Complet list of 1it1 con file
Complete list of 1it1.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 547
C A 0001 ALA CA 2.842 C A 0002 PRO CD
C A 0001 ALA C 2.429 C A 0002 PRO CA
C A 0001 ALA C 3.103 C A 0002 PRO C
C A 0001 ALA C 3.609 C A 0002 PRO CB
C A 0001 ALA C 3.618 C A 0002 PRO CG
C A 0001 ALA C 2.478 C A 0002 PRO CD
C A 0001 ALA CB 3.726 C A 0002 PRO CD
C A 0002 PRO C 2.414 C A 0003 LYS CA
C A 0002 PRO C 3.345 C A 0003 LYS C
C A 0002 PRO C 3.508 C A 0003 LYS CB
C A 0002 PRO C 3.562 C A 0003 LYS CG
C A 0002 PRO CB 3.605 C A 0043 TYR CG
C A 0002 PRO CG 3.744 C A 0043 TYR CG
C A 0002 PRO CG 3.654 C A 0043 TYR CD1
C A 0002 PRO CG 3.744 C A 0043 TYR CE1
C A 0003 LYS C 2.419 C A 0004 ALA CA
C A 0003 LYS C 2.825 C A 0004 ALA C
C A 0003 LYS C 3.601 C A 0004 ALA CB
C A 0004 ALA CA 3.796 C A 0005 PRO CA
C A 0004 ALA CA 2.842 C A 0005 PRO CD
C A 0004 ALA C 2.422 C A 0005 PRO CA
C A 0004 ALA C 3.132 C A 0005 PRO C
C A 0004 ALA C 3.595 C A 0005 PRO CB
C A 0004 ALA C 3.633 C A 0005 PRO CG
C A 0004 ALA C 2.477 C A 0005 PRO CD
C A 0004 ALA CB 3.733 C A 0005 PRO CD
C A 0005 PRO C 2.420 C A 0006 ALA CA
C A 0005 PRO C 2.988 C A 0006 ALA C
C A 0005 PRO C 3.635 C A 0006 ALA CB
C A 0005 PRO CG 3.239 E A 0009 LEU CD1
C A 0005 PRO CG 3.235 H A 0022 HIS CE1
C A 0005 PRO CD 3.289 H A 0022 HIS CE1
C A 0006 ALA C 2.417 C A 0007 ASP CA
C A 0006 ALA C 2.944 C A 0007 ASP C
C A 0006 ALA C 3.631 C A 0007 ASP CB
C A 0007 ASP C 2.414 C A 0008 GLY CA
C A 0007 ASP C 3.301 C A 0008 GLY C
C A 0007 ASP CB 3.247 H A 0021 ASN CG
C A 0007 ASP CG 3.650 H A 0023 SER CA
C A 0007 ASP CG 2.935 H A 0023 SER CB
C A 0008 GLY C 2.415 E A 0009 LEU CA
C A 0008 GLY C 2.985 E A 0009 LEU C
C A 0008 GLY C 3.643 E A 0009 LEU CB
C A 0008 GLY CA 3.302 E A 0019 VAL CG1
C A 0008 GLY C 3.322 E A 0019 VAL CG1
E A 0009 LEU CA 3.798 E A 0010 LYS CA
E A 0009 LEU C 2.402 E A 0010 LYS CA
E A 0009 LEU C 3.263 E A 0010 LYS C
E A 0009 LEU C 3.549 E A 0010 LYS CB
E A 0009 LEU C 3.785 E A 0019 VAL CA
E A 0009 LEU CD1 3.306 H A 0022 HIS CE1
E A 0010 LYS C 2.421 E A 0011 MET CA
E A 0010 LYS C 3.177 E A 0011 MET C
E A 0010 LYS C 3.596 E A 0011 MET CB
E A 0010 LYS CG 3.107 E A 0019 VAL CG2
E A 0011 MET C 2.416 C A 0012 ASP CA
E A 0011 MET C 3.390 C A 0012 ASP C
E A 0011 MET C 3.477 C A 0012 ASP CB
E A 0011 MET CE 3.378 C A 0046 CYS CB
E A 0011 MET CE 3.398 H A 0065 TYR CE1
E A 0011 MET CE 3.326 H A 0065 TYR CZ
E A 0011 MET CE 3.519 H A 0069 MET CE
C A 0012 ASP C 2.413 C A 0013 LYS CA
C A 0012 ASP C 2.917 C A 0013 LYS C
C A 0012 ASP C 3.607 C A 0013 LYS CB
C A 0012 ASP CA 3.797 C A 0017 PRO CA
C A 0012 ASP CA 3.555 C A 0017 PRO CB
C A 0012 ASP CB 3.696 C A 0017 PRO CB
C A 0013 LYS C 2.426 C A 0014 THR CA
C A 0013 LYS C 3.456 C A 0014 THR C
C A 0013 LYS C 3.449 C A 0014 THR CB
C A 0013 LYS C 3.598 C A 0014 THR CG2
C A 0013 LYS CG 3.305 C A 0047 ALA CB
C A 0013 LYS CE 3.646 C A 0047 ALA CB
C A 0013 LYS CD 3.703 C A 0053 ASP CG
C A 0013 LYS CB 3.738 H A 0065 TYR CD2
C A 0013 LYS CB 3.189 H A 0065 TYR CE2
C A 0013 LYS CB 3.531 H A 0065 TYR CZ
C A 0013 LYS CG 3.785 H A 0065 TYR CZ
C A 0014 THR C 2.427 C A 0015 LYS CA
C A 0014 THR C 3.078 C A 0015 LYS C
C A 0014 THR C 3.633 C A 0015 LYS CB
C A 0014 THR CG2 3.715 C A 0055 MET CE
C A 0014 THR CG2 3.452 H A 0065 TYR CD2
C A 0015 LYS C 2.424 C A 0016 GLN CA
C A 0015 LYS C 3.333 C A 0016 GLN C
C A 0015 LYS C 3.523 C A 0016 GLN CB
C A 0015 LYS C 3.214 C A 0017 PRO CD
C A 0016 GLN CA 2.844 C A 0017 PRO CD
C A 0016 GLN C 2.431 C A 0017 PRO CA
C A 0016 GLN C 3.063 C A 0017 PRO C
C A 0016 GLN C 3.618 C A 0017 PRO CB
C A 0016 GLN C 3.595 C A 0017 PRO CG
C A 0016 GLN C 2.480 C A 0017 PRO CD
C A 0017 PRO C 2.427 E A 0018 VAL CA
C A 0017 PRO C 3.525 E A 0018 VAL C
C A 0017 PRO C 3.354 E A 0018 VAL CB
C A 0017 PRO C 3.447 E A 0018 VAL CG2
E A 0018 VAL C 2.420 E A 0019 VAL CA
E A 0018 VAL C 3.230 E A 0019 VAL C
E A 0018 VAL C 3.581 E A 0019 VAL CB
E A 0018 VAL CG2 3.661 C A 0105 CYS C
E A 0018 VAL CG2 3.517 C A 0106 HIS CE1
E A 0019 VAL C 2.426 E A 0020 PHE CA
E A 0019 VAL C 3.291 E A 0020 PHE C
E A 0019 VAL C 3.576 E A 0020 PHE CB
E A 0020 PHE C 2.410 H A 0021 ASN CA
E A 0020 PHE C 3.335 H A 0021 ASN C
E A 0020 PHE C 3.492 H A 0021 ASN CB
E A 0020 PHE CE2 3.627 H A 0022 HIS CG
E A 0020 PHE CE2 3.284 H A 0022 HIS CD2
E A 0020 PHE CD1 3.466 H A 0025 HIS CE1
E A 0020 PHE CE1 3.122 H A 0025 HIS CG
E A 0020 PHE CE1 3.108 H A 0025 HIS CD2
E A 0020 PHE CE1 2.860 H A 0025 HIS CE1
E A 0020 PHE CZ 3.414 H A 0025 HIS CB
E A 0020 PHE CZ 2.997 H A 0025 HIS CG
E A 0020 PHE CZ 3.410 H A 0025 HIS CD2
E A 0020 PHE CZ 3.587 H A 0025 HIS CE1
H A 0021 ASN C 2.415 H A 0022 HIS CA
H A 0021 ASN C 2.864 H A 0022 HIS C
H A 0021 ASN C 3.626 H A 0022 HIS CB
H A 0022 HIS C 2.427 H A 0023 SER CA
H A 0022 HIS C 2.882 H A 0023 SER C
H A 0022 HIS C 3.632 H A 0023 SER CB
H A 0022 HIS C 3.419 C A 0026 LYS CG
