Complet list of 1e0e con file
Complete list of 1e0e.con file
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 203
C A 0001 PHE C 2.437 C A 0002 LEU CA
C A 0001 PHE C 3.269 C A 0002 LEU C
C A 0001 PHE C 3.653 C A 0002 LEU CB
C A 0001 PHE C 3.694 H A 0005 ILE CD1
C A 0001 PHE CG 3.674 H A 0005 ILE CD1
C A 0001 PHE CD2 3.439 H A 0005 ILE CD1
C A 0001 PHE CE1 3.729 H A 0005 ILE CD1
C A 0001 PHE CE2 3.356 H A 0005 ILE CD1
C A 0001 PHE CZ 3.507 H A 0005 ILE CD1
C A 0002 LEU C 2.436 C A 0003 GLU CA
C A 0002 LEU C 3.189 C A 0003 GLU C
C A 0002 LEU C 3.679 C A 0003 GLU CB
C A 0003 GLU C 2.438 C A 0004 LYS CA
C A 0003 GLU C 3.265 C A 0004 LYS C
C A 0003 GLU C 3.650 C A 0004 LYS CB
C A 0003 GLU C 3.779 H A 0007 PRO CD
C A 0004 LYS C 2.433 H A 0005 ILE CA
C A 0004 LYS C 3.114 H A 0005 ILE C
C A 0004 LYS C 3.723 H A 0005 ILE CB
C A 0004 LYS C 3.535 H A 0007 PRO CD
H A 0005 ILE C 2.436 H A 0006 GLU CA
H A 0005 ILE C 2.976 H A 0006 GLU C
H A 0005 ILE C 3.721 H A 0006 GLU CB
H A 0005 ILE C 3.680 H A 0007 PRO CD
H A 0005 ILE CG2 3.545 H A 0032 VAL CG1
H A 0005 ILE CD1 3.625 H A 0032 VAL CG1
H A 0006 GLU CA 2.948 H A 0007 PRO CD
H A 0006 GLU C 2.476 H A 0007 PRO CA
H A 0006 GLU C 2.964 H A 0007 PRO C
H A 0006 GLU C 3.638 H A 0007 PRO CB
H A 0006 GLU C 3.672 H A 0007 PRO CG
H A 0006 GLU C 2.523 H A 0007 PRO CD
H A 0006 GLU CB 3.071 H A 0007 PRO CD
H A 0007 PRO C 2.433 H A 0008 ALA CA
H A 0007 PRO C 3.094 H A 0008 ALA C
H A 0007 PRO C 3.693 H A 0008 ALA CB
H A 0007 PRO C 3.712 C A 0026 PHE CZ
H A 0007 PRO CB 3.792 C A 0026 PHE CE2
H A 0008 ALA CA 3.799 H A 0009 GLN CA
H A 0008 ALA C 2.429 H A 0009 GLN CA
H A 0008 ALA C 3.025 H A 0009 GLN C
H A 0008 ALA C 3.710 H A 0009 GLN CB
H A 0008 ALA CA 3.462 C A 0026 PHE CE1
H A 0008 ALA CA 3.488 C A 0026 PHE CZ
H A 0008 ALA CB 3.656 C A 0026 PHE CD1
H A 0008 ALA CB 3.751 C A 0026 PHE CE1
H A 0008 ALA C 3.650 H A 0036 ILE CD1
H A 0008 ALA CB 3.533 H A 0036 ILE CD1
H A 0009 GLN C 2.432 H A 0010 GLU CA
H A 0009 GLN C 3.117 H A 0010 GLU C
H A 0009 GLN C 3.695 H A 0010 GLU CB
H A 0009 GLN CA 3.731 H A 0036 ILE CG2
H A 0010 GLU C 2.435 H A 0011 GLU CA
H A 0010 GLU C 3.049 H A 0011 GLU C
H A 0010 GLU C 3.713 H A 0011 GLU CB
H A 0011 GLU CA 3.796 H A 0012 HIS CA
H A 0011 GLU C 2.419 H A 0012 HIS CA
H A 0011 GLU C 3.021 H A 0012 HIS C
H A 0011 GLU C 3.726 H A 0012 HIS CB
