Complet list of 1wjb con file
Complete list of 1wjb.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 191
C A 0001 PHE C 2.432 H A 0002 LEU CA
C A 0001 PHE C 3.008 H A 0002 LEU C
C A 0001 PHE C 3.696 H A 0002 LEU CB
H A 0002 LEU C 2.419 H A 0003 ASP CA
H A 0002 LEU C 2.992 H A 0003 ASP C
H A 0002 LEU C 3.688 H A 0003 ASP CB
H A 0003 ASP C 2.417 H A 0004 GLY CA
H A 0003 ASP C 2.960 H A 0004 GLY C
H A 0004 GLY C 2.422 H A 0005 ILE CA
H A 0004 GLY C 3.032 H A 0005 ILE C
H A 0004 GLY C 3.695 H A 0005 ILE CB
H A 0005 ILE C 2.413 H A 0006 ASP CA
H A 0005 ILE C 2.955 H A 0006 ASP C
H A 0005 ILE C 3.692 H A 0006 ASP CB
H A 0005 ILE CD1 3.731 H A 0035 GLU CD
H A 0006 ASP C 2.414 H A 0007 LYS CA
H A 0006 ASP C 3.026 H A 0007 LYS C
H A 0006 ASP C 3.688 H A 0007 LYS CB
H A 0007 LYS C 2.428 H A 0008 ALA CA
H A 0007 LYS C 3.052 H A 0008 ALA C
H A 0007 LYS C 3.689 H A 0008 ALA CB
H A 0008 ALA C 2.429 C A 0009 GLN CA
H A 0008 ALA C 3.005 C A 0009 GLN C
H A 0008 ALA C 3.691 C A 0009 GLN CB
H A 0008 ALA CB 3.736 H A 0036 ILE CD1
C A 0009 GLN C 2.435 C A 0010 GLU CA
C A 0009 GLN C 3.676 C A 0010 GLU C
C A 0009 GLN C 3.168 C A 0010 GLU CB
C A 0010 GLU C 2.433 C A 0011 GLU CA
C A 0010 GLU C 3.163 C A 0011 GLU C
C A 0010 GLU C 3.677 C A 0011 GLU CB
C A 0011 GLU C 2.426 C A 0012 HIS CA
C A 0011 GLU C 3.067 C A 0012 HIS C
C A 0011 GLU C 3.683 C A 0012 HIS CB
C A 0012 HIS C 2.442 C A 0013 GLU CA
C A 0012 HIS C 3.341 C A 0013 GLU C
C A 0012 HIS C 3.605 C A 0013 GLU CB
C A 0012 HIS C 3.792 C A 0013 GLU CG
C A 0012 HIS CA 3.708 H A 0016 HIS CG
C A 0012 HIS CE1 3.757 H A 0042 LYS CB
C A 0013 GLU C 2.436 H A 0014 LYS CA
C A 0013 GLU C 3.051 H A 0014 LYS C
C A 0013 GLU C 3.697 H A 0014 LYS CB
H A 0014 LYS C 2.419 H A 0015 TYR CA
H A 0014 LYS C 2.951 H A 0015 TYR C
H A 0014 LYS C 3.693 H A 0015 TYR CB
H A 0015 TYR C 2.416 H A 0016 HIS CA
H A 0015 TYR C 2.953 H A 0016 HIS C
H A 0015 TYR C 3.701 H A 0016 HIS CB
H A 0016 HIS C 2.411 H A 0017 SER CA
H A 0016 HIS C 2.937 H A 0017 SER C
H A 0016 HIS C 3.693 H A 0017 SER CB
H A 0017 SER C 2.432 C A 0018 ASN CA
H A 0017 SER C 3.271 C A 0018 ASN C
H A 0017 SER C 3.625 C A 0018 ASN CB
C A 0018 ASN C 2.419 H A 0019 TRP CA
C A 0018 ASN C 3.055 H A 0019 TRP C
C A 0018 ASN C 3.694 H A 0019 TRP CB
H A 0019 TRP C 2.427 H A 0020 ARG CA
H A 0019 TRP C 2.981 H A 0020 ARG C
H A 0019 TRP C 3.699 H A 0020 ARG CB
H A 0019 TRP CD2 3.740 H A 0020 ARG CA
H A 0019 TRP CD2 3.698 H A 0020 ARG CG
H A 0019 TRP CE2 3.465 H A 0020 ARG CG
H A 0019 TRP CE3 3.382 H A 0020 ARG CA
H A 0019 TRP CE3 3.792 H A 0020 ARG CG
H A 0019 TRP CZ2 3.358 H A 0020 ARG CG
H A 0019 TRP CZ3 3.786 H A 0020 ARG CA
H A 0019 TRP CZ3 3.680 H A 0020 ARG CG
H A 0019 TRP CH2 3.467 H A 0020 ARG CG
H A 0019 TRP CZ3 3.683 H A 0030 PRO CA
H A 0019 TRP CZ3 3.409 H A 0030 PRO CB
H A 0019 TRP CZ3 3.706 H A 0030 PRO CG
H A 0019 TRP CH2 3.524 H A 0030 PRO CB
H A 0019 TRP CH2 3.727 H A 0030 PRO CG
H A 0019 TRP CE3 3.552 H A 0033 ALA CB
H A 0020 ARG C 2.421 H A 0021 ALA CA
H A 0020 ARG C 2.961 H A 0021 ALA C
H A 0020 ARG C 3.694 H A 0021 ALA CB
H A 0021 ALA C 2.427 H A 0022 MET CA
H A 0021 ALA C 2.983 H A 0022 MET C
H A 0021 ALA C 3.688 H A 0022 MET CB
H A 0022 MET C 2.415 H A 0023 ALA CA
H A 0022 MET C 2.959 H A 0023 ALA C
H A 0022 MET C 3.686 H A 0023 ALA CB
H A 0022 MET CE 3.430 H A 0036 ILE CD1
H A 0023 ALA C 2.424 H A 0024 SER CA
H A 0023 ALA C 3.054 H A 0024 SER C
H A 0023 ALA C 3.688 H A 0024 SER CB
H A 0024 SER C 2.424 H A 0025 ASP CA
H A 0024 SER C 2.980 H A 0025 ASP C
H A 0024 SER C 3.693 H A 0025 ASP CB
H A 0025 ASP C 2.438 H A 0026 PHE CA
H A 0025 ASP C 3.320 H A 0026 PHE C
H A 0025 ASP C 3.605 H A 0026 PHE CB
H A 0026 PHE C 2.422 C A 0027 ASN CA
H A 0026 PHE C 2.921 C A 0027 ASN C
H A 0026 PHE C 3.034 C A 0027 ASN CB
H A 0026 PHE C 3.616 C A 0027 ASN CG
H A 0026 PHE CB 3.445 C A 0028 LEU CD1
C A 0027 ASN C 2.447 C A 0028 LEU CA
C A 0027 ASN C 3.416 C A 0028 LEU C
