Complet list of 1tmz con file
Complete list of 1tmz.con file
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 121
C A 0001 MET C 2.448 C A 0002 ASP CA
C A 0001 MET C 2.921 C A 0002 ASP C
C A 0001 MET C 3.735 C A 0002 ASP CB
C A 0001 MET CA 3.589 H A 0004 ILE CB
C A 0001 MET CA 3.574 H A 0004 ILE CG1
C A 0001 MET C 3.737 H A 0004 ILE CB
C A 0002 ASP C 2.448 C A 0003 ALA CA
C A 0002 ASP C 3.245 C A 0003 ALA C
C A 0002 ASP C 3.676 C A 0003 ALA CB
C A 0002 ASP CA 3.670 H A 0005 LYS CG
C A 0002 ASP CA 3.793 H A 0005 LYS CD
C A 0002 ASP C 3.504 H A 0005 LYS CG
C A 0003 ALA C 2.448 H A 0004 ILE CA
C A 0003 ALA C 3.129 H A 0004 ILE C
C A 0003 ALA C 3.697 H A 0004 ILE CB
H A 0004 ILE C 2.448 H A 0005 LYS CA
H A 0004 ILE C 2.935 H A 0005 LYS C
H A 0004 ILE C 3.731 H A 0005 LYS CB
H A 0004 ILE CA 3.691 H A 0007 LYS CB
H A 0005 LYS C 2.448 H A 0006 LYS CA
H A 0005 LYS C 3.210 H A 0006 LYS C
H A 0005 LYS C 3.664 H A 0006 LYS CB
H A 0005 LYS C 3.781 H A 0006 LYS CG
H A 0006 LYS C 2.448 H A 0007 LYS CA
H A 0006 LYS C 2.918 H A 0007 LYS C
H A 0006 LYS C 3.731 H A 0007 LYS CB
H A 0006 LYS CA 3.794 H A 0009 GLN CB
H A 0006 LYS C 3.788 H A 0009 GLN CB
H A 0006 LYS C 3.605 H A 0010 MET CG
H A 0007 LYS C 2.448 H A 0008 MET CA
H A 0007 LYS C 3.048 H A 0008 MET C
H A 0007 LYS C 3.725 H A 0008 MET CB
H A 0008 MET C 2.448 H A 0009 GLN CA
H A 0008 MET C 3.102 H A 0009 GLN C
H A 0008 MET C 3.724 H A 0009 GLN CB
H A 0008 MET C 3.659 H A 0012 LYS CG
H A 0009 GLN C 2.447 H A 0010 MET CA
H A 0009 GLN C 3.208 H A 0010 MET C
H A 0009 GLN C 3.684 H A 0010 MET CB
H A 0009 GLN CA 3.243 H A 0012 LYS CG
H A 0009 GLN C 3.398 H A 0012 LYS CG
H A 0010 MET C 2.448 H A 0011 LEU CA
H A 0010 MET C 3.130 H A 0011 LEU C
H A 0010 MET C 3.697 H A 0011 LEU CB
H A 0011 LEU C 2.447 H A 0012 LYS CA
H A 0011 LEU C 3.140 H A 0012 LYS C
H A 0011 LEU C 3.692 H A 0012 LYS CB
H A 0012 LYS C 2.448 H A 0013 LEU CA
H A 0012 LYS C 3.107 H A 0013 LEU C
H A 0012 LYS C 3.704 H A 0013 LEU CB
H A 0012 LYS CD 3.655 H A 0013 LEU CA
H A 0012 LYS CD 3.366 H A 0016 TYR CE2
H A 0012 LYS CD 3.683 H A 0016 TYR CZ
H A 0012 LYS CE 3.798 H A 0016 TYR CE2
H A 0013 LEU C 2.449 H A 0014 ASP CA
H A 0013 LEU C 3.070 H A 0014 ASP C
H A 0013 LEU C 3.732 H A 0014 ASP CB
H A 0014 ASP C 2.449 H A 0015 ASN CA
H A 0014 ASP C 3.001 H A 0015 ASN C
H A 0014 ASP C 3.738 H A 0015 ASN CB
H A 0014 ASP CG 3.663 H A 0017 HIS CD2
H A 0015 ASN C 2.415 H A 0016 TYR CA
H A 0015 ASN C 2.968 H A 0016 TYR C
H A 0015 ASN C 3.716 H A 0016 TYR CB
H A 0016 TYR C 2.447 H A 0017 HIS CA
H A 0016 TYR C 3.067 H A 0017 HIS C
H A 0016 TYR C 3.721 H A 0017 HIS CB
