Complet list of 1aca con file
Complete list of 1aca.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 570
C A 0001 SER C 2.480 C A 0002 GLN CA
C A 0001 SER C 3.489 C A 0002 GLN C
C A 0001 SER C 3.532 C A 0002 GLN CB
C A 0002 GLN C 2.436 H A 0003 ALA CA
C A 0002 GLN C 3.015 H A 0003 ALA C
C A 0002 GLN C 3.659 H A 0003 ALA CB
C A 0002 GLN CG 3.764 H A 0003 ALA CA
C A 0002 GLN CG 3.613 H A 0003 ALA C
C A 0002 GLN CD 3.743 H A 0003 ALA C
H A 0003 ALA C 2.460 H A 0004 GLU CA
H A 0003 ALA C 2.859 H A 0004 GLU C
H A 0003 ALA C 3.696 H A 0004 GLU CB
H A 0003 ALA C 3.723 H A 0006 ASP CB
H A 0003 ALA CB 3.376 H A 0006 ASP CB
H A 0003 ALA CA 3.791 H A 0070 MET CE
H A 0003 ALA CB 3.578 H A 0070 MET CE
H A 0004 GLU CA 3.770 H A 0005 PHE CA
H A 0004 GLU C 2.446 H A 0005 PHE CA
H A 0004 GLU C 2.932 H A 0005 PHE C
H A 0004 GLU C 3.596 H A 0005 PHE CB
H A 0004 GLU CA 3.719 H A 0007 LYS CB
H A 0004 GLU C 3.470 H A 0007 LYS CB
H A 0004 GLU CD 3.714 H A 0007 LYS CE
H A 0005 PHE CA 3.784 H A 0006 ASP CA
H A 0005 PHE C 2.434 H A 0006 ASP CA
H A 0005 PHE C 2.987 H A 0006 ASP C
H A 0005 PHE C 3.583 H A 0006 ASP CB
H A 0005 PHE CD1 3.306 H A 0006 ASP CA
H A 0005 PHE CD1 3.504 H A 0006 ASP CB
H A 0005 PHE CD1 3.475 H A 0006 ASP CG
H A 0005 PHE CE1 3.762 H A 0006 ASP CA
H A 0005 PHE CE1 3.350 H A 0006 ASP CG
H A 0005 PHE CE2 3.585 H A 0031 TYR CA
H A 0005 PHE CZ 3.501 H A 0031 TYR CA
H A 0005 PHE CZ 3.747 H A 0031 TYR C
H A 0005 PHE CZ 3.497 H A 0031 TYR CD1
H A 0005 PHE CE1 3.575 H A 0034 ALA CB
H A 0005 PHE CE2 3.146 H A 0034 ALA CB
H A 0005 PHE CZ 2.969 H A 0034 ALA CB
H A 0005 PHE CE1 3.299 H A 0035 THR CG2
H A 0005 PHE CZ 3.512 H A 0035 THR CG2
H A 0005 PHE CB 3.684 H A 0070 MET CB
H A 0005 PHE CB 3.388 H A 0070 MET CG
H A 0005 PHE CG 3.283 H A 0070 MET CG
H A 0005 PHE CD2 3.454 H A 0070 MET CA
H A 0005 PHE CD2 3.691 H A 0070 MET CB
H A 0005 PHE CD2 3.432 H A 0070 MET CG
H A 0005 PHE CD2 3.457 H A 0073 TYR CB
H A 0005 PHE CD2 3.381 H A 0073 TYR CG
H A 0005 PHE CD2 2.910 H A 0073 TYR CD2
H A 0005 PHE CD2 3.784 H A 0073 TYR CE2
H A 0005 PHE CE2 3.340 H A 0073 TYR CB
H A 0005 PHE CE2 3.128 H A 0073 TYR CG
H A 0005 PHE CE2 3.026 H A 0073 TYR CD2
H A 0005 PHE CE2 3.747 H A 0073 TYR CE2
H A 0005 PHE CA 3.486 H A 0074 ILE CG1
H A 0005 PHE CB 3.337 H A 0074 ILE CG1
H A 0005 PHE CB 3.663 H A 0074 ILE CD1
H A 0006 ASP C 2.437 H A 0007 LYS CA
H A 0006 ASP C 3.032 H A 0007 LYS C
H A 0006 ASP C 3.619 H A 0007 LYS CB
H A 0006 ASP CA 3.737 H A 0009 ALA CB
H A 0006 ASP C 3.630 H A 0009 ALA CB
H A 0007 LYS C 2.462 H A 0008 ALA CA
H A 0007 LYS C 2.901 H A 0008 ALA C
H A 0007 LYS C 3.723 H A 0008 ALA CB
H A 0008 ALA C 2.484 H A 0009 ALA CA
H A 0008 ALA C 3.066 H A 0009 ALA C
H A 0008 ALA C 3.645 H A 0009 ALA CB
H A 0008 ALA CB 3.724 H A 0073 TYR CE2
H A 0008 ALA CA 3.768 H A 0077 VAL CG1
H A 0008 ALA C 3.679 H A 0077 VAL CG1
H A 0008 ALA CB 3.520 H A 0077 VAL CB
H A 0008 ALA CB 3.620 H A 0077 VAL CG1
H A 0008 ALA CB 3.604 H A 0077 VAL CG2
H A 0009 ALA C 2.436 H A 0010 GLU CA
H A 0009 ALA C 3.157 H A 0010 GLU C
H A 0009 ALA C 3.542 H A 0010 GLU CB
H A 0009 ALA C 3.729 H A 0010 GLU CG
H A 0009 ALA CB 3.527 H A 0031 TYR CD1
H A 0009 ALA CB 3.129 H A 0031 TYR CE1
H A 0010 GLU CA 3.777 H A 0011 GLU CA
H A 0010 GLU C 2.406 H A 0011 GLU CA
H A 0010 GLU C 2.902 H A 0011 GLU C
H A 0010 GLU C 3.549 H A 0011 GLU CB
H A 0010 GLU CA 3.725 H A 0013 LYS CE
H A 0010 GLU CD 3.402 H A 0013 LYS CE
H A 0011 GLU C 2.454 H A 0012 VAL CA
H A 0011 GLU C 3.032 H A 0012 VAL C
H A 0011 GLU C 3.651 H A 0012 VAL CB
H A 0011 GLU CD 3.559 C A 0086 ILE CG1
H A 0011 GLU CD 3.447 C A 0086 ILE CD1
H A 0012 VAL C 2.472 H A 0013 LYS CA
H A 0012 VAL C 3.311 H A 0013 LYS C
H A 0012 VAL C 3.648 H A 0013 LYS CB
H A 0012 VAL CA 3.541 H A 0015 LEU CG
H A 0012 VAL CA 3.535 H A 0015 LEU CD1
H A 0012 VAL C 3.585 H A 0015 LEU CG
H A 0012 VAL C 3.569 H A 0015 LEU CD1
H A 0012 VAL CB 3.650 H A 0077 VAL CG1
H A 0012 VAL CB 3.787 H A 0077 VAL CG2
H A 0012 VAL CG2 3.717 H A 0077 VAL CG2
H A 0012 VAL CG2 3.599 H A 0080 LEU CG
H A 0012 VAL CG2 3.669 H A 0080 LEU CD2
H A 0013 LYS C 2.433 H A 0014 HIS CA
H A 0013 LYS C 3.222 H A 0014 HIS C
H A 0013 LYS C 3.662 H A 0014 HIS CB
H A 0014 HIS CA 3.798 H A 0015 LEU CA
H A 0014 HIS C 2.420 H A 0015 LEU CA
H A 0014 HIS C 2.761 H A 0015 LEU C
H A 0014 HIS C 3.613 H A 0015 LEU CB
H A 0014 HIS CB 3.723 C A 0086 ILE CD1
H A 0015 LEU C 2.418 C A 0016 LYS CA
H A 0015 LEU C 2.914 C A 0016 LYS C
H A 0015 LEU C 3.658 C A 0016 LYS CB
H A 0015 LEU C 3.781 C A 0016 LYS CD
H A 0015 LEU CD1 2.959 C A 0019 PRO CG
H A 0015 LEU CD1 3.650 C A 0019 PRO CD
H A 0015 LEU CD1 3.256 H A 0080 LEU CB
H A 0015 LEU CD1 3.533 H A 0080 LEU CG
H A 0015 LEU CD1 3.715 H A 0080 LEU CD1
H A 0015 LEU CD2 3.524 H A 0080 LEU C
H A 0015 LEU CD2 3.427 H A 0080 LEU CB
H A 0015 LEU CD2 3.079 C A 0086 ILE CG2
C A 0016 LYS C 2.422 C A 0017 THR CA
C A 0016 LYS C 3.053 C A 0017 THR CB
C A 0017 THR C 2.509 C A 0018 LYS CA