H A 0023 SER C 2.421 H A 0024 THR CA
H A 0023 SER C 3.111 H A 0024 THR C
H A 0023 SER C 3.623 H A 0024 THR CB
H A 0023 SER CA 3.325 C A 0026 LYS CG
H A 0023 SER CA 3.559 C A 0026 LYS CD
H A 0023 SER CA 3.665 C A 0026 LYS CE
H A 0023 SER C 3.768 C A 0026 LYS CG
H A 0024 THR C 2.416 H A 0025 HIS CA
H A 0024 THR C 3.517 H A 0025 HIS C
H A 0024 THR C 3.328 H A 0025 HIS CB
H A 0024 THR C 3.211 H A 0025 HIS CG
H A 0024 THR CB 3.589 H A 0025 HIS CE1
H A 0025 HIS C 2.417 C A 0026 LYS CA
H A 0025 HIS C 2.871 C A 0026 LYS C
H A 0025 HIS C 3.632 C A 0026 LYS CB
H A 0025 HIS CA 3.549 C A 0028 VAL CG2
H A 0025 HIS C 3.758 C A 0028 VAL CB
C A 0026 LYS C 2.425 C A 0027 ALA CA
C A 0026 LYS C 3.178 C A 0027 ALA C
C A 0026 LYS C 3.605 C A 0027 ALA CB
C A 0027 ALA C 2.425 C A 0028 VAL CA
C A 0027 ALA C 3.178 C A 0028 VAL C
C A 0027 ALA C 3.602 C A 0028 VAL CB
C A 0028 VAL CA 3.798 H A 0029 LYS CA
C A 0028 VAL C 2.400 H A 0029 LYS CA
C A 0028 VAL C 3.194 H A 0029 LYS C
C A 0028 VAL C 3.571 H A 0029 LYS CB
H A 0029 LYS CA 3.793 H A 0030 CYS CA
H A 0029 LYS C 2.411 H A 0030 CYS CA
H A 0029 LYS C 2.841 H A 0030 CYS C
H A 0029 LYS C 3.615 H A 0030 CYS CB
H A 0029 LYS CB 3.348 H A 0032 ASP CB
H A 0030 CYS C 2.426 H A 0031 GLY CA
H A 0030 CYS C 3.217 H A 0031 GLY C
H A 0031 GLY C 2.410 H A 0032 ASP CA
H A 0031 GLY C 3.100 H A 0032 ASP C
H A 0031 GLY C 3.606 H A 0032 ASP CB
H A 0031 GLY C 3.637 C A 0035 HIS CA
H A 0031 GLY CA 3.352 E A 0041 GLU CD
H A 0032 ASP C 2.424 H A 0033 CYS CA
H A 0032 ASP C 3.200 H A 0033 CYS C
H A 0032 ASP C 3.589 H A 0033 CYS CB
H A 0032 ASP CB 3.720 C A 0077 LYS CG
H A 0032 ASP CB 3.443 C A 0077 LYS CD
H A 0032 ASP CG 3.237 C A 0077 LYS CG
H A 0032 ASP CG 2.837 C A 0077 LYS CD
H A 0032 ASP CG 2.861 C A 0077 LYS CE
H A 0033 CYS C 2.427 H A 0034 HIS CA
H A 0033 CYS C 3.194 H A 0034 HIS C
H A 0033 CYS C 3.609 H A 0034 HIS CB
H A 0034 HIS C 2.431 C A 0035 HIS CA
H A 0034 HIS C 2.828 C A 0035 HIS C
H A 0034 HIS C 3.605 C A 0035 HIS CB
H A 0034 HIS C 3.726 C A 0035 HIS CG
H A 0034 HIS CG 3.737 C A 0043 TYR CA
H A 0034 HIS CE1 3.766 C A 0043 TYR C
H A 0034 HIS CE1 3.657 C A 0044 GLN C
C A 0035 HIS CA 2.835 E A 0036 PRO CD
C A 0035 HIS C 2.433 E A 0036 PRO CA
C A 0035 HIS C 3.059 E A 0036 PRO C
C A 0035 HIS C 3.619 E A 0036 PRO CB
C A 0035 HIS C 3.593 E A 0036 PRO CG
C A 0035 HIS C 2.479 E A 0036 PRO CD
C A 0035 HIS CB 3.236 E A 0036 PRO CD
C A 0035 HIS CE1 3.010 E A 0037 VAL CG2
C A 0035 HIS C 3.722 E A 0041 GLU CA
C A 0035 HIS C 3.174 E A 0041 GLU CG
C A 0035 HIS CB 3.396 C A 0076 PHE CG
C A 0035 HIS CB 3.411 C A 0076 PHE CD1
C A 0035 HIS CB 3.208 C A 0076 PHE CD2
C A 0035 HIS CB 3.236 C A 0076 PHE CE1
C A 0035 HIS CB 3.020 C A 0076 PHE CE2
C A 0035 HIS CB 3.034 C A 0076 PHE CZ
C A 0035 HIS CG 3.679 C A 0076 PHE CG
C A 0035 HIS CG 2.986 C A 0076 PHE CD2
C A 0035 HIS CG 2.860 C A 0076 PHE CE2
C A 0035 HIS CG 3.475 C A 0076 PHE CZ
C A 0035 HIS CD2 3.783 C A 0076 PHE CG
C A 0035 HIS CD2 3.039 C A 0076 PHE CD2
C A 0035 HIS CD2 3.403 C A 0076 PHE CE2
C A 0035 HIS CE1 3.737 C A 0076 PHE CE2
E A 0036 PRO C 2.425 E A 0037 VAL CA
E A 0036 PRO C 3.468 E A 0037 VAL C
E A 0036 PRO C 3.408 E A 0037 VAL CB
E A 0036 PRO C 3.568 E A 0037 VAL CG2
E A 0036 PRO CA 3.630 E A 0041 GLU CA
E A 0036 PRO CA 3.320 E A 0041 GLU CG
E A 0037 VAL C 2.410 C A 0038 ASN CA
E A 0037 VAL C 2.873 C A 0038 ASN C
E A 0037 VAL C 2.914 C A 0038 ASN CB
E A 0037 VAL CB 3.769 C A 0042 ASP CG
E A 0037 VAL CG1 3.672 C A 0042 ASP CG
C A 0038 ASN C 2.415 C A 0039 GLY CA
C A 0038 ASN C 3.233 C A 0039 GLY C
C A 0039 GLY C 2.425 E A 0040 LYS CA
C A 0039 GLY C 3.632 E A 0040 LYS C
C A 0039 GLY C 3.205 E A 0040 LYS CB
C A 0039 GLY C 3.626 E A 0040 LYS CG
E A 0040 LYS C 2.424 E A 0041 GLU CA
E A 0040 LYS C 2.990 E A 0041 GLU C
E A 0040 LYS C 3.652 E A 0041 GLU CB
E A 0041 GLU C 2.405 C A 0042 ASP CA
E A 0041 GLU C 2.987 C A 0042 ASP C
E A 0041 GLU C 3.629 C A 0042 ASP CB
E A 0041 GLU CB 3.601 C A 0043 TYR CE1
E A 0041 GLU CB 3.757 C A 0043 TYR CE2
E A 0041 GLU CB 3.269 C A 0043 TYR CZ
C A 0042 ASP C 2.414 C A 0043 TYR CA
C A 0042 ASP C 3.135 C A 0043 TYR C
C A 0042 ASP C 3.603 C A 0043 TYR CB
C A 0042 ASP CB 3.766 C A 0044 GLN CD
C A 0043 TYR C 2.424 C A 0044 GLN CA
C A 0043 TYR C 3.534 C A 0044 GLN C
C A 0043 TYR C 3.346 C A 0044 GLN CB
C A 0044 GLN C 2.423 C A 0045 LYS CA
C A 0044 GLN C 2.836 C A 0045 LYS C
C A 0044 GLN C 3.609 C A 0045 LYS CB
C A 0044 GLN CG 3.506 C A 0048 THR CG2
C A 0044 GLN CD 3.123 C A 0048 THR CG2
C A 0045 LYS C 2.426 C A 0046 CYS CA
C A 0045 LYS C 2.946 C A 0046 CYS C
C A 0045 LYS C 3.630 C A 0046 CYS CB
C A 0046 CYS C 2.419 C A 0047 ALA CA
C A 0046 CYS C 3.234 C A 0047 ALA C
C A 0046 CYS C 3.573 C A 0047 ALA CB
C A 0046 CYS C 3.687 C A 0052 HIS CB
C A 0046 CYS CB 3.767 H A 0069 MET CE
C A 0047 ALA C 2.411 C A 0048 THR CA
C A 0047 ALA C 2.855 C A 0048 THR C
C A 0047 ALA C 3.613 C A 0048 THR CB