H A 0011 GLU CD 3.543 H A 0025 LYS CE
H A 0011 GLU CB 3.642 C A 0026 PHE CE1
H A 0012 HIS C 2.427 H A 0013 GLU CA
H A 0012 HIS C 3.060 H A 0013 GLU C
H A 0012 HIS C 3.699 H A 0013 GLU CB
H A 0012 HIS CD2 3.458 C A 0016 HIS CA
H A 0012 HIS CE1 3.573 C A 0016 HIS CA
H A 0012 HIS CE1 3.534 C A 0016 HIS C
H A 0012 HIS CB 3.439 H A 0036 ILE CG2
H A 0012 HIS CE1 3.772 H A 0037 VAL CG2
H A 0013 GLU C 2.434 H A 0014 LYS CA
H A 0013 GLU C 3.429 H A 0014 LYS C
H A 0013 GLU C 3.553 H A 0014 LYS CB
H A 0014 LYS C 2.434 H A 0015 TYR CA
H A 0014 LYS C 3.683 H A 0015 TYR C
H A 0014 LYS C 3.234 H A 0015 TYR CB
H A 0014 LYS C 3.085 H A 0015 TYR CG
H A 0014 LYS C 3.644 H A 0015 TYR CD1
H A 0014 LYS C 3.305 H A 0015 TYR CD2
H A 0014 LYS CB 3.515 H A 0015 TYR CD2
H A 0014 LYS CB 3.536 H A 0015 TYR CE2
H A 0014 LYS CG 3.754 H A 0015 TYR CE2
H A 0014 LYS CD 3.342 H A 0015 TYR CE2
H A 0014 LYS CD 3.539 H A 0015 TYR CZ
H A 0015 TYR C 2.466 C A 0016 HIS CA
H A 0015 TYR C 2.928 C A 0016 HIS C
H A 0015 TYR C 3.232 C A 0016 HIS CB
C A 0016 HIS C 2.437 C A 0017 SER CA
C A 0016 HIS C 2.998 C A 0017 SER C
C A 0016 HIS C 3.713 C A 0017 SER CB
C A 0017 SER C 2.438 C A 0018 ASN CA
C A 0017 SER C 3.112 C A 0018 ASN C
C A 0017 SER C 3.701 C A 0018 ASN CB
C A 0017 SER CB 3.649 H A 0021 GLU CB
C A 0017 SER CB 3.297 H A 0021 GLU CG
C A 0017 SER C 3.255 H A 0022 LEU CD2
C A 0017 SER CB 3.288 H A 0022 LEU CD2
C A 0018 ASN C 2.441 H A 0019 VAL CA
C A 0018 ASN C 2.974 H A 0019 VAL C
C A 0018 ASN C 3.746 H A 0019 VAL CB
C A 0018 ASN C 3.566 H A 0022 LEU CD2
H A 0019 VAL C 2.437 H A 0020 LYS CA
H A 0019 VAL C 2.965 H A 0020 LYS C
H A 0019 VAL C 3.721 H A 0020 LYS CB
H A 0019 VAL CG1 3.461 H A 0030 ASN CA
H A 0019 VAL CG1 3.457 H A 0030 ASN C
H A 0019 VAL CA 3.763 H A 0033 ALA CB
H A 0019 VAL CG1 3.147 H A 0033 ALA CB
H A 0019 VAL CG2 3.259 H A 0034 ARG CA
H A 0019 VAL CG2 3.481 H A 0034 ARG CB
H A 0020 LYS C 2.430 H A 0021 GLU CA
H A 0020 LYS C 3.061 H A 0021 GLU C
H A 0020 LYS C 3.700 H A 0021 GLU CB
H A 0021 GLU C 2.435 H A 0022 LEU CA
H A 0021 GLU C 3.025 H A 0022 LEU C
H A 0021 GLU C 3.718 H A 0022 LEU CB
H A 0022 LEU C 2.434 H A 0023 SER CA
H A 0022 LEU C 3.105 H A 0023 SER C
H A 0022 LEU C 3.700 H A 0023 SER CB
H A 0022 LEU CB 3.690 H A 0033 ALA CB
H A 0023 SER C 2.431 H A 0024 HIS CA
H A 0023 SER C 3.141 H A 0024 HIS C
H A 0023 SER C 3.690 H A 0024 HIS CB