H A 0017 HIS C 2.447 H A 0018 LEU CA
H A 0017 HIS C 3.122 H A 0018 LEU C
H A 0017 HIS C 3.698 H A 0018 LEU CB
H A 0017 HIS CD2 3.640 H A 0018 LEU CG
H A 0018 LEU C 2.447 H A 0019 GLU CA
H A 0018 LEU C 3.008 H A 0019 GLU C
H A 0018 LEU C 3.740 H A 0019 GLU CB
H A 0019 GLU C 2.449 H A 0020 ASN CA
H A 0019 GLU C 3.039 H A 0020 ASN C
H A 0019 GLU C 3.736 H A 0020 ASN CB
H A 0020 ASN C 2.448 H A 0021 GLU CA
H A 0020 ASN C 3.218 H A 0021 GLU C
H A 0020 ASN C 3.684 H A 0021 GLU CB
H A 0020 ASN C 3.705 H A 0024 ARG CG
H A 0021 GLU C 2.448 H A 0022 VAL CA
H A 0021 GLU C 3.122 H A 0022 VAL C
H A 0021 GLU C 3.696 H A 0022 VAL CB
H A 0021 GLU CA 3.793 H A 0024 ARG CG
H A 0022 VAL C 2.447 H A 0023 ALA CA
H A 0022 VAL C 3.034 H A 0023 ALA C
H A 0022 VAL C 3.721 H A 0023 ALA CB
H A 0022 VAL CG1 3.381 H A 0026 LYS CG
H A 0022 VAL CG1 3.696 H A 0026 LYS CD
H A 0023 ALA C 2.449 H A 0024 ARG CA
H A 0023 ALA C 3.179 H A 0024 ARG C
H A 0023 ALA C 3.708 H A 0024 ARG CB
H A 0024 ARG C 2.448 H A 0025 LEU CA
H A 0024 ARG C 3.047 H A 0025 LEU C
H A 0024 ARG C 3.719 H A 0025 LEU CB
H A 0025 LEU C 2.447 H A 0026 LYS CA
H A 0025 LEU C 2.988 H A 0026 LYS C
H A 0025 LEU C 3.728 H A 0026 LYS CB
H A 0026 LYS C 2.448 C A 0027 LYS CA
H A 0026 LYS C 3.062 C A 0027 LYS C
H A 0026 LYS C 3.715 C A 0027 LYS CB
C A 0027 LYS C 2.448 C A 0028 LEU CA
C A 0027 LYS C 3.423 C A 0028 LEU C
C A 0027 LYS C 3.526 C A 0028 LEU CB
C A 0028 LEU C 2.448 C A 0029 VAL CA
C A 0028 LEU C 3.384 C A 0029 VAL C
C A 0028 LEU C 3.559 C A 0029 VAL CB
C A 0028 LEU C 3.572 C A 0029 VAL CG2
C A 0028 LEU C 3.480 C A 0031 GLU CG
C A 0029 VAL C 2.447 C A 0030 GLY CA
C A 0029 VAL C 3.026 C A 0030 GLY C
C A 0029 VAL C 3.440 C A 0031 GLU CG
C A 0030 GLY C 2.448 C A 0031 GLU CA
C A 0030 GLY C 2.847 C A 0031 GLU C
C A 0030 GLY C 3.730 C A 0031 GLU CB
C A 0031 GLU CA 3.781 C A 0032 ARG CZ
C A 0031 GLU C 2.449 C A 0032 ARG CA
C A 0031 GLU C 2.854 C A 0032 ARG C
C A 0031 GLU C 3.729 C A 0032 ARG CB
C A 0031 GLU CB 3.798 C A 0032 ARG CZ
CHARGE_ATTR 2.00 12.00 32
C A 0002 ASP OD1 7.370 H A 0005 LYS NZ
C A 0002 ASP OD2 6.177 H A 0005 LYS NZ
C A 0002 ASP OD1 10.81 H A 0006 LYS NZ
C A 0002 ASP OD2 10.28 H A 0006 LYS NZ
H A 0014 ASP OD1 10.68 H A 0007 LYS NZ
H A 0014 ASP OD2 9.718 H A 0007 LYS NZ
H A 0014 ASP OD1 10.99 H A 0012 LYS NZ
H A 0014 ASP OD1 5.131 H A 0017 HIS ND1
H A 0014 ASP OD1 3.764 H A 0017 HIS NE2
H A 0014 ASP OD2 6.274 H A 0017 HIS ND1
H A 0014 ASP OD2 4.442 H A 0017 HIS NE2
H A 0019 GLU OE1 9.471 H A 0017 HIS ND1
H A 0019 GLU OE1 9.185 H A 0017 HIS NE2
H A 0019 GLU OE2 11.60 H A 0017 HIS ND1
H A 0019 GLU OE2 11.40 H A 0017 HIS NE2