C A 0017 THR C 2.769 C A 0018 LYS C
C A 0017 THR C 3.694 C A 0018 LYS CB
C A 0017 THR C 3.631 C A 0019 PRO CD
C A 0017 THR CB 3.794 H A 0084 TYR CD1
C A 0017 THR CG2 3.415 H A 0084 TYR CD1
C A 0017 THR CG2 3.584 H A 0084 TYR CE1
C A 0018 LYS CA 2.919 C A 0019 PRO CD
C A 0018 LYS C 2.406 C A 0019 PRO CA
C A 0018 LYS C 2.987 C A 0019 PRO C
C A 0018 LYS C 3.576 C A 0019 PRO CB
C A 0018 LYS C 3.494 C A 0019 PRO CG
C A 0018 LYS C 2.497 C A 0019 PRO CD
C A 0019 PRO CA 3.765 H A 0020 ALA CA
C A 0019 PRO C 2.390 H A 0020 ALA CA
C A 0019 PRO C 2.977 H A 0020 ALA C
C A 0019 PRO C 3.660 H A 0020 ALA CB
C A 0019 PRO CB 3.051 H A 0080 LEU CD1
C A 0019 PRO CG 3.081 H A 0080 LEU CD1
C A 0019 PRO CA 3.492 H A 0084 TYR CE2
C A 0019 PRO CA 3.332 H A 0084 TYR CZ
C A 0019 PRO CB 3.750 H A 0084 TYR CD2
C A 0019 PRO CB 3.152 H A 0084 TYR CE2
C A 0019 PRO CB 3.572 H A 0084 TYR CZ
C A 0019 PRO CG 3.559 H A 0084 TYR CD2
C A 0019 PRO CG 3.539 H A 0084 TYR CE2
H A 0020 ALA C 2.434 H A 0021 ASP CA
H A 0020 ALA C 2.844 H A 0021 ASP C
H A 0020 ALA C 3.622 H A 0021 ASP CB
H A 0020 ALA C 3.627 H A 0024 MET CG
H A 0021 ASP C 2.472 H A 0022 GLU CA
H A 0021 ASP C 3.106 H A 0022 GLU C
H A 0021 ASP C 3.737 H A 0022 GLU CB
H A 0021 ASP CA 3.683 H A 0024 MET CB
H A 0021 ASP CA 3.538 H A 0024 MET CG
H A 0021 ASP C 3.695 H A 0024 MET CB
H A 0021 ASP CG 3.794 C A 0049 PHE CE2
H A 0022 GLU C 2.420 H A 0023 GLU CA
H A 0022 GLU C 3.089 H A 0023 GLU C
H A 0022 GLU C 3.613 H A 0023 GLU CB
H A 0022 GLU CA 3.723 H A 0025 LEU CB
H A 0022 GLU CA 3.407 H A 0025 LEU CD1
H A 0022 GLU C 3.485 H A 0025 LEU CB
H A 0023 GLU C 2.440 H A 0024 MET CA
H A 0023 GLU C 2.821 H A 0024 MET C
H A 0023 GLU C 3.693 H A 0024 MET CB
H A 0023 GLU CD 3.378 H A 0083 LYS CE
H A 0024 MET C 2.490 H A 0025 LEU CA
H A 0024 MET C 2.891 H A 0025 LEU C
H A 0024 MET C 3.605 H A 0025 LEU CB
H A 0025 LEU CA 3.790 H A 0026 PHE CA
H A 0025 LEU C 2.413 H A 0026 PHE CA
H A 0025 LEU C 3.008 H A 0026 PHE C
H A 0025 LEU C 3.686 H A 0026 PHE CB
H A 0025 LEU CG 3.459 H A 0053 ALA CB
H A 0025 LEU CD1 3.780 H A 0053 ALA CB
H A 0025 LEU CD2 3.352 H A 0053 ALA CA
H A 0025 LEU CD2 3.533 H A 0053 ALA C
H A 0025 LEU CD2 3.254 H A 0053 ALA CB
H A 0026 PHE CA 3.784 H A 0027 ILE CA
H A 0026 PHE C 2.403 H A 0027 ILE CA
H A 0026 PHE C 2.824 H A 0027 ILE C
H A 0026 PHE C 3.582 H A 0027 ILE CB
H A 0026 PHE CD1 3.508 H A 0030 HIS CD2
H A 0026 PHE CE1 3.764 H A 0030 HIS CB
H A 0026 PHE CE1 3.358 H A 0030 HIS CG
H A 0026 PHE CE1 3.045 H A 0030 HIS CD2
H A 0026 PHE CE2 3.426 H A 0030 HIS CD2
H A 0026 PHE CZ 3.543 H A 0030 HIS CG
H A 0026 PHE CZ 2.999 H A 0030 HIS CD2
H A 0026 PHE CZ 3.669 H A 0030 HIS CE1
H A 0026 PHE CZ 3.741 H A 0072 ALA CB
H A 0026 PHE CG 3.536 H A 0076 LYS CG
H A 0026 PHE CD1 3.312 H A 0076 LYS CB
H A 0026 PHE CD1 3.081 H A 0076 LYS CG
H A 0026 PHE CE1 3.263 H A 0076 LYS CB
H A 0026 PHE CE1 3.213 H A 0076 LYS CG
H A 0026 PHE CZ 3.752 H A 0076 LYS CG
H A 0027 ILE C 2.427 H A 0028 TYR CA
H A 0027 ILE C 2.956 H A 0028 TYR C
H A 0027 ILE C 3.624 H A 0028 TYR CB
H A 0027 ILE CG2 3.280 H A 0073 TYR CE1
H A 0027 ILE CD1 3.196 H A 0076 LYS C
H A 0027 ILE CD1 3.455 H A 0076 LYS CB
H A 0027 ILE CD1 3.512 H A 0077 VAL CA
H A 0027 ILE CG1 3.684 H A 0080 LEU CD2
H A 0027 ILE CD1 3.345 H A 0080 LEU CD2
H A 0028 TYR CA 3.796 H A 0029 SER CA
H A 0028 TYR C 2.421 H A 0029 SER CA
H A 0028 TYR C 2.912 H A 0029 SER C
H A 0028 TYR C 3.681 H A 0029 SER CB
H A 0028 TYR C 3.720 H A 0032 LYS CG
H A 0028 TYR CG 3.440 H A 0032 LYS CG
H A 0028 TYR CD1 3.121 H A 0032 LYS CG
H A 0028 TYR CD1 3.567 H A 0032 LYS CD
H A 0028 TYR CD2 3.617 H A 0032 LYS CG
H A 0028 TYR CE1 3.029 H A 0032 LYS CG
H A 0028 TYR CE1 3.042 H A 0032 LYS CD
H A 0028 TYR CE1 3.218 H A 0032 LYS CE
H A 0028 TYR CE2 3.532 H A 0032 LYS CG
H A 0028 TYR CZ 3.259 H A 0032 LYS CG
H A 0028 TYR CZ 3.457 H A 0032 LYS CD
H A 0028 TYR CZ 3.134 H A 0032 LYS CE
H A 0028 TYR CG 3.567 H A 0054 LYS CA
H A 0028 TYR CG 3.316 H A 0054 LYS CB
H A 0028 TYR CD1 3.451 H A 0054 LYS CB
H A 0028 TYR CD2 3.025 H A 0054 LYS CA
H A 0028 TYR CD2 3.091 H A 0054 LYS C
H A 0028 TYR CD2 3.107 H A 0054 LYS CB
H A 0028 TYR CE1 3.404 H A 0054 LYS CB
H A 0028 TYR CE2 3.307 H A 0054 LYS CA
H A 0028 TYR CE2 2.955 H A 0054 LYS C
H A 0028 TYR CE2 3.055 H A 0054 LYS CB
H A 0028 TYR CZ 3.219 H A 0054 LYS CB
H A 0028 TYR CD2 3.762 H A 0058 TRP CB
H A 0028 TYR CE2 3.534 H A 0058 TRP CB
H A 0028 TYR CE2 3.480 H A 0058 TRP CE3
H A 0028 TYR CZ 3.659 H A 0058 TRP CE3
H A 0029 SER C 2.404 H A 0030 HIS CA
H A 0029 SER C 3.011 H A 0030 HIS C
H A 0029 SER C 3.527 H A 0030 HIS CB
H A 0029 SER CB 3.099 H A 0057 ALA C
H A 0029 SER CB 3.481 H A 0057 ALA CB
H A 0029 SER CA 3.523 H A 0058 TRP CA
H A 0029 SER CA 3.778 H A 0058 TRP CB
H A 0029 SER CB 3.522 H A 0058 TRP CA
H A 0029 SER CA 3.528 H A 0061 LEU CD1
H A 0029 SER C 2.958 H A 0061 LEU CD1
H A 0029 SER CB 3.407 H A 0061 LEU CD1
H A 0030 HIS C 2.462 H A 0031 TYR CA
