Complet list of 1nla con file
Complete list of 1nla.con file
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 196
C A 0001 MET C 2.424 C A 0002 LYS CA
C A 0001 MET C 3.158 C A 0002 LYS C
C A 0001 MET C 3.612 C A 0002 LYS CB
C A 0002 LYS C 2.422 C A 0003 GLY CA
C A 0002 LYS C 3.693 C A 0003 GLY C
C A 0003 GLY C 2.424 C A 0004 MET CA
C A 0003 GLY C 3.470 C A 0004 MET C
C A 0003 GLY C 3.422 C A 0004 MET CB
C A 0004 MET C 2.423 C A 0005 SER CA
C A 0004 MET C 3.045 C A 0005 SER C
C A 0004 MET C 3.634 C A 0005 SER CB
C A 0005 SER C 2.422 C A 0006 LYS CA
C A 0005 SER C 3.691 C A 0006 LYS C
C A 0005 SER C 3.007 C A 0006 LYS CB
C A 0005 SER C 3.658 C A 0006 LYS CG
C A 0006 LYS C 2.419 C A 0007 MET CA
C A 0006 LYS C 2.952 C A 0007 MET C
C A 0006 LYS C 3.636 C A 0007 MET CB
C A 0007 MET CA 2.882 H A 0008 PRO CD
C A 0007 MET C 2.430 H A 0008 PRO CA
C A 0007 MET C 3.098 H A 0008 PRO C
C A 0007 MET C 3.614 H A 0008 PRO CB
C A 0007 MET C 3.629 H A 0008 PRO CG
C A 0007 MET C 2.494 H A 0008 PRO CD
C A 0007 MET CB 3.695 H A 0008 PRO CD
H A 0008 PRO C 2.423 H A 0009 GLN CA
H A 0008 PRO C 2.984 H A 0009 GLN C
H A 0008 PRO C 3.640 H A 0009 GLN CB
H A 0008 PRO CG 3.795 H A 0011 LEU CG
H A 0008 PRO CG 3.403 H A 0011 LEU CD1
H A 0009 GLN C 2.423 H A 0010 PHE CA
H A 0009 GLN C 3.046 H A 0010 PHE C
H A 0009 GLN C 3.636 H A 0010 PHE CB
H A 0010 PHE C 2.424 H A 0011 LEU CA
H A 0010 PHE C 3.256 H A 0011 LEU C
H A 0010 PHE C 3.573 H A 0011 LEU CB
H A 0010 PHE C 3.751 H A 0011 LEU CG
H A 0011 LEU C 2.427 H A 0012 ASN CA
H A 0011 LEU C 3.106 H A 0012 ASN C
H A 0011 LEU C 3.629 H A 0012 ASN CB
H A 0011 LEU CD2 3.312 C A 0014 TRP CD2
H A 0011 LEU CD2 3.345 C A 0014 TRP CE2
H A 0011 LEU CD2 3.531 C A 0014 TRP CE3
H A 0011 LEU CD2 3.608 C A 0014 TRP CZ2
H A 0011 LEU CD2 3.772 C A 0014 TRP CZ3
H A 0011 LEU CB 3.762 H A 0019 LEU CD2
H A 0012 ASN C 2.423 H A 0013 ARG CA
H A 0012 ASN C 3.289 H A 0013 ARG C
H A 0012 ASN C 3.557 H A 0013 ARG CB
H A 0013 ARG C 2.416 C A 0014 TRP CA
H A 0013 ARG C 2.992 C A 0014 TRP C
H A 0013 ARG C 3.621 C A 0014 TRP CB
H A 0013 ARG C 3.789 C A 0014 TRP CD1
C A 0014 TRP CA 2.897 H A 0015 PRO CD
C A 0014 TRP C 2.421 H A 0015 PRO CA
C A 0014 TRP C 3.057 H A 0015 PRO C
C A 0014 TRP C 3.612 H A 0015 PRO CB
C A 0014 TRP C 3.619 H A 0015 PRO CG
C A 0014 TRP C 2.494 H A 0015 PRO CD
C A 0014 TRP CB 3.697 H A 0015 PRO CD
C A 0014 TRP CB 3.702 H A 0019 LEU CG
C A 0014 TRP CB 3.799 H A 0019 LEU CD1
C A 0014 TRP CZ3 3.530 H A 0037 ILE CD1
C A 0014 TRP CH2 3.647 H A 0037 ILE CD1
H A 0015 PRO C 2.413 H A 0016 ARG CA
H A 0015 PRO C 3.123 H A 0016 ARG C
H A 0015 PRO C 3.586 H A 0016 ARG CB
H A 0015 PRO CG 3.398 H A 0018 VAL CG2
H A 0016 ARG C 2.417 H A 0017 GLU CA
H A 0016 ARG C 3.045 H A 0017 GLU C
H A 0016 ARG C 3.633 H A 0017 GLU CB
H A 0017 GLU C 2.422 H A 0018 VAL CA
H A 0017 GLU C 3.338 H A 0018 VAL C
H A 0017 GLU C 3.527 H A 0018 VAL CB
H A 0017 GLU C 3.635 H A 0018 VAL CG2
H A 0018 VAL C 2.423 H A 0019 LEU CA
H A 0018 VAL C 3.036 H A 0019 LEU C
H A 0018 VAL C 3.633 H A 0019 LEU CB
H A 0018 VAL C 3.750 H A 0022 VAL CG2
H A 0019 LEU C 2.418 H A 0020 ASP CA
H A 0019 LEU C 3.018 H A 0020 ASP C
H A 0019 LEU C 3.634 H A 0020 ASP CB
H A 0020 ASP C 2.423 H A 0021 LEU CA
H A 0020 ASP C 3.152 H A 0021 LEU C
H A 0020 ASP C 3.604 H A 0021 LEU CB
H A 0021 LEU C 2.428 H A 0022 VAL CA
H A 0021 LEU C 2.979 H A 0022 VAL C
H A 0021 LEU C 3.640 H A 0022 VAL CB
H A 0021 LEU C 3.664 H A 0025 VAL CG2
H A 0022 VAL C 2.426 H A 0023 ARG CA
H A 0022 VAL C 2.975 H A 0023 ARG C
H A 0022 VAL C 3.634 H A 0023 ARG CB
H A 0022 VAL CG1 3.244 H A 0033 VAL CG1
H A 0022 VAL CG1 3.593 H A 0037 ILE CD1
H A 0023 ARG C 2.425 H A 0024 LYS CA
H A 0023 ARG C 3.106 H A 0024 LYS C
H A 0023 ARG C 3.628 H A 0024 LYS CB
H A 0024 LYS C 2.423 H A 0025 VAL CA
H A 0024 LYS C 3.192 H A 0025 VAL C
H A 0024 LYS C 3.599 H A 0025 VAL CB
H A 0025 VAL C 2.420 H A 0026 ALA CA
H A 0025 VAL C 3.017 H A 0026 ALA C
H A 0025 VAL C 3.635 H A 0026 ALA CB
H A 0025 VAL CB 3.319 H A 0036 GLU CD
H A 0025 VAL CG1 3.602 H A 0036 GLU CG
H A 0025 VAL CG1 3.215 H A 0036 GLU CD
H A 0025 VAL CG1 3.657 H A 0040 ARG CZ
H A 0026 ALA C 2.423 H A 0027 GLU CA
H A 0026 ALA C 3.077 H A 0027 GLU C
H A 0026 ALA C 3.629 H A 0027 GLU CB
H A 0026 ALA CB 3.653 H A 0032 SER C
H A 0026 ALA CB 3.615 H A 0033 VAL CA
H A 0026 ALA CB 3.087 H A 0033 VAL CG2
H A 0027 GLU C 2.423 H A 0028 GLU CA