H A 0019 GLU OE1 9.135 H A 0026 LYS NZ
H A 0019 GLU OE2 7.513 H A 0026 LYS NZ
H A 0021 GLU OE1 5.216 H A 0017 HIS ND1
H A 0021 GLU OE1 6.613 H A 0017 HIS NE2
H A 0021 GLU OE2 5.876 H A 0017 HIS ND1
H A 0021 GLU OE2 6.804 H A 0017 HIS NE2
H A 0021 GLU OE1 6.727 H A 0024 ARG NH1
H A 0021 GLU OE1 6.487 H A 0024 ARG NH2
H A 0021 GLU OE2 8.189 H A 0024 ARG NH1
H A 0021 GLU OE2 8.339 H A 0024 ARG NH2
H A 0021 GLU OE1 11.20 C A 0027 LYS NZ
C A 0031 GLU OE1 11.60 H A 0026 LYS NZ
C A 0031 GLU OE2 11.53 H A 0026 LYS NZ
C A 0031 GLU OE1 6.112 C A 0032 ARG NH1
C A 0031 GLU OE1 4.267 C A 0032 ARG NH2
C A 0031 GLU OE2 7.375 C A 0032 ARG NH1
C A 0031 GLU OE2 5.993 C A 0032 ARG NH2
CHARGE_REPU 2.00 12.00 20
H A 0005 LYS NZ 6.879 H A 0006 LYS NZ
H A 0006 LYS NZ 9.215 H A 0012 LYS NZ
H A 0014 ASP OD1 10.30 H A 0019 GLU OE1
H A 0014 ASP OD2 9.356 H A 0019 GLU OE1
H A 0014 ASP OD2 11.50 H A 0019 GLU OE2
H A 0014 ASP OD1 10.19 H A 0021 GLU OE1
H A 0014 ASP OD1 10.54 H A 0021 GLU OE2
H A 0014 ASP OD2 10.83 H A 0021 GLU OE1
H A 0014 ASP OD2 11.06 H A 0021 GLU OE2
H A 0017 HIS ND1 11.23 H A 0024 ARG NH1
H A 0017 HIS ND1 10.18 H A 0024 ARG NH2
H A 0019 GLU OE1 10.15 H A 0021 GLU OE1
H A 0019 GLU OE1 11.39 H A 0021 GLU OE2
H A 0019 GLU OE2 11.74 H A 0021 GLU OE1
H A 0024 ARG NH1 5.361 C A 0027 LYS NZ
H A 0024 ARG NH2 6.752 C A 0027 LYS NZ
H A 0026 LYS NZ 10.34 C A 0032 ARG NH1
H A 0026 LYS NZ 11.14 C A 0032 ARG NH2
C A 0027 LYS NZ 7.463 C A 0032 ARG NH1
C A 0027 LYS NZ 9.523 C A 0032 ARG NH2
HB_MM 2.00 3.20 63
C A 0002 ASP N 2.293 C A 0001 MET O
C A 0003 ALA N 3.057 C A 0001 MET O
C A 0003 ALA N 2.293 C A 0002 ASP O
H A 0004 ILE N 2.615 C A 0001 MET O
H A 0004 ILE N 2.293 C A 0003 ALA O
H A 0005 LYS N 2.787 C A 0001 MET O
H A 0005 LYS N 2.293 H A 0004 ILE O
H A 0006 LYS N 3.105 H A 0004 ILE O
H A 0006 LYS N 2.293 H A 0005 LYS O
H A 0007 LYS N 2.800 C A 0003 ALA O
H A 0007 LYS N 2.854 H A 0004 ILE O
H A 0007 LYS N 2.293 H A 0006 LYS O
H A 0008 MET N 3.073 H A 0004 ILE O
H A 0008 MET N 2.293 H A 0007 LYS O
H A 0009 GLN N 2.764 H A 0006 LYS O
H A 0009 GLN N 2.293 H A 0008 MET O
H A 0010 MET N 2.699 H A 0006 LYS O
H A 0010 MET N 3.071 H A 0007 LYS O
H A 0010 MET N 2.294 H A 0009 GLN O
H A 0011 LEU N 2.930 H A 0007 LYS O
H A 0011 LEU N 2.293 H A 0010 MET O
H A 0012 LYS N 2.748 H A 0008 MET O
H A 0012 LYS N 2.293 H A 0011 LEU O
H A 0013 LEU N 2.293 H A 0012 LYS O
H A 0014 ASP N 3.091 H A 0010 MET O
H A 0014 ASP N 2.293 H A 0013 LEU O
H A 0015 ASN N 3.081 H A 0011 LEU O
H A 0015 ASN N 2.293 H A 0014 ASP O
H A 0016 TYR N 2.293 H A 0015 ASN O
H A 0017 HIS N 3.168 H A 0013 LEU O
H A 0017 HIS N 3.194 H A 0014 ASP O