H A 0030 HIS C 2.989 H A 0031 TYR C
H A 0030 HIS C 3.675 H A 0031 TYR CB
H A 0030 HIS CB 3.390 H A 0073 TYR CA
H A 0030 HIS CB 3.370 H A 0073 TYR CB
H A 0031 TYR C 2.485 H A 0032 LYS CA
H A 0031 TYR C 3.080 H A 0032 LYS C
H A 0031 TYR C 3.615 H A 0032 LYS CB
H A 0031 TYR CD1 3.785 H A 0035 THR CG2
H A 0031 TYR CE1 3.486 H A 0035 THR CG2
H A 0031 TYR CA 3.430 H A 0073 TYR CD1
H A 0031 TYR CA 3.645 H A 0073 TYR CE1
H A 0031 TYR CB 3.521 H A 0073 TYR CD1
H A 0031 TYR CB 3.190 H A 0073 TYR CE1
H A 0032 LYS CA 3.793 H A 0033 GLN CA
H A 0032 LYS C 2.398 H A 0033 GLN CA
H A 0032 LYS C 2.930 H A 0033 GLN C
H A 0032 LYS C 3.673 H A 0033 GLN CB
H A 0032 LYS CE 3.671 H A 0036 VAL CG2
H A 0032 LYS CB 3.755 H A 0058 TRP CG
H A 0032 LYS CB 3.547 H A 0058 TRP CD2
H A 0032 LYS CB 3.763 H A 0058 TRP CE2
H A 0032 LYS CE 3.792 H A 0058 TRP CE3
H A 0032 LYS CE 3.423 H A 0058 TRP CZ3
H A 0033 GLN C 2.456 H A 0034 ALA CA
H A 0033 GLN C 3.038 H A 0034 ALA C
H A 0033 GLN C 3.635 H A 0034 ALA CB
H A 0033 GLN CD 3.628 C A 0037 GLY C
H A 0033 GLN CG 3.587 H A 0058 TRP CD1
H A 0033 GLN CG 3.350 H A 0061 LEU CB
H A 0033 GLN CG 3.605 H A 0061 LEU CD1
H A 0033 GLN CB 3.685 H A 0069 ALA CB
H A 0034 ALA C 2.463 H A 0035 THR CA
H A 0034 ALA C 3.237 H A 0035 THR C
H A 0034 ALA C 3.684 H A 0035 THR CB
H A 0034 ALA CA 3.715 H A 0066 LYS CA
H A 0035 THR C 2.405 H A 0036 VAL CA
H A 0035 THR C 3.165 H A 0036 VAL C
H A 0035 THR C 3.703 H A 0036 VAL CB
H A 0036 VAL C 2.473 C A 0037 GLY CA
H A 0036 VAL C 3.486 C A 0037 GLY C
H A 0036 VAL CB 3.420 H A 0058 TRP CZ2
H A 0036 VAL CB 3.767 H A 0058 TRP CH2
H A 0036 VAL CG1 3.512 H A 0058 TRP CZ2
H A 0036 VAL CG1 3.619 H A 0058 TRP CH2
H A 0036 VAL CG2 3.786 H A 0058 TRP CH2
H A 0036 VAL C 3.707 H A 0066 LYS CE
C A 0037 GLY C 2.508 C A 0038 ASP CA
C A 0037 GLY C 3.001 C A 0038 ASP C
C A 0037 GLY C 3.597 C A 0038 ASP CB
C A 0038 ASP C 2.498 C A 0039 ILE CA
C A 0038 ASP C 3.058 C A 0039 ILE C
C A 0038 ASP C 3.585 C A 0039 ILE CB
C A 0038 ASP CA 3.446 H A 0062 LYS CG
C A 0038 ASP C 3.789 H A 0062 LYS CG
C A 0038 ASP CB 3.283 H A 0062 LYS CG
C A 0038 ASP CG 3.446 H A 0062 LYS CG
C A 0039 ILE C 2.484 C A 0040 ASN CA
C A 0039 ILE C 3.544 C A 0040 ASN C
C A 0039 ILE C 3.459 C A 0040 ASN CB
C A 0039 ILE CD1 3.571 H A 0055 TRP CG
C A 0039 ILE CD1 3.492 H A 0055 TRP CD1
C A 0039 ILE CD1 3.511 H A 0055 TRP CD2
C A 0039 ILE CD1 3.379 H A 0055 TRP CE2
C A 0039 ILE CA 3.542 H A 0058 TRP CE2
C A 0039 ILE CA 3.284 H A 0058 TRP CZ2
C A 0039 ILE CA 3.663 H A 0058 TRP CH2
C A 0039 ILE CB 3.626 H A 0058 TRP CD2
C A 0039 ILE CB 3.561 H A 0058 TRP CE2
C A 0039 ILE CB 3.777 H A 0058 TRP CZ2
C A 0039 ILE CG1 3.766 H A 0058 TRP CD2
C A 0039 ILE CG1 3.466 H A 0058 TRP CE3
C A 0039 ILE CG1 3.514 H A 0058 TRP CZ3
C A 0039 ILE CD1 3.740 H A 0058 TRP CD2
C A 0039 ILE CD1 3.387 H A 0058 TRP CE3
C A 0039 ILE CG2 3.654 H A 0059 ASN CA
C A 0039 ILE CD1 3.657 H A 0059 ASN CB
C A 0039 ILE CG2 3.304 H A 0062 LYS CE
C A 0040 ASN C 2.452 C A 0041 THR CA
C A 0040 ASN C 3.530 C A 0041 THR C
C A 0040 ASN C 3.493 C A 0041 THR CB
C A 0040 ASN C 3.480 C A 0041 THR CG2
C A 0041 THR C 2.427 C A 0042 GLU CA
C A 0041 THR C 3.477 C A 0042 GLU C
C A 0041 THR C 3.458 C A 0042 GLU CB
C A 0041 THR C 3.361 C A 0042 GLU CG
C A 0041 THR C 3.776 H A 0055 TRP CE2
C A 0041 THR CG2 3.520 H A 0058 TRP CZ3
C A 0041 THR CG2 3.623 H A 0058 TRP CH2
C A 0042 GLU CA 3.715 C A 0043 ARG CA
C A 0042 GLU C 2.403 C A 0043 ARG CA
C A 0042 GLU C 3.025 C A 0043 ARG C
C A 0042 GLU C 3.676 C A 0043 ARG CB
C A 0042 GLU CA 3.772 H A 0055 TRP CE2
C A 0042 GLU C 3.220 H A 0055 TRP CD1
C A 0042 GLU C 3.572 H A 0055 TRP CE2
C A 0043 ARG CA 2.760 C A 0044 PRO CD
C A 0043 ARG C 2.526 C A 0044 PRO CA
C A 0043 ARG C 3.229 C A 0044 PRO C
C A 0043 ARG C 3.616 C A 0044 PRO CB
C A 0043 ARG C 3.446 C A 0044 PRO CG
C A 0043 ARG C 2.459 C A 0044 PRO CD
C A 0043 ARG CB 3.412 C A 0044 PRO CD
C A 0043 ARG CG 3.243 C A 0044 PRO CD
C A 0044 PRO CA 3.771 C A 0045 GLY CA
C A 0044 PRO C 2.471 C A 0045 GLY CA
C A 0044 PRO C 3.384 C A 0045 GLY C
C A 0044 PRO CB 3.406 C A 0048 ASP CA
C A 0044 PRO CB 3.792 C A 0048 ASP C
C A 0044 PRO CB 3.554 H A 0051 GLY CA
C A 0044 PRO CB 3.759 H A 0051 GLY C
C A 0044 PRO CG 3.716 H A 0051 GLY CA
C A 0044 PRO CG 3.290 H A 0051 GLY C
C A 0044 PRO CD 3.702 H A 0051 GLY CA
C A 0044 PRO CD 3.034 H A 0051 GLY C
C A 0044 PRO CG 3.367 H A 0052 LYS CA
C A 0044 PRO CG 3.157 H A 0052 LYS CB
C A 0044 PRO CD 3.308 H A 0052 LYS CA
C A 0044 PRO CD 3.607 H A 0052 LYS CB
C A 0045 GLY C 2.471 C A 0046 MET CA
C A 0045 GLY C 3.053 C A 0046 MET C
C A 0045 GLY C 3.586 C A 0046 MET CB
C A 0045 GLY C 3.799 C A 0046 MET CG
C A 0046 MET C 2.450 C A 0047 LEU CA
C A 0046 MET C 3.604 C A 0047 LEU C
C A 0046 MET C 3.379 C A 0047 LEU CB
C A 0046 MET C 3.366 C A 0047 LEU CG
C A 0047 LEU C 2.478 C A 0048 ASP CA
C A 0047 LEU C 2.976 C A 0048 ASP C
C A 0047 LEU C 3.589 C A 0048 ASP CB
C A 0047 LEU CD2 3.716 C A 0049 PHE CE1