H A 0027 GLU C 3.125 H A 0028 GLU C
H A 0027 GLU C 3.621 H A 0028 GLU CB
H A 0028 GLU C 2.422 H A 0029 ASN CA
H A 0028 GLU C 3.041 H A 0029 ASN C
H A 0028 GLU C 3.632 H A 0029 ASN CB
H A 0029 ASN C 2.421 H A 0030 GLY CA
H A 0029 ASN C 3.457 H A 0030 GLY C
H A 0030 GLY C 2.423 C A 0031 ARG CA
H A 0030 GLY C 3.684 C A 0031 ARG C
H A 0030 GLY C 3.072 C A 0031 ARG CB
H A 0030 GLY C 3.764 C A 0031 ARG CG
C A 0031 ARG C 2.426 H A 0032 SER CA
C A 0031 ARG C 3.190 H A 0032 SER C
C A 0031 ARG C 3.601 H A 0032 SER CB
C A 0031 ARG CD 3.742 H A 0035 SER CB
H A 0032 SER C 2.417 H A 0033 VAL CA
H A 0032 SER C 3.183 H A 0033 VAL C
H A 0032 SER C 3.573 H A 0033 VAL CB
H A 0033 VAL C 2.418 H A 0034 ASN CA
H A 0033 VAL C 2.937 H A 0034 ASN C
H A 0033 VAL C 3.639 H A 0034 ASN CB
H A 0034 ASN C 2.421 H A 0035 SER CA
H A 0034 ASN C 3.221 H A 0035 SER C
H A 0034 ASN C 3.581 H A 0035 SER CB
H A 0035 SER C 2.417 H A 0036 GLU CA
H A 0035 SER C 2.966 H A 0036 GLU C
H A 0035 SER C 3.628 H A 0036 GLU CB
H A 0035 SER C 3.731 H A 0038 TYR CB
H A 0036 GLU C 2.423 H A 0037 ILE CA
H A 0036 GLU C 2.953 H A 0037 ILE C
H A 0036 GLU C 3.637 H A 0037 ILE CB
H A 0036 GLU CG 3.694 H A 0040 ARG CD
H A 0037 ILE C 2.421 H A 0038 TYR CA
H A 0037 ILE C 3.064 H A 0038 TYR C
H A 0037 ILE C 3.623 H A 0038 TYR CB
H A 0037 ILE C 3.796 H A 0041 VAL CG2
H A 0038 TYR C 2.426 H A 0039 GLN CA
H A 0038 TYR C 3.106 H A 0039 GLN C
H A 0038 TYR C 3.625 H A 0039 GLN CB
H A 0039 GLN C 2.425 H A 0040 ARG CA
H A 0039 GLN C 2.951 H A 0040 ARG C
H A 0039 GLN C 3.641 H A 0040 ARG CB
H A 0040 ARG C 2.433 H A 0041 VAL CA
H A 0040 ARG C 3.231 H A 0041 VAL C
H A 0040 ARG C 3.577 H A 0041 VAL CB
H A 0041 VAL C 2.425 H A 0042 MET CA
H A 0041 VAL C 3.101 H A 0042 MET C
H A 0041 VAL C 3.623 H A 0042 MET CB
H A 0042 MET C 2.423 H A 0043 GLU CA
H A 0042 MET C 3.198 H A 0043 GLU C
H A 0042 MET C 3.599 H A 0043 GLU CB
H A 0043 GLU C 2.420 H A 0044 SER CA
H A 0043 GLU C 3.024 H A 0044 SER C
H A 0043 GLU C 3.636 H A 0044 SER CB
H A 0044 SER C 2.424 H A 0045 PHE CA
H A 0044 SER C 2.990 H A 0045 PHE C
H A 0044 SER C 3.635 H A 0045 PHE CB
H A 0045 PHE C 2.424 H A 0046 LYS CA
H A 0045 PHE C 3.029 H A 0046 LYS C
H A 0045 PHE C 3.640 H A 0046 LYS CB
H A 0045 PHE CB 3.628 C A 0051 ILE CG1
H A 0045 PHE CB 3.367 C A 0051 ILE CD1
H A 0046 LYS C 2.428 H A 0047 LYS CA
H A 0046 LYS C 2.920 H A 0047 LYS C
H A 0046 LYS C 3.636 H A 0047 LYS CB
H A 0046 LYS CD 3.574 C A 0053 ALA CB
H A 0047 LYS C 2.424 H A 0048 GLU CA
H A 0047 LYS C 3.287 H A 0048 GLU C
H A 0047 LYS C 3.558 H A 0048 GLU CB
H A 0048 GLU C 2.418 H A 0049 GLY CA
H A 0048 GLU C 3.262 H A 0049 GLY C
H A 0049 GLY C 2.423 C A 0050 ARG CA
H A 0049 GLY C 3.228 C A 0050 ARG C
H A 0049 GLY C 3.585 C A 0050 ARG CB
C A 0050 ARG C 2.423 C A 0051 ILE CA
C A 0050 ARG C 3.167 C A 0051 ILE C
C A 0050 ARG C 3.610 C A 0051 ILE CB
C A 0051 ILE C 2.423 C A 0052 GLY CA
C A 0051 ILE C 3.407 C A 0052 GLY C
C A 0052 GLY C 2.424 C A 0053 ALA CA
C A 0052 GLY C 3.086 C A 0053 ALA C
C A 0052 GLY C 3.631 C A 0053 ALA CB
CHARGE_ATTR 2.00 12.00 56
H A 0017 GLU OE1 10.84 H A 0016 ARG NH1
H A 0017 GLU OE1 10.15 H A 0016 ARG NH2
H A 0017 GLU OE2 9.444 H A 0016 ARG NH1
H A 0017 GLU OE2 8.568 H A 0016 ARG NH2
H A 0020 ASP OD1 10.01 H A 0016 ARG NH1
H A 0020 ASP OD1 10.93 H A 0016 ARG NH2
H A 0020 ASP OD2 7.978 H A 0016 ARG NH1
H A 0020 ASP OD2 9.004 H A 0016 ARG NH2
H A 0020 ASP OD1 8.333 H A 0023 ARG NH1
H A 0020 ASP OD1 7.286 H A 0023 ARG NH2
H A 0020 ASP OD2 8.894 H A 0023 ARG NH1
H A 0020 ASP OD2 8.027 H A 0023 ARG NH2
H A 0020 ASP OD1 6.224 H A 0024 LYS NZ
H A 0020 ASP OD2 7.803 H A 0024 LYS NZ
H A 0027 GLU OE1 8.000 H A 0023 ARG NH1
H A 0027 GLU OE1 6.717 H A 0023 ARG NH2
H A 0027 GLU OE2 9.570 H A 0023 ARG NH1
H A 0027 GLU OE2 7.939 H A 0023 ARG NH2
H A 0027 GLU OE1 6.125 H A 0024 LYS NZ
H A 0027 GLU OE2 5.219 H A 0024 LYS NZ
H A 0028 GLU OE1 9.823 H A 0024 LYS NZ
H A 0028 GLU OE2 7.925 H A 0024 LYS NZ
H A 0028 GLU OE1 11.25 C A 0031 ARG NH1
H A 0028 GLU OE1 11.30 C A 0031 ARG NH2
H A 0028 GLU OE1 8.911 H A 0040 ARG NH1
H A 0028 GLU OE1 7.743 H A 0040 ARG NH2
H A 0028 GLU OE2 10.21 H A 0040 ARG NH1
H A 0028 GLU OE2 9.051 H A 0040 ARG NH2
H A 0036 GLU OE1 10.94 H A 0023 ARG NH1
H A 0036 GLU OE1 11.07 H A 0023 ARG NH2
H A 0036 GLU OE1 11.20 H A 0024 LYS NZ
H A 0036 GLU OE2 11.96 H A 0024 LYS NZ
H A 0036 GLU OE1 9.528 C A 0031 ARG NH1
H A 0036 GLU OE1 9.017 C A 0031 ARG NH2