C A 0027 ASN C 3.551 C A 0028 LEU CB
C A 0027 ASN C 3.727 C A 0028 LEU CG
C A 0028 LEU CA 2.934 C A 0029 PRO CD
C A 0028 LEU C 2.441 C A 0029 PRO CA
C A 0028 LEU C 3.084 C A 0029 PRO C
C A 0028 LEU C 3.639 C A 0029 PRO CB
C A 0028 LEU C 3.640 C A 0029 PRO CG
C A 0028 LEU C 2.491 C A 0029 PRO CD
C A 0028 LEU CB 3.544 C A 0029 PRO CD
C A 0029 PRO CA 2.940 H A 0030 PRO CD
C A 0029 PRO C 2.462 H A 0030 PRO CA
C A 0029 PRO C 2.942 H A 0030 PRO C
C A 0029 PRO C 3.612 H A 0030 PRO CB
C A 0029 PRO C 3.672 H A 0030 PRO CG
C A 0029 PRO C 2.497 H A 0030 PRO CD
C A 0029 PRO CB 3.724 H A 0030 PRO CD
H A 0030 PRO C 2.407 H A 0031 VAL CA
H A 0030 PRO C 2.970 H A 0031 VAL C
H A 0030 PRO C 3.676 H A 0031 VAL CB
H A 0031 VAL C 2.408 H A 0032 VAL CA
H A 0031 VAL C 3.014 H A 0032 VAL C
H A 0031 VAL C 3.684 H A 0032 VAL CB
H A 0032 VAL C 2.424 H A 0033 ALA CA
H A 0032 VAL C 2.995 H A 0033 ALA C
H A 0032 VAL C 3.693 H A 0033 ALA CB
H A 0033 ALA C 2.426 H A 0034 LYS CA
H A 0033 ALA C 2.987 H A 0034 LYS C
H A 0033 ALA C 3.703 H A 0034 LYS CB
H A 0034 LYS C 2.416 H A 0035 GLU CA
H A 0034 LYS C 2.956 H A 0035 GLU C
H A 0034 LYS C 3.693 H A 0035 GLU CB
H A 0035 GLU C 2.418 H A 0036 ILE CA
H A 0035 GLU C 2.963 H A 0036 ILE C
H A 0035 GLU C 3.692 H A 0036 ILE CB
H A 0036 ILE C 2.424 H A 0037 VAL CA
H A 0036 ILE C 2.984 H A 0037 VAL C
H A 0036 ILE C 3.693 H A 0037 VAL CB
H A 0037 VAL C 2.422 H A 0038 ALA CA
H A 0037 VAL C 3.018 H A 0038 ALA C
H A 0037 VAL C 3.690 H A 0038 ALA CB
H A 0038 ALA C 2.425 H A 0039 SER CA
H A 0038 ALA C 3.087 H A 0039 SER C
H A 0038 ALA C 3.684 H A 0039 SER CB
H A 0039 SER C 2.414 C A 0040 CYS CA
H A 0039 SER C 3.076 C A 0040 CYS C
H A 0039 SER C 3.676 C A 0040 CYS CB
C A 0040 CYS C 2.427 H A 0041 ASP CA
C A 0040 CYS C 2.985 H A 0041 ASP C
C A 0040 CYS C 3.697 H A 0041 ASP CB
H A 0041 ASP C 2.416 H A 0042 LYS CA
H A 0041 ASP C 2.973 H A 0042 LYS C
H A 0041 ASP C 3.694 H A 0042 LYS CB
H A 0042 LYS C 2.422 H A 0043 CYS CA
H A 0042 LYS C 3.126 H A 0043 CYS C
H A 0042 LYS C 3.684 H A 0043 CYS CB
H A 0043 CYS C 2.425 H A 0044 GLN CA
H A 0043 CYS C 3.122 H A 0044 GLN C
H A 0043 CYS C 3.679 H A 0044 GLN CB
H A 0044 GLN C 2.414 C A 0045 LEU CA
H A 0044 GLN C 3.049 C A 0045 LEU C
H A 0044 GLN C 3.679 C A 0045 LEU CB
C A 0045 LEU C 2.424 C A 0046 LYS CA
C A 0045 LEU C 3.210 C A 0046 LYS C
C A 0045 LEU C 3.639 C A 0046 LYS CB
C A 0046 LYS C 2.426 C A 0047 GLY CA
C A 0046 LYS C 3.175 C A 0047 GLY C
C A 0047 GLY C 2.422 C A 0048 GLU CA
C A 0047 GLY C 3.125 C A 0048 GLU C
C A 0047 GLY C 3.665 C A 0048 GLU CB
C A 0048 GLU C 2.425 C A 0049 ALA CA
C A 0048 GLU C 3.047 C A 0049 ALA C
C A 0048 GLU C 3.694 C A 0049 ALA CB
C A 0049 ALA C 2.424 C A 0050 MET CA
C A 0049 ALA C 3.132 C A 0050 MET C
C A 0049 ALA C 3.665 C A 0050 MET CB
C A 0050 MET C 2.419 C A 0051 HIS CA
C A 0050 MET C 3.084 C A 0051 HIS C
C A 0050 MET C 3.678 C A 0051 HIS CB
C A 0051 HIS C 2.428 C A 0052 GLY CA
C A 0051 HIS C 3.156 C A 0052 GLY C
C A 0052 GLY C 2.432 C A 0053 GLN CA
C A 0052 GLY C 3.618 C A 0053 GLN C
C A 0052 GLY C 3.270 C A 0053 GLN CB
C A 0053 GLN C 2.433 C A 0054 VAL CA
C A 0053 GLN C 3.293 C A 0054 VAL C
C A 0053 GLN C 3.615 C A 0054 VAL CB
C A 0054 VAL C 2.426 C A 0055 ASP CA
C A 0054 VAL C 3.181 C A 0055 ASP C
C A 0054 VAL C 3.657 C A 0055 ASP CB
CHARGE_ATTR 2.00 12.00 51
H A 0003 ASP OD1 5.446 H A 0007 LYS NZ
H A 0003 ASP OD2 6.178 H A 0007 LYS NZ
H A 0006 ASP OD1 6.868 H A 0007 LYS NZ
H A 0006 ASP OD2 6.311 H A 0007 LYS NZ
H A 0006 ASP OD1 10.96 H A 0016 HIS NE2
C A 0010 GLU OE1 10.63 H A 0007 LYS NZ
C A 0010 GLU OE2 11.60 H A 0007 LYS NZ
C A 0010 GLU OE1 11.99 C A 0012 HIS ND1
C A 0010 GLU OE1 9.178 H A 0016 HIS ND1
C A 0010 GLU OE1 7.150 H A 0016 HIS NE2
C A 0010 GLU OE2 10.36 H A 0016 HIS ND1
C A 0010 GLU OE2 8.416 H A 0016 HIS NE2
C A 0011 GLU OE1 10.20 C A 0012 HIS ND1
C A 0011 GLU OE1 10.99 C A 0012 HIS NE2
C A 0011 GLU OE2 10.85 C A 0012 HIS ND1