C A 0047 ALA CA 3.770 C A 0052 HIS CA
C A 0047 ALA CA 3.522 C A 0052 HIS C
C A 0047 ALA CA 3.575 C A 0052 HIS CB
C A 0047 ALA CB 3.577 C A 0052 HIS C
C A 0047 ALA CB 3.760 C A 0053 ASP CA
C A 0047 ALA CB 3.303 H A 0065 TYR CD1
C A 0047 ALA CB 2.978 H A 0065 TYR CE1
C A 0047 ALA CB 3.650 H A 0065 TYR CZ
C A 0048 THR C 2.422 C A 0049 ALA CA
C A 0048 THR C 3.023 C A 0049 ALA C
C A 0048 THR C 3.629 C A 0049 ALA CB
C A 0048 THR CA 3.716 C A 0051 CYS CB
C A 0048 THR CB 3.202 C A 0051 CYS CB
C A 0049 ALA C 2.421 C A 0050 GLY CA
C A 0049 ALA C 3.524 C A 0050 GLY C
C A 0050 GLY C 2.421 C A 0051 CYS CA
C A 0050 GLY C 3.478 C A 0051 CYS C
C A 0050 GLY C 3.374 C A 0051 CYS CB
C A 0051 CYS C 2.422 C A 0052 HIS CA
C A 0051 CYS C 3.450 C A 0052 HIS C
C A 0051 CYS C 3.427 C A 0052 HIS CB
C A 0051 CYS C 3.576 C A 0052 HIS CG
C A 0052 HIS C 2.425 C A 0053 ASP CA
C A 0052 HIS C 3.232 C A 0053 ASP C
C A 0052 HIS C 3.588 C A 0053 ASP CB
C A 0052 HIS CE1 3.741 C A 0062 ALA C
C A 0052 HIS C 3.645 H A 0065 TYR CD1
C A 0052 HIS CB 3.586 H A 0065 TYR CD1
C A 0052 HIS CE1 3.650 H A 0068 ALA CB
C A 0053 ASP C 2.410 C A 0054 ASN CA
C A 0053 ASP C 3.119 C A 0054 ASN C
C A 0053 ASP C 3.605 C A 0054 ASN CB
C A 0053 ASP CA 3.673 C A 0055 MET CE
C A 0053 ASP C 3.174 C A 0055 MET CE
C A 0054 ASN C 2.421 C A 0055 MET CA
C A 0054 ASN C 3.186 C A 0055 MET C
C A 0054 ASN C 3.598 C A 0055 MET CB
C A 0054 ASN C 3.371 C A 0055 MET CE
C A 0054 ASN CG 3.579 C A 0059 ASP CB
C A 0054 ASN CB 3.467 H A 0064 GLY CA
C A 0054 ASN CG 3.084 H A 0064 GLY CA
C A 0055 MET C 2.417 C A 0056 ASP CA
C A 0055 MET C 3.121 C A 0056 ASP C
C A 0055 MET C 3.614 C A 0056 ASP CB
C A 0056 ASP C 2.426 C A 0057 LYS CA
C A 0056 ASP C 2.856 C A 0057 LYS C
C A 0056 ASP C 3.011 C A 0057 LYS CB
C A 0056 ASP C 3.414 C A 0057 LYS CG
C A 0056 ASP CB 3.574 C A 0058 LYS CG
C A 0056 ASP CG 3.269 C A 0058 LYS CG
C A 0057 LYS C 2.425 C A 0058 LYS CA
C A 0057 LYS C 3.604 C A 0058 LYS C
C A 0057 LYS C 3.251 C A 0058 LYS CB
C A 0057 LYS CA 3.454 H A 0066 TYR CB
C A 0057 LYS CA 3.669 H A 0066 TYR CG
C A 0057 LYS CA 3.611 H A 0066 TYR CD2
C A 0057 LYS CB 3.473 H A 0066 TYR CD2
C A 0058 LYS C 2.425 C A 0059 ASP CA
C A 0058 LYS C 2.908 C A 0059 ASP C
C A 0058 LYS C 3.635 C A 0059 ASP CB
C A 0059 ASP C 2.422 C A 0060 LYS CA
C A 0059 ASP C 3.210 C A 0060 LYS C
C A 0059 ASP C 3.592 C A 0060 LYS CB
C A 0059 ASP CG 3.719 H A 0064 GLY CA
C A 0060 LYS C 2.425 C A 0061 SER CA
C A 0060 LYS C 3.414 C A 0061 SER C
C A 0060 LYS C 3.472 C A 0061 SER CB
C A 0060 LYS C 3.774 H A 0067 HIS CG
C A 0061 SER C 2.422 C A 0062 ALA CA
C A 0061 SER C 3.285 C A 0062 ALA C
C A 0061 SER C 3.558 C A 0062 ALA CB
C A 0061 SER C 3.618 H A 0067 HIS CD2
C A 0062 ALA C 2.422 C A 0063 LYS CA
C A 0062 ALA C 3.595 C A 0063 LYS C
C A 0062 ALA C 3.260 C A 0063 LYS CB
C A 0063 LYS C 2.411 H A 0064 GLY CA
C A 0063 LYS C 3.500 H A 0064 GLY C
H A 0064 GLY C 2.420 H A 0065 TYR CA
H A 0064 GLY C 2.888 H A 0065 TYR C
H A 0064 GLY C 3.618 H A 0065 TYR CB
H A 0065 TYR C 2.433 H A 0066 TYR CA
H A 0065 TYR C 2.886 H A 0066 TYR C
H A 0065 TYR C 3.589 H A 0066 TYR CB
H A 0065 TYR C 3.480 H A 0069 MET CG
H A 0066 TYR C 2.422 H A 0067 HIS CA
H A 0066 TYR C 2.854 H A 0067 HIS C
H A 0066 TYR C 3.607 H A 0067 HIS CB
H A 0066 TYR CA 3.548 H A 0070 HIS CE1
H A 0066 TYR CG 3.561 H A 0070 HIS CE1
H A 0066 TYR CD1 3.648 H A 0070 HIS CG
H A 0066 TYR CD1 3.755 H A 0070 HIS CE1
H A 0066 TYR CD2 3.583 H A 0070 HIS CE1
H A 0066 TYR CE1 3.600 H A 0070 HIS CG
H A 0066 TYR CE2 3.796 H A 0070 HIS CE1
H A 0067 HIS C 2.421 H A 0068 ALA CA
H A 0067 HIS C 2.885 H A 0068 ALA C
H A 0067 HIS C 3.618 H A 0068 ALA CB
H A 0067 HIS CD2 3.734 H A 0068 ALA CA
H A 0067 HIS CA 3.550 H A 0071 ASP CG
H A 0067 HIS C 3.624 H A 0071 ASP CB
H A 0067 HIS C 3.623 H A 0071 ASP CG
H A 0067 HIS CG 3.569 H A 0071 ASP CG
H A 0067 HIS CE1 3.376 H A 0071 ASP CB
H A 0067 HIS CE1 3.173 H A 0071 ASP CG
H A 0067 HIS CE1 3.600 C A 0074 THR CG2
H A 0068 ALA C 2.419 H A 0069 MET CA
H A 0068 ALA C 3.272 H A 0069 MET C
H A 0068 ALA C 3.561 H A 0069 MET CB
H A 0068 ALA C 3.765 H A 0069 MET CG
H A 0068 ALA C 3.541 H A 0078 SER CB
H A 0069 MET C 2.409 H A 0070 HIS CA
H A 0069 MET C 3.403 H A 0070 HIS C
H A 0069 MET C 3.466 H A 0070 HIS CB
H A 0069 MET C 3.463 H A 0070 HIS CG
H A 0069 MET CB 3.753 H A 0070 HIS CE1
H A 0070 HIS C 2.418 H A 0071 ASP CA
H A 0070 HIS C 3.193 H A 0071 ASP C
H A 0070 HIS C 3.589 H A 0071 ASP CB
H A 0070 HIS CA 3.483 H A 0080 VAL CB
H A 0070 HIS CA 3.798 H A 0080 VAL CG2
H A 0071 ASP C 2.427 C A 0072 LYS CA
H A 0071 ASP C 3.432 C A 0072 LYS C
H A 0071 ASP C 3.459 C A 0072 LYS CB
H A 0071 ASP C 3.402 C A 0072 LYS CG
H A 0071 ASP CB 3.383 C A 0074 THR CG2
C A 0072 LYS C 2.422 C A 0073 GLY CA
C A 0072 LYS C 3.022 C A 0073 GLY C
C A 0072 LYS CA 3.654 H A 0081 GLY CA
C A 0072 LYS CG 3.699 H A 0081 GLY CA