H A 0036 GLU OE2 10.59 C A 0031 ARG NH1
H A 0036 GLU OE2 9.692 C A 0031 ARG NH2
H A 0036 GLU OE1 5.726 H A 0040 ARG NH1
H A 0036 GLU OE1 6.623 H A 0040 ARG NH2
H A 0036 GLU OE2 4.963 H A 0040 ARG NH1
H A 0036 GLU OE2 5.420 H A 0040 ARG NH2
H A 0043 GLU OE1 10.06 C A 0031 ARG NH2
H A 0043 GLU OE2 11.53 C A 0031 ARG NH2
H A 0043 GLU OE1 7.258 H A 0040 ARG NH1
H A 0043 GLU OE1 7.068 H A 0040 ARG NH2
H A 0043 GLU OE2 9.365 H A 0040 ARG NH1
H A 0043 GLU OE2 9.198 H A 0040 ARG NH2
H A 0043 GLU OE1 7.402 H A 0046 LYS NZ
H A 0043 GLU OE2 6.363 H A 0046 LYS NZ
H A 0043 GLU OE1 11.67 H A 0047 LYS NZ
H A 0043 GLU OE2 10.99 H A 0047 LYS NZ
H A 0048 GLU OE1 8.896 H A 0047 LYS NZ
H A 0048 GLU OE2 8.509 H A 0047 LYS NZ
H A 0048 GLU OE1 3.943 C A 0050 ARG NH1
H A 0048 GLU OE1 5.031 C A 0050 ARG NH2
H A 0048 GLU OE2 4.611 C A 0050 ARG NH1
H A 0048 GLU OE2 6.112 C A 0050 ARG NH2
CHARGE_REPU 2.00 12.00 32
H A 0017 GLU OE1 10.36 H A 0020 ASP OD1
H A 0017 GLU OE1 9.451 H A 0020 ASP OD2
H A 0017 GLU OE2 10.99 H A 0020 ASP OD1
H A 0017 GLU OE2 9.712 H A 0020 ASP OD2
H A 0020 ASP OD1 10.08 H A 0027 GLU OE1
H A 0020 ASP OD1 10.29 H A 0027 GLU OE2
H A 0020 ASP OD2 11.86 H A 0027 GLU OE1
H A 0020 ASP OD1 11.89 H A 0028 GLU OE1
H A 0020 ASP OD1 10.14 H A 0028 GLU OE2
H A 0020 ASP OD1 10.49 H A 0036 GLU OE1
H A 0020 ASP OD1 10.39 H A 0036 GLU OE2
H A 0023 ARG NH1 9.146 H A 0024 LYS NZ
H A 0023 ARG NH2 7.088 H A 0024 LYS NZ
H A 0027 GLU OE1 10.48 H A 0028 GLU OE1
H A 0027 GLU OE1 9.586 H A 0028 GLU OE2
H A 0027 GLU OE2 9.658 H A 0028 GLU OE1
H A 0027 GLU OE2 8.616 H A 0028 GLU OE2
H A 0027 GLU OE1 9.087 H A 0036 GLU OE1
H A 0027 GLU OE1 10.80 H A 0036 GLU OE2
H A 0027 GLU OE2 10.22 H A 0036 GLU OE1
H A 0027 GLU OE2 11.73 H A 0036 GLU OE2
H A 0028 GLU OE1 8.997 H A 0036 GLU OE1
H A 0028 GLU OE1 8.978 H A 0036 GLU OE2
H A 0028 GLU OE2 9.208 H A 0036 GLU OE1
H A 0028 GLU OE2 9.228 H A 0036 GLU OE2
C A 0031 ARG NH1 7.858 H A 0040 ARG NH1
C A 0031 ARG NH1 9.386 H A 0040 ARG NH2
C A 0031 ARG NH2 6.240 H A 0040 ARG NH1
C A 0031 ARG NH2 7.909 H A 0040 ARG NH2
C A 0031 ARG NH2 11.96 H A 0046 LYS NZ
H A 0036 GLU OE2 11.58 H A 0043 GLU OE1
H A 0047 LYS NZ 11.03 C A 0050 ARG NH1
HB_MM 2.00 3.20 84
C A 0002 LYS N 2.197 C A 0001 MET O
C A 0003 GLY N 2.960 C A 0001 MET O
C A 0003 GLY N 2.196 C A 0002 LYS O
C A 0004 MET N 2.197 C A 0003 GLY O
C A 0005 SER N 2.197 C A 0004 MET O
C A 0006 LYS N 2.195 C A 0005 SER O
C A 0007 MET N 2.195 C A 0006 LYS O
H A 0008 PRO N 2.227 C A 0007 MET O
H A 0009 GLN N 2.196 H A 0008 PRO O
H A 0010 PHE N 2.916 H A 0008 PRO O
H A 0010 PHE N 2.195 H A 0009 GLN O
H A 0011 LEU N 3.072 H A 0008 PRO O
H A 0011 LEU N 2.199 H A 0010 PHE O
H A 0012 ASN N 2.198 H A 0011 LEU O
H A 0013 ARG N 2.196 H A 0012 ASN O
C A 0014 TRP N 2.195 H A 0013 ARG O
H A 0015 PRO N 2.221 C A 0014 TRP O
H A 0016 ARG N 2.197 H A 0015 PRO O
H A 0017 GLU N 2.195 H A 0016 ARG O
H A 0018 VAL N 3.170 H A 0016 ARG O
H A 0018 VAL N 2.197 H A 0017 GLU O
H A 0019 LEU N 3.121 H A 0015 PRO O
H A 0019 LEU N 2.195 H A 0018 VAL O
H A 0020 ASP N 3.124 H A 0016 ARG O
H A 0020 ASP N 2.194 H A 0019 LEU O
H A 0021 LEU N 3.193 H A 0018 VAL O
H A 0021 LEU N 2.197 H A 0020 ASP O
H A 0022 VAL N 3.067 H A 0018 VAL O
H A 0022 VAL N 2.198 H A 0021 LEU O
H A 0023 ARG N 2.194 H A 0022 VAL O
H A 0024 LYS N 2.195 H A 0023 ARG O
H A 0025 VAL N 2.922 H A 0021 LEU O
H A 0025 VAL N 2.959 H A 0022 VAL O
H A 0025 VAL N 2.193 H A 0024 LYS O
H A 0026 ALA N 3.093 H A 0022 VAL O
H A 0026 ALA N 2.194 H A 0025 VAL O
H A 0027 GLU N 2.197 H A 0026 ALA O
H A 0028 GLU N 3.140 H A 0025 VAL O
H A 0028 GLU N 2.196 H A 0027 GLU O
H A 0029 ASN N 3.126 H A 0025 VAL O
H A 0029 ASN N 2.196 H A 0028 GLU O
H A 0030 GLY N 3.165 H A 0026 ALA O
H A 0030 GLY N 2.196 H A 0029 ASN O
C A 0031 ARG N 2.196 H A 0030 GLY O
H A 0032 SER N 2.197 C A 0031 ARG O
H A 0033 VAL N 2.195 H A 0032 SER O
H A 0034 ASN N 2.192 H A 0033 VAL O
H A 0035 SER N 2.980 H A 0033 VAL O
H A 0035 SER N 2.200 H A 0034 ASN O
H A 0036 GLU N 2.946 H A 0033 VAL O
H A 0036 GLU N 2.197 H A 0035 SER O
H A 0037 ILE N 3.120 H A 0033 VAL O
H A 0037 ILE N 2.197 H A 0036 GLU O
H A 0038 TYR N 3.121 H A 0035 SER O
H A 0038 TYR N 2.982 H A 0036 GLU O
H A 0038 TYR N 2.192 H A 0037 ILE O
H A 0039 GLN N 3.018 H A 0035 SER O
H A 0039 GLN N 2.908 H A 0036 GLU O
H A 0039 GLN N 2.194 H A 0038 TYR O
H A 0040 ARG N 3.158 H A 0036 GLU O
H A 0040 ARG N 2.198 H A 0039 GLN O