C A 0011 GLU OE2 11.73 C A 0012 HIS NE2
C A 0011 GLU OE1 10.71 H A 0014 LYS NZ
C A 0011 GLU OE1 9.413 H A 0016 HIS ND1
C A 0011 GLU OE1 8.598 H A 0016 HIS NE2
C A 0011 GLU OE2 10.26 H A 0016 HIS ND1
C A 0011 GLU OE2 9.598 H A 0016 HIS NE2
C A 0013 GLU OE1 9.301 C A 0012 HIS ND1
C A 0013 GLU OE1 9.977 C A 0012 HIS NE2
C A 0013 GLU OE2 10.01 C A 0012 HIS ND1
C A 0013 GLU OE2 10.26 C A 0012 HIS NE2
C A 0013 GLU OE1 8.469 H A 0014 LYS NZ
C A 0013 GLU OE2 6.942 H A 0014 LYS NZ
C A 0013 GLU OE1 7.927 H A 0016 HIS ND1
C A 0013 GLU OE1 6.799 H A 0016 HIS NE2
C A 0013 GLU OE2 9.305 H A 0016 HIS ND1
C A 0013 GLU OE2 8.542 H A 0016 HIS NE2
H A 0025 ASP OD1 11.49 H A 0007 LYS NZ
H A 0025 ASP OD1 11.87 H A 0016 HIS NE2
H A 0035 GLU OE1 10.32 H A 0016 HIS ND1
H A 0035 GLU OE1 9.846 H A 0016 HIS NE2
H A 0035 GLU OE2 10.85 H A 0016 HIS ND1
H A 0035 GLU OE2 10.65 H A 0016 HIS NE2
H A 0041 ASP OD1 10.56 C A 0012 HIS ND1
H A 0041 ASP OD1 11.67 C A 0012 HIS NE2
H A 0041 ASP OD2 9.954 C A 0012 HIS ND1
H A 0041 ASP OD2 11.31 C A 0012 HIS NE2
H A 0041 ASP OD1 11.42 H A 0016 HIS ND1
H A 0041 ASP OD2 10.53 H A 0016 HIS ND1
H A 0041 ASP OD2 11.91 H A 0016 HIS NE2
H A 0041 ASP OD1 7.646 H A 0042 LYS NZ
H A 0041 ASP OD2 6.884 H A 0042 LYS NZ
C A 0048 GLU OE1 8.785 C A 0051 HIS ND1
C A 0048 GLU OE1 9.979 C A 0051 HIS NE2
C A 0048 GLU OE2 6.677 C A 0051 HIS ND1
C A 0048 GLU OE2 7.949 C A 0051 HIS NE2
C A 0055 ASP OD1 11.49 C A 0051 HIS NE2
CHARGE_REPU 2.00 12.00 45
H A 0003 ASP OD1 7.486 H A 0006 ASP OD1
H A 0003 ASP OD1 5.914 H A 0006 ASP OD2
H A 0003 ASP OD2 9.436 H A 0006 ASP OD1
H A 0003 ASP OD2 8.004 H A 0006 ASP OD2
H A 0006 ASP OD1 6.366 C A 0010 GLU OE1
H A 0006 ASP OD1 7.981 C A 0010 GLU OE2
H A 0006 ASP OD2 8.430 C A 0010 GLU OE1
H A 0006 ASP OD2 9.896 C A 0010 GLU OE2
H A 0006 ASP OD1 10.84 H A 0035 GLU OE1
H A 0006 ASP OD1 11.40 H A 0035 GLU OE2
H A 0006 ASP OD2 11.67 H A 0035 GLU OE1
C A 0010 GLU OE1 7.369 C A 0011 GLU OE1
C A 0010 GLU OE1 8.036 C A 0011 GLU OE2
C A 0010 GLU OE2 6.406 C A 0011 GLU OE1
C A 0010 GLU OE2 7.226 C A 0011 GLU OE2
C A 0010 GLU OE1 7.031 C A 0013 GLU OE1
C A 0010 GLU OE1 8.960 C A 0013 GLU OE2
C A 0010 GLU OE2 6.319 C A 0013 GLU OE1
C A 0010 GLU OE2 7.973 C A 0013 GLU OE2
C A 0010 GLU OE1 10.82 H A 0025 ASP OD1
C A 0010 GLU OE1 11.80 H A 0025 ASP OD2
C A 0010 GLU OE2 11.11 H A 0025 ASP OD1
C A 0010 GLU OE2 11.79 H A 0025 ASP OD2
C A 0011 GLU OE1 4.434 C A 0013 GLU OE1
C A 0011 GLU OE1 4.546 C A 0013 GLU OE2
C A 0011 GLU OE2 6.524 C A 0013 GLU OE1
C A 0011 GLU OE2 6.647 C A 0013 GLU OE2
C A 0012 HIS ND1 11.15 H A 0014 LYS NZ
C A 0012 HIS NE2 10.01 H A 0014 LYS NZ
C A 0012 HIS ND1 3.448 H A 0016 HIS ND1
C A 0012 HIS ND1 5.527 H A 0016 HIS NE2
C A 0012 HIS NE2 5.419 H A 0016 HIS ND1
C A 0012 HIS NE2 7.374 H A 0016 HIS NE2
C A 0012 HIS ND1 7.488 H A 0042 LYS NZ
C A 0012 HIS NE2 7.822 H A 0042 LYS NZ
C A 0012 HIS ND1 11.03 C A 0046 LYS NZ
C A 0012 HIS NE2 10.16 C A 0046 LYS NZ
C A 0013 GLU OE1 11.61 H A 0025 ASP OD1
C A 0013 GLU OE1 11.37 H A 0025 ASP OD2
H A 0016 HIS ND1 9.837 H A 0042 LYS NZ
H A 0016 HIS NE2 11.58 H A 0042 LYS NZ
H A 0020 ARG NH1 9.950 H A 0034 LYS NZ
H A 0020 ARG NH2 10.73 H A 0034 LYS NZ
H A 0035 GLU OE2 11.19 H A 0041 ASP OD1
H A 0035 GLU OE2 10.68 H A 0041 ASP OD2
HB_MM 2.00 3.20 91
H A 0002 LEU N 2.199 C A 0001 PHE O
H A 0003 ASP N 2.192 H A 0002 LEU O
H A 0004 GLY N 2.194 H A 0003 ASP O
H A 0005 ILE N 3.165 C A 0001 PHE O
H A 0005 ILE N 3.141 H A 0002 LEU O
H A 0005 ILE N 2.198 H A 0004 GLY O
H A 0006 ASP N 3.048 H A 0002 LEU O
H A 0006 ASP N 3.175 H A 0003 ASP O
H A 0006 ASP N 2.191 H A 0005 ILE O
H A 0007 LYS N 2.190 H A 0006 ASP O
H A 0008 ALA N 2.927 H A 0004 GLY O
H A 0008 ALA N 2.198 H A 0007 LYS O
C A 0009 GLN N 2.532 H A 0005 ILE O
C A 0009 GLN N 2.196 H A 0008 ALA O
C A 0010 GLU N 2.201 C A 0009 GLN O
C A 0011 GLU N 2.197 C A 0010 GLU O
C A 0012 HIS N 2.199 C A 0011 GLU O
C A 0013 GLU N 2.675 C A 0011 GLU O
