Complet list of 1j46 con file
Complete list of 1j46.con file
COMMENT BEGIN
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CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "B"
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "C"
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "A"
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "C"
AND
CHAIN(S) "C"
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "C"
AND
CHAIN(S) "A"
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 358
C A 0001 MET C 2.431 C A 0002 GLN CA
C A 0001 MET C 3.390 C A 0002 GLN C
C A 0001 MET C 3.553 C A 0002 GLN CB
C A 0001 MET C 3.662 C A 0002 GLN CG
C A 0002 GLN C 2.421 C A 0003 ASP CA
C A 0002 GLN C 3.204 C A 0003 ASP C
C A 0002 GLN C 3.634 C A 0003 ASP CB
C A 0003 ASP C 2.408 C A 0004 ARG CA
C A 0003 ASP C 3.191 C A 0004 ARG C
C A 0003 ASP C 3.633 C A 0004 ARG CB
C A 0004 ARG C 2.421 C A 0005 VAL CA
C A 0004 ARG C 3.216 C A 0005 VAL C
C A 0004 ARG C 3.639 C A 0005 VAL CB
C A 0005 VAL C 2.422 C A 0006 LYS CA
C A 0005 VAL C 3.218 C A 0006 LYS C
C A 0005 VAL C 3.606 C A 0006 LYS CB
C A 0005 VAL C 3.654 C A 0006 LYS CG
C A 0005 VAL CG1 3.362 H A 0065 HIS CE1
C A 0005 VAL CG1 3.390 H A 0069 TYR CD2
C A 0005 VAL CG1 3.457 H A 0069 TYR CE2
C A 0005 VAL CB 3.757 C A 0072 TYR CE1
C A 0006 LYS C 2.440 C A 0007 ARG CA
C A 0006 LYS C 3.092 C A 0007 ARG C
C A 0006 LYS C 3.699 C A 0007 ARG CB
C A 0007 ARG CA 2.894 C A 0008 PRO CD
C A 0007 ARG C 2.446 C A 0008 PRO CA
C A 0007 ARG C 2.992 C A 0008 PRO C
C A 0007 ARG C 3.661 C A 0008 PRO CB
C A 0007 ARG C 3.636 C A 0008 PRO CG
C A 0007 ARG C 2.483 C A 0008 PRO CD
C A 0007 ARG CB 3.491 C A 0008 PRO CD
C A 0007 ARG CD 3.531 C A 0074 TYR CD1
C A 0007 ARG CD 3.480 C A 0074 TYR CE1
C A 0007 ARG CZ 3.644 C A 0074 TYR CG
C A 0007 ARG CZ 3.462 C A 0074 TYR CD1
C A 0007 ARG CZ 3.697 C A 0074 TYR CD2
C A 0007 ARG CZ 3.330 C A 0074 TYR CE1
C A 0007 ARG CZ 3.574 C A 0074 TYR CE2
C A 0007 ARG CZ 3.389 C A 0074 TYR CZ
C A 0008 PRO C 2.417 C A 0009 MET CA
C A 0008 PRO C 3.086 C A 0009 MET C
C A 0008 PRO C 3.665 C A 0009 MET CB
C A 0009 MET C 2.429 H A 0010 ASN CA
C A 0009 MET C 3.163 H A 0010 ASN C
C A 0009 MET C 3.671 H A 0010 ASN CB
C A 0009 MET CB 3.582 H A 0014 VAL CG2
H A 0010 ASN C 2.432 H A 0011 ALA CA
H A 0010 ASN C 2.926 H A 0011 ALA C
H A 0010 ASN C 3.696 H A 0011 ALA CB
H A 0010 ASN C 3.783 H A 0058 ALA CB
H A 0011 ALA C 2.408 H A 0012 PHE CA
H A 0011 ALA C 3.079 H A 0012 PHE C
H A 0011 ALA C 3.680 H A 0012 PHE CB
H A 0011 ALA CB 3.786 H A 0055 PHE CA
H A 0011 ALA CB 3.582 H A 0055 PHE CD1
H A 0011 ALA CB 3.741 H A 0055 PHE CE1
H A 0011 ALA CA 3.684 H A 0058 ALA CB
H A 0012 PHE C 2.403 H A 0013 ILE CA
H A 0012 PHE C 2.946 H A 0013 ILE C
H A 0012 PHE C 3.685 H A 0013 ILE CB
H A 0012 PHE CE2 3.466 H A 0015 TRP CZ3
H A 0012 PHE CE1 3.657 H A 0016 SER CB
H A 0012 PHE CD2 3.641 H A 0043 TRP CG
H A 0012 PHE CD2 3.782 H A 0043 TRP CD1
H A 0012 PHE CD2 3.779 H A 0043 TRP CD2
H A 0013 ILE C 2.425 H A 0014 VAL CA