H A 0017 HIS N 2.293 H A 0016 TYR O
H A 0018 LEU N 2.630 H A 0014 ASP O
H A 0018 LEU N 3.085 H A 0015 ASN O
H A 0018 LEU N 2.293 H A 0017 HIS O
H A 0019 GLU N 2.619 H A 0015 ASN O
H A 0019 GLU N 2.293 H A 0018 LEU O
H A 0020 ASN N 2.785 H A 0016 TYR O
H A 0020 ASN N 2.293 H A 0019 GLU O
H A 0021 GLU N 2.987 H A 0018 LEU O
H A 0021 GLU N 2.293 H A 0020 ASN O
H A 0022 VAL N 2.679 H A 0018 LEU O
H A 0022 VAL N 2.293 H A 0021 GLU O
H A 0023 ALA N 2.576 H A 0019 GLU O
H A 0023 ALA N 2.293 H A 0022 VAL O
H A 0024 ARG N 2.292 H A 0023 ALA O
H A 0025 LEU N 3.120 H A 0021 GLU O
H A 0025 LEU N 2.293 H A 0024 ARG O
H A 0026 LYS N 2.589 H A 0022 VAL O
H A 0026 LYS N 2.293 H A 0025 LEU O
C A 0027 LYS N 2.293 H A 0026 LYS O
C A 0028 LEU N 2.773 H A 0025 LEU O
C A 0028 LEU N 3.120 H A 0026 LYS O
C A 0028 LEU N 2.293 C A 0027 LYS O
C A 0029 VAL N 2.735 H A 0025 LEU O
C A 0029 VAL N 2.294 C A 0028 LEU O
C A 0030 GLY N 2.562 H A 0026 LYS O
C A 0030 GLY N 2.294 C A 0029 VAL O
C A 0031 GLU N 2.585 H A 0026 LYS O
C A 0031 GLU N 2.686 C A 0029 VAL O
C A 0031 GLU N 2.293 C A 0030 GLY O
C A 0032 ARG N 2.984 C A 0030 GLY O
C A 0032 ARG N 2.293 C A 0031 GLU O
HB_MS 2.00 3.20 1
H A 0016 TYR O 3.024 H A 0020 ASN ND2
AROMATIC 0.00 8.00 1
H A 0012 LYS 5.011 H A 0016 TYR
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 24
C A 0001 MET CG 3.772 C B 0001 MET CG
H A 0004 ILE CG2 3.173 H B 0004 ILE CG2
H A 0007 LYS CG 3.798 H B 0008 MET CB
H A 0011 LEU C 3.748 H B 0011 LEU CD1
H A 0011 LEU CB 3.214 H B 0011 LEU CB
H A 0011 LEU CD1 3.404 H B 0012 LYS CA
H A 0011 LEU CD1 3.215 H B 0012 LYS CB
H A 0012 LYS CA 3.424 H B 0011 LEU CD1
H A 0012 LYS CB 3.291 H B 0011 LEU CD1
H A 0018 LEU CD1 3.534 H B 0015 ASN CG
H A 0018 LEU CB 3.573 H B 0018 LEU CD1
H A 0019 GLU CD 3.461 H B 0018 LEU CD2
H A 0022 VAL CG2 2.991 H B 0022 VAL CG2
H A 0022 VAL CG1 3.743 H B 0025 LEU CD1
H A 0025 LEU CD1 3.742 H B 0025 LEU CB
H A 0025 LEU CD1 3.614 C B 0026 LYS CG
H A 0025 LEU CD2 3.628 C B 0029 VAL CB
H A 0026 LYS CG 3.663 H B 0025 LEU CD1
C A 0028 LEU CD2 3.100 C B 0029 VAL CG1
C A 0029 VAL CB 3.168 H B 0025 LEU CD2
C A 0029 VAL CG1 3.495 H B 0025 LEU CD2
C A 0029 VAL CG2 3.307 H B 0025 LEU CD2
C A 0029 VAL CG1 3.057 C B 0028 LEU CD2
C A 0029 VAL CG2 3.101 C B 0029 VAL CG2
CHARGE_ATTR 2.00 12.00 16
H A 0014 ASP OD2 11.81 H B 0017 HIS NE2
H A 0017 HIS NE2 11.71 H B 0014 ASP OD2
H A 0017 HIS ND1 8.452 H B 0019 GLU OE1
H A 0017 HIS ND1 8.193 H B 0019 GLU OE2
H A 0017 HIS NE2 6.370 H B 0019 GLU OE1
H A 0017 HIS NE2 6.278 H B 0019 GLU OE2
H A 0019 GLU OE1 7.603 H B 0017 HIS ND1
H A 0019 GLU OE1 5.592 H B 0017 HIS NE2