H A 0024 HIS C 2.431 H A 0025 LYS CA
H A 0024 HIS C 3.175 H A 0025 LYS C
H A 0024 HIS C 3.683 H A 0025 LYS CB
H A 0025 LYS C 2.435 C A 0026 PHE CA
H A 0025 LYS C 3.301 C A 0026 PHE C
H A 0025 LYS C 3.625 C A 0026 PHE CB
H A 0025 LYS CD 3.666 C A 0026 PHE CE1
C A 0026 PHE CA 3.799 C A 0027 GLY CA
C A 0026 PHE C 2.420 C A 0027 GLY CA
C A 0026 PHE C 3.601 C A 0027 GLY C
C A 0027 GLY C 2.441 C A 0028 ILE CA
C A 0027 GLY C 2.994 C A 0028 ILE C
C A 0027 GLY C 3.749 C A 0028 ILE CB
C A 0028 ILE CA 2.950 C A 0029 PRO CD
C A 0028 ILE C 2.464 C A 0029 PRO CA
C A 0028 ILE C 2.996 C A 0029 PRO C
C A 0028 ILE C 3.671 C A 0029 PRO CB
C A 0028 ILE C 3.616 C A 0029 PRO CG
C A 0028 ILE C 2.519 C A 0029 PRO CD
C A 0028 ILE CB 3.635 C A 0029 PRO CD
C A 0028 ILE CD1 3.537 H A 0033 ALA CA
C A 0028 ILE CD1 3.699 H A 0033 ALA CB
C A 0029 PRO C 2.435 H A 0030 ASN CA
C A 0029 PRO C 3.053 H A 0030 ASN C
C A 0029 PRO C 3.711 H A 0030 ASN CB
C A 0029 PRO CG 3.454 H A 0032 VAL CG2
H A 0030 ASN C 2.423 H A 0031 LEU CA
H A 0030 ASN C 3.157 H A 0031 LEU C
H A 0030 ASN C 3.673 H A 0031 LEU CB
H A 0031 LEU C 2.429 H A 0032 VAL CA
H A 0031 LEU C 2.978 H A 0032 VAL C
H A 0031 LEU C 3.738 H A 0032 VAL CB
H A 0031 LEU CA 3.757 H A 0034 ARG CG
H A 0031 LEU C 3.722 H A 0034 ARG CG
H A 0032 VAL C 2.430 H A 0033 ALA CA
H A 0032 VAL C 3.120 H A 0033 ALA C
H A 0032 VAL C 3.685 H A 0033 ALA CB
H A 0033 ALA CA 3.798 H A 0034 ARG CA
H A 0033 ALA C 2.432 H A 0034 ARG CA
H A 0033 ALA C 3.002 H A 0034 ARG C
H A 0033 ALA C 3.722 H A 0034 ARG CB
H A 0034 ARG C 2.434 H A 0035 GLN CA
H A 0034 ARG C 2.993 H A 0035 GLN C
H A 0034 ARG C 3.718 H A 0035 GLN CB
H A 0035 GLN CA 3.797 H A 0036 ILE CA
H A 0035 GLN C 2.436 H A 0036 ILE CA
H A 0035 GLN C 3.069 H A 0036 ILE C
H A 0035 GLN C 3.728 H A 0036 ILE CB
H A 0036 ILE CA 3.799 H A 0037 VAL CA
H A 0036 ILE C 2.432 H A 0037 VAL CA
H A 0036 ILE C 3.052 H A 0037 VAL C
H A 0036 ILE C 3.730 H A 0037 VAL CB
H A 0037 VAL CA 3.799 H A 0038 ASN CA
H A 0037 VAL C 2.437 H A 0038 ASN CA
H A 0037 VAL C 3.028 H A 0038 ASN C
H A 0037 VAL C 3.714 H A 0038 ASN CB
H A 0038 ASN C 2.433 H A 0039 SER CA
H A 0038 ASN C 3.108 H A 0039 SER C
H A 0038 ASN C 3.697 H A 0039 SER CB
H A 0038 ASN C 3.727 H A 0044 GLN CG
H A 0039 SER C 2.437 C A 0040 CYS CA
H A 0039 SER C 3.031 C A 0040 CYS C
H A 0039 SER C 3.711 C A 0040 CYS CB