H A 0041 VAL N 3.130 H A 0037 ILE O
H A 0041 VAL N 2.895 H A 0039 GLN O
H A 0041 VAL N 2.200 H A 0040 ARG O
H A 0042 MET N 2.906 H A 0038 TYR O
H A 0042 MET N 2.845 H A 0039 GLN O
H A 0042 MET N 2.198 H A 0041 VAL O
H A 0043 GLU N 3.113 H A 0039 GLN O
H A 0043 GLU N 2.196 H A 0042 MET O
H A 0044 SER N 2.195 H A 0043 GLU O
H A 0045 PHE N 2.198 H A 0044 SER O
H A 0046 LYS N 2.198 H A 0045 PHE O
H A 0047 LYS N 3.012 H A 0044 SER O
H A 0047 LYS N 2.197 H A 0046 LYS O
H A 0048 GLU N 3.073 H A 0046 LYS O
H A 0048 GLU N 2.195 H A 0047 LYS O
H A 0049 GLY N 3.085 H A 0045 PHE O
H A 0049 GLY N 3.078 H A 0046 LYS O
H A 0049 GLY N 2.196 H A 0048 GLU O
C A 0050 ARG N 3.195 H A 0045 PHE O
C A 0050 ARG N 2.198 H A 0049 GLY O
C A 0051 ILE N 2.197 C A 0050 ARG O
C A 0052 GLY N 2.196 C A 0051 ILE O
C A 0053 ALA N 2.187 C A 0052 GLY O
HB_MS 2.00 3.20 3
H A 0026 ALA N 2.724 H A 0036 GLU OE1
H A 0041 VAL O 2.447 H A 0044 SER OG
H A 0045 PHE N 2.749 H A 0044 SER OG
AROMATIC 0.00 8.00 1
C A 0050 ARG 7.549 H A 0045 PHE
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 79
H A 0008 PRO CB 3.311 H B 0010 PHE CD1
H A 0008 PRO CG 3.126 H B 0010 PHE CD1
H A 0008 PRO CG 3.435 H B 0010 PHE CE1
H A 0010 PHE CD1 3.291 H B 0008 PRO CB
H A 0010 PHE CD1 3.140 H B 0008 PRO CG
H A 0010 PHE CE1 3.434 H B 0008 PRO CG
H A 0010 PHE CB 3.183 H B 0010 PHE CB
H A 0010 PHE CB 3.729 H B 0010 PHE CG
H A 0010 PHE CG 3.716 H B 0010 PHE CB
H A 0010 PHE CD2 3.199 H B 0010 PHE CD2
H A 0010 PHE CE1 3.759 H B 0011 LEU CD1
H A 0010 PHE CZ 3.717 H B 0011 LEU CD1
H A 0010 PHE CE1 3.734 H B 0034 ASN CA
H A 0010 PHE CZ 3.664 H B 0034 ASN CA
H A 0011 LEU CD1 3.671 H B 0010 PHE CE1
H A 0011 LEU CD1 3.654 H B 0010 PHE CZ
C A 0014 TRP CZ2 3.709 H B 0037 ILE C
C A 0014 TRP CG 3.747 H B 0038 TYR CD1
C A 0014 TRP CD2 3.454 H B 0038 TYR CD1
C A 0014 TRP CE2 3.684 H B 0038 TYR CA
C A 0014 TRP CE2 3.550 H B 0038 TYR CB
C A 0014 TRP CE2 3.565 H B 0038 TYR CD1
C A 0014 TRP CZ2 3.260 H B 0038 TYR CA
C A 0014 TRP CZ2 3.702 H B 0038 TYR CB
C A 0014 TRP CZ3 3.473 H B 0041 VAL CG1
C A 0014 TRP CH2 3.665 H B 0041 VAL CB
C A 0014 TRP CH2 3.444 H B 0041 VAL CG1
C A 0014 TRP CH2 3.743 H B 0041 VAL CG2
H A 0015 PRO CD 3.398 H B 0038 TYR CE1
H A 0015 PRO CD 3.425 H B 0038 TYR CZ
H A 0021 LEU CG 3.712 H B 0045 PHE CE1
H A 0021 LEU CD2 3.610 H B 0045 PHE CB
H A 0021 LEU CD2 3.005 H B 0045 PHE CG
H A 0021 LEU CD2 3.072 H B 0045 PHE CD1
H A 0021 LEU CD2 3.313 H B 0045 PHE CD2
H A 0021 LEU CD2 3.431 H B 0045 PHE CE1
H A 0021 LEU CD2 3.647 H B 0045 PHE CE2
H A 0021 LEU CD2 3.701 H B 0045 PHE CZ
H A 0021 LEU CD2 3.799 C B 0051 ILE CG1
H A 0025 VAL CG2 3.408 H B 0045 PHE CE1
H A 0034 ASN CA 3.749 H B 0010 PHE CE1
H A 0034 ASN CA 3.699 H B 0010 PHE CZ
H A 0037 ILE C 3.634 C B 0014 TRP CZ2
H A 0037 ILE CG2 3.536 H B 0037 ILE CG2
H A 0037 ILE CG2 3.678 H B 0041 VAL CG2
H A 0037 ILE CD1 3.499 H B 0041 VAL CG1
H A 0038 TYR CA 3.603 C B 0014 TRP CE2
H A 0038 TYR CA 3.206 C B 0014 TRP CZ2
H A 0038 TYR CA 3.774 C B 0014 TRP CH2
H A 0038 TYR CB 3.459 C B 0014 TRP CE2
H A 0038 TYR CB 3.653 C B 0014 TRP CZ2
H A 0038 TYR CD1 3.634 C B 0014 TRP CG
H A 0038 TYR CD1 3.348 C B 0014 TRP CD2
H A 0038 TYR CD1 3.530 C B 0014 TRP CE2
H A 0038 TYR CD1 3.728 C B 0014 TRP CE3
H A 0038 TYR CE1 3.295 H B 0015 PRO CD
H A 0038 TYR CZ 3.633 H B 0015 PRO CG
H A 0038 TYR CZ 3.264 H B 0015 PRO CD
H A 0038 TYR CE1 3.710 H B 0018 VAL CG1
H A 0040 ARG CB 3.597 H B 0044 SER CB
H A 0040 ARG CG 3.471 H B 0044 SER CB
H A 0041 VAL CB 3.639 C B 0014 TRP CH2
H A 0041 VAL CG1 3.466 C B 0014 TRP CZ3
H A 0041 VAL CG1 3.446 C B 0014 TRP CH2
H A 0041 VAL CG2 3.731 C B 0014 TRP CH2
H A 0041 VAL CG1 3.390 H B 0037 ILE CD1
H A 0041 VAL CG2 3.610 H B 0037 ILE CG2
H A 0041 VAL CG2 3.035 H B 0041 VAL CG2
H A 0044 SER CB 3.503 H B 0040 ARG CB
H A 0044 SER CB 3.368 H B 0040 ARG CG
H A 0045 PHE CB 3.513 H B 0021 LEU CD2
H A 0045 PHE CG 2.973 H B 0021 LEU CD2
H A 0045 PHE CD1 3.140 H B 0021 LEU CD2
H A 0045 PHE CD2 3.265 H B 0021 LEU CD2
H A 0045 PHE CE1 3.785 H B 0021 LEU CG
H A 0045 PHE CE1 3.562 H B 0021 LEU CD2
H A 0045 PHE CE2 3.671 H B 0021 LEU CD2
H A 0045 PHE CE1 3.269 H B 0025 VAL CG2
C A 0051 ILE CG1 3.568 H B 0021 LEU CD2
CHARGE_ATTR 2.00 12.00 42
H A 0013 ARG NH1 11.34 H B 0036 GLU OE1
H A 0017 GLU OE1 10.41 H B 0046 LYS NZ
H A 0017 GLU OE2 11.92 H B 0046 LYS NZ
H A 0020 ASP OD1 11.65 C B 0050 ARG NH1