H A 0019 GLU OE2 7.132 H B 0017 HIS ND1
H A 0019 GLU OE2 5.011 H B 0017 HIS NE2
H A 0021 GLU OE1 7.821 C B 0026 LYS NZ
H A 0021 GLU OE2 5.943 C B 0026 LYS NZ
H A 0026 LYS NZ 11.60 H B 0014 ASP OD1
H A 0026 LYS NZ 11.08 H B 0014 ASP OD2
H A 0026 LYS NZ 6.154 H B 0021 GLU OE1
H A 0026 LYS NZ 4.365 H B 0021 GLU OE2
CHARGE_REPU 2.00 12.00 30
H A 0007 LYS NZ 11.18 H B 0007 LYS NZ
H A 0007 LYS NZ 7.377 H B 0012 LYS NZ
H A 0012 LYS NZ 8.653 H B 0007 LYS NZ
H A 0014 ASP OD1 11.46 H B 0014 ASP OD2
H A 0014 ASP OD2 11.49 H B 0014 ASP OD1
H A 0014 ASP OD2 9.972 H B 0014 ASP OD2
H A 0014 ASP OD1 6.741 H B 0019 GLU OE1
H A 0014 ASP OD1 7.644 H B 0019 GLU OE2
H A 0014 ASP OD2 4.961 H B 0019 GLU OE1
H A 0014 ASP OD2 6.346 H B 0019 GLU OE2
H A 0017 HIS ND1 11.30 C B 0026 LYS NZ
H A 0017 HIS NE2 11.46 C B 0026 LYS NZ
H A 0019 GLU OE1 6.706 H B 0014 ASP OD1
H A 0019 GLU OE1 4.666 H B 0014 ASP OD2
H A 0019 GLU OE2 6.357 H B 0014 ASP OD1
H A 0019 GLU OE2 4.739 H B 0014 ASP OD2
H A 0019 GLU OE1 9.748 H B 0019 GLU OE1
H A 0019 GLU OE1 10.59 H B 0019 GLU OE2
H A 0019 GLU OE2 11.60 H B 0019 GLU OE1
H A 0019 GLU OE1 5.872 H B 0021 GLU OE1
H A 0019 GLU OE1 7.101 H B 0021 GLU OE2
H A 0019 GLU OE2 5.441 H B 0021 GLU OE1
H A 0019 GLU OE2 6.334 H B 0021 GLU OE2
H A 0021 GLU OE1 11.23 H B 0019 GLU OE1
H A 0021 GLU OE1 10.24 H B 0019 GLU OE2
H A 0021 GLU OE2 10.74 H B 0019 GLU OE1
H A 0021 GLU OE2 9.361 H B 0019 GLU OE2
H A 0024 ARG NH1 11.25 C B 0026 LYS NZ
H A 0026 LYS NZ 8.868 H B 0017 HIS ND1
H A 0026 LYS NZ 8.142 H B 0017 HIS NE2
HB_SS 2.00 3.20 1
H A 0014 ASP OD2 3.061 H B 0015 ASN ND2
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 115
C B 0001 MET C 2.449 C B 0002 ASP CA
C B 0001 MET C 2.919 C B 0002 ASP C
C B 0001 MET C 3.734 C B 0002 ASP CB
C B 0001 MET CA 3.588 H B 0004 ILE CB
C B 0001 MET CA 3.563 H B 0004 ILE CG1
C B 0001 MET C 3.745 H B 0004 ILE CB
C B 0002 ASP C 2.448 C B 0003 ALA CA
C B 0002 ASP C 3.246 C B 0003 ALA C
C B 0002 ASP C 3.676 C B 0003 ALA CB
C B 0002 ASP CA 3.661 H B 0005 LYS CG
C B 0002 ASP CA 3.792 H B 0005 LYS CD
C B 0002 ASP C 3.490 H B 0005 LYS CG
C B 0003 ALA C 2.448 H B 0004 ILE CA
C B 0003 ALA C 3.121 H B 0004 ILE C
C B 0003 ALA C 3.699 H B 0004 ILE CB
H B 0004 ILE C 2.447 H B 0005 LYS CA
H B 0004 ILE C 2.938 H B 0005 LYS C
H B 0004 ILE C 3.731 H B 0005 LYS CB
H B 0004 ILE CA 3.639 H B 0007 LYS CB
H B 0004 ILE C 3.783 H B 0007 LYS CB
H B 0005 LYS C 2.447 H B 0006 LYS CA
H B 0005 LYS C 3.229 H B 0006 LYS C
H B 0005 LYS C 3.655 H B 0006 LYS CB
H B 0005 LYS C 3.748 H B 0006 LYS CG
H B 0005 LYS C 3.740 H B 0008 MET CG
H B 0006 LYS C 2.448 H B 0007 LYS CA
H B 0006 LYS C 2.942 H B 0007 LYS C