C A 0013 GLU N 2.201 C A 0012 HIS O
H A 0014 LYS N 2.203 C A 0013 GLU O
H A 0015 TYR N 2.196 H A 0014 LYS O
H A 0016 HIS N 2.196 H A 0015 TYR O
H A 0017 SER N 3.054 H A 0014 LYS O
H A 0017 SER N 2.194 H A 0016 HIS O
C A 0018 ASN N 3.197 H A 0014 LYS O
C A 0018 ASN N 3.163 H A 0015 TYR O
C A 0018 ASN N 2.200 H A 0017 SER O
H A 0019 TRP N 2.194 C A 0018 ASN O
H A 0020 ARG N 2.197 H A 0019 TRP O
H A 0021 ALA N 2.193 H A 0020 ARG O
H A 0022 MET N 3.165 H A 0019 TRP O
H A 0022 MET N 2.198 H A 0021 ALA O
H A 0023 ALA N 3.126 H A 0019 TRP O
H A 0023 ALA N 3.185 H A 0020 ARG O
H A 0023 ALA N 2.192 H A 0022 MET O
H A 0024 SER N 3.053 H A 0020 ARG O
H A 0024 SER N 3.131 H A 0021 ALA O
H A 0024 SER N 2.197 H A 0023 ALA O
H A 0025 ASP N 2.823 H A 0021 ALA O
H A 0025 ASP N 3.193 H A 0022 MET O
H A 0025 ASP N 2.196 H A 0024 SER O
H A 0026 PHE N 3.022 H A 0022 MET O
H A 0026 PHE N 2.200 H A 0025 ASP O
C A 0027 ASN N 2.623 H A 0023 ALA O
C A 0027 ASN N 3.117 H A 0024 SER O
C A 0027 ASN N 2.196 H A 0026 PHE O
C A 0028 LEU N 2.868 H A 0023 ALA O
C A 0028 LEU N 3.152 H A 0026 PHE O
C A 0028 LEU N 2.204 C A 0027 ASN O
C A 0029 PRO N 2.195 C A 0028 LEU O
H A 0030 PRO N 2.204 C A 0029 PRO O
H A 0031 VAL N 2.425 C A 0029 PRO O
H A 0031 VAL N 2.183 H A 0030 PRO O
H A 0032 VAL N 3.016 C A 0029 PRO O
H A 0032 VAL N 2.188 H A 0031 VAL O
H A 0033 ALA N 2.196 H A 0032 VAL O
H A 0034 LYS N 2.758 H A 0030 PRO O
H A 0034 LYS N 2.197 H A 0033 ALA O
H A 0035 GLU N 2.193 H A 0034 LYS O
H A 0036 ILE N 3.138 H A 0033 ALA O
H A 0036 ILE N 2.193 H A 0035 GLU O
H A 0037 VAL N 3.038 H A 0034 LYS O
H A 0037 VAL N 2.197 H A 0036 ILE O
H A 0038 ALA N 2.930 H A 0034 LYS O
H A 0038 ALA N 3.091 H A 0035 GLU O
H A 0038 ALA N 2.198 H A 0037 VAL O
H A 0039 SER N 2.881 H A 0035 GLU O
H A 0039 SER N 2.197 H A 0038 ALA O
C A 0040 CYS N 2.877 H A 0036 ILE O
C A 0040 CYS N 2.192 H A 0039 SER O
H A 0041 ASP N 3.137 H A 0039 SER O
H A 0041 ASP N 2.199 C A 0040 CYS O
H A 0042 LYS N 2.191 H A 0041 ASP O
H A 0043 CYS N 3.141 C A 0040 CYS O
H A 0043 CYS N 2.194 H A 0042 LYS O
H A 0044 GLN N 2.916 C A 0040 CYS O
H A 0044 GLN N 3.139 H A 0041 ASP O
H A 0044 GLN N 2.196 H A 0043 CYS O
C A 0045 LEU N 3.065 H A 0041 ASP O
C A 0045 LEU N 2.193 H A 0044 GLN O
C A 0046 LYS N 2.196 C A 0045 LEU O
C A 0047 GLY N 2.198 C A 0046 LYS O
C A 0048 GLU N 2.196 C A 0047 GLY O
C A 0049 ALA N 2.197 C A 0048 GLU O
C A 0050 MET N 2.196 C A 0049 ALA O
C A 0051 HIS N 2.196 C A 0050 MET O
C A 0052 GLY N 3.076 C A 0050 MET O
C A 0052 GLY N 2.200 C A 0051 HIS O
C A 0053 GLN N 2.198 C A 0052 GLY O
C A 0054 VAL N 2.199 C A 0053 GLN O
C A 0055 ASP N 2.197 C A 0054 VAL O
HB_MS 2.00 3.20 3
H A 0014 LYS O 2.364 H A 0017 SER OG
C A 0018 ASN N 2.746 H A 0017 SER OG
H A 0036 ILE N 2.886 H A 0035 GLU OE1
HB_SS 2.00 3.20 1
H A 0035 GLU OE2 2.478 H A 0039 SER OG
AROMATIC 0.00 8.00 2
C A 0012 HIS 5.293 H A 0016 HIS
H A 0034 LYS 5.883 H A 0019 TRP
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 19
C A 0001 PHE CE1 3.329 C B 0001 PHE CE1
C A 0001 PHE CE1 3.602 C B 0001 PHE CZ
C A 0001 PHE CZ 3.634 C B 0001 PHE CE1
C A 0001 PHE CZ 3.368 C B 0001 PHE CZ
C A 0001 PHE CG 3.775 C B 0029 PRO CG
C A 0001 PHE CD1 3.692 C B 0029 PRO CG
H A 0002 LEU CD2 3.593 H B 0031 VAL CG2
H A 0005 ILE CD1 3.344 H B 0031 VAL CG2
C A 0029 PRO CG 3.700 C B 0001 PHE CG
C A 0029 PRO CG 3.659 C B 0001 PHE CD1
H A 0031 VAL CG2 3.583 H B 0002 LEU CD2
H A 0031 VAL CG2 3.287 H B 0005 ILE CD1
H A 0038 ALA CB 3.630 H B 0038 ALA CB
C A 0045 LEU CD2 3.758 C B 0045 LEU CD2
C A 0049 ALA C 3.632 C B 0049 ALA C
C A 0051 HIS CB 3.736 C B 0051 HIS CE1
C A 0051 HIS CG 3.779 C B 0051 HIS CE1
C A 0051 HIS CE1 3.734 C B 0051 HIS CB
C A 0051 HIS CE1 3.789 C B 0051 HIS CG
CHARGE_ATTR 2.00 12.00 19
H A 0034 LYS NZ 6.939 H B 0035 GLU OE1
H A 0034 LYS NZ 5.008 H B 0035 GLU OE2
H A 0034 LYS NZ 11.63 H B 0041 ASP OD1
H A 0034 LYS NZ 11.15 H B 0041 ASP OD2