C A 0047 LEU CB 3.485 C A 0050 LYS CB
C A 0047 LEU CD1 3.641 C A 0050 LYS CD
C A 0048 ASP CA 3.798 C A 0049 PHE CA
C A 0048 ASP C 2.447 C A 0049 PHE CA
C A 0048 ASP C 2.878 C A 0049 PHE C
C A 0048 ASP C 3.716 C A 0049 PHE CB
C A 0049 PHE CA 3.780 C A 0050 LYS CA
C A 0049 PHE C 2.467 C A 0050 LYS CA
C A 0049 PHE C 2.999 C A 0050 LYS C
C A 0049 PHE C 3.718 C A 0050 LYS CB
C A 0049 PHE CG 3.732 C A 0050 LYS CA
C A 0049 PHE CD2 3.531 C A 0050 LYS CA
C A 0049 PHE CD2 3.791 C A 0050 LYS CB
C A 0049 PHE CE1 3.551 C A 0050 LYS CB
C A 0049 PHE CE2 3.717 C A 0050 LYS CA
C A 0049 PHE CE2 3.464 C A 0050 LYS CB
C A 0049 PHE CE2 3.492 C A 0050 LYS CG
C A 0049 PHE CZ 3.332 C A 0050 LYS CB
C A 0049 PHE CZ 3.436 C A 0050 LYS CG
C A 0049 PHE CZ 3.644 C A 0050 LYS CD
C A 0050 LYS CA 3.772 H A 0051 GLY CA
C A 0050 LYS C 2.447 H A 0051 GLY CA
C A 0050 LYS C 2.908 H A 0051 GLY C
C A 0050 LYS C 3.637 H A 0054 LYS CG
C A 0050 LYS C 3.372 H A 0054 LYS CD
C A 0050 LYS C 3.259 H A 0054 LYS CE
C A 0050 LYS CB 3.625 H A 0054 LYS CE
C A 0050 LYS CG 3.604 H A 0054 LYS CE
H A 0051 GLY CA 3.734 H A 0052 LYS CA
H A 0051 GLY C 2.345 H A 0052 LYS CA
H A 0051 GLY C 2.907 H A 0052 LYS C
H A 0051 GLY C 3.499 H A 0052 LYS CB
H A 0051 GLY CA 3.720 H A 0054 LYS CG
H A 0051 GLY CA 3.600 H A 0054 LYS CE
H A 0051 GLY C 3.697 H A 0054 LYS CG
H A 0052 LYS CA 3.781 H A 0053 ALA CA
H A 0052 LYS C 2.397 H A 0053 ALA CA
H A 0052 LYS C 2.795 H A 0053 ALA C
H A 0052 LYS C 3.571 H A 0053 ALA CB
H A 0052 LYS CD 3.606 H A 0053 ALA CA
H A 0052 LYS C 3.543 H A 0056 ASP CB
H A 0052 LYS CG 3.520 H A 0056 ASP CB
H A 0052 LYS CG 3.385 H A 0056 ASP CG
H A 0052 LYS CD 3.792 H A 0056 ASP CB
H A 0053 ALA CA 3.791 H A 0054 LYS CA
H A 0053 ALA C 2.403 H A 0054 LYS CA
H A 0053 ALA C 2.932 H A 0054 LYS C
H A 0053 ALA C 3.786 H A 0054 LYS CB
H A 0054 LYS C 2.448 H A 0055 TRP CA
H A 0054 LYS C 2.910 H A 0055 TRP C
H A 0054 LYS C 3.666 H A 0055 TRP CB
H A 0055 TRP C 2.478 H A 0056 ASP CA
H A 0055 TRP C 2.969 H A 0056 ASP C
H A 0055 TRP C 3.652 H A 0056 ASP CB
H A 0055 TRP C 3.701 H A 0059 ASN CB
H A 0055 TRP CE3 3.778 H A 0059 ASN CG
H A 0055 TRP CZ3 3.261 H A 0059 ASN CG
H A 0055 TRP CH2 3.631 H A 0059 ASN CG
H A 0056 ASP C 2.440 H A 0057 ALA CA
H A 0056 ASP C 2.930 H A 0057 ALA C
H A 0056 ASP C 3.696 H A 0057 ALA CB
H A 0057 ALA C 2.457 H A 0058 TRP CA
H A 0057 ALA C 3.091 H A 0058 TRP C
H A 0057 ALA C 3.660 H A 0058 TRP CB
H A 0057 ALA C 3.751 H A 0060 GLU CB
H A 0058 TRP C 2.484 H A 0059 ASN CA
H A 0058 TRP C 2.988 H A 0059 ASN C
H A 0058 TRP C 3.589 H A 0059 ASN CB
H A 0059 ASN C 2.477 H A 0060 GLU CA
H A 0059 ASN C 3.109 H A 0060 GLU C
H A 0059 ASN C 3.653 H A 0060 GLU CB
H A 0060 GLU C 2.488 H A 0061 LEU CA
H A 0060 GLU C 3.293 H A 0061 LEU C
H A 0060 GLU C 3.687 H A 0061 LEU CB
H A 0061 LEU C 2.457 H A 0062 LYS CA
H A 0061 LEU C 2.751 H A 0062 LYS C
H A 0061 LEU C 3.651 H A 0062 LYS CB
H A 0062 LYS C 2.456 C A 0063 GLY CA
H A 0062 LYS C 3.422 C A 0063 GLY C
C A 0063 GLY C 2.505 C A 0064 THR CA
C A 0063 GLY C 3.171 C A 0064 THR C
C A 0064 THR C 2.430 H A 0065 SER CA
C A 0064 THR C 3.286 H A 0065 SER C
C A 0064 THR C 3.650 H A 0065 SER CB
H A 0065 SER C 2.469 H A 0066 LYS CA
H A 0065 SER C 3.139 H A 0066 LYS C
H A 0065 SER C 3.656 H A 0066 LYS CB
H A 0066 LYS C 2.450 H A 0067 GLU CA
H A 0066 LYS C 3.218 H A 0067 GLU C
H A 0066 LYS C 3.570 H A 0067 GLU CB
H A 0066 LYS C 3.727 H A 0069 ALA CB
H A 0067 GLU C 2.428 H A 0068 ASP CA
H A 0067 GLU C 2.854 H A 0068 ASP C
H A 0067 GLU C 3.587 H A 0068 ASP CB
H A 0067 GLU CD 3.789 H A 0070 MET CE
H A 0068 ASP CA 3.738 H A 0069 ALA CA
H A 0068 ASP C 2.418 H A 0069 ALA CA
H A 0068 ASP C 2.762 H A 0069 ALA C
H A 0068 ASP C 3.659 H A 0069 ALA CB
H A 0069 ALA C 2.439 H A 0070 MET CA
H A 0069 ALA C 2.941 H A 0070 MET C
H A 0069 ALA C 3.772 H A 0070 MET CB
H A 0070 MET C 2.451 H A 0071 LYS CA
H A 0070 MET C 2.870 H A 0071 LYS C
H A 0070 MET C 3.615 H A 0071 LYS CB
H A 0070 MET C 3.616 H A 0074 ILE CG1
H A 0070 MET C 3.554 H A 0074 ILE CD1
H A 0070 MET CB 3.749 H A 0074 ILE CD1
H A 0071 LYS C 2.402 H A 0072 ALA CA
H A 0071 LYS C 3.087 H A 0072 ALA C
H A 0071 LYS C 3.597 H A 0072 ALA CB
H A 0072 ALA C 2.415 H A 0073 TYR CA
H A 0072 ALA C 2.858 H A 0073 TYR C
H A 0072 ALA C 3.676 H A 0073 TYR CB
H A 0073 TYR CA 3.783 H A 0074 ILE CA
H A 0073 TYR C 2.464 H A 0074 ILE CA
H A 0073 TYR C 2.901 H A 0074 ILE C
H A 0073 TYR C 3.693 H A 0074 ILE CB
H A 0073 TYR CD2 3.766 H A 0074 ILE CA
H A 0073 TYR CE1 3.665 H A 0077 VAL CG2
H A 0073 TYR CE2 3.051 H A 0077 VAL CG2
H A 0073 TYR CZ 2.958 H A 0077 VAL CG2
H A 0074 ILE CA 3.789 H A 0075 ASP CA
H A 0074 ILE C 2.414 H A 0075 ASP CA
H A 0074 ILE C 2.931 H A 0075 ASP C
H A 0074 ILE C 3.580 H A 0075 ASP CB
H A 0075 ASP CA 3.800 H A 0076 LYS CA
H A 0075 ASP C 2.399 H A 0076 LYS CA
H A 0075 ASP C 3.057 H A 0076 LYS C
H A 0075 ASP C 3.605 H A 0076 LYS CB
H A 0075 ASP CA 3.766 H A 0078 GLU CB