H B 0006 LYS C 3.731 H B 0007 LYS CB
H B 0006 LYS C 3.565 H B 0010 MET CG
H B 0007 LYS C 2.448 H B 0008 MET CA
H B 0007 LYS C 3.025 H B 0008 MET C
H B 0007 LYS C 3.728 H B 0008 MET CB
H B 0008 MET C 2.448 H B 0009 GLN CA
H B 0008 MET C 3.162 H B 0009 GLN C
H B 0008 MET C 3.706 H B 0009 GLN CB
H B 0009 GLN C 2.447 H B 0010 MET CA
H B 0009 GLN C 3.154 H B 0010 MET C
H B 0009 GLN C 3.702 H B 0010 MET CB
H B 0010 MET C 2.448 H B 0011 LEU CA
H B 0010 MET C 3.133 H B 0011 LEU C
H B 0010 MET C 3.695 H B 0011 LEU CB
H B 0011 LEU C 2.448 H B 0012 LYS CA
H B 0011 LEU C 3.118 H B 0012 LYS C
H B 0011 LEU C 3.700 H B 0012 LYS CB
H B 0012 LYS C 2.448 H B 0013 LEU CA
H B 0012 LYS C 3.116 H B 0013 LEU C
H B 0012 LYS C 3.702 H B 0013 LEU CB
H B 0012 LYS CG 3.540 H B 0016 TYR CE2
H B 0012 LYS CG 3.258 H B 0016 TYR CZ
H B 0012 LYS CD 3.307 H B 0016 TYR CE2
H B 0012 LYS CD 3.642 H B 0016 TYR CZ
H B 0013 LEU C 2.448 H B 0014 ASP CA
H B 0013 LEU C 2.989 H B 0014 ASP C
H B 0013 LEU C 3.739 H B 0014 ASP CB
H B 0014 ASP C 2.448 H B 0015 ASN CA
H B 0014 ASP C 2.980 H B 0015 ASN C
H B 0014 ASP C 3.738 H B 0015 ASN CB
H B 0015 ASN C 2.414 H B 0016 TYR CA
H B 0015 ASN C 2.939 H B 0016 TYR C
H B 0015 ASN C 3.718 H B 0016 TYR CB
H B 0016 TYR C 2.447 H B 0017 HIS CA
H B 0016 TYR C 3.037 H B 0017 HIS C
H B 0016 TYR C 3.727 H B 0017 HIS CB
H B 0016 TYR C 3.724 H B 0020 ASN CG
H B 0017 HIS C 2.448 H B 0018 LEU CA
H B 0017 HIS C 3.036 H B 0018 LEU C
H B 0017 HIS C 3.721 H B 0018 LEU CB
H B 0017 HIS CD2 3.655 H B 0018 LEU CG
H B 0017 HIS CD2 3.695 H B 0018 LEU CD2
H B 0018 LEU C 2.449 H B 0019 GLU CA
H B 0018 LEU C 3.040 H B 0019 GLU C
H B 0018 LEU C 3.737 H B 0019 GLU CB
H B 0019 GLU C 2.447 H B 0020 ASN CA
H B 0019 GLU C 3.003 H B 0020 ASN C
H B 0019 GLU C 3.739 H B 0020 ASN CB
H B 0020 ASN C 2.448 H B 0021 GLU CA
H B 0020 ASN C 3.138 H B 0021 GLU C
H B 0020 ASN C 3.714 H B 0021 GLU CB
H B 0021 GLU C 2.447 H B 0022 VAL CA
H B 0021 GLU C 3.135 H B 0022 VAL C
H B 0021 GLU C 3.692 H B 0022 VAL CB
H B 0022 VAL C 2.448 H B 0023 ALA CA
H B 0022 VAL C 3.053 H B 0023 ALA C
H B 0022 VAL C 3.720 H B 0023 ALA CB
H B 0023 ALA C 2.448 H B 0024 ARG CA
H B 0023 ALA C 3.250 H B 0024 ARG C
H B 0023 ALA C 3.680 H B 0024 ARG CB
H B 0023 ALA C 3.509 H B 0024 ARG CD
H B 0024 ARG C 2.448 H B 0025 LEU CA
H B 0024 ARG C 3.148 H B 0025 LEU C
H B 0024 ARG C 3.689 H B 0025 LEU CB
H B 0025 LEU C 2.448 C B 0026 LYS CA
H B 0025 LEU C 3.037 C B 0026 LYS C
H B 0025 LEU C 3.721 C B 0026 LYS CB
C B 0026 LYS C 2.448 C B 0027 LYS CA
C B 0026 LYS C 3.171 C B 0027 LYS C
C B 0026 LYS C 3.682 C B 0027 LYS CB