H A 0035 GLU OE1 7.039 H B 0034 LYS NZ
H A 0035 GLU OE2 5.089 H B 0034 LYS NZ
H A 0041 ASP OD1 11.60 H B 0034 LYS NZ
H A 0041 ASP OD2 11.13 H B 0034 LYS NZ
H A 0041 ASP OD1 10.60 C B 0046 LYS NZ
C A 0046 LYS NZ 10.50 H B 0041 ASP OD1
C A 0046 LYS NZ 11.92 H B 0041 ASP OD2
C A 0048 GLU OE1 9.016 C B 0051 HIS ND1
C A 0048 GLU OE1 10.48 C B 0051 HIS NE2
C A 0048 GLU OE2 6.912 C B 0051 HIS ND1
C A 0048 GLU OE2 8.435 C B 0051 HIS NE2
C A 0051 HIS ND1 8.997 C B 0048 GLU OE1
C A 0051 HIS ND1 6.897 C B 0048 GLU OE2
C A 0051 HIS NE2 10.46 C B 0048 GLU OE1
C A 0051 HIS NE2 8.413 C B 0048 GLU OE2
CHARGE_REPU 2.00 12.00 9
H A 0035 GLU OE1 10.35 H B 0035 GLU OE1
H A 0035 GLU OE1 10.66 H B 0035 GLU OE2
H A 0035 GLU OE2 10.67 H B 0035 GLU OE1
H A 0035 GLU OE2 11.12 H B 0035 GLU OE2
C A 0048 GLU OE2 11.47 C B 0048 GLU OE2
C A 0051 HIS ND1 3.290 C B 0051 HIS ND1
C A 0051 HIS ND1 4.610 C B 0051 HIS NE2
C A 0051 HIS NE2 4.574 C B 0051 HIS ND1
C A 0051 HIS NE2 4.925 C B 0051 HIS NE2
AROMATIC 0.00 8.00 1
C A 0001 PHE 4.680 C B 0001 PHE
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 191
C B 0001 PHE C 2.433 H B 0002 LEU CA
C B 0001 PHE C 3.007 H B 0002 LEU C
C B 0001 PHE C 3.697 H B 0002 LEU CB
H B 0002 LEU C 2.419 H B 0003 ASP CA
H B 0002 LEU C 2.991 H B 0003 ASP C
H B 0002 LEU C 3.688 H B 0003 ASP CB
H B 0003 ASP C 2.415 H B 0004 GLY CA
H B 0003 ASP C 2.959 H B 0004 GLY C
H B 0004 GLY C 2.422 H B 0005 ILE CA
H B 0004 GLY C 3.031 H B 0005 ILE C
H B 0004 GLY C 3.695 H B 0005 ILE CB
H B 0005 ILE C 2.412 H B 0006 ASP CA
H B 0005 ILE C 2.954 H B 0006 ASP C
H B 0005 ILE C 3.692 H B 0006 ASP CB
H B 0005 ILE CD1 3.735 H B 0035 GLU CD
H B 0006 ASP C 2.414 H B 0007 LYS CA
H B 0006 ASP C 3.026 H B 0007 LYS C
H B 0006 ASP C 3.688 H B 0007 LYS CB
H B 0007 LYS C 2.430 H B 0008 ALA CA
H B 0007 LYS C 3.053 H B 0008 ALA C
H B 0007 LYS C 3.690 H B 0008 ALA CB
H B 0008 ALA C 2.429 C B 0009 GLN CA
H B 0008 ALA C 3.007 C B 0009 GLN C
H B 0008 ALA C 3.691 C B 0009 GLN CB
H B 0008 ALA CB 3.732 H B 0036 ILE CD1
C B 0009 GLN C 2.434 C B 0010 GLU CA
C B 0009 GLN C 3.678 C B 0010 GLU C
C B 0009 GLN C 3.164 C B 0010 GLU CB
C B 0010 GLU C 2.431 C B 0011 GLU CA
C B 0010 GLU C 3.161 C B 0011 GLU C
C B 0010 GLU C 3.678 C B 0011 GLU CB
C B 0011 GLU C 2.425 C B 0012 HIS CA
C B 0011 GLU C 3.066 C B 0012 HIS C
C B 0011 GLU C 3.683 C B 0012 HIS CB
C B 0012 HIS C 2.441 C B 0013 GLU CA
C B 0012 HIS C 3.340 C B 0013 GLU C
C B 0012 HIS C 3.605 C B 0013 GLU CB
C B 0012 HIS C 3.794 C B 0013 GLU CG
C B 0012 HIS CA 3.707 H B 0016 HIS CG
C B 0012 HIS CE1 3.756 H B 0042 LYS CB
C B 0013 GLU C 2.434 H B 0014 LYS CA
C B 0013 GLU C 3.050 H B 0014 LYS C
C B 0013 GLU C 3.698 H B 0014 LYS CB
H B 0014 LYS C 2.421 H B 0015 TYR CA
H B 0014 LYS C 2.950 H B 0015 TYR C
H B 0014 LYS C 3.694 H B 0015 TYR CB
H B 0015 TYR C 2.416 H B 0016 HIS CA
H B 0015 TYR C 2.954 H B 0016 HIS C
H B 0015 TYR C 3.700 H B 0016 HIS CB
H B 0016 HIS C 2.413 H B 0017 SER CA
H B 0016 HIS C 2.937 H B 0017 SER C
H B 0016 HIS C 3.694 H B 0017 SER CB
H B 0017 SER C 2.434 C B 0018 ASN CA
H B 0017 SER C 3.273 C B 0018 ASN C
H B 0017 SER C 3.625 C B 0018 ASN CB
C B 0018 ASN C 2.419 H B 0019 TRP CA
C B 0018 ASN C 3.054 H B 0019 TRP C
C B 0018 ASN C 3.691 H B 0019 TRP CB
H B 0019 TRP C 2.427 H B 0020 ARG CA
H B 0019 TRP C 2.979 H B 0020 ARG C
H B 0019 TRP C 3.698 H B 0020 ARG CB
H B 0019 TRP CD2 3.741 H B 0020 ARG CA
H B 0019 TRP CD2 3.699 H B 0020 ARG CG
H B 0019 TRP CE2 3.465 H B 0020 ARG CG
H B 0019 TRP CE3 3.382 H B 0020 ARG CA
H B 0019 TRP CE3 3.794 H B 0020 ARG CG
H B 0019 TRP CZ2 3.358 H B 0020 ARG CG
H B 0019 TRP CZ3 3.787 H B 0020 ARG CA
H B 0019 TRP CZ3 3.684 H B 0020 ARG CG
H B 0019 TRP CH2 3.469 H B 0020 ARG CG
H B 0019 TRP CZ3 3.683 H B 0030 PRO CA
H B 0019 TRP CZ3 3.408 H B 0030 PRO CB
H B 0019 TRP CZ3 3.705 H B 0030 PRO CG
H B 0019 TRP CH2 3.526 H B 0030 PRO CB
H B 0019 TRP CH2 3.728 H B 0030 PRO CG
H B 0019 TRP CE3 3.554 H B 0033 ALA CB