H A 0013 ILE C 2.962 H A 0014 VAL C
H A 0013 ILE C 3.700 H A 0014 VAL CB
H A 0014 VAL C 2.444 H A 0015 TRP CA
H A 0014 VAL C 3.054 H A 0015 TRP C
H A 0014 VAL C 3.692 H A 0015 TRP CB
H A 0014 VAL CG2 3.592 H A 0061 LEU CD1
H A 0015 TRP C 2.416 H A 0016 SER CA
H A 0015 TRP C 3.135 H A 0016 SER C
H A 0015 TRP C 3.668 H A 0016 SER CB
H A 0015 TRP CZ2 3.526 H A 0019 GLN CG
H A 0015 TRP CB 3.574 H A 0043 TRP CZ3
H A 0015 TRP CG 3.638 H A 0043 TRP CE3
H A 0015 TRP CG 3.241 H A 0043 TRP CZ3
H A 0015 TRP CD1 3.609 H A 0043 TRP CZ3
H A 0015 TRP CD2 3.222 H A 0043 TRP CE3
H A 0015 TRP CD2 3.424 H A 0043 TRP CZ3
H A 0015 TRP CE2 3.541 H A 0043 TRP CE3
H A 0015 TRP CE3 3.404 H A 0043 TRP CE3
H A 0015 TRP CD1 3.588 H A 0054 PHE CE1
H A 0015 TRP CD1 3.617 H A 0054 PHE CZ
H A 0016 SER C 2.412 H A 0017 ARG CA
H A 0016 SER C 2.866 H A 0017 ARG C
H A 0016 SER C 3.686 H A 0017 ARG CB
H A 0016 SER C 3.667 H A 0020 ARG CB
H A 0017 ARG C 2.424 H A 0018 ASP CA
H A 0017 ARG C 3.179 H A 0018 ASP C
H A 0017 ARG C 3.662 H A 0018 ASP CB
H A 0018 ASP C 2.419 H A 0019 GLN CA
H A 0018 ASP C 3.042 H A 0019 GLN C
H A 0018 ASP C 3.689 H A 0019 GLN CB
H A 0019 GLN C 2.434 H A 0020 ARG CA
H A 0019 GLN C 2.945 H A 0020 ARG C
H A 0019 GLN C 3.694 H A 0020 ARG CB
H A 0019 GLN CG 3.762 H A 0039 LEU CD2
H A 0020 ARG C 2.419 H A 0021 ARG CA
H A 0020 ARG C 3.025 H A 0021 ARG C
H A 0020 ARG C 3.700 H A 0021 ARG CB
H A 0021 ARG C 2.427 H A 0022 LYS CA
H A 0021 ARG C 2.953 H A 0022 LYS C
H A 0021 ARG C 3.682 H A 0022 LYS CB
H A 0022 LYS C 2.428 H A 0023 MET CA
H A 0022 LYS C 3.054 H A 0023 MET C
H A 0022 LYS C 3.688 H A 0023 MET CB
H A 0023 MET C 2.414 H A 0024 ALA CA
H A 0023 MET C 3.047 H A 0024 ALA C
H A 0023 MET C 3.688 H A 0024 ALA CB
H A 0023 MET CG 3.746 H A 0035 ILE CG2
H A 0024 ALA C 2.410 H A 0025 LEU CA
H A 0024 ALA C 3.010 H A 0025 LEU C
H A 0024 ALA C 3.688 H A 0025 LEU CB
H A 0024 ALA C 3.636 H A 0027 ASN C
H A 0024 ALA C 3.783 C A 0028 PRO CA
H A 0025 LEU C 2.420 H A 0026 GLU CA
H A 0025 LEU C 3.130 H A 0026 GLU C
H A 0025 LEU C 3.667 H A 0026 GLU CB
H A 0025 LEU C 3.788 C A 0028 PRO CD
H A 0026 GLU C 2.437 H A 0027 ASN CA
H A 0026 GLU C 3.533 H A 0027 ASN C
H A 0026 GLU C 3.418 H A 0027 ASN CB
H A 0026 GLU C 3.294 H A 0027 ASN CG
H A 0026 GLU C 3.259 C A 0028 PRO CD
H A 0027 ASN CA 2.865 C A 0028 PRO CD
H A 0027 ASN C 2.459 C A 0028 PRO CA
H A 0027 ASN C 3.186 C A 0028 PRO C
H A 0027 ASN C 3.633 C A 0028 PRO CB
H A 0027 ASN C 3.644 C A 0028 PRO CG
H A 0027 ASN C 2.470 C A 0028 PRO CD
C A 0028 PRO C 2.426 C A 0029 ARG CA
C A 0028 PRO C 3.388 C A 0029 ARG C
C A 0028 PRO C 3.534 C A 0029 ARG CB
C A 0028 PRO C 3.510 C A 0029 ARG CG
C A 0029 ARG C 2.418 C A 0030 MET CA
C A 0029 ARG C 3.113 C A 0030 MET C
C A 0029 ARG C 3.664 C A 0030 MET CB
C A 0030 MET C 2.419 H A 0031 ARG CA
C A 0030 MET C 3.094 H A 0031 ARG C
C A 0030 MET C 3.661 H A 0031 ARG CB
C A 0030 MET CB 3.716 H A 0035 ILE CG1
C A 0030 MET CG 3.386 H A 0035 ILE CG1
H A 0031 ARG C 2.413 H A 0032 ASN CA