C A 0073 GLY C 2.426 C A 0074 THR CA
C A 0073 GLY C 3.362 C A 0074 THR C
C A 0073 GLY C 3.514 C A 0074 THR CB
C A 0074 THR C 2.426 C A 0075 LYS CA
C A 0074 THR C 2.809 C A 0075 LYS C
C A 0074 THR C 3.605 C A 0075 LYS CB
C A 0075 LYS C 2.431 C A 0076 PHE CA
C A 0075 LYS C 3.608 C A 0076 PHE C
C A 0075 LYS C 3.249 C A 0076 PHE CB
C A 0075 LYS C 3.043 C A 0076 PHE CG
C A 0075 LYS C 3.509 C A 0076 PHE CD1
C A 0075 LYS C 3.304 C A 0076 PHE CD2
C A 0075 LYS CB 3.358 C A 0076 PHE CD2
C A 0075 LYS CB 3.427 C A 0076 PHE CE2
C A 0075 LYS CG 3.794 C A 0076 PHE CD2
C A 0075 LYS CG 3.294 C A 0076 PHE CE2
C A 0075 LYS CG 3.649 C A 0076 PHE CZ
C A 0076 PHE C 2.398 C A 0077 LYS CA
C A 0076 PHE C 2.986 C A 0077 LYS C
C A 0076 PHE C 3.636 C A 0077 LYS CB
C A 0077 LYS CA 3.799 H A 0078 SER CA
C A 0077 LYS C 2.426 H A 0078 SER CA
C A 0077 LYS C 3.172 H A 0078 SER C
C A 0077 LYS C 3.596 H A 0078 SER CB
H A 0078 SER C 2.428 H A 0079 CYS CA
H A 0078 SER C 2.988 H A 0079 CYS C
H A 0078 SER C 3.638 H A 0079 CYS CB
H A 0079 CYS C 2.421 H A 0080 VAL CA
H A 0079 CYS C 3.024 H A 0080 VAL C
H A 0079 CYS C 3.637 H A 0080 VAL CB
H A 0080 VAL C 2.430 H A 0081 GLY CA
H A 0080 VAL C 3.020 H A 0081 GLY C
H A 0080 VAL CA 3.566 H A 0083 HIS CB
H A 0080 VAL C 3.635 H A 0083 HIS CB
H A 0081 GLY C 2.422 H A 0082 CYS CA
H A 0081 GLY C 3.090 H A 0082 CYS C
H A 0081 GLY C 3.626 H A 0082 CYS CB
H A 0082 CYS CA 3.797 H A 0083 HIS CA
H A 0082 CYS C 2.422 H A 0083 HIS CA
H A 0082 CYS C 3.126 H A 0083 HIS C
H A 0082 CYS C 3.594 H A 0083 HIS CB
H A 0083 HIS C 2.419 H A 0084 LEU CA
H A 0083 HIS C 2.890 H A 0084 LEU C
H A 0083 HIS C 3.610 H A 0084 LEU CB
H A 0083 HIS CA 3.526 H A 0097 LEU CB
H A 0083 HIS C 3.668 H A 0097 LEU CB
H A 0083 HIS CB 3.647 H A 0097 LEU CA
H A 0083 HIS CB 3.330 H A 0097 LEU C
H A 0083 HIS CB 3.241 H A 0097 LEU CB
H A 0083 HIS CG 3.481 H A 0097 LEU CA
H A 0083 HIS CG 3.468 H A 0097 LEU C
H A 0083 HIS CG 3.413 H A 0097 LEU CB
H A 0083 HIS C 3.477 C A 0098 THR CG2
H A 0083 HIS CB 3.659 C A 0098 THR CG2
H A 0084 LEU C 2.425 H A 0085 GLU CA
H A 0084 LEU C 3.251 H A 0085 GLU C
H A 0084 LEU C 3.578 H A 0085 GLU CB
H A 0084 LEU CA 2.910 C A 0098 THR CG2
H A 0084 LEU CB 3.143 C A 0098 THR CG2
H A 0084 LEU CG 3.098 C A 0098 THR CG2
H A 0084 LEU CD1 3.721 C A 0098 THR CG2
H A 0085 GLU C 2.423 H A 0086 THR CA
H A 0085 GLU C 3.023 H A 0086 THR C
H A 0085 GLU C 3.644 H A 0086 THR CB
H A 0086 THR C 2.424 H A 0087 ALA CA
H A 0086 THR C 3.225 H A 0087 ALA C
H A 0086 THR C 3.587 H A 0087 ALA CB
H A 0086 THR C 3.603 H A 0097 LEU CD1
H A 0086 THR CB 3.668 H A 0097 LEU CD1
H A 0086 THR CG2 3.162 H A 0097 LEU CD1
H A 0087 ALA C 2.422 C A 0088 GLY CA
H A 0087 ALA C 2.918 C A 0088 GLY C
H A 0087 ALA C 3.722 H A 0090 ASP CB
H A 0087 ALA CA 3.346 H A 0093 LYS CB
H A 0087 ALA CA 3.639 H A 0093 LYS CD
H A 0087 ALA CB 3.593 H A 0093 LYS C
H A 0087 ALA CB 3.382 H A 0093 LYS CB
C A 0088 GLY C 2.427 C A 0089 ALA CA
C A 0088 GLY C 2.834 C A 0089 ALA C
C A 0088 GLY C 3.045 C A 0089 ALA CB
C A 0089 ALA C 2.415 H A 0090 ASP CA
C A 0089 ALA C 3.508 H A 0090 ASP C
C A 0089 ALA C 3.327 H A 0090 ASP CB
H A 0090 ASP C 2.427 H A 0091 ALA CA
H A 0090 ASP C 2.828 H A 0091 ALA C
H A 0090 ASP C 3.602 H A 0091 ALA CB
H A 0090 ASP CB 3.389 H A 0093 LYS CB
H A 0090 ASP CG 3.299 H A 0093 LYS CB
H A 0090 ASP CG 3.633 H A 0093 LYS CG
H A 0091 ALA C 2.417 H A 0092 ALA CA
H A 0091 ALA C 3.072 H A 0092 ALA C
H A 0091 ALA C 3.624 H A 0092 ALA CB
H A 0092 ALA CA 3.799 H A 0093 LYS CA
H A 0092 ALA C 2.416 H A 0093 LYS CA
H A 0092 ALA C 3.113 H A 0093 LYS C
H A 0092 ALA C 3.601 H A 0093 LYS CB
H A 0092 ALA C 3.565 H A 0095 LYS CG
H A 0093 LYS C 2.418 H A 0094 LYS CA
H A 0093 LYS C 3.085 H A 0094 LYS C
H A 0093 LYS C 3.625 H A 0094 LYS CB
H A 0093 LYS CA 3.126 H A 0096 GLU CG
H A 0093 LYS CA 3.247 H A 0096 GLU CD
H A 0093 LYS C 3.274 H A 0096 GLU CG
H A 0093 LYS CG 3.633 H A 0096 GLU CD
H A 0093 LYS C 3.746 H A 0097 LEU CG
H A 0094 LYS C 2.424 H A 0095 LYS CA
H A 0094 LYS C 3.191 H A 0095 LYS C
H A 0094 LYS C 3.596 H A 0095 LYS CB
H A 0095 LYS C 2.431 H A 0096 GLU CA
H A 0095 LYS C 3.302 H A 0096 GLU C
H A 0095 LYS C 3.543 H A 0096 GLU CB
H A 0095 LYS C 3.567 C A 0099 GLY CA
H A 0095 LYS C 3.701 C A 0103 SER CA
H A 0095 LYS C 3.511 C A 0103 SER CB
H A 0096 GLU C 2.421 H A 0097 LEU CA
H A 0096 GLU C 3.149 H A 0097 LEU C
H A 0096 GLU C 3.598 H A 0097 LEU CB
H A 0096 GLU C 3.754 H A 0097 LEU CD2
H A 0096 GLU CG 3.260 H A 0097 LEU CG
H A 0096 GLU CG 3.424 H A 0097 LEU CD2
H A 0096 GLU CA 3.502 C A 0103 SER CA
H A 0096 GLU CA 3.402 C A 0103 SER CB
H A 0096 GLU C 3.337 C A 0103 SER CB
H A 0096 GLU CB 3.728 C A 0104 LYS CG
H A 0097 LEU C 2.413 C A 0098 THR CA
H A 0097 LEU C 3.289 C A 0098 THR C
H A 0097 LEU C 3.545 C A 0098 THR CB
H A 0097 LEU C 3.700 C A 0098 THR CG2
C A 0098 THR C 2.410 C A 0099 GLY CA
C A 0098 THR C 2.912 C A 0099 GLY C