H A 0020 ASP OD1 9.903 C B 0050 ARG NH2
H A 0020 ASP OD2 11.65 C B 0050 ARG NH2
H A 0027 GLU OE2 11.55 C B 0050 ARG NH2
H A 0028 GLU OE1 3.497 C B 0050 ARG NH1
H A 0028 GLU OE1 4.153 C B 0050 ARG NH2
H A 0028 GLU OE2 4.104 C B 0050 ARG NH1
H A 0028 GLU OE2 3.488 C B 0050 ARG NH2
H A 0036 GLU OE1 11.14 H B 0013 ARG NH1
H A 0036 GLU OE1 9.316 C B 0050 ARG NH1
H A 0036 GLU OE1 9.744 C B 0050 ARG NH2
H A 0036 GLU OE2 8.475 C B 0050 ARG NH1
H A 0036 GLU OE2 8.977 C B 0050 ARG NH2
H A 0040 ARG NH1 10.16 H B 0048 GLU OE1
H A 0040 ARG NH1 10.44 H B 0048 GLU OE2
H A 0040 ARG NH2 7.934 H B 0048 GLU OE1
H A 0040 ARG NH2 8.317 H B 0048 GLU OE2
H A 0043 GLU OE1 5.157 H B 0047 LYS NZ
H A 0043 GLU OE2 5.453 H B 0047 LYS NZ
H A 0046 LYS NZ 10.22 H B 0017 GLU OE1
H A 0046 LYS NZ 11.76 H B 0017 GLU OE2
H A 0047 LYS NZ 5.026 H B 0043 GLU OE1
H A 0047 LYS NZ 5.311 H B 0043 GLU OE2
H A 0048 GLU OE1 9.977 H B 0040 ARG NH1
H A 0048 GLU OE1 7.764 H B 0040 ARG NH2
H A 0048 GLU OE2 10.28 H B 0040 ARG NH1
H A 0048 GLU OE2 8.180 H B 0040 ARG NH2
C A 0050 ARG NH1 11.78 H B 0020 ASP OD1
C A 0050 ARG NH2 10.02 H B 0020 ASP OD1
C A 0050 ARG NH2 11.81 H B 0020 ASP OD2
C A 0050 ARG NH2 11.35 H B 0027 GLU OE2
C A 0050 ARG NH1 3.266 H B 0028 GLU OE1
C A 0050 ARG NH1 4.022 H B 0028 GLU OE2
C A 0050 ARG NH2 3.801 H B 0028 GLU OE1
C A 0050 ARG NH2 3.207 H B 0028 GLU OE2
C A 0050 ARG NH1 9.202 H B 0036 GLU OE1
C A 0050 ARG NH1 8.396 H B 0036 GLU OE2
C A 0050 ARG NH2 9.601 H B 0036 GLU OE1
C A 0050 ARG NH2 8.874 H B 0036 GLU OE2
CHARGE_REPU 2.00 12.00 41
H A 0013 ARG NH1 10.70 C B 0031 ARG NH1
H A 0013 ARG NH1 10.97 C B 0031 ARG NH2
H A 0024 LYS NZ 11.35 C B 0050 ARG NH1
H A 0024 LYS NZ 9.746 C B 0050 ARG NH2
H A 0028 GLU OE1 7.096 H B 0048 GLU OE1
H A 0028 GLU OE1 6.983 H B 0048 GLU OE2
H A 0028 GLU OE2 7.754 H B 0048 GLU OE1
H A 0028 GLU OE2 8.068 H B 0048 GLU OE2
C A 0031 ARG NH1 10.56 H B 0013 ARG NH1
C A 0031 ARG NH2 10.86 H B 0013 ARG NH1
H A 0036 GLU OE2 11.09 H B 0048 GLU OE1
H A 0040 ARG NH1 9.874 H B 0047 LYS NZ
H A 0040 ARG NH2 8.471 H B 0047 LYS NZ
H A 0040 ARG NH1 8.362 C B 0050 ARG NH1
H A 0040 ARG NH1 9.961 C B 0050 ARG NH2
H A 0040 ARG NH2 6.519 C B 0050 ARG NH1
H A 0040 ARG NH2 8.246 C B 0050 ARG NH2
H A 0043 GLU OE1 11.45 H B 0043 GLU OE1
H A 0043 GLU OE1 11.74 H B 0043 GLU OE2
H A 0043 GLU OE2 11.71 H B 0043 GLU OE1
H A 0043 GLU OE2 12.00 H B 0043 GLU OE2
H A 0043 GLU OE1 11.76 H B 0048 GLU OE1
H A 0043 GLU OE1 11.58 H B 0048 GLU OE2
H A 0046 LYS NZ 11.77 H B 0047 LYS NZ
H A 0047 LYS NZ 9.804 H B 0040 ARG NH1
H A 0047 LYS NZ 8.429 H B 0040 ARG NH2
H A 0047 LYS NZ 11.63 H B 0046 LYS NZ
H A 0047 LYS NZ 11.57 H B 0047 LYS NZ
H A 0048 GLU OE1 6.893 H B 0028 GLU OE1
H A 0048 GLU OE1 7.619 H B 0028 GLU OE2
H A 0048 GLU OE2 6.853 H B 0028 GLU OE1
H A 0048 GLU OE2 8.012 H B 0028 GLU OE2
H A 0048 GLU OE1 10.99 H B 0036 GLU OE2
H A 0048 GLU OE1 11.62 H B 0043 GLU OE1
H A 0048 GLU OE2 11.43 H B 0043 GLU OE1
C A 0050 ARG NH1 11.36 H B 0024 LYS NZ
C A 0050 ARG NH2 9.699 H B 0024 LYS NZ
C A 0050 ARG NH1 8.186 H B 0040 ARG NH1
C A 0050 ARG NH1 6.376 H B 0040 ARG NH2
C A 0050 ARG NH2 9.781 H B 0040 ARG NH1
C A 0050 ARG NH2 8.094 H B 0040 ARG NH2
HB_MS 2.00 3.20 3
H A 0010 PHE O 3.045 H B 0034 ASN ND2
H A 0034 ASN ND2 2.943 H B 0010 PHE O
H A 0034 ASN O 3.127 C B 0014 TRP NE1
AROMATIC 0.00 8.00 3
H A 0010 PHE 5.369 H B 0010 PHE
H A 0045 PHE 5.731 H B 0040 ARG
H A 0040 ARG 5.882 H B 0045 PHE
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 197
C B 0001 MET C 2.423 C B 0002 LYS CA
C B 0001 MET C 3.156 C B 0002 LYS C
C B 0001 MET C 3.612 C B 0002 LYS CB
C B 0002 LYS C 2.421 C B 0003 GLY CA
C B 0002 LYS C 3.693 C B 0003 GLY C
C B 0003 GLY C 2.424 C B 0004 MET CA
C B 0003 GLY C 3.470 C B 0004 MET C
C B 0003 GLY C 3.419 C B 0004 MET CB
C B 0004 MET C 2.422 C B 0005 SER CA
C B 0004 MET C 3.047 C B 0005 SER C
C B 0004 MET C 3.633 C B 0005 SER CB
C B 0005 SER C 2.423 C B 0006 LYS CA
C B 0005 SER C 3.694 C B 0006 LYS C
C B 0005 SER C 3.004 C B 0006 LYS CB
C B 0005 SER C 3.656 C B 0006 LYS CG
C B 0006 LYS C 2.419 C B 0007 MET CA
C B 0006 LYS C 2.949 C B 0007 MET C
C B 0006 LYS C 3.635 C B 0007 MET CB
C B 0007 MET CA 2.882 H B 0008 PRO CD
C B 0007 MET C 2.430 H B 0008 PRO CA
C B 0007 MET C 3.098 H B 0008 PRO C
C B 0007 MET C 3.614 H B 0008 PRO CB
C B 0007 MET C 3.629 H B 0008 PRO CG
C B 0007 MET C 2.493 H B 0008 PRO CD
C B 0007 MET CB 3.697 H B 0008 PRO CD