H B 0020 ARG C 2.421 H B 0021 ALA CA
H B 0020 ARG C 2.961 H B 0021 ALA C
H B 0020 ARG C 3.695 H B 0021 ALA CB
H B 0021 ALA C 2.426 H B 0022 MET CA
H B 0021 ALA C 2.984 H B 0022 MET C
H B 0021 ALA C 3.686 H B 0022 MET CB
H B 0022 MET C 2.414 H B 0023 ALA CA
H B 0022 MET C 2.960 H B 0023 ALA C
H B 0022 MET C 3.685 H B 0023 ALA CB
H B 0022 MET CE 3.436 H B 0036 ILE CD1
H B 0023 ALA C 2.421 H B 0024 SER CA
H B 0023 ALA C 3.050 H B 0024 SER C
H B 0023 ALA C 3.685 H B 0024 SER CB
H B 0024 SER C 2.425 H B 0025 ASP CA
H B 0024 SER C 2.980 H B 0025 ASP C
H B 0024 SER C 3.694 H B 0025 ASP CB
H B 0025 ASP C 2.438 H B 0026 PHE CA
H B 0025 ASP C 3.319 H B 0026 PHE C
H B 0025 ASP C 3.606 H B 0026 PHE CB
H B 0026 PHE C 2.422 C B 0027 ASN CA
H B 0026 PHE C 2.920 C B 0027 ASN C
H B 0026 PHE C 3.035 C B 0027 ASN CB
H B 0026 PHE C 3.613 C B 0027 ASN CG
H B 0026 PHE CB 3.439 C B 0028 LEU CD1
C B 0027 ASN C 2.448 C B 0028 LEU CA
C B 0027 ASN C 3.417 C B 0028 LEU C
C B 0027 ASN C 3.552 C B 0028 LEU CB
C B 0027 ASN C 3.724 C B 0028 LEU CG
C B 0028 LEU CA 2.933 C B 0029 PRO CD
C B 0028 LEU C 2.441 C B 0029 PRO CA
C B 0028 LEU C 3.083 C B 0029 PRO C
C B 0028 LEU C 3.639 C B 0029 PRO CB
C B 0028 LEU C 3.639 C B 0029 PRO CG
C B 0028 LEU C 2.490 C B 0029 PRO CD
C B 0028 LEU CB 3.544 C B 0029 PRO CD
C B 0029 PRO CA 2.941 H B 0030 PRO CD
C B 0029 PRO C 2.461 H B 0030 PRO CA
C B 0029 PRO C 2.942 H B 0030 PRO C
C B 0029 PRO C 3.613 H B 0030 PRO CB
C B 0029 PRO C 3.672 H B 0030 PRO CG
C B 0029 PRO C 2.498 H B 0030 PRO CD
C B 0029 PRO CB 3.725 H B 0030 PRO CD
H B 0030 PRO C 2.407 H B 0031 VAL CA
H B 0030 PRO C 2.971 H B 0031 VAL C
H B 0030 PRO C 3.677 H B 0031 VAL CB
H B 0031 VAL C 2.407 H B 0032 VAL CA
H B 0031 VAL C 3.014 H B 0032 VAL C
H B 0031 VAL C 3.684 H B 0032 VAL CB
H B 0032 VAL C 2.426 H B 0033 ALA CA
H B 0032 VAL C 2.998 H B 0033 ALA C
H B 0032 VAL C 3.695 H B 0033 ALA CB
H B 0033 ALA C 2.424 H B 0034 LYS CA
H B 0033 ALA C 2.987 H B 0034 LYS C
H B 0033 ALA C 3.702 H B 0034 LYS CB
H B 0034 LYS C 2.417 H B 0035 GLU CA
H B 0034 LYS C 2.957 H B 0035 GLU C
H B 0034 LYS C 3.693 H B 0035 GLU CB
H B 0035 GLU C 2.418 H B 0036 ILE CA
H B 0035 GLU C 2.964 H B 0036 ILE C
H B 0035 GLU C 3.694 H B 0036 ILE CB
H B 0036 ILE C 2.426 H B 0037 VAL CA
H B 0036 ILE C 2.984 H B 0037 VAL C
H B 0036 ILE C 3.693 H B 0037 VAL CB
H B 0037 VAL C 2.424 H B 0038 ALA CA
H B 0037 VAL C 3.020 H B 0038 ALA C
H B 0037 VAL C 3.690 H B 0038 ALA CB
H B 0038 ALA C 2.424 H B 0039 SER CA
H B 0038 ALA C 3.086 H B 0039 SER C
H B 0038 ALA C 3.682 H B 0039 SER CB
H B 0039 SER C 2.413 C B 0040 CYS CA
H B 0039 SER C 3.073 C B 0040 CYS C
H B 0039 SER C 3.673 C B 0040 CYS CB
C B 0040 CYS C 2.426 H B 0041 ASP CA
C B 0040 CYS C 2.985 H B 0041 ASP C
C B 0040 CYS C 3.695 H B 0041 ASP CB
H B 0041 ASP C 2.416 H B 0042 LYS CA
H B 0041 ASP C 2.971 H B 0042 LYS C
H B 0041 ASP C 3.694 H B 0042 LYS CB
H B 0042 LYS C 2.420 H B 0043 CYS CA
H B 0042 LYS C 3.125 H B 0043 CYS C
H B 0042 LYS C 3.683 H B 0043 CYS CB
H B 0043 CYS C 2.423 H B 0044 GLN CA
H B 0043 CYS C 3.121 H B 0044 GLN C
H B 0043 CYS C 3.678 H B 0044 GLN CB
H B 0044 GLN C 2.415 C B 0045 LEU CA
H B 0044 GLN C 3.051 C B 0045 LEU C
H B 0044 GLN C 3.679 C B 0045 LEU CB
C B 0045 LEU C 2.424 C B 0046 LYS CA
C B 0045 LEU C 3.210 C B 0046 LYS C
C B 0045 LEU C 3.639 C B 0046 LYS CB
C B 0046 LYS C 2.425 C B 0047 GLY CA
C B 0046 LYS C 3.175 C B 0047 GLY C
C B 0047 GLY C 2.424 C B 0048 GLU CA
C B 0047 GLY C 3.129 C B 0048 GLU C
C B 0047 GLY C 3.665 C B 0048 GLU CB
C B 0048 GLU C 2.425 C B 0049 ALA CA
C B 0048 GLU C 3.047 C B 0049 ALA C
C B 0048 GLU C 3.694 C B 0049 ALA CB
C B 0049 ALA C 2.421 C B 0050 MET CA
C B 0049 ALA C 3.129 C B 0050 MET C
C B 0049 ALA C 3.663 C B 0050 MET CB
C B 0050 MET C 2.419 C B 0051 HIS CA
C B 0050 MET C 3.087 C B 0051 HIS C
C B 0050 MET C 3.678 C B 0051 HIS CB
C B 0051 HIS C 2.429 C B 0052 GLY CA
C B 0051 HIS C 3.158 C B 0052 GLY C