H A 0031 ARG C 2.920 H A 0032 ASN C
H A 0031 ARG C 3.719 H A 0032 ASN CB
H A 0032 ASN C 2.405 H A 0033 SER CA
H A 0032 ASN C 2.955 H A 0033 SER C
H A 0032 ASN C 3.683 H A 0033 SER CB
H A 0033 SER C 2.405 H A 0034 GLU CA
H A 0033 SER C 3.137 H A 0034 GLU C
H A 0033 SER C 3.654 H A 0034 GLU CB
H A 0034 GLU C 2.407 H A 0035 ILE CA
H A 0034 GLU C 2.908 H A 0035 ILE C
H A 0034 GLU C 3.707 H A 0035 ILE CB
H A 0035 ILE C 2.411 H A 0036 SER CA
H A 0035 ILE C 2.892 H A 0036 SER C
H A 0035 ILE C 3.676 H A 0036 SER CB
H A 0035 ILE CG2 3.656 H A 0039 LEU CG
H A 0035 ILE CG2 3.458 H A 0039 LEU CD1
H A 0036 SER C 2.427 H A 0037 LYS CA
H A 0036 SER C 3.103 H A 0037 LYS C
H A 0036 SER C 3.690 H A 0037 LYS CB
H A 0037 LYS C 2.409 H A 0038 GLN CA
H A 0037 LYS C 3.035 H A 0038 GLN C
H A 0037 LYS C 3.684 H A 0038 GLN CB
H A 0038 GLN C 2.410 H A 0039 LEU CA
H A 0038 GLN C 2.929 H A 0039 LEU C
H A 0038 GLN C 3.691 H A 0039 LEU CB
H A 0039 LEU C 2.409 H A 0040 GLY CA
H A 0039 LEU C 2.955 H A 0040 GLY C
H A 0040 GLY C 2.423 H A 0041 TYR CA
H A 0040 GLY C 2.997 H A 0041 TYR C
H A 0040 GLY C 3.679 H A 0041 TYR CB
H A 0041 TYR C 2.425 H A 0042 GLN CA
H A 0041 TYR C 3.042 H A 0042 GLN C
H A 0041 TYR C 3.690 H A 0042 GLN CB
H A 0041 TYR CE1 3.682 C A 0045 MET CE
H A 0041 TYR CZ 3.421 C A 0045 MET CE
H A 0042 GLN C 2.434 H A 0043 TRP CA
H A 0042 GLN C 2.989 H A 0043 TRP C
H A 0042 GLN C 3.689 H A 0043 TRP CB
H A 0043 TRP C 2.411 H A 0044 LYS CA
H A 0043 TRP C 3.060 H A 0044 LYS C
H A 0043 TRP C 3.680 H A 0044 LYS CB
H A 0043 TRP CE3 3.321 C A 0046 LEU CD1
H A 0043 TRP CZ3 3.694 C A 0046 LEU CD1
H A 0043 TRP CZ2 3.649 H A 0051 LYS CE
H A 0044 LYS C 2.423 C A 0045 MET CA
H A 0044 LYS C 3.297 C A 0045 MET C
H A 0044 LYS C 3.613 C A 0045 MET CB
H A 0044 LYS C 3.792 C A 0045 MET CG
C A 0045 MET C 2.414 C A 0046 LEU CA
C A 0045 MET C 3.050 C A 0046 LEU C
C A 0045 MET C 3.690 C A 0046 LEU CB
C A 0046 LEU C 2.422 H A 0047 THR CA
C A 0046 LEU C 3.178 H A 0047 THR C
C A 0046 LEU C 3.660 H A 0047 THR CB
C A 0046 LEU CB 3.466 H A 0051 LYS CG
H A 0047 THR C 2.420 H A 0048 GLU CA
H A 0047 THR C 3.015 H A 0048 GLU C
H A 0047 THR C 3.695 H A 0048 GLU CB
H A 0048 GLU C 2.414 H A 0049 ALA CA
H A 0048 GLU C 2.947 H A 0049 ALA C
H A 0048 GLU C 3.693 H A 0049 ALA CB
H A 0049 ALA C 2.418 H A 0050 GLU CA
H A 0049 ALA C 3.038 H A 0050 GLU C
H A 0049 ALA C 3.685 H A 0050 GLU CB
H A 0050 GLU C 2.426 H A 0051 LYS CA
H A 0050 GLU C 3.110 H A 0051 LYS C
H A 0050 GLU C 3.684 H A 0051 LYS CB
H A 0050 GLU C 3.517 H A 0053 PRO CD
H A 0051 LYS C 2.426 H A 0052 TRP CA
H A 0051 LYS C 2.903 H A 0052 TRP C
H A 0051 LYS C 3.699 H A 0052 TRP CB
H A 0051 LYS C 3.414 H A 0053 PRO CD
H A 0051 LYS CE 3.686 H A 0055 PHE CE1
H A 0052 TRP CA 2.981 H A 0053 PRO CD
H A 0052 TRP C 2.446 H A 0053 PRO CA
H A 0052 TRP C 2.974 H A 0053 PRO C
H A 0052 TRP C 3.664 H A 0053 PRO CB
H A 0052 TRP C 3.640 H A 0053 PRO CG
H A 0052 TRP C 2.498 H A 0053 PRO CD
H A 0052 TRP CB 3.217 H A 0053 PRO CD
H A 0052 TRP CG 3.734 H A 0053 PRO CD