H B 0008 PRO C 2.425 H B 0009 GLN CA
H B 0008 PRO C 2.985 H B 0009 GLN C
H B 0008 PRO C 3.641 H B 0009 GLN CB
H B 0008 PRO CG 3.795 H B 0011 LEU CG
H B 0008 PRO CG 3.405 H B 0011 LEU CD1
H B 0009 GLN C 2.422 H B 0010 PHE CA
H B 0009 GLN C 3.044 H B 0010 PHE C
H B 0009 GLN C 3.635 H B 0010 PHE CB
H B 0010 PHE C 2.421 H B 0011 LEU CA
H B 0010 PHE C 3.254 H B 0011 LEU C
H B 0010 PHE C 3.570 H B 0011 LEU CB
H B 0010 PHE C 3.750 H B 0011 LEU CG
H B 0011 LEU C 2.426 H B 0012 ASN CA
H B 0011 LEU C 3.107 H B 0012 ASN C
H B 0011 LEU C 3.626 H B 0012 ASN CB
H B 0011 LEU CD2 3.309 C B 0014 TRP CD2
H B 0011 LEU CD2 3.326 C B 0014 TRP CE2
H B 0011 LEU CD2 3.526 C B 0014 TRP CE3
H B 0011 LEU CD2 3.576 C B 0014 TRP CZ2
H B 0011 LEU CD2 3.755 C B 0014 TRP CZ3
H B 0011 LEU CD2 3.779 C B 0014 TRP CH2
H B 0011 LEU CB 3.763 H B 0019 LEU CD2
H B 0012 ASN C 2.422 H B 0013 ARG CA
H B 0012 ASN C 3.287 H B 0013 ARG C
H B 0012 ASN C 3.559 H B 0013 ARG CB
H B 0013 ARG C 2.417 C B 0014 TRP CA
H B 0013 ARG C 2.992 C B 0014 TRP C
H B 0013 ARG C 3.621 C B 0014 TRP CB
H B 0013 ARG C 3.789 C B 0014 TRP CD1
C B 0014 TRP CA 2.895 H B 0015 PRO CD
C B 0014 TRP C 2.412 H B 0015 PRO CA
C B 0014 TRP C 3.050 H B 0015 PRO C
C B 0014 TRP C 3.610 H B 0015 PRO CB
C B 0014 TRP C 3.616 H B 0015 PRO CG
C B 0014 TRP C 2.493 H B 0015 PRO CD
C B 0014 TRP CB 3.694 H B 0015 PRO CD
C B 0014 TRP CB 3.704 H B 0019 LEU CG
C B 0014 TRP CB 3.797 H B 0019 LEU CD1
C B 0014 TRP CZ3 3.530 H B 0037 ILE CD1
C B 0014 TRP CH2 3.633 H B 0037 ILE CD1
H B 0015 PRO C 2.416 H B 0016 ARG CA
H B 0015 PRO C 3.128 H B 0016 ARG C
H B 0015 PRO C 3.590 H B 0016 ARG CB
H B 0015 PRO CG 3.407 H B 0018 VAL CG2
H B 0016 ARG C 2.416 H B 0017 GLU CA
H B 0016 ARG C 3.045 H B 0017 GLU C
H B 0016 ARG C 3.630 H B 0017 GLU CB
H B 0017 GLU C 2.422 H B 0018 VAL CA
H B 0017 GLU C 3.332 H B 0018 VAL C
H B 0017 GLU C 3.528 H B 0018 VAL CB
H B 0017 GLU C 3.639 H B 0018 VAL CG2
H B 0018 VAL C 2.424 H B 0019 LEU CA
H B 0018 VAL C 3.035 H B 0019 LEU C
H B 0018 VAL C 3.633 H B 0019 LEU CB
H B 0018 VAL C 3.752 H B 0022 VAL CG2
H B 0019 LEU C 2.415 H B 0020 ASP CA
H B 0019 LEU C 3.017 H B 0020 ASP C
H B 0019 LEU C 3.635 H B 0020 ASP CB
H B 0020 ASP C 2.419 H B 0021 LEU CA
H B 0020 ASP C 3.145 H B 0021 LEU C
H B 0020 ASP C 3.603 H B 0021 LEU CB
H B 0021 LEU C 2.426 H B 0022 VAL CA
H B 0021 LEU C 2.979 H B 0022 VAL C
H B 0021 LEU C 3.638 H B 0022 VAL CB
H B 0021 LEU C 3.663 H B 0025 VAL CG2
H B 0022 VAL C 2.426 H B 0023 ARG CA
H B 0022 VAL C 2.975 H B 0023 ARG C
H B 0022 VAL C 3.634 H B 0023 ARG CB
H B 0022 VAL CG1 3.243 H B 0033 VAL CG1
H B 0022 VAL CG1 3.596 H B 0037 ILE CD1
H B 0023 ARG C 2.425 H B 0024 LYS CA
H B 0023 ARG C 3.107 H B 0024 LYS C
H B 0023 ARG C 3.629 H B 0024 LYS CB
H B 0024 LYS C 2.424 H B 0025 VAL CA
H B 0024 LYS C 3.193 H B 0025 VAL C
H B 0024 LYS C 3.602 H B 0025 VAL CB
H B 0025 VAL C 2.419 H B 0026 ALA CA
H B 0025 VAL C 3.018 H B 0026 ALA C
H B 0025 VAL C 3.635 H B 0026 ALA CB
H B 0025 VAL CB 3.318 H B 0036 GLU CD
H B 0025 VAL CG1 3.601 H B 0036 GLU CG
H B 0025 VAL CG1 3.213 H B 0036 GLU CD
H B 0025 VAL CG1 3.653 H B 0040 ARG CZ
H B 0026 ALA C 2.424 H B 0027 GLU CA
H B 0026 ALA C 3.080 H B 0027 GLU C
H B 0026 ALA C 3.632 H B 0027 GLU CB
H B 0026 ALA CB 3.655 H B 0032 SER C
H B 0026 ALA CB 3.618 H B 0033 VAL CA
H B 0026 ALA CB 3.091 H B 0033 VAL CG2
H B 0027 GLU C 2.423 H B 0028 GLU CA
H B 0027 GLU C 3.127 H B 0028 GLU C
H B 0027 GLU C 3.620 H B 0028 GLU CB
H B 0028 GLU C 2.423 H B 0029 ASN CA
H B 0028 GLU C 3.042 H B 0029 ASN C
H B 0028 GLU C 3.633 H B 0029 ASN CB
H B 0029 ASN C 2.421 H B 0030 GLY CA
H B 0029 ASN C 3.458 H B 0030 GLY C
H B 0030 GLY C 2.422 C B 0031 ARG CA
H B 0030 GLY C 3.683 C B 0031 ARG C
H B 0030 GLY C 3.072 C B 0031 ARG CB
H B 0030 GLY C 3.764 C B 0031 ARG CG
C B 0031 ARG C 2.428 H B 0032 SER CA
C B 0031 ARG C 3.190 H B 0032 SER C
C B 0031 ARG C 3.602 H B 0032 SER CB
C B 0031 ARG CD 3.740 H B 0035 SER CB
H B 0032 SER C 2.418 H B 0033 VAL CA
H B 0032 SER C 3.185 H B 0033 VAL C
H B 0032 SER C 3.574 H B 0033 VAL CB
H B 0033 VAL C 2.418 H B 0034 ASN CA
H B 0033 VAL C 2.937 H B 0034 ASN C
H B 0033 VAL C 3.641 H B 0034 ASN CB
H B 0034 ASN C 2.419 H B 0035 SER CA
H B 0034 ASN C 3.219 H B 0035 SER C
H B 0034 ASN C 3.580 H B 0035 SER CB
H B 0035 SER C 2.418 H B 0036 GLU CA
H B 0035 SER C 2.966 H B 0036 GLU C
H B 0035 SER C 3.625 H B 0036 GLU CB