C A 0099 GLY C 2.416 C A 0100 CYS CA
C A 0099 GLY C 3.152 C A 0100 CYS C
C A 0099 GLY C 3.631 C A 0100 CYS CB
C A 0099 GLY CA 3.256 C A 0103 SER CB
C A 0099 GLY C 3.159 C A 0103 SER CB
C A 0100 CYS C 2.407 C A 0101 LYS CA
C A 0100 CYS C 3.314 C A 0101 LYS C
C A 0100 CYS C 3.527 C A 0101 LYS CB
C A 0100 CYS C 3.726 C A 0101 LYS CG
C A 0100 CYS CA 3.638 C A 0106 HIS CD2
C A 0100 CYS C 3.500 C A 0106 HIS CB
C A 0100 CYS C 3.634 C A 0106 HIS CD2
C A 0101 LYS C 2.414 C A 0102 GLY CA
C A 0101 LYS C 3.668 C A 0102 GLY C
C A 0102 GLY C 2.414 C A 0103 SER CA
C A 0102 GLY C 3.535 C A 0103 SER C
C A 0102 GLY C 3.319 C A 0103 SER CB
C A 0103 SER C 2.429 C A 0104 LYS CA
C A 0103 SER C 3.311 C A 0104 LYS C
C A 0103 SER C 3.524 C A 0104 LYS CB
C A 0103 SER C 3.749 C A 0104 LYS CG
C A 0104 LYS CA 3.774 C A 0105 CYS CA
C A 0104 LYS C 2.412 C A 0105 CYS CA
C A 0104 LYS C 3.142 C A 0105 CYS C
C A 0104 LYS C 3.573 C A 0105 CYS CB
C A 0105 CYS C 2.423 C A 0106 HIS CA
C A 0105 CYS C 3.513 C A 0106 HIS C
C A 0105 CYS C 3.373 C A 0106 HIS CB
C A 0105 CYS C 3.631 C A 0106 HIS CG
C A 0106 HIS C 2.423 C A 0107 SER CA
C A 0106 HIS C 2.941 C A 0107 SER C
C A 0106 HIS C 3.636 C A 0107 SER CB
CHARGE_ATTR 2.00 12.00 141
C A 0007 ASP OD1 5.167 H A 0022 HIS ND1
C A 0007 ASP OD1 7.034 H A 0022 HIS NE2
C A 0007 ASP OD2 7.231 H A 0022 HIS ND1
C A 0007 ASP OD2 9.168 H A 0022 HIS NE2
C A 0007 ASP OD1 6.819 H A 0025 HIS ND1
C A 0007 ASP OD1 8.990 H A 0025 HIS NE2
C A 0007 ASP OD2 8.322 H A 0025 HIS ND1
C A 0007 ASP OD2 10.41 H A 0025 HIS NE2
C A 0007 ASP OD1 5.972 C A 0026 LYS NZ
C A 0007 ASP OD2 5.740 C A 0026 LYS NZ
C A 0007 ASP OD1 11.35 H A 0034 HIS NE2
C A 0012 ASP OD1 8.664 E A 0010 LYS NZ
C A 0012 ASP OD2 6.738 E A 0010 LYS NZ
C A 0012 ASP OD1 5.665 C A 0013 LYS NZ
C A 0012 ASP OD2 7.275 C A 0013 LYS NZ
C A 0012 ASP OD1 7.296 C A 0045 LYS NZ
C A 0012 ASP OD2 8.019 C A 0045 LYS NZ
H A 0032 ASP OD1 11.79 H A 0025 HIS NE2
H A 0032 ASP OD2 11.53 H A 0025 HIS NE2
H A 0032 ASP OD1 8.517 H A 0029 LYS NZ
H A 0032 ASP OD2 6.440 H A 0029 LYS NZ
H A 0032 ASP OD1 10.99 H A 0034 HIS ND1
H A 0032 ASP OD1 11.34 H A 0034 HIS NE2
H A 0032 ASP OD2 11.84 H A 0034 HIS ND1
H A 0032 ASP OD2 11.87 H A 0034 HIS NE2
H A 0032 ASP OD1 8.705 C A 0035 HIS ND1
H A 0032 ASP OD1 8.719 C A 0035 HIS NE2
H A 0032 ASP OD2 10.45 C A 0035 HIS ND1
H A 0032 ASP OD2 10.57 C A 0035 HIS NE2
H A 0032 ASP OD1 11.82 C A 0052 HIS NE2
H A 0032 ASP OD1 10.89 C A 0075 LYS NZ
H A 0032 ASP OD1 3.731 C A 0077 LYS NZ
H A 0032 ASP OD2 2.398 C A 0077 LYS NZ
E A 0041 GLU OE1 11.17 H A 0022 HIS NE2
E A 0041 GLU OE1 10.89 H A 0029 LYS NZ
E A 0041 GLU OE2 11.19 H A 0029 LYS NZ
E A 0041 GLU OE1 7.448 H A 0034 HIS ND1
E A 0041 GLU OE1 8.095 H A 0034 HIS NE2
E A 0041 GLU OE2 9.212 H A 0034 HIS ND1
E A 0041 GLU OE2 10.10 H A 0034 HIS NE2
E A 0041 GLU OE1 8.076 C A 0035 HIS ND1
E A 0041 GLU OE1 9.245 C A 0035 HIS NE2
E A 0041 GLU OE2 8.220 C A 0035 HIS ND1
E A 0041 GLU OE2 9.797 C A 0035 HIS NE2
E A 0041 GLU OE1 10.47 E A 0040 LYS NZ
E A 0041 GLU OE2 10.57 E A 0040 LYS NZ
E A 0041 GLU OE1 11.50 C A 0077 LYS NZ
C A 0042 ASP OD1 7.374 H A 0034 HIS ND1
C A 0042 ASP OD1 9.440 H A 0034 HIS NE2
C A 0042 ASP OD2 7.550 H A 0034 HIS ND1
C A 0042 ASP OD2 9.536 H A 0034 HIS NE2
C A 0042 ASP OD1 6.542 C A 0035 HIS ND1
C A 0042 ASP OD1 7.431 C A 0035 HIS NE2
C A 0042 ASP OD2 7.949 C A 0035 HIS ND1
C A 0042 ASP OD2 8.344 C A 0035 HIS NE2
C A 0042 ASP OD1 6.172 E A 0040 LYS NZ
C A 0042 ASP OD2 6.352 E A 0040 LYS NZ
C A 0042 ASP OD2 11.53 C A 0045 LYS NZ
C A 0042 ASP OD1 11.21 C A 0052 HIS ND1
C A 0042 ASP OD1 9.552 C A 0052 HIS NE2
C A 0042 ASP OD2 10.86 C A 0052 HIS ND1
C A 0042 ASP OD2 9.492 C A 0052 HIS NE2
C A 0053 ASP OD1 4.514 C A 0013 LYS NZ
C A 0053 ASP OD2 4.179 C A 0013 LYS NZ
C A 0053 ASP OD1 11.59 C A 0015 LYS NZ
C A 0053 ASP OD1 7.864 C A 0045 LYS NZ
C A 0053 ASP OD2 7.388 C A 0045 LYS NZ
C A 0053 ASP OD1 9.249 C A 0052 HIS ND1
C A 0053 ASP OD1 10.71 C A 0052 HIS NE2
C A 0053 ASP OD2 10.10 C A 0052 HIS ND1
C A 0053 ASP OD2 11.41 C A 0052 HIS NE2
C A 0053 ASP OD1 9.386 C A 0063 LYS NZ
C A 0053 ASP OD2 8.919 C A 0063 LYS NZ
C A 0056 ASP OD1 10.66 C A 0015 LYS NZ
C A 0056 ASP OD1 7.313 C A 0057 LYS NZ
C A 0056 ASP OD2 9.273 C A 0057 LYS NZ
C A 0056 ASP OD1 5.312 C A 0058 LYS NZ
C A 0056 ASP OD2 4.775 C A 0058 LYS NZ
C A 0056 ASP OD1 10.55 C A 0063 LYS NZ
C A 0056 ASP OD2 8.709 C A 0063 LYS NZ
C A 0059 ASP OD2 11.61 C A 0035 HIS NE2
C A 0059 ASP OD1 8.064 C A 0052 HIS ND1
C A 0059 ASP OD1 9.846 C A 0052 HIS NE2
C A 0059 ASP OD2 6.056 C A 0052 HIS ND1
C A 0059 ASP OD2 7.967 C A 0052 HIS NE2
C A 0059 ASP OD1 6.599 C A 0058 LYS NZ
C A 0059 ASP OD2 8.162 C A 0058 LYS NZ
C A 0059 ASP OD1 9.688 C A 0060 LYS NZ
C A 0059 ASP OD2 9.727 C A 0060 LYS NZ
C A 0059 ASP OD1 7.030 C A 0063 LYS NZ
C A 0059 ASP OD2 6.863 C A 0063 LYS NZ
C A 0059 ASP OD1 7.195 H A 0067 HIS ND1