H A 0052 TRP CD1 3.671 H A 0053 PRO CD
H A 0052 TRP CZ2 3.478 H A 0056 GLN CD
H A 0053 PRO C 2.431 H A 0054 PHE CA
H A 0053 PRO C 3.175 H A 0054 PHE C
H A 0053 PRO C 3.666 H A 0054 PHE CB
H A 0054 PHE C 2.413 H A 0055 PHE CA
H A 0054 PHE C 3.024 H A 0055 PHE C
H A 0054 PHE C 3.690 H A 0055 PHE CB
H A 0055 PHE C 2.409 H A 0056 GLN CA
H A 0055 PHE C 2.938 H A 0056 GLN C
H A 0055 PHE C 3.694 H A 0056 GLN CB
H A 0056 GLN C 2.414 H A 0057 GLU CA
H A 0056 GLN C 2.974 H A 0057 GLU C
H A 0056 GLN C 3.695 H A 0057 GLU CB
H A 0057 GLU C 2.414 H A 0058 ALA CA
H A 0057 GLU C 2.914 H A 0058 ALA C
H A 0057 GLU C 3.699 H A 0058 ALA CB
H A 0058 ALA CA 3.796 H A 0059 GLN CA
H A 0058 ALA C 2.416 H A 0059 GLN CA
H A 0058 ALA C 2.982 H A 0059 GLN C
H A 0058 ALA C 3.682 H A 0059 GLN CB
H A 0059 GLN C 2.429 H A 0060 LYS CA
H A 0059 GLN C 3.031 H A 0060 LYS C
H A 0059 GLN C 3.693 H A 0060 LYS CB
H A 0060 LYS C 2.421 H A 0061 LEU CA
H A 0060 LYS C 2.953 H A 0061 LEU C
H A 0060 LYS C 3.706 H A 0061 LEU CB
H A 0061 LEU C 2.418 H A 0062 GLN CA
H A 0061 LEU C 3.042 H A 0062 GLN C
H A 0061 LEU C 3.681 H A 0062 GLN CB
H A 0062 GLN C 2.419 H A 0063 ALA CA
H A 0062 GLN C 3.019 H A 0063 ALA C
H A 0062 GLN C 3.695 H A 0063 ALA CB
H A 0063 ALA C 2.419 H A 0064 MET CA
H A 0063 ALA C 2.985 H A 0064 MET C
H A 0063 ALA C 3.697 H A 0064 MET CB
H A 0064 MET C 2.416 H A 0065 HIS CA
H A 0064 MET C 2.947 H A 0065 HIS C
H A 0064 MET C 3.693 H A 0065 HIS CB
H A 0065 HIS C 2.432 H A 0066 ARG CA
H A 0065 HIS C 3.038 H A 0066 ARG C
H A 0065 HIS C 3.711 H A 0066 ARG CB
H A 0066 ARG C 2.402 H A 0067 GLU CA
H A 0066 ARG C 3.033 H A 0067 GLU C
H A 0066 ARG C 3.678 H A 0067 GLU CB
H A 0067 GLU C 2.412 H A 0068 LYS CA
H A 0067 GLU C 3.014 H A 0068 LYS C
H A 0067 GLU C 3.674 H A 0068 LYS CB
H A 0068 LYS C 2.434 H A 0069 TYR CA
H A 0068 LYS C 3.536 H A 0069 TYR C
H A 0068 LYS C 3.411 H A 0069 TYR CB
H A 0068 LYS C 3.287 H A 0069 TYR CG
H A 0068 LYS C 3.399 H A 0069 TYR CD1
H A 0068 LYS CG 3.709 H A 0069 TYR CE1
H A 0068 LYS CG 3.723 H A 0069 TYR CE2
H A 0068 LYS CG 3.494 H A 0069 TYR CZ
H A 0068 LYS CD 3.480 H A 0069 TYR CE2
H A 0068 LYS CD 3.339 H A 0069 TYR CZ
H A 0068 LYS CE 3.717 H A 0069 TYR CZ
H A 0068 LYS C 3.471 C A 0070 PRO CD
H A 0069 TYR CA 2.852 C A 0070 PRO CD
H A 0069 TYR C 2.460 C A 0070 PRO CA
H A 0069 TYR C 3.093 C A 0070 PRO C
H A 0069 TYR C 3.665 C A 0070 PRO CB
H A 0069 TYR C 3.631 C A 0070 PRO CG
H A 0069 TYR C 2.460 C A 0070 PRO CD
H A 0069 TYR CB 3.675 C A 0072 TYR CB
C A 0070 PRO C 2.422 C A 0071 ASN CA
C A 0070 PRO C 3.377 C A 0071 ASN C
C A 0070 PRO C 3.551 C A 0071 ASN CB
C A 0071 ASN C 2.417 C A 0072 TYR CA
C A 0071 ASN C 3.017 C A 0072 TYR C
C A 0071 ASN C 3.686 C A 0072 TYR CB
C A 0072 TYR C 2.425 C A 0073 LYS CA
C A 0072 TYR C 3.553 C A 0073 LYS C
C A 0072 TYR C 3.385 C A 0073 LYS CB
C A 0072 TYR CD2 3.775 C A 0073 LYS C
C A 0072 TYR CE2 3.591 C A 0073 LYS C
C A 0073 LYS C 2.411 C A 0074 TYR CA
C A 0073 LYS C 3.069 C A 0074 TYR C
C A 0073 LYS C 3.669 C A 0074 TYR CB