C B 0052 GLY C 2.431 C B 0053 GLN CA
C B 0052 GLY C 3.618 C B 0053 GLN C
C B 0052 GLY C 3.266 C B 0053 GLN CB
C B 0053 GLN C 2.434 C B 0054 VAL CA
C B 0053 GLN C 3.293 C B 0054 VAL C
C B 0053 GLN C 3.615 C B 0054 VAL CB
C B 0054 VAL C 2.425 C B 0055 ASP CA
C B 0054 VAL C 3.180 C B 0055 ASP C
C B 0054 VAL C 3.655 C B 0055 ASP CB
CHARGE_ATTR 2.00 12.00 51
H B 0003 ASP OD1 5.434 H B 0007 LYS NZ
H B 0003 ASP OD2 6.170 H B 0007 LYS NZ
H B 0006 ASP OD1 6.869 H B 0007 LYS NZ
H B 0006 ASP OD2 6.304 H B 0007 LYS NZ
H B 0006 ASP OD1 10.95 H B 0016 HIS NE2
C B 0010 GLU OE1 10.63 H B 0007 LYS NZ
C B 0010 GLU OE2 11.60 H B 0007 LYS NZ
C B 0010 GLU OE1 11.99 C B 0012 HIS ND1
C B 0010 GLU OE1 9.177 H B 0016 HIS ND1
C B 0010 GLU OE1 7.147 H B 0016 HIS NE2
C B 0010 GLU OE2 10.36 H B 0016 HIS ND1
C B 0010 GLU OE2 8.416 H B 0016 HIS NE2
C B 0011 GLU OE1 10.20 C B 0012 HIS ND1
C B 0011 GLU OE1 10.99 C B 0012 HIS NE2
C B 0011 GLU OE2 10.85 C B 0012 HIS ND1
C B 0011 GLU OE2 11.73 C B 0012 HIS NE2
C B 0011 GLU OE1 10.71 H B 0014 LYS NZ
C B 0011 GLU OE1 9.413 H B 0016 HIS ND1
C B 0011 GLU OE1 8.597 H B 0016 HIS NE2
C B 0011 GLU OE2 10.26 H B 0016 HIS ND1
C B 0011 GLU OE2 9.597 H B 0016 HIS NE2
C B 0013 GLU OE1 9.305 C B 0012 HIS ND1
C B 0013 GLU OE1 9.982 C B 0012 HIS NE2
C B 0013 GLU OE2 10.01 C B 0012 HIS ND1
C B 0013 GLU OE2 10.26 C B 0012 HIS NE2
C B 0013 GLU OE1 8.481 H B 0014 LYS NZ
C B 0013 GLU OE2 6.953 H B 0014 LYS NZ
C B 0013 GLU OE1 7.929 H B 0016 HIS ND1
C B 0013 GLU OE1 6.799 H B 0016 HIS NE2
C B 0013 GLU OE2 9.306 H B 0016 HIS ND1
C B 0013 GLU OE2 8.541 H B 0016 HIS NE2
H B 0025 ASP OD1 11.50 H B 0007 LYS NZ
H B 0025 ASP OD1 11.86 H B 0016 HIS NE2
H B 0035 GLU OE1 10.32 H B 0016 HIS ND1
H B 0035 GLU OE1 9.854 H B 0016 HIS NE2
H B 0035 GLU OE2 10.84 H B 0016 HIS ND1
H B 0035 GLU OE2 10.64 H B 0016 HIS NE2
H B 0041 ASP OD1 10.55 C B 0012 HIS ND1
H B 0041 ASP OD1 11.67 C B 0012 HIS NE2
H B 0041 ASP OD2 9.957 C B 0012 HIS ND1
H B 0041 ASP OD2 11.32 C B 0012 HIS NE2
H B 0041 ASP OD1 11.41 H B 0016 HIS ND1
H B 0041 ASP OD2 10.54 H B 0016 HIS ND1
H B 0041 ASP OD2 11.92 H B 0016 HIS NE2
H B 0041 ASP OD1 7.644 H B 0042 LYS NZ
H B 0041 ASP OD2 6.878 H B 0042 LYS NZ
C B 0048 GLU OE1 8.782 C B 0051 HIS ND1
C B 0048 GLU OE1 9.976 C B 0051 HIS NE2
C B 0048 GLU OE2 6.673 C B 0051 HIS ND1
C B 0048 GLU OE2 7.945 C B 0051 HIS NE2
C B 0055 ASP OD1 11.51 C B 0051 HIS NE2
CHARGE_REPU 2.00 12.00 45
H B 0003 ASP OD1 7.482 H B 0006 ASP OD1
H B 0003 ASP OD1 5.906 H B 0006 ASP OD2
H B 0003 ASP OD2 9.431 H B 0006 ASP OD1
H B 0003 ASP OD2 7.996 H B 0006 ASP OD2
H B 0006 ASP OD1 6.359 C B 0010 GLU OE1
H B 0006 ASP OD1 7.971 C B 0010 GLU OE2
H B 0006 ASP OD2 8.422 C B 0010 GLU OE1
H B 0006 ASP OD2 9.884 C B 0010 GLU OE2
H B 0006 ASP OD1 10.83 H B 0035 GLU OE1
H B 0006 ASP OD1 11.40 H B 0035 GLU OE2
H B 0006 ASP OD2 11.66 H B 0035 GLU OE1
C B 0010 GLU OE1 7.378 C B 0011 GLU OE1
C B 0010 GLU OE1 8.041 C B 0011 GLU OE2
C B 0010 GLU OE2 6.412 C B 0011 GLU OE1
C B 0010 GLU OE2 7.224 C B 0011 GLU OE2
C B 0010 GLU OE1 7.034 C B 0013 GLU OE1
C B 0010 GLU OE1 8.966 C B 0013 GLU OE2
C B 0010 GLU OE2 6.325 C B 0013 GLU OE1
C B 0010 GLU OE2 7.983 C B 0013 GLU OE2
C B 0010 GLU OE1 10.82 H B 0025 ASP OD1
C B 0010 GLU OE1 11.80 H B 0025 ASP OD2
C B 0010 GLU OE2 11.12 H B 0025 ASP OD1
C B 0010 GLU OE2 11.80 H B 0025 ASP OD2
C B 0011 GLU OE1 4.428 C B 0013 GLU OE1
C B 0011 GLU OE1 4.538 C B 0013 GLU OE2
C B 0011 GLU OE2 6.517 C B 0013 GLU OE1
C B 0011 GLU OE2 6.639 C B 0013 GLU OE2
C B 0012 HIS ND1 11.16 H B 0014 LYS NZ
C B 0012 HIS NE2 10.01 H B 0014 LYS NZ
C B 0012 HIS ND1 3.450 H B 0016 HIS ND1
C B 0012 HIS ND1 5.530 H B 0016 HIS NE2
C B 0012 HIS NE2 5.420 H B 0016 HIS ND1
C B 0012 HIS NE2 7.377 H B 0016 HIS NE2
C B 0012 HIS ND1 7.485 H B 0042 LYS NZ
C B 0012 HIS NE2 7.817 H B 0042 LYS NZ
C B 0012 HIS ND1 11.04 C B 0046 LYS NZ
C B 0012 HIS NE2 10.16 C B 0046 LYS NZ