H A 0075 ASP C 3.481 H A 0078 GLU CB
H A 0076 LYS C 2.432 H A 0077 VAL CA
H A 0076 LYS C 2.766 H A 0077 VAL C
H A 0076 LYS C 3.732 H A 0077 VAL CB
H A 0076 LYS CD 3.384 H A 0079 GLU CD
H A 0076 LYS CE 3.369 H A 0079 GLU CD
H A 0077 VAL CA 3.791 H A 0078 GLU CA
H A 0077 VAL C 2.418 H A 0078 GLU CA
H A 0077 VAL C 2.814 H A 0078 GLU C
H A 0077 VAL C 3.712 H A 0078 GLU CB
H A 0078 GLU C 2.440 H A 0079 GLU CA
H A 0078 GLU C 2.941 H A 0079 GLU C
H A 0078 GLU C 3.692 H A 0079 GLU CB
H A 0078 GLU C 3.733 H A 0081 LYS CB
H A 0079 GLU C 2.435 H A 0080 LEU CA
H A 0079 GLU C 2.907 H A 0080 LEU C
H A 0079 GLU C 3.517 H A 0080 LEU CB
H A 0079 GLU C 3.501 H A 0083 LYS CD
H A 0079 GLU CB 3.737 H A 0083 LYS CD
H A 0079 GLU CB 3.370 H A 0083 LYS CE
H A 0079 GLU CD 3.789 H A 0083 LYS CE
H A 0080 LEU CA 3.788 H A 0081 LYS CA
H A 0080 LEU C 2.438 H A 0081 LYS CA
H A 0080 LEU C 2.914 H A 0081 LYS C
H A 0080 LEU C 3.644 H A 0081 LYS CB
H A 0080 LEU CD1 3.773 H A 0083 LYS CD
H A 0080 LEU CD1 3.241 H A 0084 TYR CD2
H A 0080 LEU CD1 3.138 H A 0084 TYR CE2
H A 0081 LYS C 2.474 H A 0082 LYS CA
H A 0081 LYS C 3.404 H A 0082 LYS C
H A 0081 LYS C 3.553 H A 0082 LYS CB
H A 0081 LYS C 3.680 H A 0082 LYS CG
H A 0081 LYS CA 3.346 C A 0086 ILE CG2
H A 0081 LYS CD 3.573 C A 0086 ILE CG2
H A 0081 LYS CE 3.687 C A 0086 ILE CG1
H A 0082 LYS C 2.451 H A 0083 LYS CA
H A 0082 LYS C 2.953 H A 0083 LYS C
H A 0082 LYS C 3.676 H A 0083 LYS CB
H A 0083 LYS CA 3.761 H A 0084 TYR CA
H A 0083 LYS C 2.403 H A 0084 TYR CA
H A 0083 LYS C 3.367 H A 0084 TYR C
H A 0083 LYS C 3.514 H A 0084 TYR CB
H A 0083 LYS C 3.374 H A 0084 TYR CG
H A 0083 LYS C 3.541 H A 0084 TYR CD2
H A 0083 LYS CB 3.290 H A 0084 TYR CD2
H A 0083 LYS CB 3.304 H A 0084 TYR CE2
H A 0084 TYR C 2.408 C A 0085 GLY CA
H A 0084 TYR C 3.292 C A 0085 GLY C
C A 0085 GLY CA 3.759 C A 0086 ILE CA
C A 0085 GLY C 2.414 C A 0086 ILE CA
C A 0085 GLY C 3.318 C A 0086 ILE C
C A 0085 GLY C 3.590 C A 0086 ILE CB
C A 0085 GLY C 3.694 C A 0086 ILE CG2
CHARGE_ATTR 2.00 12.00 126
H A 0004 GLU OE1 4.057 H A 0007 LYS NZ
H A 0004 GLU OE2 5.802 H A 0007 LYS NZ
H A 0006 ASP OD1 9.326 H A 0007 LYS NZ
H A 0006 ASP OD2 9.560 H A 0007 LYS NZ
H A 0006 ASP OD1 7.135 H A 0013 LYS NZ
H A 0006 ASP OD2 9.298 H A 0013 LYS NZ
H A 0006 ASP OD1 11.68 H A 0014 HIS ND1
H A 0006 ASP OD1 10.98 H A 0032 LYS NZ
H A 0006 ASP OD2 11.90 H A 0032 LYS NZ
H A 0006 ASP OD1 8.867 H A 0066 LYS NZ
H A 0006 ASP OD2 7.595 H A 0066 LYS NZ
H A 0010 GLU OE1 9.230 H A 0007 LYS NZ
H A 0010 GLU OE2 8.890 H A 0007 LYS NZ
H A 0010 GLU OE1 2.654 H A 0013 LYS NZ
H A 0010 GLU OE2 2.685 H A 0013 LYS NZ
H A 0010 GLU OE1 4.799 H A 0014 HIS ND1
H A 0010 GLU OE1 5.008 H A 0014 HIS NE2
H A 0010 GLU OE2 6.791 H A 0014 HIS ND1
H A 0010 GLU OE2 7.157 H A 0014 HIS NE2
H A 0011 GLU OE1 10.81 H A 0007 LYS NZ
H A 0011 GLU OE2 9.791 H A 0007 LYS NZ
H A 0011 GLU OE1 10.62 H A 0013 LYS NZ
H A 0011 GLU OE2 10.81 H A 0013 LYS NZ
H A 0011 GLU OE1 7.410 H A 0014 HIS ND1
H A 0011 GLU OE1 9.118 H A 0014 HIS NE2
H A 0011 GLU OE2 6.959 H A 0014 HIS ND1
H A 0011 GLU OE2 8.272 H A 0014 HIS NE2
H A 0011 GLU OE1 9.057 C A 0016 LYS NZ
H A 0011 GLU OE2 8.754 C A 0016 LYS NZ
H A 0011 GLU OE1 2.796 H A 0081 LYS NZ
H A 0011 GLU OE2 2.643 H A 0081 LYS NZ
H A 0011 GLU OE1 8.656 H A 0082 LYS NZ
H A 0011 GLU OE2 10.44 H A 0082 LYS NZ
H A 0021 ASP OD1 8.160 C A 0018 LYS NZ
H A 0021 ASP OD2 9.346 C A 0018 LYS NZ
H A 0021 ASP OD1 5.305 C A 0050 LYS NZ
H A 0021 ASP OD2 3.526 C A 0050 LYS NZ
H A 0021 ASP OD1 10.42 H A 0054 LYS NZ
H A 0021 ASP OD2 8.220 H A 0054 LYS NZ
H A 0022 GLU OE1 10.96 H A 0052 LYS NZ
H A 0022 GLU OE2 11.96 H A 0052 LYS NZ
H A 0022 GLU OE1 9.857 H A 0076 LYS NZ
H A 0022 GLU OE2 10.87 H A 0076 LYS NZ
H A 0022 GLU OE1 9.559 H A 0083 LYS NZ
H A 0022 GLU OE2 9.703 H A 0083 LYS NZ
H A 0023 GLU OE1 11.03 H A 0030 HIS ND1
H A 0023 GLU OE1 10.04 H A 0030 HIS NE2
H A 0023 GLU OE2 11.46 H A 0030 HIS NE2
H A 0023 GLU OE1 2.471 H A 0076 LYS NZ
H A 0023 GLU OE2 2.765 H A 0076 LYS NZ
H A 0023 GLU OE1 9.851 H A 0082 LYS NZ
H A 0023 GLU OE2 10.18 H A 0082 LYS NZ
H A 0023 GLU OE1 3.918 H A 0083 LYS NZ
H A 0023 GLU OE2 2.781 H A 0083 LYS NZ
C A 0038 ASP OD1 11.21 H A 0030 HIS ND1
C A 0038 ASP OD1 6.000 H A 0062 LYS NZ
C A 0038 ASP OD2 5.223 H A 0062 LYS NZ
C A 0038 ASP OD1 7.271 H A 0066 LYS NZ
C A 0038 ASP OD2 9.341 H A 0066 LYS NZ
C A 0042 GLU OE1 11.22 C A 0043 ARG NH1
C A 0042 GLU OE2 11.14 H A 0062 LYS NZ
C A 0048 ASP OD1 7.612 C A 0043 ARG NH1
C A 0048 ASP OD1 9.526 C A 0043 ARG NH2
C A 0048 ASP OD2 9.799 C A 0043 ARG NH1
C A 0048 ASP OD2 11.66 C A 0043 ARG NH2
C A 0048 ASP OD1 9.729 H A 0052 LYS NZ
C A 0048 ASP OD2 11.48 H A 0052 LYS NZ
C A 0048 ASP OD1 10.88 H A 0054 LYS NZ
C A 0048 ASP OD2 10.84 H A 0054 LYS NZ
H A 0056 ASP OD1 4.223 C A 0043 ARG NH1
H A 0056 ASP OD1 2.647 C A 0043 ARG NH2
H A 0056 ASP OD2 5.166 C A 0043 ARG NH1
H A 0056 ASP OD2 3.393 C A 0043 ARG NH2
H A 0056 ASP OD1 4.021 H A 0052 LYS NZ
