016 C A 0087 HIS NE2
C A 0086 HIS NE2 7.074 C A 0087 HIS ND1
C A 0086 HIS NE2 8.545 C A 0087 HIS NE2
C A 0086 HIS ND1 7.293 C A 0088 HIS ND1
C A 0086 HIS ND1 9.347 C A 0088 HIS NE2
C A 0086 HIS NE2 7.859 C A 0088 HIS ND1
C A 0086 HIS NE2 9.675 C A 0088 HIS NE2
C A 0086 HIS ND1 7.866 C A 0089 HIS ND1
C A 0086 HIS ND1 7.362 C A 0089 HIS NE2
C A 0086 HIS NE2 9.833 C A 0089 HIS ND1
C A 0086 HIS NE2 9.488 C A 0089 HIS NE2
C A 0087 HIS ND1 8.823 C A 0088 HIS ND1
C A 0087 HIS ND1 10.40 C A 0088 HIS NE2
C A 0087 HIS NE2 10.72 C A 0088 HIS ND1
C A 0087 HIS ND1 7.988 C A 0089 HIS ND1
C A 0087 HIS ND1 6.416 C A 0089 HIS NE2
C A 0087 HIS NE2 8.579 C A 0089 HIS ND1
C A 0087 HIS NE2 6.617 C A 0089 HIS NE2
C A 0088 HIS ND1 6.795 C A 0089 HIS ND1
C A 0088 HIS ND1 7.891 C A 0089 HIS NE2
C A 0088 HIS NE2 8.473 C A 0089 HIS ND1
C A 0088 HIS NE2 9.664 C A 0089 HIS NE2
C A 0088 HIS ND1 7.067 C A 0090 HIS ND1
C A 0088 HIS ND1 8.521 C A 0090 HIS NE2
C A 0088 HIS NE2 5.731 C A 0090 HIS ND1
C A 0088 HIS NE2 6.920 C A 0090 HIS NE2
C A 0089 HIS ND1 9.641 C A 0090 HIS ND1
C A 0089 HIS ND1 11.52 C A 0090 HIS NE2
C A 0089 HIS NE2 10.93 C A 0090 HIS ND1
C A 0089 HIS ND1 11.80 C A 0091 HIS ND1
C A 0089 HIS NE2 11.91 C A 0091 HIS ND1
C A 0090 HIS ND1 7.906 C A 0091 HIS ND1
C A 0090 HIS ND1 9.679 C A 0091 HIS NE2
C A 0090 HIS NE2 7.531 C A 0091 HIS ND1
C A 0090 HIS NE2 9.510 C A 0091 HIS NE2
HB_MM 2.00 3.20 139
C A 0002 LYS N 2.253 C A 0001 MET O
C A 0003 ILE N 2.258 C A 0002 LYS O
C A 0004 ILE N 2.252 C A 0003 ILE O
C A 0004 ILE N 3.097 E A 0018 THR O
C A 0005 SER N 2.251 C A 0004 ILE O
C A 0006 ILE N 2.254 C A 0005 SER O
C A 0007 SER N 2.251 C A 0006 ILE O
C A 0008 GLU N 2.255 C A 0007 SER O
C A 0009 THR N 2.251 C A 0008 GLU O
C A 0010 PRO N 2.219 C A 0009 THR O
C A 0011 ASN N 3.007 C A 0009 THR O
C A 0011 ASN N 2.255 C A 0010 PRO O
C A 0012 HIS N 2.252 C A 0011 ASN O
C A 0013 ASN N 2.253 C A 0012 HIS O
E A 0014 THR N 2.253 C A 0013 ASN O
E A 0015 MET N 2.254 E A 0014 THR O
E A 0015 MET N 3.181 E A 0063 VAL O
E A 0016 LYS N 2.254 E A 0015 MET O
E A 0017 ILE N 2.255 E A 0016 LYS O
E A 0017 ILE N 2.715 E A 0061 ILE O
E A 0018 THR N 3.140 C A 0005 SER O
E A 0018 THR N 2.258 E A 0017 ILE O
C A 0019 LEU N 2.253 E A 0018 THR O
C A 0020 SER N 2.254 C A 0019 LEU O
C A 0021 GLU N 2.943 C A 0019 LEU O
C A 0021 GLU N 2.254 C A 0020 SER O
C A 0022 SER N 2.254 C A 0021 GLU O
C A 0023 ARG N 2.260 C A 0022 SER O