C A 0040 CYS C 2.435 H A 0041 ALA CA
C A 0040 CYS C 3.093 H A 0041 ALA C
C A 0040 CYS C 3.696 H A 0041 ALA CB
H A 0041 ALA C 2.437 H A 0042 GLN CA
H A 0041 ALA C 2.992 H A 0042 GLN C
H A 0041 ALA C 3.716 H A 0042 GLN CB
H A 0042 GLN C 2.435 H A 0043 CYS CA
H A 0042 GLN C 3.301 H A 0043 CYS C
H A 0042 GLN C 3.628 H A 0043 CYS CB
H A 0043 CYS C 2.440 H A 0044 GLN CA
H A 0043 CYS C 2.983 H A 0044 GLN C
H A 0043 CYS C 3.720 H A 0044 GLN CB
H A 0044 GLN C 2.436 C A 0045 GLN CA
H A 0044 GLN C 3.140 C A 0045 GLN C
H A 0044 GLN C 3.692 C A 0045 GLN CB
C A 0045 GLN C 2.437 C A 0046 LYS CA
C A 0045 GLN C 3.351 C A 0046 LYS C
C A 0045 GLN C 3.597 C A 0046 LYS CB
CHARGE_ATTR 2.00 12.00 38
C A 0003 GLU OE1 7.696 C A 0004 LYS NZ
C A 0003 GLU OE2 7.707 C A 0004 LYS NZ
H A 0010 GLU OE1 6.577 H A 0014 LYS NZ
H A 0010 GLU OE2 6.470 H A 0014 LYS NZ
H A 0010 GLU OE1 10.60 H A 0025 LYS NZ
H A 0011 GLU OE1 9.732 H A 0012 HIS ND1
H A 0011 GLU OE1 10.83 H A 0012 HIS NE2
H A 0011 GLU OE2 9.134 H A 0012 HIS ND1
H A 0011 GLU OE2 10.15 H A 0012 HIS NE2
H A 0011 GLU OE1 7.479 H A 0014 LYS NZ
H A 0011 GLU OE2 8.073 H A 0014 LYS NZ
H A 0011 GLU OE1 11.98 C A 0016 HIS ND1
H A 0011 GLU OE2 11.06 C A 0016 HIS ND1
H A 0011 GLU OE2 11.37 C A 0016 HIS NE2
H A 0011 GLU OE1 4.210 H A 0025 LYS NZ
H A 0011 GLU OE2 3.556 H A 0025 LYS NZ
H A 0013 GLU OE1 9.349 H A 0012 HIS ND1
H A 0013 GLU OE1 8.588 H A 0012 HIS NE2
H A 0013 GLU OE2 8.537 H A 0012 HIS ND1
H A 0013 GLU OE2 7.750 H A 0012 HIS NE2
H A 0013 GLU OE1 9.363 H A 0014 LYS NZ
H A 0013 GLU OE2 11.36 H A 0014 LYS NZ
H A 0013 GLU OE1 8.656 C A 0016 HIS ND1
H A 0013 GLU OE1 8.508 C A 0016 HIS NE2
H A 0013 GLU OE2 8.258 C A 0016 HIS ND1
H A 0013 GLU OE2 8.559 C A 0016 HIS NE2
H A 0021 GLU OE1 9.829 H A 0012 HIS ND1
H A 0021 GLU OE1 11.15 H A 0012 HIS NE2
H A 0021 GLU OE2 10.23 H A 0012 HIS ND1
H A 0021 GLU OE2 11.84 H A 0012 HIS NE2
H A 0021 GLU OE1 10.21 H A 0020 LYS NZ
H A 0021 GLU OE2 9.382 H A 0020 LYS NZ
H A 0021 GLU OE1 7.038 H A 0024 HIS ND1
H A 0021 GLU OE1 8.905 H A 0024 HIS NE2
H A 0021 GLU OE2 5.870 H A 0024 HIS ND1
H A 0021 GLU OE2 7.474 H A 0024 HIS NE2
H A 0021 GLU OE1 6.660 H A 0025 LYS NZ
H A 0021 GLU OE2 5.538 H A 0025 LYS NZ
CHARGE_REPU 2.00 12.00 38
C A 0003 GLU OE1 7.888 H A 0006 GLU OE1
C A 0003 GLU OE1 10.07 H A 0006 GLU OE2
C A 0003 GLU OE2 8.878 H A 0006 GLU OE1