C A 0073 LYS CG 3.758 C A 0075 ARG CG
C A 0074 TYR C 2.423 C A 0075 ARG CA
C A 0074 TYR C 3.533 C A 0075 ARG C
C A 0074 TYR C 3.358 C A 0075 ARG CB
C A 0074 TYR C 3.207 C A 0075 ARG CG
C A 0074 TYR C 3.703 C A 0076 PRO CD
C A 0074 TYR CE2 3.600 C A 0076 PRO CG
C A 0074 TYR CE2 3.674 C A 0076 PRO CD
C A 0074 TYR CZ 3.574 C A 0076 PRO CB
C A 0074 TYR CZ 3.608 C A 0076 PRO CG
C A 0074 TYR CZ 3.762 C A 0076 PRO CD
C A 0075 ARG CA 2.904 C A 0076 PRO CD
C A 0075 ARG C 2.455 C A 0076 PRO CA
C A 0075 ARG C 3.128 C A 0076 PRO C
C A 0075 ARG C 3.649 C A 0076 PRO CB
C A 0075 ARG C 3.655 C A 0076 PRO CG
C A 0075 ARG C 2.488 C A 0076 PRO CD
C A 0076 PRO C 2.417 C A 0077 ARG CA
C A 0076 PRO C 3.203 C A 0077 ARG C
C A 0076 PRO C 3.658 C A 0077 ARG CB
C A 0077 ARG C 2.417 C A 0078 ARG CA
C A 0077 ARG C 3.192 C A 0078 ARG C
C A 0077 ARG C 3.639 C A 0078 ARG CB
C A 0078 ARG C 2.432 C A 0079 LYS CA
C A 0078 ARG C 3.242 C A 0079 LYS C
C A 0078 ARG C 3.619 C A 0079 LYS CB
C A 0079 LYS C 2.394 C A 0080 ALA CA
C A 0079 LYS C 2.964 C A 0080 ALA C
C A 0079 LYS C 3.683 C A 0080 ALA CB
C A 0080 ALA C 2.416 C A 0081 LYS CA
C A 0080 ALA C 3.582 C A 0081 LYS C
C A 0080 ALA C 3.305 C A 0081 LYS CB
C A 0081 LYS C 2.427 C A 0082 MET CA
C A 0081 LYS C 3.539 C A 0082 MET C
C A 0081 LYS C 3.373 C A 0082 MET CB
C A 0081 LYS CE 3.703 C A 0083 LEU CD2
C A 0082 MET C 2.418 C A 0083 LEU CA
C A 0082 MET C 3.235 C A 0083 LEU C
C A 0082 MET C 3.627 C A 0083 LEU CB
C A 0083 LEU CA 2.907 C A 0084 PRO CD
C A 0083 LEU C 2.461 C A 0084 PRO CA
C A 0083 LEU C 3.091 C A 0084 PRO C
C A 0083 LEU C 3.659 C A 0084 PRO CB
C A 0083 LEU C 3.643 C A 0084 PRO CG
C A 0083 LEU C 2.484 C A 0084 PRO CD
C A 0083 LEU CB 3.663 C A 0084 PRO CD
C A 0084 PRO C 2.429 C A 0085 LYS CA
C A 0084 PRO C 3.553 C A 0085 LYS C
C A 0084 PRO C 3.375 C A 0085 LYS CB
C A 0084 PRO C 3.284 C A 0085 LYS CG
CHARGE_ATTR 2.00 12.00 45
C A 0003 ASP OD1 11.94 C A 0004 ARG NH1
C A 0003 ASP OD1 9.218 C A 0006 LYS NZ
C A 0003 ASP OD2 9.737 C A 0006 LYS NZ
C A 0003 ASP OD1 11.96 H A 0068 LYS NZ
C A 0003 ASP OD2 10.07 H A 0068 LYS NZ
H A 0018 ASP OD1 10.31 H A 0017 ARG NH1
H A 0018 ASP OD1 9.107 H A 0017 ARG NH2
H A 0018 ASP OD2 10.42 H A 0017 ARG NH1
H A 0018 ASP OD2 9.450 H A 0017 ARG NH2
H A 0018 ASP OD1 11.75 H A 0020 ARG NH1
H A 0018 ASP OD1 11.61 H A 0020 ARG NH2
H A 0018 ASP OD1 7.908 H A 0021 ARG NH1
H A 0018 ASP OD1 9.743 H A 0021 ARG NH2
H A 0018 ASP OD2 9.832 H A 0021 ARG NH1
H A 0018 ASP OD2 11.76 H A 0021 ARG NH2
H A 0018 ASP OD1 8.447 H A 0022 LYS NZ
H A 0018 ASP OD2 8.959 H A 0022 LYS NZ
H A 0026 GLU OE1 4.824 H A 0022 LYS NZ
H A 0026 GLU OE2 3.856 H A 0022 LYS NZ
H A 0034 GLU OE1 7.605 H A 0031 ARG NH1
H A 0034 GLU OE1 7.611 H A 0031 ARG NH2
H A 0034 GLU OE2 6.298 H A 0031 ARG NH1
H A 0034 GLU OE2 6.580 H A 0031 ARG NH2
H A 0034 GLU OE1 7.428 H A 0037 LYS NZ
H A 0034 GLU OE2 6.462 H A 0037 LYS NZ
H A 0048 GLU OE1 8.396 H A 0051 LYS NZ
H A 0048 GLU OE2 8.461 H A 0051 LYS NZ
H A 0050 GLU OE1 9.641 H A 0051 LYS NZ