H A 0056 ASP OD2 2.519 H A 0052 LYS NZ
H A 0056 ASP OD1 11.33 H A 0054 LYS NZ
H A 0056 ASP OD1 11.63 H A 0062 LYS NZ
H A 0060 GLU OE1 8.396 H A 0030 HIS ND1
H A 0060 GLU OE1 6.465 H A 0030 HIS NE2
H A 0060 GLU OE2 10.46 H A 0030 HIS ND1
H A 0060 GLU OE2 8.596 H A 0030 HIS NE2
H A 0060 GLU OE1 10.80 C A 0043 ARG NH2
H A 0060 GLU OE2 11.03 C A 0043 ARG NH1
H A 0060 GLU OE2 8.943 C A 0043 ARG NH2
H A 0060 GLU OE1 8.598 H A 0052 LYS NZ
H A 0060 GLU OE2 7.051 H A 0052 LYS NZ
H A 0060 GLU OE1 11.81 H A 0076 LYS NZ
H A 0067 GLU OE1 11.16 H A 0030 HIS ND1
H A 0067 GLU OE1 10.26 H A 0066 LYS NZ
H A 0067 GLU OE2 9.283 H A 0066 LYS NZ
H A 0067 GLU OE1 7.338 H A 0071 LYS NZ
H A 0067 GLU OE2 9.249 H A 0071 LYS NZ
H A 0068 ASP OD1 9.198 H A 0030 HIS ND1
H A 0068 ASP OD1 10.65 H A 0030 HIS NE2
H A 0068 ASP OD2 9.349 H A 0030 HIS ND1
H A 0068 ASP OD2 10.89 H A 0030 HIS NE2
H A 0068 ASP OD2 10.87 H A 0066 LYS NZ
H A 0068 ASP OD1 2.504 H A 0071 LYS NZ
H A 0068 ASP OD2 4.594 H A 0071 LYS NZ
H A 0075 ASP OD1 9.614 H A 0030 HIS ND1
H A 0075 ASP OD1 10.70 H A 0030 HIS NE2
H A 0075 ASP OD2 10.52 H A 0030 HIS ND1
H A 0075 ASP OD2 11.22 H A 0030 HIS NE2
H A 0075 ASP OD1 9.462 H A 0071 LYS NZ
H A 0075 ASP OD2 10.63 H A 0071 LYS NZ
H A 0075 ASP OD1 10.97 H A 0076 LYS NZ
H A 0075 ASP OD2 10.06 H A 0076 LYS NZ
H A 0075 ASP OD1 8.981 H A 0082 LYS NZ
H A 0075 ASP OD2 7.922 H A 0082 LYS NZ
H A 0078 GLU OE1 10.85 H A 0076 LYS NZ
H A 0078 GLU OE2 11.75 H A 0076 LYS NZ
H A 0078 GLU OE1 7.465 H A 0081 LYS NZ
H A 0078 GLU OE2 5.662 H A 0081 LYS NZ
H A 0078 GLU OE1 2.456 H A 0082 LYS NZ
H A 0078 GLU OE2 4.142 H A 0082 LYS NZ
H A 0078 GLU OE1 10.97 H A 0083 LYS NZ
H A 0078 GLU OE2 11.86 H A 0083 LYS NZ
H A 0079 GLU OE1 11.48 H A 0030 HIS NE2
H A 0079 GLU OE2 11.16 H A 0030 HIS ND1
H A 0079 GLU OE2 10.45 H A 0030 HIS NE2
H A 0079 GLU OE1 2.503 H A 0076 LYS NZ
H A 0079 GLU OE2 2.799 H A 0076 LYS NZ
H A 0079 GLU OE1 7.144 H A 0082 LYS NZ
H A 0079 GLU OE2 7.203 H A 0082 LYS NZ
H A 0079 GLU OE1 3.411 H A 0083 LYS NZ
H A 0079 GLU OE2 5.507 H A 0083 LYS NZ
CHARGE_REPU 2.00 12.00 106
H A 0004 GLU OE1 9.050 H A 0006 ASP OD1
H A 0004 GLU OE1 8.418 H A 0006 ASP OD2
H A 0004 GLU OE2 10.85 H A 0006 ASP OD1
H A 0004 GLU OE2 9.928 H A 0006 ASP OD2
H A 0004 GLU OE1 11.72 H A 0010 GLU OE1
H A 0004 GLU OE1 10.90 H A 0010 GLU OE2
H A 0004 GLU OE1 11.72 H A 0011 GLU OE1
H A 0004 GLU OE1 11.29 H A 0011 GLU OE2
H A 0004 GLU OE1 9.909 H A 0067 GLU OE1
H A 0004 GLU OE1 9.436 H A 0067 GLU OE2
H A 0004 GLU OE2 9.483 H A 0067 GLU OE1
H A 0004 GLU OE2 9.122 H A 0067 GLU OE2
H A 0006 ASP OD1 7.812 H A 0010 GLU OE1
H A 0006 ASP OD1 5.828 H A 0010 GLU OE2
H A 0006 ASP OD2 9.830 H A 0010 GLU OE1
H A 0006 ASP OD2 7.885 H A 0010 GLU OE2
H A 0006 ASP OD1 11.05 H A 0067 GLU OE1
H A 0006 ASP OD1 10.27 H A 0067 GLU OE2
H A 0006 ASP OD2 9.147 H A 0067 GLU OE1
H A 0006 ASP OD2 8.185 H A 0067 GLU OE2
H A 0007 LYS NZ 11.03 H A 0013 LYS NZ
H A 0007 LYS NZ 11.12 H A 0014 HIS ND1
H A 0007 LYS NZ 11.34 H A 0014 HIS NE2
H A 0010 GLU OE1 10.07 H A 0011 GLU OE1
H A 0010 GLU OE1 9.738 H A 0011 GLU OE2
H A 0010 GLU OE2 11.07 H A 0011 GLU OE1
H A 0010 GLU OE2 10.91 H A 0011 GLU OE2
H A 0011 GLU OE1 11.92 H A 0075 ASP OD1
H A 0011 GLU OE1 7.479 H A 0078 GLU OE1
H A 0011 GLU OE1 5.444 H A 0078 GLU OE2
H A 0011 GLU OE2 9.074 H A 0078 GLU OE1
H A 0011 GLU OE2 7.000 H A 0078 GLU OE2
H A 0013 LYS NZ 5.832 H A 0014 HIS ND1
H A 0013 LYS NZ 6.610 H A 0014 HIS NE2
H A 0013 LYS NZ 11.71 H A 0032 LYS NZ
H A 0014 HIS ND1 9.766 C A 0016 LYS NZ
H A 0014 HIS NE2 10.43 C A 0016 LYS NZ
H A 0014 HIS ND1 8.945 H A 0081 LYS NZ
H A 0014 HIS NE2 10.32 H A 0081 LYS NZ
C A 0016 LYS NZ 7.783 H A 0081 LYS NZ
C A 0018 LYS NZ 9.559 C A 0050 LYS NZ
H A 0021 ASP OD1 9.332 H A 0022 GLU OE1
H A 0021 ASP OD1 7.872 H A 0022 GLU OE2
H A 0021 ASP OD2 10.08 H A 0022 GLU OE1
H A 0021 ASP OD2 8.977 H A 0022 GLU OE2
H A 0021 ASP OD1 11.29 H A 0023 GLU OE1
H A 0021 ASP OD1 11.73 H A 0023 GLU OE2
H A 0021 ASP OD2 11.60 H A 0023 GLU OE1
H A 0022 GLU OE1 8.778 H A 0023 GLU OE1
H A 0022 GLU OE1 7.916 H A 0023 GLU OE2
H A 0022 GLU OE2 9.425 H A 0023 GLU OE1
H A 0022 GLU OE2 8.585 H A 0023 GLU OE2
H A 0022 GLU OE1 11.18 H A 0079 GLU OE1
H A 0022 GLU OE2 11.88 H A 0079 GLU OE1
H A 0023 GLU OE1 11.74 H A 0075 ASP OD2
H A 0023 GLU OE1 11.53 H A 0078 GLU OE1
H A 0023 GLU OE1 3.648 H A 0079 GLU OE1
H A 0023 GLU OE1 4.903 H A 0079 GLU OE2
H A 0023 GLU OE2 3.322 H A 0079 GLU OE1
H A 0023 GLU OE2 4.843 H A 0079 GLU OE2
H A 0030 HIS ND1 11.42 H A 0066 LYS NZ
H A 0030 HIS ND1 9.775 H A 0071 LYS NZ
H A 0030 HIS NE2 11.20 H A 0071 LYS NZ
H A 0030 HIS ND1 10.40 H A 0076 LYS NZ
H A 0030 HIS NE2 9.370 H A 0076 LYS NZ
H A 0032 LYS NZ 11.40 C A 0050 LYS NZ
H A 0032 LYS NZ 6.708 H A 0054 LYS NZ
H A 0032 LYS NZ 11.83 H A 0062 LYS NZ
H A 0032 LYS NZ 10.35 H A 0066 LYS NZ
C A 0038 ASP OD1 11.85 H A 0068 ASP OD1
C A 0038 ASP OD1 9.957 H A 0068 ASP OD2