C B 0026 LYS CE 3.623 C B 0030 GLY CA
C B 0027 LYS C 2.448 C B 0028 LEU CA
C B 0027 LYS C 3.349 C B 0028 LEU C
C B 0027 LYS C 3.583 C B 0028 LEU CB
C B 0027 LYS C 3.792 C B 0031 GLU CB
C B 0028 LEU C 2.448 C B 0029 VAL CA
C B 0028 LEU C 3.386 C B 0029 VAL C
C B 0028 LEU C 3.556 C B 0029 VAL CB
C B 0028 LEU C 3.563 C B 0029 VAL CG2
C B 0029 VAL C 2.448 C B 0030 GLY CA
C B 0029 VAL C 2.987 C B 0030 GLY C
C B 0030 GLY C 2.449 C B 0031 GLU CA
C B 0030 GLY C 2.843 C B 0031 GLU C
C B 0030 GLY C 3.730 C B 0031 GLU CB
C B 0031 GLU C 2.449 C B 0032 ARG CA
C B 0031 GLU C 2.933 C B 0032 ARG C
C B 0031 GLU C 3.743 C B 0032 ARG CB
C B 0031 GLU CD 3.200 C B 0032 ARG C
CHARGE_ATTR 2.00 12.00 32
C B 0002 ASP OD1 7.886 H B 0005 LYS NZ
C B 0002 ASP OD2 6.722 H B 0005 LYS NZ
C B 0002 ASP OD1 8.266 H B 0006 LYS NZ
C B 0002 ASP OD2 8.184 H B 0006 LYS NZ
H B 0014 ASP OD1 10.78 H B 0007 LYS NZ
H B 0014 ASP OD2 10.42 H B 0007 LYS NZ
H B 0014 ASP OD1 11.87 H B 0012 LYS NZ
H B 0014 ASP OD1 5.546 H B 0017 HIS ND1
H B 0014 ASP OD1 4.393 H B 0017 HIS NE2
H B 0014 ASP OD2 6.078 H B 0017 HIS ND1
H B 0014 ASP OD2 4.353 H B 0017 HIS NE2
H B 0019 GLU OE1 10.44 H B 0017 HIS ND1
H B 0019 GLU OE1 10.30 H B 0017 HIS NE2
H B 0019 GLU OE2 11.45 H B 0017 HIS ND1
H B 0019 GLU OE2 11.36 H B 0017 HIS NE2
H B 0019 GLU OE1 11.14 H B 0024 ARG NH1
H B 0019 GLU OE2 10.24 H B 0024 ARG NH1
H B 0019 GLU OE2 11.94 H B 0024 ARG NH2
H B 0019 GLU OE2 10.75 C B 0026 LYS NZ
H B 0019 GLU OE2 10.93 C B 0027 LYS NZ
H B 0021 GLU OE1 4.019 H B 0017 HIS ND1
H B 0021 GLU OE1 3.476 H B 0017 HIS NE2
H B 0021 GLU OE2 5.832 H B 0017 HIS ND1
H B 0021 GLU OE2 5.413 H B 0017 HIS NE2
H B 0021 GLU OE1 11.60 H B 0024 ARG NH1
C B 0031 GLU OE1 10.57 C B 0026 LYS NZ
C B 0031 GLU OE2 10.26 C B 0026 LYS NZ
C B 0031 GLU OE1 10.22 C B 0027 LYS NZ
C B 0031 GLU OE1 8.178 C B 0032 ARG NH1
C B 0031 GLU OE1 8.513 C B 0032 ARG NH2
C B 0031 GLU OE2 8.685 C B 0032 ARG NH1
C B 0031 GLU OE2 8.414 C B 0032 ARG NH2
CHARGE_REPU 2.00 12.00 21
H B 0005 LYS NZ 8.334 H B 0006 LYS NZ
H B 0014 ASP OD1 11.45 H B 0019 GLU OE1
H B 0014 ASP OD2 10.37 H B 0019 GLU OE1
H B 0014 ASP OD2 11.94 H B 0019 GLU OE2
H B 0014 ASP OD1 7.754 H B 0021 GLU OE1
H B 0014 ASP OD1 9.636 H B 0021 GLU OE2
H B 0014 ASP OD2 7.126 H B 0021 GLU OE1
H B 0014 ASP OD2 8.993 H B 0021 GLU OE2
H B 0017 HIS ND1 11.92 H B 0024 ARG NH1
H B 0017 HIS ND1 11.87 H B 0024 ARG NH2
H B 0019 GLU OE1 10.19 H B 0021 GLU OE1
H B 0019 GLU OE1 11.91 H B 0021 GLU OE2
H B 0019 GLU OE2 10.57 H B 0021 GLU OE1
H B 0019 GLU OE2 11.98 H B 0021 GLU OE2
H B 0024 ARG NH1 4.532 C B 0027 LYS NZ
H B 0024 ARG NH2 6.451 C B 0027 LYS NZ