H B 0035 SER C 3.736 H B 0038 TYR CB
H B 0036 GLU C 2.423 H B 0037 ILE CA
H B 0036 GLU C 2.951 H B 0037 ILE C
H B 0036 GLU C 3.638 H B 0037 ILE CB
H B 0036 GLU CG 3.695 H B 0040 ARG CD
H B 0037 ILE C 2.420 H B 0038 TYR CA
H B 0037 ILE C 3.059 H B 0038 TYR C
H B 0037 ILE C 3.624 H B 0038 TYR CB
H B 0037 ILE C 3.794 H B 0041 VAL CG2
H B 0038 TYR C 2.428 H B 0039 GLN CA
H B 0038 TYR C 3.111 H B 0039 GLN C
H B 0038 TYR C 3.629 H B 0039 GLN CB
H B 0039 GLN C 2.420 H B 0040 ARG CA
H B 0039 GLN C 2.947 H B 0040 ARG C
H B 0039 GLN C 3.636 H B 0040 ARG CB
H B 0040 ARG C 2.432 H B 0041 VAL CA
H B 0040 ARG C 3.228 H B 0041 VAL C
H B 0040 ARG C 3.575 H B 0041 VAL CB
H B 0041 VAL C 2.426 H B 0042 MET CA
H B 0041 VAL C 3.102 H B 0042 MET C
H B 0041 VAL C 3.625 H B 0042 MET CB
H B 0042 MET C 2.423 H B 0043 GLU CA
H B 0042 MET C 3.198 H B 0043 GLU C
H B 0042 MET C 3.599 H B 0043 GLU CB
H B 0043 GLU C 2.421 H B 0044 SER CA
H B 0043 GLU C 3.025 H B 0044 SER C
H B 0043 GLU C 3.635 H B 0044 SER CB
H B 0044 SER C 2.423 H B 0045 PHE CA
H B 0044 SER C 2.990 H B 0045 PHE C
H B 0044 SER C 3.632 H B 0045 PHE CB
H B 0045 PHE C 2.425 H B 0046 LYS CA
H B 0045 PHE C 3.028 H B 0046 LYS C
H B 0045 PHE C 3.642 H B 0046 LYS CB
H B 0045 PHE CB 3.630 C B 0051 ILE CG1
H B 0045 PHE CB 3.377 C B 0051 ILE CD1
H B 0046 LYS C 2.429 H B 0047 LYS CA
H B 0046 LYS C 2.923 H B 0047 LYS C
H B 0046 LYS C 3.638 H B 0047 LYS CB
H B 0046 LYS CD 3.572 C B 0053 ALA CB
H B 0047 LYS C 2.424 H B 0048 GLU CA
H B 0047 LYS C 3.290 H B 0048 GLU C
H B 0047 LYS C 3.556 H B 0048 GLU CB
H B 0048 GLU C 2.422 H B 0049 GLY CA
H B 0048 GLU C 3.261 H B 0049 GLY C
H B 0049 GLY C 2.422 C B 0050 ARG CA
H B 0049 GLY C 3.228 C B 0050 ARG C
H B 0049 GLY C 3.585 C B 0050 ARG CB
C B 0050 ARG C 2.424 C B 0051 ILE CA
C B 0050 ARG C 3.163 C B 0051 ILE C
C B 0050 ARG C 3.610 C B 0051 ILE CB
C B 0051 ILE C 2.422 C B 0052 GLY CA
C B 0051 ILE C 3.410 C B 0052 GLY C
C B 0052 GLY C 2.421 C B 0053 ALA CA
C B 0052 GLY C 3.083 C B 0053 ALA C
C B 0052 GLY C 3.627 C B 0053 ALA CB
CHARGE_ATTR 2.00 12.00 56
H B 0017 GLU OE1 10.85 H B 0016 ARG NH1
H B 0017 GLU OE1 10.15 H B 0016 ARG NH2
H B 0017 GLU OE2 9.448 H B 0016 ARG NH1
H B 0017 GLU OE2 8.571 H B 0016 ARG NH2
H B 0020 ASP OD1 10.02 H B 0016 ARG NH1
H B 0020 ASP OD1 10.93 H B 0016 ARG NH2
H B 0020 ASP OD2 7.984 H B 0016 ARG NH1
H B 0020 ASP OD2 9.005 H B 0016 ARG NH2
H B 0020 ASP OD1 8.334 H B 0023 ARG NH1
H B 0020 ASP OD1 7.286 H B 0023 ARG NH2
H B 0020 ASP OD2 8.896 H B 0023 ARG NH1
H B 0020 ASP OD2 8.028 H B 0023 ARG NH2
H B 0020 ASP OD1 6.223 H B 0024 LYS NZ
H B 0020 ASP OD2 7.802 H B 0024 LYS NZ
H B 0027 GLU OE1 8.002 H B 0023 ARG NH1
H B 0027 GLU OE1 6.719 H B 0023 ARG NH2
H B 0027 GLU OE2 9.570 H B 0023 ARG NH1
H B 0027 GLU OE2 7.937 H B 0023 ARG NH2
H B 0027 GLU OE1 6.123 H B 0024 LYS NZ
H B 0027 GLU OE2 5.209 H B 0024 LYS NZ
H B 0028 GLU OE1 9.819 H B 0024 LYS NZ
H B 0028 GLU OE2 7.922 H B 0024 LYS NZ
H B 0028 GLU OE1 11.24 C B 0031 ARG NH1
H B 0028 GLU OE1 11.29 C B 0031 ARG NH2
H B 0028 GLU OE1 8.909 H B 0040 ARG NH1
H B 0028 GLU OE1 7.741 H B 0040 ARG NH2
H B 0028 GLU OE2 10.21 H B 0040 ARG NH1
H B 0028 GLU OE2 9.050 H B 0040 ARG NH2
H B 0036 GLU OE1 10.94 H B 0023 ARG NH1
H B 0036 GLU OE1 11.07 H B 0023 ARG NH2
H B 0036 GLU OE1 11.20 H B 0024 LYS NZ
H B 0036 GLU OE2 11.95 H B 0024 LYS NZ
H B 0036 GLU OE1 9.528 C B 0031 ARG NH1
H B 0036 GLU OE1 9.017 C B 0031 ARG NH2
H B 0036 GLU OE2 10.59 C B 0031 ARG NH1
H B 0036 GLU OE2 9.687 C B 0031 ARG NH2
H B 0036 GLU OE1 5.730 H B 0040 ARG NH1
H B 0036 GLU OE1 6.626 H B 0040 ARG NH2
H B 0036 GLU OE2 4.960 H B 0040 ARG NH1
H B 0036 GLU OE2 5.414 H B 0040 ARG NH2
H B 0043 GLU OE1 10.06 C B 0031 ARG NH2
H B 0043 GLU OE2 11.53 C B 0031 ARG NH2
H B 0043 GLU OE1 7.254 H B 0040 ARG NH1
H B 0043 GLU OE1 7.066 H B 0040 ARG NH2
H B 0043 GLU OE2 9.362 H B 0040 ARG NH1
H B 0043 GLU OE2 9.195 H B 0040 ARG NH2
H B 0043 GLU OE1 7.404 H B 0046 LYS NZ
H B 0043 GLU OE2 6.366 H B 0046 LYS NZ
H B 0043 GLU OE1 11.67 H B 0047 LYS NZ
H B 0043 GLU OE2 10.99 H B 0047 LYS NZ
H B 0048 GLU OE1 8.901 H B 0047 LYS NZ
H B 0048 GLU OE2 8.514 H B 0047 LYS NZ
H B 0048 GLU OE1 3.942 C B 0050 ARG NH1
H B 0048 GLU OE1 5.030 C B 0050 ARG NH2
H B 0048 GLU OE2 4.613 C B 0050 ARG NH1
H B 0048 GLU OE2 6.114 C B 0050 ARG NH2
CHARGE_REPU 2.00 12.00 32
H B 0017 GLU OE1 10.36 H B 0020 ASP OD1
H B 0017 GLU OE1 9.451 H B 0020 ASP OD2