H A 0050 GLU OE2 11.40 H A 0051 LYS NZ
H A 0057 GLU OE1 10.14 H A 0017 ARG NH1
H A 0057 GLU OE1 10.72 H A 0017 ARG NH2
H A 0057 GLU OE2 8.916 H A 0017 ARG NH1
H A 0057 GLU OE2 9.463 H A 0017 ARG NH2
H A 0057 GLU OE1 9.277 H A 0060 LYS NZ
H A 0057 GLU OE2 8.320 H A 0060 LYS NZ
H A 0067 GLU OE1 8.999 H A 0060 LYS NZ
H A 0067 GLU OE2 10.69 H A 0060 LYS NZ
H A 0067 GLU OE1 10.60 H A 0065 HIS ND1
H A 0067 GLU OE1 11.81 H A 0065 HIS NE2
H A 0067 GLU OE2 11.95 H A 0065 HIS ND1
H A 0067 GLU OE1 10.01 H A 0066 ARG NH1
H A 0067 GLU OE1 11.68 H A 0066 ARG NH2
H A 0067 GLU OE2 10.88 H A 0066 ARG NH1
H A 0067 GLU OE1 10.55 H A 0068 LYS NZ
H A 0067 GLU OE2 10.94 H A 0068 LYS NZ
CHARGE_REPU 2.00 12.00 57
C A 0004 ARG NH1 8.460 C A 0006 LYS NZ
C A 0004 ARG NH2 10.20 C A 0006 LYS NZ
C A 0004 ARG NH1 10.10 C A 0007 ARG NH1
C A 0004 ARG NH1 11.81 C A 0007 ARG NH2
C A 0004 ARG NH2 9.128 C A 0007 ARG NH1
C A 0004 ARG NH2 10.68 C A 0007 ARG NH2
C A 0004 ARG NH1 11.90 H A 0065 HIS NE2
C A 0004 ARG NH2 11.40 H A 0065 HIS NE2
C A 0004 ARG NH1 10.75 C A 0075 ARG NH1
C A 0004 ARG NH1 8.801 C A 0075 ARG NH2
C A 0004 ARG NH2 8.739 C A 0075 ARG NH1
C A 0004 ARG NH2 6.955 C A 0075 ARG NH2
C A 0004 ARG NH1 8.728 C A 0077 ARG NH1
C A 0004 ARG NH1 8.066 C A 0077 ARG NH2
C A 0004 ARG NH2 8.996 C A 0077 ARG NH1
C A 0004 ARG NH2 8.204 C A 0077 ARG NH2
C A 0006 LYS NZ 11.16 H A 0017 ARG NH1
C A 0006 LYS NZ 11.35 H A 0065 HIS ND1
C A 0006 LYS NZ 11.11 H A 0065 HIS NE2
C A 0007 ARG NH1 10.56 H A 0065 HIS NE2
C A 0007 ARG NH2 11.51 H A 0065 HIS ND1
C A 0007 ARG NH2 10.01 H A 0065 HIS NE2
C A 0007 ARG NH2 11.89 C A 0073 LYS NZ
H A 0017 ARG NH1 11.12 H A 0020 ARG NH2
H A 0017 ARG NH2 11.52 H A 0020 ARG NH2
H A 0017 ARG NH1 11.94 H A 0021 ARG NH1
H A 0017 ARG NH2 9.953 H A 0021 ARG NH1
H A 0017 ARG NH2 11.95 H A 0021 ARG NH2
H A 0017 ARG NH1 10.75 H A 0065 HIS ND1
H A 0018 ASP OD1 11.31 H A 0026 GLU OE1
H A 0018 ASP OD1 10.37 H A 0026 GLU OE2
H A 0018 ASP OD2 11.47 H A 0026 GLU OE2
H A 0018 ASP OD1 10.48 H A 0057 GLU OE1
H A 0018 ASP OD1 10.71 H A 0057 GLU OE2
H A 0018 ASP OD2 8.680 H A 0057 GLU OE1
H A 0018 ASP OD2 9.078 H A 0057 GLU OE2
C A 0029 ARG NH1 11.97 H A 0031 ARG NH2
H A 0031 ARG NH1 10.20 H A 0037 LYS NZ
H A 0031 ARG NH2 11.61 H A 0037 LYS NZ
H A 0044 LYS NZ 9.526 H A 0051 LYS NZ
H A 0048 GLU OE1 11.73 H A 0050 GLU OE1
H A 0065 HIS ND1 11.84 H A 0066 ARG NH2
H A 0065 HIS NE2 11.59 H A 0066 ARG NH1
H A 0065 HIS NE2 11.04 H A 0066 ARG NH2
H A 0065 HIS ND1 7.430 H A 0068 LYS NZ
H A 0065 HIS NE2 8.926 H A 0068 LYS NZ
H A 0066 ARG NH2 11.85 C A 0073 LYS NZ
C A 0073 LYS NZ 7.101 C A 0075 ARG NH1
C A 0073 LYS NZ 8.940 C A 0075 ARG NH2
C A 0075 ARG NH2 10.55 C A 0077 ARG NH2
C A 0077 ARG NH1 8.662 C A 0079 LYS NZ
C A 0077 ARG NH2 10.77 C A 0079 LYS NZ
C A 0078 ARG NH1 11.74 C A 0079 LYS NZ
C A 0078 ARG NH2 11.43 C A 0079 LYS NZ
C A 0078 ARG NH1 7.654 C A 0081 LYS NZ
C A 0078 ARG NH2 6.596 C A 0081 LYS NZ
C A 0079 LYS NZ 10.04 C A 0081 LYS NZ
HB_MM 2.00 3.20 154
C A 0002 GLN N 2.198 C A 0001 MET O