C A 0024 GLU N 2.261 C A 0023 ARG O
C A 0025 GLY N 2.589 C A 0023 ARG O
C A 0025 GLY N 2.256 C A 0024 GLU O
C A 0026 MET N 2.251 C A 0025 GLY O
C A 0027 THR N 2.252 C A 0026 MET O
C A 0028 SER N 2.253 C A 0027 THR O
E A 0029 ASP N 2.255 C A 0028 SER O
E A 0029 ASP N 2.683 E A 0056 HIS O
E A 0030 THR N 2.254 E A 0029 ASP O
E A 0031 TYR N 2.255 E A 0030 THR O
E A 0031 TYR N 2.926 E A 0054 ILE O
C A 0032 THR N 2.256 E A 0031 TYR O
C A 0033 LYS N 2.252 C A 0032 THR O
C A 0034 VAL N 2.260 C A 0033 LYS O
C A 0035 ASP N 2.252 C A 0034 VAL O
C A 0036 ASP N 2.254 C A 0035 ASP O
C A 0037 SER N 2.261 C A 0036 ASP O
C A 0038 GLN N 2.253 C A 0037 SER O
H A 0039 PRO N 2.220 C A 0038 GLN O
H A 0040 ALA N 2.251 H A 0039 PRO O
H A 0041 PHE N 2.878 H A 0039 PRO O
H A 0041 PHE N 2.251 H A 0040 ALA O
H A 0042 ILE N 2.576 H A 0039 PRO O
H A 0042 ILE N 3.048 H A 0040 ALA O
H A 0042 ILE N 2.257 H A 0041 PHE O
H A 0043 ASN N 2.728 H A 0040 ALA O
H A 0043 ASN N 2.250 H A 0042 ILE O
H A 0044 ASP N 3.197 H A 0042 ILE O
H A 0044 ASP N 2.261 H A 0043 ASN O
H A 0045 ILE N 3.055 H A 0042 ILE O
H A 0045 ILE N 2.256 H A 0044 ASP O
H A 0046 LEU N 3.155 H A 0042 ILE O
H A 0046 LEU N 2.250 H A 0045 ILE O
H A 0047 LYS N 2.848 H A 0043 ASN O
H A 0047 LYS N 2.862 H A 0044 ASP O
H A 0047 LYS N 2.255 H A 0046 LEU O
H A 0048 VAL N 2.494 H A 0044 ASP O
H A 0048 VAL N 3.033 H A 0045 ILE O
H A 0048 VAL N 2.253 H A 0047 LYS O
C A 0049 GLU N 2.255 H A 0048 VAL O
C A 0050 GLY N 2.254 C A 0049 GLU O
E A 0051 VAL N 3.181 H A 0048 VAL O
E A 0051 VAL N 2.254 C A 0050 GLY O
E A 0052 LYS N 2.254 E A 0051 VAL O
E A 0052 LYS N 2.917 E A 0064 ASP O
E A 0053 SER N 2.254 E A 0052 LYS O
E A 0054 ILE N 3.027 E A 0031 TYR O
E A 0054 ILE N 2.257 E A 0053 SER O
E A 0055 PHE N 2.255 E A 0054 ILE O
E A 0055 PHE N 3.011 E A 0062 SER O
E A 0056 HIS N 2.654 E A 0029 ASP O
E A 0056 HIS N 2.255 E A 0055 PHE O
E A 0057 VAL N 2.254 E A 0056 HIS O
C A 0058 MET N 2.255 E A 0057 VAL O
C A 0059 ASP N 2.252 C A 0058 MET O
E A 0060 PHE N 3.055 E A 0057 VAL O
E A 0060 PHE N 2.254 C A 0059 ASP O
E A 0061 ILE N 2.255 E A 0060 PHE O
E A 0062 SER N 2.954 E A 0055 PHE O
E A 0062 SER N 2.255 E A 0061 ILE O
E A 0063 VAL N 3.087 E A 0015 MET O
E A 0063 VAL N 2.254 E A 0062 SER O
E A 0064 ASP N 3.157 E A 0053 SER O
E A 0064 ASP N 2.259 E A 0063 VAL O
E A 0065 LYS N 2.720 C A 0013 ASN O
E A 0065 LYS N 2.257 E A 0064 ASP O
C A 0066 GLU N 2.936 C A 0050 GLY O