C A 0059 ASP OD1 7.551 H A 0067 HIS NE2
C A 0059 ASP OD2 6.433 H A 0067 HIS ND1
C A 0059 ASP OD2 6.686 H A 0067 HIS NE2
C A 0059 ASP OD1 11.82 H A 0070 HIS ND1
C A 0059 ASP OD2 10.29 H A 0070 HIS ND1
H A 0071 ASP OD1 9.695 C A 0052 HIS ND1
H A 0071 ASP OD1 10.66 C A 0052 HIS NE2
H A 0071 ASP OD2 10.22 C A 0052 HIS ND1
H A 0071 ASP OD2 11.05 C A 0052 HIS NE2
H A 0071 ASP OD1 4.991 C A 0060 LYS NZ
H A 0071 ASP OD2 2.957 C A 0060 LYS NZ
H A 0071 ASP OD1 3.190 H A 0067 HIS ND1
H A 0071 ASP OD1 4.962 H A 0067 HIS NE2
H A 0071 ASP OD2 2.387 H A 0067 HIS ND1
H A 0071 ASP OD2 3.996 H A 0067 HIS NE2
H A 0071 ASP OD1 5.558 H A 0070 HIS ND1
H A 0071 ASP OD1 7.563 H A 0070 HIS NE2
H A 0071 ASP OD2 7.702 H A 0070 HIS ND1
H A 0071 ASP OD2 9.715 H A 0070 HIS NE2
H A 0071 ASP OD1 8.893 C A 0072 LYS NZ
H A 0071 ASP OD2 8.847 C A 0072 LYS NZ
H A 0071 ASP OD1 11.84 C A 0106 HIS NE2
H A 0085 GLU OE1 8.625 C A 0072 LYS NZ
H A 0085 GLU OE2 7.564 C A 0072 LYS NZ
H A 0085 GLU OE1 8.271 C A 0077 LYS NZ
H A 0085 GLU OE2 10.17 C A 0077 LYS NZ
H A 0085 GLU OE1 11.70 H A 0094 LYS NZ
H A 0085 GLU OE2 9.667 H A 0094 LYS NZ
H A 0090 ASP OD2 11.82 H A 0083 HIS ND1
H A 0090 ASP OD1 5.481 H A 0093 LYS NZ
H A 0090 ASP OD2 3.338 H A 0093 LYS NZ
H A 0090 ASP OD1 9.198 H A 0094 LYS NZ
H A 0090 ASP OD2 10.27 H A 0094 LYS NZ
H A 0090 ASP OD1 8.934 H A 0095 LYS NZ
H A 0090 ASP OD2 9.817 H A 0095 LYS NZ
H A 0090 ASP OD2 11.40 C A 0104 LYS NZ
H A 0096 GLU OE1 11.26 H A 0025 HIS NE2
H A 0096 GLU OE2 10.81 H A 0025 HIS ND1
H A 0096 GLU OE2 9.486 H A 0025 HIS NE2
H A 0096 GLU OE1 8.718 H A 0083 HIS ND1
H A 0096 GLU OE1 9.186 H A 0083 HIS NE2
H A 0096 GLU OE2 7.328 H A 0083 HIS ND1
H A 0096 GLU OE2 7.489 H A 0083 HIS NE2
H A 0096 GLU OE1 6.561 H A 0093 LYS NZ
H A 0096 GLU OE2 5.927 H A 0093 LYS NZ
H A 0096 GLU OE1 6.293 H A 0095 LYS NZ
H A 0096 GLU OE2 8.285 H A 0095 LYS NZ
H A 0096 GLU OE1 5.829 C A 0104 LYS NZ
H A 0096 GLU OE2 6.507 C A 0104 LYS NZ
CHARGE_REPU 2.00 12.00 131
C A 0012 ASP OD1 8.038 C A 0053 ASP OD1
C A 0012 ASP OD1 8.777 C A 0053 ASP OD2
C A 0012 ASP OD2 9.842 C A 0053 ASP OD1
C A 0012 ASP OD2 10.67 C A 0053 ASP OD2
C A 0013 LYS NZ 3.834 C A 0045 LYS NZ
C A 0013 LYS NZ 11.50 C A 0052 HIS ND1
C A 0015 LYS NZ 6.230 C A 0057 LYS NZ
H A 0022 HIS ND1 6.603 H A 0025 HIS ND1
H A 0022 HIS ND1 8.358 H A 0025 HIS NE2
H A 0022 HIS NE2 6.840 H A 0025 HIS ND1
H A 0022 HIS NE2 8.265 H A 0025 HIS NE2
H A 0022 HIS ND1 9.753 C A 0026 LYS NZ
H A 0022 HIS NE2 10.81 C A 0026 LYS NZ
H A 0022 HIS ND1 8.712 H A 0034 HIS ND1
H A 0022 HIS ND1 6.546 H A 0034 HIS NE2
H A 0022 HIS NE2 6.576 H A 0034 HIS ND1
H A 0022 HIS NE2 4.381 H A 0034 HIS NE2
H A 0022 HIS ND1 11.99 C A 0045 LYS NZ
H A 0022 HIS NE2 11.50 C A 0045 LYS NZ
H A 0025 HIS ND1 9.824 C A 0026 LYS NZ
H A 0025 HIS NE2 11.81 C A 0026 LYS NZ
H A 0025 HIS ND1 11.47 H A 0034 HIS ND1
H A 0025 HIS ND1 9.647 H A 0034 HIS NE2
H A 0025 HIS NE2 11.86 H A 0034 HIS ND1
H A 0025 HIS NE2 10.32 H A 0034 HIS NE2
H A 0025 HIS NE2 11.00 C A 0077 LYS NZ
H A 0025 HIS ND1 8.757 H A 0083 HIS ND1
H A 0025 HIS ND1 6.667 H A 0083 HIS NE2
H A 0025 HIS NE2 6.635 H A 0083 HIS ND1
H A 0025 HIS NE2 4.493 H A 0083 HIS NE2
H A 0025 HIS ND1 11.18 C A 0104 LYS NZ
H A 0025 HIS NE2 10.81 C A 0104 LYS NZ
H A 0029 LYS NZ 6.732 C A 0077 LYS NZ
H A 0032 ASP OD1 9.104 E A 0041 GLU OE1
H A 0032 ASP OD1 9.569 E A 0041 GLU OE2
H A 0032 ASP OD2 9.215 E A 0041 GLU OE1
H A 0032 ASP OD2 9.732 E A 0041 GLU OE2
H A 0032 ASP OD1 10.22 H A 0085 GLU OE1
H A 0032 ASP OD2 10.25 H A 0085 GLU OE1
H A 0034 HIS ND1 7.605 C A 0035 HIS ND1
H A 0034 HIS ND1 6.990 C A 0035 HIS NE2
H A 0034 HIS NE2 9.516 C A 0035 HIS ND1
H A 0034 HIS NE2 8.802 C A 0035 HIS NE2
H A 0034 HIS ND1 10.80 E A 0040 LYS NZ
H A 0034 HIS ND1 10.53 C A 0045 LYS NZ
H A 0034 HIS NE2 10.65 C A 0045 LYS NZ
H A 0034 HIS ND1 10.25 C A 0052 HIS ND1
H A 0034 HIS ND1 8.455 C A 0052 HIS NE2
H A 0034 HIS NE2 11.69 C A 0052 HIS ND1
H A 0034 HIS NE2 10.02 C A 0052 HIS NE2
C A 0035 HIS ND1 8.516 C A 0052 HIS ND1
C A 0035 HIS ND1 6.426 C A 0052 HIS NE2
C A 0035 HIS NE2 6.558 C A 0052 HIS ND1
C A 0035 HIS NE2 4.398 C A 0052 HIS NE2
C A 0035 HIS ND1 11.09 H A 0067 HIS NE2
C A 0035 HIS NE2 11.46 H A 0067 HIS ND1
C A 0035 HIS NE2 9.627 H A 0067 HIS NE2
C A 0035 HIS ND1 8.111 C A 0075 LYS NZ
C A 0035 HIS NE2 9.140 C A 0075 LYS NZ
E A 0041 GLU OE1 8.762 C A 0042 ASP OD1
E A 0041 GLU OE1 10.41 C A 0042 ASP OD2
E A 0041 GLU OE2 9.017 C A 0042 ASP OD1
E A 0041 GLU OE2 10.92 C A 0042 ASP OD2
C A 0052 HIS ND1 8.947 C A 0063 LYS NZ
C A 0052 HIS NE2 10.53 C A 0063 LYS NZ
C A 0052 HIS ND1 8.115 H A 0067 HIS ND1
C A 0052 HIS ND1 7.299 H A 0067 HIS NE2
C A 0052 HIS NE2 9.071 H A 0067 HIS ND1
C A 0052 HIS NE2 7.823 H A 0067 HIS NE2
C A 0052 HIS ND1 9.937 H A 0070 HIS ND1
C A 0052 HIS ND1 11.51 H A 0070 HIS NE2
C A 0052 HIS NE2 11.10 H A 0070 HIS ND1