C A 0003 ASP N 2.201 C A 0002 GLN O
C A 0004 ARG N 2.187 C A 0003 ASP O
C A 0005 VAL N 2.199 C A 0004 ARG O
C A 0006 LYS N 2.197 C A 0005 VAL O
C A 0007 ARG N 2.200 C A 0006 LYS O
C A 0008 PRO N 2.206 C A 0007 ARG O
C A 0009 MET N 2.192 C A 0008 PRO O
H A 0010 ASN N 2.199 C A 0009 MET O
H A 0011 ALA N 2.202 H A 0010 ASN O
H A 0012 PHE N 2.947 H A 0010 ASN O
H A 0012 PHE N 2.190 H A 0011 ALA O
H A 0013 ILE N 2.946 H A 0010 ASN O
H A 0013 ILE N 2.190 H A 0012 PHE O
H A 0014 VAL N 2.877 H A 0010 ASN O
H A 0014 VAL N 2.192 H A 0013 ILE O
H A 0015 TRP N 2.974 H A 0011 ALA O
H A 0015 TRP N 2.209 H A 0014 VAL O
H A 0016 SER N 2.635 H A 0012 PHE O
H A 0016 SER N 3.157 H A 0013 ILE O
H A 0016 SER N 2.194 H A 0015 TRP O
H A 0017 ARG N 2.858 H A 0013 ILE O
H A 0017 ARG N 2.188 H A 0016 SER O
H A 0018 ASP N 3.111 H A 0016 SER O
H A 0018 ASP N 2.198 H A 0017 ARG O
H A 0019 GLN N 3.028 H A 0015 TRP O
H A 0019 GLN N 3.164 H A 0016 SER O
H A 0019 GLN N 2.192 H A 0018 ASP O
H A 0020 ARG N 2.393 H A 0016 SER O
H A 0020 ARG N 2.199 H A 0019 GLN O
H A 0021 ARG N 2.192 H A 0020 ARG O
H A 0022 LYS N 3.160 H A 0018 ASP O
H A 0022 LYS N 2.946 H A 0019 GLN O
H A 0022 LYS N 2.195 H A 0021 ARG O
H A 0023 MET N 2.935 H A 0019 GLN O
H A 0023 MET N 2.198 H A 0022 LYS O
H A 0024 ALA N 3.013 H A 0020 ARG O
H A 0024 ALA N 3.135 H A 0021 ARG O
H A 0024 ALA N 2.193 H A 0023 MET O
H A 0025 LEU N 3.000 H A 0021 ARG O
H A 0025 LEU N 2.190 H A 0024 ALA O
H A 0026 GLU N 3.182 H A 0022 LYS O
H A 0026 GLU N 2.198 H A 0025 LEU O
H A 0027 ASN N 2.413 H A 0023 MET O
H A 0027 ASN N 2.204 H A 0026 GLU O
C A 0028 PRO N 2.537 H A 0024 ALA O
C A 0028 PRO N 2.204 H A 0027 ASN O
C A 0029 ARG N 2.195 C A 0028 PRO O
C A 0030 MET N 2.196 C A 0029 ARG O
H A 0031 ARG N 2.190 C A 0030 MET O
H A 0032 ASN N 2.194 H A 0031 ARG O
H A 0033 SER N 2.949 H A 0031 ARG O
H A 0033 SER N 2.192 H A 0032 ASN O
H A 0034 GLU N 2.951 H A 0031 ARG O
H A 0034 GLU N 2.195 H A 0033 SER O
H A 0035 ILE N 3.018 H A 0031 ARG O
H A 0035 ILE N 2.195 H A 0034 GLU O
H A 0036 SER N 2.738 H A 0032 ASN O
H A 0036 SER N 2.195 H A 0035 ILE O
H A 0037 LYS N 2.926 H A 0034 GLU O
H A 0037 LYS N 2.964 H A 0035 ILE O
H A 0037 LYS N 2.197 H A 0036 SER O
H A 0038 GLN N 3.025 H A 0034 GLU O
H A 0038 GLN N 2.951 H A 0035 ILE O
H A 0038 GLN N 2.187 H A 0037 LYS O
H A 0039 LEU N 2.822 H A 0035 ILE O
H A 0039 LEU N 2.193 H A 0038 GLN O
H A 0040 GLY N 3.178 H A 0036 SER O
H A 0040 GLY N 2.194 H A 0039 LEU O
H A 0041 TYR N 3.097 H A 0037 LYS O
H A 0041 TYR N 3.004 H A 0038 GLN O
H A 0041 TYR N 2.198 H A 0040 GLY O
H A 0042 GLN N 2.725 H A 0038 GLN O
H A 0042 GLN N 3.187 H A 0039 LEU O
H A 0042 GLN N 2.198 H A 0041 TYR O
H A 0043 TRP N 2.567 H A 0039 LEU O
H A 0043 TRP N 2.199 H A 0042 GLN O
H A 0044 LYS N 3.028 H A 0040 GLY O
H A 0044 LYS N 2.190 H A 0043 TRP O
C A 0045 MET N 2.886 H A 0042 GLN O
C A 0045 MET N 3.125 H A 0043 TRP O
C A 0045 MET N 2.193 H A 0044 LYS O
C A 0046 LEU N 2.189 C A 0045 MET O
H A 0047 THR N 2.194 C A 0046 LEU O