C A 0066 GLU N 2.249 E A 0065 LYS O
C A 0067 ASN N 2.254 C A 0066 GLU O
C A 0068 ASP N 2.808 C A 0066 GLU O
C A 0068 ASP N 2.255 C A 0067 ASN O
C A 0069 ALA N 2.617 C A 0066 GLU O
C A 0069 ALA N 2.255 C A 0068 ASP O
H A 0070 ASN N 2.257 C A 0069 ALA O
H A 0071 TRP N 2.254 H A 0070 ASN O
H A 0072 GLU N 2.251 H A 0071 TRP O
H A 0073 THR N 2.829 H A 0071 TRP O
H A 0073 THR N 2.250 H A 0072 GLU O
H A 0074 VAL N 2.874 H A 0071 TRP O
H A 0074 VAL N 2.252 H A 0073 THR O
H A 0075 LEU N 2.515 H A 0071 TRP O
H A 0075 LEU N 2.252 H A 0074 VAL O
H A 0076 PRO N 2.221 H A 0075 LEU O
H A 0077 LYS N 2.891 H A 0074 VAL O
H A 0077 LYS N 2.773 H A 0075 LEU O
H A 0077 LYS N 2.254 H A 0076 PRO O
H A 0078 VAL N 2.996 H A 0074 VAL O
H A 0078 VAL N 2.688 H A 0075 LEU O
H A 0078 VAL N 2.255 H A 0077 LYS O
H A 0079 GLU N 2.857 H A 0075 LEU O
H A 0079 GLU N 2.252 H A 0078 VAL O
H A 0080 ALA N 3.175 H A 0077 LYS O
H A 0080 ALA N 3.158 H A 0078 VAL O
H A 0080 ALA N 2.256 H A 0079 GLU O
H A 0081 VAL N 2.849 H A 0078 VAL O
H A 0081 VAL N 3.091 H A 0079 GLU O
H A 0081 VAL N 2.252 H A 0080 ALA O
H A 0082 PHE N 2.251 H A 0081 VAL O
C A 0083 GLU N 3.138 H A 0079 GLU O
C A 0083 GLU N 3.199 H A 0080 ALA O
C A 0083 GLU N 3.024 H A 0081 VAL O
C A 0083 GLU N 2.252 H A 0082 PHE O
C A 0084 LEU N 2.254 C A 0083 GLU O
C A 0085 GLU N 2.258 C A 0084 LEU O
C A 0086 HIS N 2.254 C A 0085 GLU O
C A 0087 HIS N 2.257 C A 0086 HIS O
C A 0088 HIS N 2.254 C A 0087 HIS O
C A 0089 HIS N 2.258 C A 0088 HIS O
C A 0090 HIS N 3.005 C A 0088 HIS O
C A 0090 HIS N 2.254 C A 0089 HIS O
C A 0091 HIS N 2.258 C A 0090 HIS O
HB_MS 2.00 3.20 16
C A 0001 MET N 3.118 C A 0020 SER OG
C A 0005 SER O 2.698 E A 0018 THR OG1
C A 0010 PRO N 2.885 C A 0009 THR OG1
C A 0012 HIS N 2.655 C A 0011 ASN OD1
C A 0012 HIS O 3.189 H A 0071 TRP NE1
C A 0036 ASP O 2.525 C A 0037 SER OG
C A 0036 ASP N 2.609 C A 0038 GLN OE1
C A 0037 SER N 3.134 C A 0038 GLN OE1
H A 0039 PRO O 3.174 H A 0043 ASN ND2
E A 0063 VAL O 2.733 E A 0014 THR OG1
E A 0064 ASP N 3.159 E A 0014 THR OG1
E A 0065 LYS O 2.560 C A 0013 ASN ND2
C A 0066 GLU O 2.612 E A 0065 LYS NZ
C A 0069 ALA O 2.808 E A 0065 LYS NZ
H A 0071 TRP N 3.115 H A 0072 GLU OE2
C A 0086 HIS O 2.686 C A 0087 HIS ND1
HB_SS 2.00 3.20 3
E A 0056 HIS NE2 2.947 C A 0027 THR OG1
E A 0064 ASP OD1 3.194 E A 0014 THR OG1
E A 0064 ASP OD2 2.830 E A 0014 THR OG1
AROMATIC 0.00 8.00 1
E A 0065 LYS 6.900 C A 0012 HIS