C B 0013 GLU OE1 11.61 H B 0025 ASP OD1
C B 0013 GLU OE1 11.37 H B 0025 ASP OD2
H B 0016 HIS ND1 9.836 H B 0042 LYS NZ
H B 0016 HIS NE2 11.58 H B 0042 LYS NZ
H B 0020 ARG NH1 9.952 H B 0034 LYS NZ
H B 0020 ARG NH2 10.73 H B 0034 LYS NZ
H B 0035 GLU OE2 11.18 H B 0041 ASP OD1
H B 0035 GLU OE2 10.68 H B 0041 ASP OD2
HB_MM 2.00 3.20 91
H B 0002 LEU N 2.200 C B 0001 PHE O
H B 0003 ASP N 2.192 H B 0002 LEU O
H B 0004 GLY N 2.194 H B 0003 ASP O
H B 0005 ILE N 3.158 C B 0001 PHE O
H B 0005 ILE N 3.132 H B 0002 LEU O
H B 0005 ILE N 2.198 H B 0004 GLY O
H B 0006 ASP N 3.041 H B 0002 LEU O
H B 0006 ASP N 3.175 H B 0003 ASP O
H B 0006 ASP N 2.190 H B 0005 ILE O
H B 0007 LYS N 2.191 H B 0006 ASP O
H B 0008 ALA N 2.921 H B 0004 GLY O
H B 0008 ALA N 2.198 H B 0007 LYS O
C B 0009 GLN N 2.531 H B 0005 ILE O
C B 0009 GLN N 2.198 H B 0008 ALA O
C B 0010 GLU N 2.202 C B 0009 GLN O
C B 0011 GLU N 2.197 C B 0010 GLU O
C B 0012 HIS N 2.197 C B 0011 GLU O
C B 0013 GLU N 2.674 C B 0011 GLU O
C B 0013 GLU N 2.202 C B 0012 HIS O
H B 0014 LYS N 2.202 C B 0013 GLU O
H B 0015 TYR N 2.195 H B 0014 LYS O
H B 0016 HIS N 2.195 H B 0015 TYR O
H B 0017 SER N 3.057 H B 0014 LYS O
H B 0017 SER N 2.192 H B 0016 HIS O
C B 0018 ASN N 3.197 H B 0014 LYS O
C B 0018 ASN N 3.167 H B 0015 TYR O
C B 0018 ASN N 2.200 H B 0017 SER O
H B 0019 TRP N 2.194 C B 0018 ASN O
H B 0020 ARG N 2.197 H B 0019 TRP O
H B 0021 ALA N 2.193 H B 0020 ARG O
H B 0022 MET N 3.166 H B 0019 TRP O
H B 0022 MET N 2.198 H B 0021 ALA O
H B 0023 ALA N 3.128 H B 0019 TRP O
H B 0023 ALA N 3.187 H B 0020 ARG O
H B 0023 ALA N 2.193 H B 0022 MET O
H B 0024 SER N 3.052 H B 0020 ARG O
H B 0024 SER N 3.134 H B 0021 ALA O
H B 0024 SER N 2.196 H B 0023 ALA O
H B 0025 ASP N 2.827 H B 0021 ALA O
H B 0025 ASP N 3.194 H B 0022 MET O
H B 0025 ASP N 2.197 H B 0024 SER O
H B 0026 PHE N 3.021 H B 0022 MET O
H B 0026 PHE N 2.200 H B 0025 ASP O
C B 0027 ASN N 2.622 H B 0023 ALA O
C B 0027 ASN N 3.113 H B 0024 SER O
C B 0027 ASN N 2.196 H B 0026 PHE O
C B 0028 LEU N 2.870 H B 0023 ALA O
C B 0028 LEU N 3.151 H B 0026 PHE O
C B 0028 LEU N 2.205 C B 0027 ASN O
C B 0029 PRO N 2.197 C B 0028 LEU O
H B 0030 PRO N 2.202 C B 0029 PRO O
H B 0031 VAL N 2.423 C B 0029 PRO O
H B 0031 VAL N 2.185 H B 0030 PRO O
H B 0032 VAL N 3.017 C B 0029 PRO O
H B 0032 VAL N 2.187 H B 0031 VAL O
H B 0033 ALA N 2.198 H B 0032 VAL O
H B 0034 LYS N 2.755 H B 0030 PRO O
H B 0034 LYS N 2.197 H B 0033 ALA O
H B 0035 GLU N 2.191 H B 0034 LYS O
H B 0036 ILE N 3.143 H B 0033 ALA O
H B 0036 ILE N 2.193 H B 0035 GLU O
H B 0037 VAL N 3.037 H B 0034 LYS O
H B 0037 VAL N 2.198 H B 0036 ILE O
H B 0038 ALA N 2.931 H B 0034 LYS O
H B 0038 ALA N 3.088 H B 0035 GLU O
H B 0038 ALA N 2.197 H B 0037 VAL O
H B 0039 SER N 2.882 H B 0035 GLU O
H B 0039 SER N 2.198 H B 0038 ALA O
C B 0040 CYS N 2.879 H B 0036 ILE O
C B 0040 CYS N 2.191 H B 0039 SER O
H B 0041 ASP N 3.134 H B 0039 SER O
H B 0041 ASP N 2.197 C B 0040 CYS O
H B 0042 LYS N 2.192 H B 0041 ASP O
H B 0043 CYS N 3.142 C B 0040 CYS O
H B 0043 CYS N 2.193 H B 0042 LYS O
H B 0044 GLN N 2.911 C B 0040 CYS O
H B 0044 GLN N 3.136 H B 0041 ASP O
H B 0044 GLN N 2.195 H B 0043 CYS O
C B 0045 LEU N 3.068 H B 0041 ASP O
C B 0045 LEU N 2.192 H B 0044 GLN O
C B 0046 LYS N 2.197 C B 0045 LEU O
C B 0047 GLY N 2.197 C B 0046 LYS O
C B 0048 GLU N 2.196 C B 0047 GLY O
C B 0049 ALA N 2.197 C B 0048 GLU O
C B 0050 MET N 2.195 C B 0049 ALA O
C B 0051 HIS N 2.196 C B 0050 MET O
C B 0052 GLY N 3.083 C B 0050 MET O
C B 0052 GLY N 2.200 C B 0051 HIS O
C B 0053 GLN N 2.198 C B 0052 GLY O
C B 0054 VAL N 2.199 C B 0053 GLN O
C B 0055 ASP N 2.197 C B 0054 VAL O
HB_MS 2.00 3.20 4
H B 0014 LYS O 2.362 H B 0017 SER OG
C B 0018 ASN N 2.747 H B 0017 SER OG
H B 0036 ILE N 2.897 H B 0035 GLU OE1
H B 0038 ALA O 2.561 H B 0044 GLN NE2
HB_SS 2.00 3.20 1
H B 0035 GLU OE2 2.478 H B 0039 SER OG
AROMATIC 0.00 8.00 2
C B 0012 HIS 5.296 H B 0016 HIS
H B 0034 LYS 5.885 H B 0019 TRP