H A 0048 GLU N 2.194 H A 0047 THR O
H A 0049 ALA N 2.197 H A 0048 GLU O
H A 0050 GLU N 2.197 H A 0049 ALA O
H A 0051 LYS N 2.768 H A 0047 THR O
H A 0051 LYS N 3.159 H A 0048 GLU O
H A 0051 LYS N 2.191 H A 0050 GLU O
H A 0052 TRP N 2.522 H A 0048 GLU O
H A 0052 TRP N 2.194 H A 0051 LYS O
H A 0053 PRO N 3.145 H A 0051 LYS O
H A 0053 PRO N 2.198 H A 0052 TRP O
H A 0054 PHE N 2.806 H A 0051 LYS O
H A 0054 PHE N 2.913 H A 0052 TRP O
H A 0054 PHE N 2.196 H A 0053 PRO O
H A 0055 PHE N 2.968 H A 0051 LYS O
H A 0055 PHE N 2.805 H A 0052 TRP O
H A 0055 PHE N 2.192 H A 0054 PHE O
H A 0056 GLN N 2.859 H A 0052 TRP O
H A 0056 GLN N 2.195 H A 0055 PHE O
H A 0057 GLU N 2.195 H A 0056 GLN O
H A 0058 ALA N 3.087 H A 0054 PHE O
H A 0058 ALA N 3.126 H A 0055 PHE O
H A 0058 ALA N 2.193 H A 0057 GLU O
H A 0059 GLN N 2.800 H A 0055 PHE O
H A 0059 GLN N 3.058 H A 0056 GLN O
H A 0059 GLN N 3.184 H A 0057 GLU O
H A 0059 GLN N 2.199 H A 0058 ALA O
H A 0060 LYS N 2.731 H A 0056 GLN O
H A 0060 LYS N 2.984 H A 0057 GLU O
H A 0060 LYS N 2.200 H A 0059 GLN O
H A 0061 LEU N 2.717 H A 0057 GLU O
H A 0061 LEU N 2.198 H A 0060 LYS O
H A 0062 GLN N 2.798 H A 0058 ALA O
H A 0062 GLN N 2.196 H A 0061 LEU O
H A 0063 ALA N 2.918 H A 0059 GLN O
H A 0063 ALA N 3.171 H A 0060 LYS O
H A 0063 ALA N 2.196 H A 0062 GLN O
H A 0064 MET N 2.762 H A 0060 LYS O
H A 0064 MET N 2.198 H A 0063 ALA O
H A 0065 HIS N 2.697 H A 0061 LEU O
H A 0065 HIS N 2.196 H A 0064 MET O
H A 0066 ARG N 2.877 H A 0062 GLN O
H A 0066 ARG N 3.086 H A 0063 ALA O
H A 0066 ARG N 2.204 H A 0065 HIS O
H A 0067 GLU N 2.965 H A 0063 ALA O
H A 0067 GLU N 3.006 H A 0064 MET O
H A 0067 GLU N 2.190 H A 0066 ARG O
H A 0068 LYS N 3.197 H A 0064 MET O
H A 0068 LYS N 2.193 H A 0067 GLU O
H A 0069 TYR N 3.159 H A 0065 HIS O
H A 0069 TYR N 2.201 H A 0068 LYS O
C A 0070 PRO N 2.905 H A 0066 ARG O
C A 0070 PRO N 2.204 H A 0069 TYR O
C A 0071 ASN N 3.032 H A 0069 TYR O
C A 0071 ASN N 2.196 C A 0070 PRO O
C A 0072 TYR N 3.024 H A 0069 TYR O
C A 0072 TYR N 2.194 C A 0071 ASN O
C A 0073 LYS N 2.197 C A 0072 TYR O
C A 0074 TYR N 2.196 C A 0073 LYS O
C A 0075 ARG N 2.193 C A 0074 TYR O
C A 0076 PRO N 2.205 C A 0075 ARG O
C A 0077 ARG N 2.199 C A 0076 PRO O
C A 0078 ARG N 2.197 C A 0077 ARG O
C A 0079 LYS N 2.195 C A 0078 ARG O
C A 0080 ALA N 2.195 C A 0079 LYS O
C A 0081 LYS N 2.890 C A 0079 LYS O
C A 0081 LYS N 2.191 C A 0080 ALA O
C A 0082 MET N 2.200 C A 0081 LYS O
C A 0083 LEU N 2.194 C A 0082 MET O
C A 0084 PRO N 2.206 C A 0083 LEU O
C A 0085 LYS N 2.198 C A 0084 PRO O
HB_MS 2.00 3.20 4
H A 0012 PHE O 2.331 H A 0016 SER OG
H A 0013 ILE O 2.719 H A 0016 SER OG
H A 0032 ASN O 2.396 H A 0036 SER OG
H A 0050 GLU N 3.184 H A 0047 THR OG1
HB_SS 2.00 3.20 1
C A 0007 ARG NH1 2.916 C A 0074 TYR OH
AROMATIC 0.00 8.00 7
H A 0020 ARG 5.994 H A 0012 PHE
H A 0065 HIS 5.958 C A 0072 TYR
H A 0012 PHE 5.653 H A 0043 TRP
H A 0051 LYS 4.891 H A 0043 TRP
C A 0007 ARG 2.983 C A 0074 TYR
H A 0051 LYS 5.716 H A 0055 PHE
H A 0065 HIS 5.705 H A 0069 TYR