C A 0052 HIS NE2 11.82 C A 0075 LYS NZ
C A 0053 ASP OD1 11.64 C A 0056 ASP OD2
C A 0053 ASP OD1 10.79 C A 0059 ASP OD2
C A 0053 ASP OD2 11.67 C A 0059 ASP OD2
C A 0056 ASP OD1 8.237 C A 0059 ASP OD1
C A 0056 ASP OD1 8.633 C A 0059 ASP OD2
C A 0056 ASP OD2 7.033 C A 0059 ASP OD1
C A 0056 ASP OD2 7.662 C A 0059 ASP OD2
C A 0057 LYS NZ 11.73 C A 0058 LYS NZ
C A 0057 LYS NZ 9.901 H A 0070 HIS ND1
C A 0057 LYS NZ 9.995 H A 0070 HIS NE2
C A 0057 LYS NZ 11.09 C A 0106 HIS NE2
C A 0058 LYS NZ 11.84 C A 0060 LYS NZ
C A 0058 LYS NZ 11.05 C A 0063 LYS NZ
C A 0058 LYS NZ 11.14 H A 0067 HIS ND1
C A 0059 ASP OD1 9.546 H A 0071 ASP OD1
C A 0059 ASP OD1 9.209 H A 0071 ASP OD2
C A 0059 ASP OD2 8.606 H A 0071 ASP OD1
C A 0059 ASP OD2 8.619 H A 0071 ASP OD2
C A 0060 LYS NZ 4.242 H A 0067 HIS ND1
C A 0060 LYS NZ 5.301 H A 0067 HIS NE2
C A 0060 LYS NZ 10.48 H A 0070 HIS ND1
C A 0060 LYS NZ 9.469 C A 0072 LYS NZ
H A 0067 HIS ND1 7.842 H A 0070 HIS ND1
H A 0067 HIS ND1 10.01 H A 0070 HIS NE2
H A 0067 HIS NE2 9.241 H A 0070 HIS ND1
H A 0067 HIS NE2 11.35 H A 0070 HIS NE2
H A 0067 HIS ND1 10.99 C A 0072 LYS NZ
H A 0067 HIS NE2 11.69 C A 0072 LYS NZ
H A 0067 HIS NE2 10.87 C A 0075 LYS NZ
H A 0070 HIS ND1 11.58 C A 0072 LYS NZ
H A 0070 HIS ND1 10.22 H A 0083 HIS ND1
H A 0070 HIS ND1 11.37 H A 0083 HIS NE2
H A 0070 HIS NE2 9.197 H A 0083 HIS ND1
H A 0070 HIS NE2 10.51 H A 0083 HIS NE2
H A 0070 HIS ND1 8.582 C A 0106 HIS ND1
H A 0070 HIS ND1 6.554 C A 0106 HIS NE2
H A 0070 HIS NE2 6.418 C A 0106 HIS ND1
H A 0070 HIS NE2 4.352 C A 0106 HIS NE2
C A 0072 LYS NZ 11.76 H A 0083 HIS ND1
C A 0072 LYS NZ 8.643 H A 0094 LYS NZ
C A 0077 LYS NZ 11.20 H A 0083 HIS NE2
H A 0083 HIS ND1 11.91 H A 0093 LYS NZ
H A 0083 HIS NE2 11.81 H A 0093 LYS NZ
H A 0083 HIS ND1 10.59 C A 0104 LYS NZ
H A 0083 HIS NE2 10.48 C A 0104 LYS NZ
H A 0083 HIS ND1 9.582 C A 0106 HIS ND1
H A 0083 HIS ND1 9.078 C A 0106 HIS NE2
H A 0083 HIS NE2 10.78 C A 0106 HIS ND1
H A 0083 HIS NE2 10.49 C A 0106 HIS NE2
H A 0090 ASP OD1 6.441 H A 0096 GLU OE1
H A 0090 ASP OD1 7.099 H A 0096 GLU OE2
H A 0090 ASP OD2 5.848 H A 0096 GLU OE1
H A 0090 ASP OD2 6.007 H A 0096 GLU OE2
H A 0093 LYS NZ 11.89 H A 0095 LYS NZ
H A 0093 LYS NZ 11.25 C A 0104 LYS NZ
H A 0095 LYS NZ 7.852 C A 0104 LYS NZ
C A 0101 LYS NZ 10.62 C A 0106 HIS ND1
C A 0101 LYS NZ 10.36 C A 0106 HIS NE2
HB_MM 2.00 3.20 175
C A 0002 PRO N 2.225 C A 0001 ALA O
C A 0003 LYS N 2.195 C A 0002 PRO O
C A 0004 ALA N 2.192 C A 0003 LYS O
C A 0005 PRO N 3.171 C A 0003 LYS O
C A 0005 PRO N 2.226 C A 0004 ALA O
C A 0006 ALA N 2.196 C A 0005 PRO O
C A 0007 ASP N 2.194 C A 0006 ALA O
C A 0008 GLY N 2.190 C A 0007 ASP O
E A 0009 LEU N 2.195 C A 0008 GLY O
E A 0009 LEU N 2.788 E A 0020 PHE O
E A 0010 LYS N 3.132 C A 0008 GLY O
E A 0010 LYS N 2.184 E A 0009 LEU O
E A 0011 MET N 2.197 E A 0010 LYS O
E A 0011 MET N 2.399 E A 0018 VAL O
C A 0012 ASP N 3.186 E A 0010 LYS O
C A 0012 ASP N 2.190 E A 0011 MET O
C A 0013 LYS N 2.190 C A 0012 ASP O
C A 0014 THR N 2.883 C A 0012 ASP O
C A 0014 THR N 2.196 C A 0013 LYS O
C A 0015 LYS N 2.199 C A 0014 THR O
C A 0016 GLN N 2.198 C A 0015 LYS O
C A 0017 PRO N 2.224 C A 0016 GLN O
E A 0018 VAL N 2.707 E A 0011 MET O
E A 0018 VAL N 2.201 C A 0017 PRO O
E A 0019 VAL N 2.192 E A 0018 VAL O
E A 0020 PHE N 2.306 E A 0009 LEU O
E A 0020 PHE N 2.198 E A 0019 VAL O
H A 0021 ASN N 2.192 E A 0020 PHE O
H A 0022 HIS N 2.195 H A 0021 ASN O
H A 0023 SER N 2.815 H A 0021 ASN O
H A 0023 SER N 2.199 H A 0022 HIS O
H A 0024 THR N 2.746 H A 0021 ASN O
H A 0024 THR N 2.989 H A 0022 HIS O
H A 0024 THR N 2.197 H A 0023 SER O
H A 0025 HIS N 2.453 H A 0022 HIS O
H A 0025 HIS N 3.109 H A 0023 SER O
H A 0025 HIS N 2.197 H A 0024 THR O
C A 0026 LYS N 2.435 H A 0022 HIS O
C A 0026 LYS N 2.193 H A 0025 HIS O
C A 0027 ALA N 2.759 H A 0025 HIS O
C A 0027 ALA N 2.200 C A 0026 LYS O
C A 0028 VAL N 2.432 H A 0025 HIS O
C A 0028 VAL N 2.197 C A 0027 ALA O
H A 0029 LYS N 2.189 C A 0028 VAL O
H A 0030 CYS N 2.187 H A 0029 LYS O
H A 0031 GLY N 2.548 H A 0029 LYS O
H A 0031 GLY N 2.199 H A 0030 CYS O
H A 0032 ASP N 2.351 H A 0029 LYS O
H A 0032 ASP N 2.188 H A 0031 GLY O
H A 0033 CYS N 2.199 H A 0032 ASP O
H A 0034 HIS N 3.041 H A 0030 CYS O
H A 0034 HIS N 2.202 H A 0033 CYS O
C A 0035 HIS N 2.994 H A 0031 GLY O
C A 0035 HIS N 2.985 H A 0033 CYS O
C A 0035 HIS N 2.201 H A 0034 HIS O
E A 0036 PRO N 2.228 C A 0035 HIS O
E A 0037 VAL N 3.087 C A 0035 HIS O
E A 0037 VAL N 2.199 E A 0036 PRO O
E A 0037 VAL N 2.782 E A 0040 LYS O
C A 0038 ASN N 2.188 E A 0037 VAL O
C A 0039 GLY N 2.583 E A 0037 VAL O
C A 0039 GLY N 2.195 C A 0038 ASN O
E A 0040 LYS N 2.373 E A 0037 VAL O
E A 0040 LYS N 2.200 C A 0039 GLY O
E A 0041 GLU N 2.198 E A 0040 LYS O
C A 0042 ASP N 2.951 E A 0040 LYS O
C A 0042 ASP N 2.190 E A 0041 GLU O
C A 0043 TYR N 2.767 E A 0041 GLU O
C A 0043 TYR N 2.193 C A 0042 ASP O