C A 0038 ASP OD2 11.13 H A 0068 ASP OD2
C A 0043 ARG NH1 5.786 H A 0052 LYS NZ
C A 0043 ARG NH2 4.834 H A 0052 LYS NZ
C A 0048 ASP OD1 10.04 H A 0056 ASP OD1
C A 0048 ASP OD1 10.82 H A 0056 ASP OD2
C A 0048 ASP OD2 11.97 H A 0056 ASP OD1
C A 0050 LYS NZ 6.000 H A 0054 LYS NZ
H A 0052 LYS NZ 11.68 H A 0054 LYS NZ
H A 0056 ASP OD1 8.956 H A 0060 GLU OE1
H A 0056 ASP OD1 7.400 H A 0060 GLU OE2
H A 0056 ASP OD2 7.742 H A 0060 GLU OE1
H A 0056 ASP OD2 5.988 H A 0060 GLU OE2
H A 0062 LYS NZ 11.15 H A 0066 LYS NZ
H A 0067 GLU OE1 7.431 H A 0068 ASP OD1
H A 0067 GLU OE1 7.291 H A 0068 ASP OD2
H A 0067 GLU OE2 8.983 H A 0068 ASP OD1
H A 0067 GLU OE2 8.391 H A 0068 ASP OD2
H A 0067 GLU OE1 10.34 H A 0075 ASP OD1
H A 0068 ASP OD1 11.15 H A 0075 ASP OD1
H A 0075 ASP OD1 7.944 H A 0078 GLU OE1
H A 0075 ASP OD1 8.239 H A 0078 GLU OE2
H A 0075 ASP OD2 7.268 H A 0078 GLU OE1
H A 0075 ASP OD2 8.136 H A 0078 GLU OE2
H A 0075 ASP OD1 10.87 H A 0079 GLU OE1
H A 0075 ASP OD1 9.360 H A 0079 GLU OE2
H A 0075 ASP OD2 9.711 H A 0079 GLU OE1
H A 0075 ASP OD2 8.050 H A 0079 GLU OE2
H A 0076 LYS NZ 9.168 H A 0082 LYS NZ
H A 0076 LYS NZ 4.642 H A 0083 LYS NZ
H A 0078 GLU OE1 9.125 H A 0079 GLU OE1
H A 0078 GLU OE1 8.897 H A 0079 GLU OE2
H A 0078 GLU OE2 10.24 H A 0079 GLU OE1
H A 0078 GLU OE2 10.16 H A 0079 GLU OE2
H A 0081 LYS NZ 8.707 H A 0082 LYS NZ
H A 0082 LYS NZ 8.776 H A 0083 LYS NZ
HB_MM 2.00 3.20 192
C A 0002 GLN N 2.225 C A 0001 SER O
H A 0003 ALA N 2.223 C A 0002 GLN O
H A 0004 GLU N 2.635 C A 0002 GLN O
H A 0004 GLU N 2.189 H A 0003 ALA O
H A 0005 PHE N 2.783 H A 0003 ALA O
H A 0005 PHE N 2.187 H A 0004 GLU O
H A 0006 ASP N 2.535 H A 0003 ALA O
H A 0006 ASP N 2.208 H A 0005 PHE O
H A 0007 LYS N 3.115 H A 0003 ALA O
H A 0007 LYS N 2.769 H A 0004 GLU O
H A 0007 LYS N 3.035 H A 0005 PHE O
H A 0007 LYS N 2.203 H A 0006 ASP O
H A 0008 ALA N 2.727 H A 0004 GLU O
H A 0008 ALA N 2.748 H A 0005 PHE O
H A 0008 ALA N 2.179 H A 0007 LYS O
H A 0009 ALA N 2.726 H A 0005 PHE O
H A 0009 ALA N 3.107 H A 0007 LYS O
H A 0009 ALA N 2.219 H A 0008 ALA O
H A 0010 GLU N 2.787 H A 0007 LYS O
H A 0010 GLU N 2.728 H A 0008 ALA O
H A 0010 GLU N 2.202 H A 0009 ALA O
H A 0011 GLU N 3.083 H A 0007 LYS O
H A 0011 GLU N 2.842 H A 0008 ALA O
H A 0011 GLU N 2.199 H A 0010 GLU O
H A 0012 VAL N 2.900 H A 0008 ALA O
H A 0012 VAL N 3.099 H A 0010 GLU O
H A 0012 VAL N 2.222 H A 0011 GLU O
H A 0013 LYS N 2.740 H A 0010 GLU O
H A 0013 LYS N 2.727 H A 0011 GLU O
H A 0013 LYS N 2.199 H A 0012 VAL O
H A 0014 HIS N 3.168 H A 0010 GLU O
H A 0014 HIS N 2.571 H A 0011 GLU O
H A 0014 HIS N 2.213 H A 0013 LYS O
H A 0015 LEU N 2.918 H A 0011 GLU O
H A 0015 LEU N 2.236 H A 0014 HIS O
C A 0016 LYS N 3.089 H A 0014 HIS O
C A 0016 LYS N 2.212 H A 0015 LEU O
C A 0017 THR N 2.518 H A 0015 LEU O
C A 0017 THR N 2.210 C A 0016 LYS O
C A 0018 LYS N 2.237 C A 0017 THR O
C A 0019 PRO N 2.587 C A 0017 THR O
C A 0019 PRO N 2.211 C A 0018 LYS O
H A 0020 ALA N 2.206 C A 0019 PRO O
H A 0021 ASP N 3.185 C A 0019 PRO O
H A 0021 ASP N 2.228 H A 0020 ALA O
H A 0022 GLU N 2.731 H A 0020 ALA O
H A 0022 GLU N 2.174 H A 0021 ASP O
H A 0023 GLU N 2.656 H A 0020 ALA O
H A 0023 GLU N 2.182 H A 0022 GLU O
H A 0024 MET N 3.002 H A 0020 ALA O
H A 0024 MET N 3.043 H A 0021 ASP O
H A 0024 MET N 2.241 H A 0023 GLU O
H A 0025 LEU N 2.663 H A 0021 ASP O
H A 0025 LEU N 2.213 H A 0024 MET O
H A 0026 PHE N 3.032 H A 0024 MET O
H A 0026 PHE N 2.236 H A 0025 LEU O
H A 0027 ILE N 3.071 H A 0023 GLU O
H A 0027 ILE N 2.769 H A 0024 MET O
H A 0027 ILE N 2.218 H A 0026 PHE O
H A 0028 TYR N 2.701 H A 0024 MET O
H A 0028 TYR N 3.167 H A 0026 PHE O
H A 0028 TYR N 2.225 H A 0027 ILE O
H A 0029 SER N 2.230 H A 0028 TYR O
H A 0030 HIS N 3.196 H A 0026 PHE O
H A 0030 HIS N 2.209 H A 0029 SER O
H A 0031 TYR N 2.783 H A 0027 ILE O
H A 0031 TYR N 3.046 H A 0028 TYR O
H A 0031 TYR N 2.204 H A 0030 HIS O
H A 0032 LYS N 2.748 H A 0028 TYR O
H A 0032 LYS N 2.208 H A 0031 TYR O
H A 0033 GLN N 2.977 H A 0029 SER O
H A 0033 GLN N 2.215 H A 0032 LYS O
H A 0034 ALA N 2.929 H A 0030 HIS O
H A 0034 ALA N 2.231 H A 0033 GLN O
H A 0035 THR N 2.773 H A 0031 TYR O
H A 0035 THR N 2.202 H A 0034 ALA O
H A 0036 VAL N 2.619 H A 0032 LYS O
H A 0036 VAL N 2.195 H A 0035 THR O
C A 0037 GLY N 2.983 H A 0032 LYS O
C A 0037 GLY N 3.031 H A 0033 GLN O
C A 0037 GLY N 2.237 H A 0036 VAL O
C A 0038 ASP N 2.225 C A 0037 GLY O
C A 0039 ILE N 2.652 C A 0037 GLY O
C A 0039 ILE N 2.228 C A 0038 ASP O
C A 0040 ASN N 2.227 C A 0039 ILE O
C A 0041 THR N 2.217 C A 0040 ASN O
C A 0042 GLU N 2.208 C A 0041 THR O
C A 0043 ARG N 2.240 C A 0042 GLU O
C A 0044 PRO N 2.230 C A 0043 ARG O
C A 0045 GLY N 2.238 C A 0044 PRO O
C A 0046 MET N 2.215 C A 0045 GLY O
C A 0047 LEU N 2.378 C A 0045 GLY O
C A 0047 LEU N 2.207 C A 0046 MET O
C A 0048 ASP N 2.220 C A 0047 LEU O
C A 0049 PHE N 3.043 C A 0047 LEU O
C A 0049 PHE N 2.236 C A 0048 ASP O
C A 0050 LYS N 2.744 C A 0047 LEU O
C A 0050 LYS N 3.042 C A 0048 ASP O