H B 0017 GLU OE2 10.99 H B 0020 ASP OD1
H B 0017 GLU OE2 9.714 H B 0020 ASP OD2
H B 0020 ASP OD1 10.08 H B 0027 GLU OE1
H B 0020 ASP OD1 10.28 H B 0027 GLU OE2
H B 0020 ASP OD2 11.86 H B 0027 GLU OE1
H B 0020 ASP OD1 11.89 H B 0028 GLU OE1
H B 0020 ASP OD1 10.13 H B 0028 GLU OE2
H B 0020 ASP OD1 10.49 H B 0036 GLU OE1
H B 0020 ASP OD1 10.39 H B 0036 GLU OE2
H B 0023 ARG NH1 9.145 H B 0024 LYS NZ
H B 0023 ARG NH2 7.086 H B 0024 LYS NZ
H B 0027 GLU OE1 10.48 H B 0028 GLU OE1
H B 0027 GLU OE1 9.584 H B 0028 GLU OE2
H B 0027 GLU OE2 9.651 H B 0028 GLU OE1
H B 0027 GLU OE2 8.607 H B 0028 GLU OE2
H B 0027 GLU OE1 9.087 H B 0036 GLU OE1
H B 0027 GLU OE1 10.79 H B 0036 GLU OE2
H B 0027 GLU OE2 10.21 H B 0036 GLU OE1
H B 0027 GLU OE2 11.72 H B 0036 GLU OE2
H B 0028 GLU OE1 8.998 H B 0036 GLU OE1
H B 0028 GLU OE1 8.967 H B 0036 GLU OE2
H B 0028 GLU OE2 9.210 H B 0036 GLU OE1
H B 0028 GLU OE2 9.219 H B 0036 GLU OE2
C B 0031 ARG NH1 7.856 H B 0040 ARG NH1
C B 0031 ARG NH1 9.385 H B 0040 ARG NH2
C B 0031 ARG NH2 6.240 H B 0040 ARG NH1
C B 0031 ARG NH2 7.909 H B 0040 ARG NH2
C B 0031 ARG NH2 11.96 H B 0046 LYS NZ
H B 0036 GLU OE2 11.57 H B 0043 GLU OE1
H B 0047 LYS NZ 11.03 C B 0050 ARG NH1
HB_MM 2.00 3.20 83
C B 0002 LYS N 2.197 C B 0001 MET O
C B 0003 GLY N 2.957 C B 0001 MET O
C B 0003 GLY N 2.196 C B 0002 LYS O
C B 0004 MET N 2.197 C B 0003 GLY O
C B 0005 SER N 2.195 C B 0004 MET O
C B 0006 LYS N 2.197 C B 0005 SER O
C B 0007 MET N 2.196 C B 0006 LYS O
H B 0008 PRO N 2.228 C B 0007 MET O
H B 0009 GLN N 2.197 H B 0008 PRO O
H B 0010 PHE N 2.911 H B 0008 PRO O
H B 0010 PHE N 2.197 H B 0009 GLN O
H B 0011 LEU N 3.068 H B 0008 PRO O
H B 0011 LEU N 2.195 H B 0010 PHE O
H B 0012 ASN N 2.196 H B 0011 LEU O
H B 0013 ARG N 2.196 H B 0012 ASN O
C B 0014 TRP N 2.186 H B 0013 ARG O
H B 0015 PRO N 2.220 C B 0014 TRP O
H B 0016 ARG N 2.194 H B 0015 PRO O
H B 0017 GLU N 2.198 H B 0016 ARG O
H B 0018 VAL N 3.171 H B 0016 ARG O
H B 0018 VAL N 2.200 H B 0017 GLU O
H B 0019 LEU N 3.134 H B 0015 PRO O
H B 0019 LEU N 2.189 H B 0018 VAL O
H B 0020 ASP N 3.119 H B 0016 ARG O
H B 0020 ASP N 2.190 H B 0019 LEU O
H B 0021 LEU N 3.181 H B 0018 VAL O
H B 0021 LEU N 2.196 H B 0020 ASP O
H B 0022 VAL N 3.064 H B 0018 VAL O
H B 0022 VAL N 2.197 H B 0021 LEU O
H B 0023 ARG N 2.194 H B 0022 VAL O
H B 0024 LYS N 2.196 H B 0023 ARG O
H B 0025 VAL N 2.921 H B 0021 LEU O
H B 0025 VAL N 2.959 H B 0022 VAL O
H B 0025 VAL N 2.194 H B 0024 LYS O
H B 0026 ALA N 3.091 H B 0022 VAL O
H B 0026 ALA N 2.193 H B 0025 VAL O
H B 0027 GLU N 2.198 H B 0026 ALA O
H B 0028 GLU N 3.137 H B 0025 VAL O
H B 0028 GLU N 2.197 H B 0027 GLU O
H B 0029 ASN N 3.124 H B 0025 VAL O
H B 0029 ASN N 2.197 H B 0028 GLU O
H B 0030 GLY N 3.162 H B 0026 ALA O
H B 0030 GLY N 2.197 H B 0029 ASN O
C B 0031 ARG N 2.195 H B 0030 GLY O
H B 0032 SER N 2.198 C B 0031 ARG O
H B 0033 VAL N 2.197 H B 0032 SER O
H B 0034 ASN N 2.193 H B 0033 VAL O
H B 0035 SER N 2.981 H B 0033 VAL O
H B 0035 SER N 2.199 H B 0034 ASN O
H B 0036 GLU N 2.950 H B 0033 VAL O
H B 0036 GLU N 2.196 H B 0035 SER O
H B 0037 ILE N 3.120 H B 0033 VAL O
H B 0037 ILE N 2.196 H B 0036 GLU O
H B 0038 TYR N 3.121 H B 0035 SER O
H B 0038 TYR N 2.986 H B 0036 GLU O
H B 0038 TYR N 2.194 H B 0037 ILE O
H B 0039 GLN N 3.017 H B 0035 SER O
H B 0039 GLN N 2.906 H B 0036 GLU O
H B 0039 GLN N 2.195 H B 0038 TYR O
H B 0040 ARG N 3.157 H B 0036 GLU O
H B 0040 ARG N 2.195 H B 0039 GLN O
H B 0041 VAL N 3.121 H B 0037 ILE O
H B 0041 VAL N 2.894 H B 0039 GLN O
H B 0041 VAL N 2.199 H B 0040 ARG O
H B 0042 MET N 2.900 H B 0038 TYR O
H B 0042 MET N 2.844 H B 0039 GLN O
H B 0042 MET N 2.198 H B 0041 VAL O
H B 0043 GLU N 3.113 H B 0039 GLN O
H B 0043 GLU N 2.196 H B 0042 MET O
H B 0044 SER N 2.195 H B 0043 GLU O
H B 0045 PHE N 2.196 H B 0044 SER O
H B 0046 LYS N 2.197 H B 0045 PHE O
H B 0047 LYS N 3.013 H B 0044 SER O
H B 0047 LYS N 2.199 H B 0046 LYS O
H B 0048 GLU N 3.075 H B 0046 LYS O
H B 0048 GLU N 2.198 H B 0047 LYS O
H B 0049 GLY N 3.085 H B 0045 PHE O
H B 0049 GLY N 3.079 H B 0046 LYS O
H B 0049 GLY N 2.196 H B 0048 GLU O
C B 0050 ARG N 2.196 H B 0049 GLY O
C B 0051 ILE N 2.195 C B 0050 ARG O
C B 0052 GLY N 2.195 C B 0051 ILE O
C B 0053 ALA N 2.195 C B 0052 GLY O
HB_MS 2.00 3.20 3
H B 0026 ALA N 2.725 H B 0036 GLU OE1
H B 0041 VAL O 2.443 H B 0044 SER OG
H B 0045 PHE N 2.747 H B 0044 SER OG
AROMATIC 0.00 8.00 1
C B 0050 ARG 7.555 H B 0045 PHE