C A 0044 GLN N 2.762 C A 0042 ASP O
C A 0044 GLN N 2.197 C A 0043 TYR O
C A 0045 LYS N 2.195 C A 0044 GLN O
C A 0046 CYS N 3.175 C A 0044 GLN O
C A 0046 CYS N 2.196 C A 0045 LYS O
C A 0047 ALA N 3.172 C A 0045 LYS O
C A 0047 ALA N 2.192 C A 0046 CYS O
C A 0048 THR N 3.080 C A 0045 LYS O
C A 0048 THR N 3.050 C A 0046 CYS O
C A 0048 THR N 2.192 C A 0047 ALA O
C A 0049 ALA N 2.195 C A 0048 THR O
C A 0050 GLY N 2.413 C A 0048 THR O
C A 0050 GLY N 2.193 C A 0049 ALA O
C A 0051 CYS N 3.046 C A 0048 THR O
C A 0051 CYS N 2.197 C A 0050 GLY O
C A 0052 HIS N 2.193 C A 0051 CYS O
C A 0053 ASP N 2.199 C A 0052 HIS O
C A 0054 ASN N 3.157 C A 0052 HIS O
C A 0054 ASN N 2.192 C A 0053 ASP O
C A 0055 MET N 2.194 C A 0054 ASN O
C A 0056 ASP N 3.077 C A 0054 ASN O
C A 0056 ASP N 2.193 C A 0055 MET O
C A 0057 LYS N 2.199 C A 0056 ASP O
C A 0058 LYS N 2.523 C A 0056 ASP O
C A 0058 LYS N 2.198 C A 0057 LYS O
C A 0059 ASP N 2.196 C A 0058 LYS O
C A 0060 LYS N 2.667 C A 0058 LYS O
C A 0060 LYS N 2.197 C A 0059 ASP O
C A 0061 SER N 3.061 C A 0059 ASP O
C A 0061 SER N 2.197 C A 0060 LYS O
C A 0062 ALA N 2.196 C A 0061 SER O
C A 0063 LYS N 2.195 C A 0062 ALA O
H A 0064 GLY N 2.191 C A 0063 LYS O
H A 0065 TYR N 2.865 C A 0052 HIS O
H A 0065 TYR N 2.197 H A 0064 GLY O
H A 0066 TYR N 2.199 H A 0065 TYR O
H A 0067 HIS N 2.194 H A 0066 TYR O
H A 0068 ALA N 2.193 H A 0067 HIS O
H A 0069 MET N 2.970 H A 0065 TYR O
H A 0069 MET N 2.668 H A 0066 TYR O
H A 0069 MET N 2.576 H A 0067 HIS O
H A 0069 MET N 2.190 H A 0068 ALA O
H A 0070 HIS N 2.540 H A 0066 TYR O
H A 0070 HIS N 2.806 H A 0067 HIS O
H A 0070 HIS N 2.189 H A 0069 MET O
H A 0071 ASP N 2.555 H A 0067 HIS O
H A 0071 ASP N 2.193 H A 0070 HIS O
C A 0072 LYS N 2.198 H A 0071 ASP O
C A 0073 GLY N 2.195 C A 0072 LYS O
C A 0074 THR N 2.419 C A 0072 LYS O
C A 0074 THR N 2.197 C A 0073 GLY O
C A 0075 LYS N 2.199 C A 0074 THR O
C A 0076 PHE N 2.490 C A 0074 THR O
C A 0076 PHE N 2.199 C A 0075 LYS O
C A 0077 LYS N 2.195 C A 0076 PHE O
H A 0078 SER N 2.963 C A 0076 PHE O
H A 0078 SER N 2.192 C A 0077 LYS O
H A 0079 CYS N 2.202 H A 0078 SER O
H A 0080 VAL N 2.704 H A 0069 MET O
H A 0080 VAL N 2.195 H A 0079 CYS O
H A 0081 GLY N 2.201 H A 0080 VAL O
H A 0082 CYS N 2.631 H A 0078 SER O
H A 0082 CYS N 2.197 H A 0081 GLY O
H A 0083 HIS N 2.907 H A 0079 CYS O
H A 0083 HIS N 3.133 H A 0080 VAL O
H A 0083 HIS N 2.201 H A 0082 CYS O
H A 0084 LEU N 2.783 H A 0080 VAL O
H A 0084 LEU N 2.196 H A 0083 HIS O
H A 0085 GLU N 2.743 H A 0083 HIS O
H A 0085 GLU N 2.199 H A 0084 LEU O
H A 0086 THR N 2.684 H A 0082 CYS O
H A 0086 THR N 2.898 H A 0083 HIS O
H A 0086 THR N 2.197 H A 0085 GLU O
H A 0087 ALA N 2.929 H A 0083 HIS O
H A 0087 ALA N 2.895 H A 0085 GLU O
H A 0087 ALA N 2.198 H A 0086 THR O
C A 0088 GLY N 3.122 H A 0085 GLU O
C A 0088 GLY N 2.195 H A 0087 ALA O
C A 0089 ALA N 2.198 C A 0088 GLY O
H A 0090 ASP N 2.978 C A 0088 GLY O
H A 0090 ASP N 2.192 C A 0089 ALA O
H A 0091 ALA N 2.197 H A 0090 ASP O
H A 0092 ALA N 2.433 H A 0090 ASP O
H A 0092 ALA N 2.194 H A 0091 ALA O
H A 0093 LYS N 2.422 H A 0090 ASP O
H A 0093 LYS N 2.197 H A 0092 ALA O
H A 0094 LYS N 2.558 H A 0090 ASP O
H A 0094 LYS N 2.196 H A 0093 LYS O
H A 0095 LYS N 3.064 H A 0091 ALA O
H A 0095 LYS N 2.197 H A 0094 LYS O
H A 0096 GLU N 2.199 H A 0095 LYS O
H A 0097 LEU N 2.689 H A 0093 LYS O
H A 0097 LEU N 2.194 H A 0096 GLU O
C A 0098 THR N 2.188 H A 0097 LEU O
C A 0099 GLY N 2.767 H A 0094 LYS O
C A 0099 GLY N 2.191 C A 0098 THR O
C A 0100 CYS N 2.951 C A 0098 THR O
C A 0100 CYS N 2.187 C A 0099 GLY O
C A 0101 LYS N 2.178 C A 0100 CYS O
C A 0102 GLY N 2.188 C A 0101 LYS O
C A 0103 SER N 2.195 C A 0102 GLY O
C A 0104 LYS N 2.907 H A 0096 GLU O
C A 0104 LYS N 2.200 C A 0103 SER O
C A 0105 CYS N 2.198 C A 0104 LYS O
C A 0106 HIS N 2.193 C A 0105 CYS O
C A 0107 SER N 2.195 C A 0106 HIS O
HB_MS 2.00 3.20 21
H A 0021 ASN O 2.763 H A 0024 THR OG1
H A 0021 ASN O 2.554 H A 0025 HIS ND1
H A 0023 SER N 2.439 C A 0007 ASP OD1
H A 0024 THR N 3.105 H A 0023 SER OG
C A 0042 ASP O 2.638 H A 0034 HIS ND1
C A 0045 LYS O 2.762 C A 0048 THR OG1
H A 0064 GLY N 2.468 C A 0059 ASP OD2
H A 0065 TYR N 3.004 C A 0054 ASN OD1
H A 0066 TYR O 2.703 H A 0070 HIS ND1
H A 0071 ASP O 2.259 H A 0078 SER OG
C A 0072 LYS O 2.843 C A 0074 THR OG1
C A 0076 PHE O 2.387 C A 0074 THR OG1
H A 0082 CYS O 2.635 H A 0086 THR OG1
H A 0092 ALA N 2.872 H A 0090 ASP OD1
H A 0093 LYS N 3.139 H A 0090 ASP OD1
H A 0094 LYS O 2.294 C A 0098 THR OG1
H A 0096 GLU O 3.183 C A 0103 SER OG
H A 0097 LEU O 2.367 H A 0083 HIS ND1
C A 0099 GLY O 2.334 C A 0103 SER OG
C A 0104 LYS N 2.621 C A 0103 SER OG
C A 0105 CYS N 2.968 C A 0103 SER OG
HB_SS 2.00 3.20 1
E A 0041 GLU OE1 2.935 C A 0043 TYR OH
AROMATIC 0.00 8.00 4
E A 0020 PHE 4.660 H A 0022 HIS
E A 0040 LYS 7.592 C A 0043 TYR
C A 0035 HIS 3.847 C A 0076 PHE
C A 0060 LYS 5.212 H A 0067 HIS