C A 0050 LYS N 2.248 C A 0049 PHE O
H A 0051 GLY N 2.708 C A 0047 LEU O
H A 0051 GLY N 3.052 C A 0048 ASP O
H A 0051 GLY N 2.204 C A 0050 LYS O
H A 0052 LYS N 2.796 C A 0048 ASP O
H A 0052 LYS N 2.981 C A 0050 LYS O
H A 0052 LYS N 2.204 H A 0051 GLY O
H A 0053 ALA N 2.720 C A 0049 PHE O
H A 0053 ALA N 2.824 C A 0050 LYS O
H A 0053 ALA N 2.201 H A 0052 LYS O
H A 0054 LYS N 2.782 C A 0050 LYS O
H A 0054 LYS N 2.745 H A 0052 LYS O
H A 0054 LYS N 2.232 H A 0053 ALA O
H A 0055 TRP N 2.950 H A 0051 GLY O
H A 0055 TRP N 2.707 H A 0052 LYS O
H A 0055 TRP N 2.227 H A 0054 LYS O
H A 0056 ASP N 2.530 H A 0052 LYS O
H A 0056 ASP N 2.217 H A 0055 TRP O
H A 0057 ALA N 2.856 H A 0053 ALA O
H A 0057 ALA N 2.218 H A 0056 ASP O
H A 0058 TRP N 2.925 H A 0054 LYS O
H A 0058 TRP N 3.047 H A 0055 TRP O
H A 0058 TRP N 3.120 H A 0056 ASP O
H A 0058 TRP N 2.200 H A 0057 ALA O
H A 0059 ASN N 2.691 H A 0055 TRP O
H A 0059 ASN N 3.176 H A 0056 ASP O
H A 0059 ASN N 2.196 H A 0058 TRP O
H A 0060 GLU N 2.950 H A 0056 ASP O
H A 0060 GLU N 2.799 H A 0058 TRP O
H A 0060 GLU N 2.257 H A 0059 ASN O
H A 0061 LEU N 2.604 H A 0058 TRP O
H A 0061 LEU N 2.212 H A 0060 GLU O
H A 0062 LYS N 3.081 H A 0058 TRP O
H A 0062 LYS N 2.242 H A 0061 LEU O
C A 0063 GLY N 2.984 H A 0061 LEU O
C A 0063 GLY N 2.217 H A 0062 LYS O
C A 0064 THR N 2.757 H A 0061 LEU O
C A 0064 THR N 2.220 C A 0063 GLY O
H A 0065 SER N 2.211 C A 0064 THR O
H A 0066 LYS N 2.211 H A 0065 SER O
H A 0067 GLU N 2.894 H A 0065 SER O
H A 0067 GLU N 2.215 H A 0066 LYS O
H A 0068 ASP N 3.000 H A 0065 SER O
H A 0068 ASP N 2.204 H A 0067 GLU O
H A 0069 ALA N 3.037 H A 0065 SER O
H A 0069 ALA N 2.244 H A 0068 ASP O
H A 0070 MET N 2.979 H A 0066 LYS O
H A 0070 MET N 2.889 H A 0067 GLU O
H A 0070 MET N 2.228 H A 0069 ALA O
H A 0071 LYS N 2.770 H A 0067 GLU O
H A 0071 LYS N 3.171 H A 0068 ASP O
H A 0071 LYS N 2.230 H A 0070 MET O
H A 0072 ALA N 2.925 H A 0070 MET O
H A 0072 ALA N 2.216 H A 0071 LYS O
H A 0073 TYR N 2.758 H A 0069 ALA O
H A 0073 TYR N 2.716 H A 0070 MET O
H A 0073 TYR N 2.204 H A 0072 ALA O
H A 0074 ILE N 2.719 H A 0070 MET O
H A 0074 ILE N 3.116 H A 0072 ALA O
H A 0074 ILE N 2.239 H A 0073 TYR O
H A 0075 ASP N 3.120 H A 0072 ALA O
H A 0075 ASP N 2.209 H A 0074 ILE O
H A 0076 LYS N 2.779 H A 0072 ALA O
H A 0076 LYS N 2.864 H A 0073 TYR O
H A 0076 LYS N 2.836 H A 0074 ILE O
H A 0076 LYS N 2.205 H A 0075 ASP O
H A 0077 VAL N 2.663 H A 0073 TYR O
H A 0077 VAL N 2.748 H A 0074 ILE O
H A 0077 VAL N 2.192 H A 0076 LYS O
H A 0078 GLU N 2.707 H A 0074 ILE O
H A 0078 GLU N 2.969 H A 0076 LYS O
H A 0078 GLU N 2.228 H A 0077 VAL O
H A 0079 GLU N 3.173 H A 0075 ASP O
H A 0079 GLU N 2.743 H A 0076 LYS O
H A 0079 GLU N 3.149 H A 0077 VAL O
H A 0079 GLU N 2.183 H A 0078 GLU O
H A 0080 LEU N 2.955 H A 0077 VAL O
H A 0080 LEU N 3.157 H A 0078 GLU O
H A 0080 LEU N 2.203 H A 0079 GLU O
H A 0081 LYS N 2.828 H A 0078 GLU O
H A 0081 LYS N 2.981 H A 0079 GLU O
H A 0081 LYS N 2.228 H A 0080 LEU O
H A 0082 LYS N 2.814 H A 0079 GLU O
H A 0082 LYS N 2.781 H A 0080 LEU O
H A 0082 LYS N 2.232 H A 0081 LYS O
H A 0083 LYS N 2.845 H A 0079 GLU O
H A 0083 LYS N 3.100 H A 0080 LEU O
H A 0083 LYS N 2.215 H A 0082 LYS O
H A 0084 TYR N 2.737 H A 0080 LEU O
H A 0084 TYR N 2.235 H A 0083 LYS O
C A 0085 GLY N 3.183 H A 0080 LEU O
C A 0085 GLY N 3.050 H A 0081 LYS O
C A 0085 GLY N 2.206 H A 0084 TYR O
C A 0086 ILE N 2.208 C A 0085 GLY O
HB_MS 2.00 3.20 25
C A 0001 SER N 2.613 H A 0004 GLU OE2
C A 0002 GLN N 2.821 H A 0004 GLU OE2
H A 0003 ALA O 2.765 C A 0002 GLN NE2
H A 0009 ALA O 2.581 H A 0013 LYS NZ
H A 0010 GLU O 2.648 H A 0014 HIS ND1
C A 0016 LYS O 2.746 C A 0017 THR OG1
H A 0020 ALA N 2.779 H A 0084 TYR OH
H A 0025 LEU O 3.116 H A 0029 SER OG
H A 0026 PHE O 2.562 H A 0029 SER OG
H A 0031 TYR O 2.675 H A 0035 THR OG1
H A 0033 GLN O 2.815 H A 0066 LYS NZ
H A 0034 ALA O 2.666 H A 0066 LYS NZ
H A 0035 THR O 2.674 H A 0066 LYS NZ
H A 0036 VAL N 2.681 H A 0035 THR OG1
H A 0036 VAL O 2.762 H A 0066 LYS NZ
C A 0038 ASP N 2.655 H A 0033 GLN OE1
C A 0038 ASP O 2.543 H A 0062 LYS NZ
C A 0039 ILE O 2.486 H A 0062 LYS NZ
C A 0041 THR O 2.656 H A 0055 TRP NE1
C A 0042 GLU N 3.129 C A 0041 THR OG1
C A 0042 GLU O 3.072 H A 0055 TRP NE1
C A 0063 GLY N 2.710 C A 0038 ASP OD2
C A 0064 THR O 2.812 H A 0033 GLN NE2
H A 0078 GLU O 2.708 H A 0082 LYS NZ
C A 0085 GLY O 2.690 C A 0016 LYS NZ
HB_SS 2.00 3.20 5
H A 0032 LYS NZ 2.703 H A 0028 TYR OH
C A 0038 ASP OD1 2.769 H A 0033 GLN NE2
H A 0055 TRP NE1 2.691 C A 0041 THR OG1
H A 0058 TRP NE1 2.639 H A 0033 GLN OE1
H A 0068 ASP OD2 2.772 H A 0065 SER OG
AROMATIC 0.00 8.00 10
H A 0026 PHE 3.757 H A 0030 HIS
H A 0013 LYS 6.737 H A 0031 TYR
H A 0032 LYS 7.053 H A 0031 TYR
H A 0013 LYS 6.633 H A 0014 HIS
C A 0043 ARG 6.384 H A 0055 TRP
H A 0062 LYS 7.786 H A 0055 TRP
H A 0028 TYR 5.526 H A 0058 TRP
H A 0032 LYS 4.239 H A 0028 TYR
H A 0032 LYS 4.892 H A 0058 TRP
C A 0050 LYS 6.238 C A 0049 PHE