C B 0026 LYS NZ 11.04 C B 0027 LYS NZ
C B 0026 LYS NZ 10.29 C B 0032 ARG NH1
C B 0026 LYS NZ 9.501 C B 0032 ARG NH2
C B 0027 LYS NZ 9.549 C B 0032 ARG NH1
C B 0027 LYS NZ 11.23 C B 0032 ARG NH2
HB_MM 2.00 3.20 64
C B 0002 ASP N 2.293 C B 0001 MET O
C B 0003 ALA N 3.048 C B 0001 MET O
C B 0003 ALA N 2.293 C B 0002 ASP O
H B 0004 ILE N 2.619 C B 0001 MET O
H B 0004 ILE N 2.294 C B 0003 ALA O
H B 0005 LYS N 2.777 C B 0001 MET O
H B 0005 LYS N 2.294 H B 0004 ILE O
H B 0006 LYS N 3.113 H B 0004 ILE O
H B 0006 LYS N 2.293 H B 0005 LYS O
H B 0007 LYS N 2.747 C B 0003 ALA O
H B 0007 LYS N 2.846 H B 0004 ILE O
H B 0007 LYS N 2.294 H B 0006 LYS O
H B 0008 MET N 3.055 H B 0004 ILE O
H B 0008 MET N 2.293 H B 0007 LYS O
H B 0009 GLN N 2.835 H B 0006 LYS O
H B 0009 GLN N 2.293 H B 0008 MET O
H B 0010 MET N 2.684 H B 0006 LYS O
H B 0010 MET N 2.939 H B 0007 LYS O
H B 0010 MET N 2.294 H B 0009 GLN O
H B 0011 LEU N 3.081 H B 0007 LYS O
H B 0011 LEU N 2.293 H B 0010 MET O
H B 0012 LYS N 2.982 H B 0008 MET O
H B 0012 LYS N 2.294 H B 0011 LEU O
H B 0013 LEU N 3.127 H B 0009 GLN O
H B 0013 LEU N 2.293 H B 0012 LYS O
H B 0014 ASP N 3.102 H B 0010 MET O
H B 0014 ASP N 2.293 H B 0013 LEU O
H B 0015 ASN N 3.091 H B 0011 LEU O
H B 0015 ASN N 2.293 H B 0014 ASP O
H B 0016 TYR N 3.150 H B 0013 LEU O
H B 0016 TYR N 2.293 H B 0015 ASN O
H B 0017 HIS N 3.124 H B 0013 LEU O
H B 0017 HIS N 3.125 H B 0014 ASP O
H B 0017 HIS N 2.294 H B 0016 TYR O
H B 0018 LEU N 2.620 H B 0014 ASP O
H B 0018 LEU N 3.077 H B 0015 ASN O
H B 0018 LEU N 2.294 H B 0017 HIS O
H B 0019 GLU N 2.723 H B 0015 ASN O
H B 0019 GLU N 2.293 H B 0018 LEU O
H B 0020 ASN N 2.865 H B 0016 TYR O
H B 0020 ASN N 2.293 H B 0019 GLU O
H B 0021 GLU N 2.779 H B 0017 HIS O
H B 0021 GLU N 2.293 H B 0020 ASN O
H B 0022 VAL N 2.627 H B 0018 LEU O
H B 0022 VAL N 3.021 H B 0019 GLU O
H B 0022 VAL N 2.293 H B 0021 GLU O
H B 0023 ALA N 2.657 H B 0019 GLU O
H B 0023 ALA N 2.294 H B 0022 VAL O
H B 0024 ARG N 2.293 H B 0023 ALA O
H B 0025 LEU N 3.012 H B 0021 GLU O
H B 0025 LEU N 2.294 H B 0024 ARG O
C B 0026 LYS N 2.661 H B 0022 VAL O
C B 0026 LYS N 2.293 H B 0025 LEU O
C B 0027 LYS N 2.293 C B 0026 LYS O
C B 0028 LEU N 2.939 H B 0025 LEU O
C B 0028 LEU N 2.293 C B 0027 LYS O
C B 0029 VAL N 2.687 H B 0025 LEU O
C B 0029 VAL N 2.293 C B 0028 LEU O
C B 0030 GLY N 2.743 C B 0026 LYS O
C B 0030 GLY N 2.293 C B 0029 VAL O
C B 0031 GLU N 2.607 C B 0026 LYS O
C B 0031 GLU N 2.704 C B 0029 VAL O
C B 0031 GLU N 2.294 C B 0030 GLY O
C B 0032 ARG N 2.293 C B 0031 GLU O
HB_MS 2.00 3.20 1
H B 0016 TYR O 2.759 H B 0020 ASN ND2
AROMATIC 0.00 8.00 1
H B 0012 LYS 4.672 H B 0016 TYR