C A 0003 GLU OE2 11.05 H A 0006 GLU OE2
H A 0006 GLU OE1 9.513 H A 0010 GLU OE1
H A 0006 GLU OE1 9.734 H A 0010 GLU OE2
H A 0006 GLU OE2 8.828 H A 0010 GLU OE1
H A 0006 GLU OE2 8.648 H A 0010 GLU OE2
H A 0006 GLU OE2 10.95 H A 0013 GLU OE1
H A 0006 GLU OE2 10.81 H A 0013 GLU OE2
H A 0010 GLU OE1 6.714 H A 0011 GLU OE1
H A 0010 GLU OE1 8.655 H A 0011 GLU OE2
H A 0010 GLU OE2 8.380 H A 0011 GLU OE1
H A 0010 GLU OE2 10.10 H A 0011 GLU OE2
H A 0010 GLU OE1 8.542 H A 0013 GLU OE1
H A 0010 GLU OE1 9.916 H A 0013 GLU OE2
H A 0010 GLU OE2 7.292 H A 0013 GLU OE1
H A 0010 GLU OE2 8.865 H A 0013 GLU OE2
H A 0011 GLU OE1 10.97 H A 0013 GLU OE1
H A 0011 GLU OE1 11.92 H A 0013 GLU OE2
H A 0011 GLU OE2 11.63 H A 0013 GLU OE1
H A 0011 GLU OE1 8.997 H A 0021 GLU OE1
H A 0011 GLU OE1 8.248 H A 0021 GLU OE2
H A 0011 GLU OE2 7.195 H A 0021 GLU OE1
H A 0011 GLU OE2 6.830 H A 0021 GLU OE2
H A 0012 HIS ND1 5.295 C A 0016 HIS ND1
H A 0012 HIS ND1 7.224 C A 0016 HIS NE2
H A 0012 HIS NE2 3.274 C A 0016 HIS ND1
H A 0012 HIS NE2 5.320 C A 0016 HIS NE2
H A 0012 HIS ND1 11.63 H A 0025 LYS NZ
H A 0014 LYS NZ 11.96 C A 0016 HIS NE2
H A 0014 LYS NZ 10.66 H A 0025 LYS NZ
H A 0020 LYS NZ 4.868 H A 0024 HIS ND1
H A 0020 LYS NZ 5.541 H A 0024 HIS NE2
H A 0024 HIS ND1 10.26 H A 0025 LYS NZ
H A 0024 HIS NE2 11.03 H A 0025 LYS NZ
H A 0034 ARG NH1 9.286 C A 0046 LYS NZ
H A 0034 ARG NH2 9.023 C A 0046 LYS NZ
HB_MM 2.00 3.20 79
C A 0002 LEU N 2.250 C A 0001 PHE O
C A 0003 GLU N 2.247 C A 0002 LEU O
C A 0004 LYS N 2.252 C A 0003 GLU O
H A 0005 ILE N 2.248 C A 0004 LYS O
H A 0006 GLU N 2.247 H A 0005 ILE O
H A 0007 PRO N 2.255 H A 0006 GLU O
H A 0008 ALA N 3.143 H A 0005 ILE O
H A 0008 ALA N 2.813 H A 0006 GLU O
H A 0008 ALA N 2.251 H A 0007 PRO O
H A 0009 GLN N 2.594 H A 0006 GLU O
H A 0009 GLN N 2.249 H A 0008 ALA O
H A 0010 GLU N 2.250 H A 0009 GLN O
H A 0011 GLU N 3.133 H A 0008 ALA O
H A 0011 GLU N 2.252 H A 0010 GLU O
H A 0012 HIS N 2.249 H A 0011 GLU O
H A 0013 GLU N 2.238 H A 0012 HIS O
H A 0014 LYS N 3.185 H A 0011 GLU O
H A 0014 LYS N 3.024 H A 0012 HIS O
H A 0014 LYS N 2.248 H A 0013 GLU O
H A 0015 TYR N 3.200 H A 0011 GLU O
H A 0015 TYR N 2.246 H A 0014 LYS O
C A 0016 HIS N 2.551 H A 0012 HIS O
C A 0016 HIS N 2.253 H A 0015 TYR O
C A 0017 SER N 2.893 H A 0015 TYR O
C A 0017 SER N 2.252 C A 0016 HIS O
C A 0018 ASN N 2.251 C A 0017 SER O
H A 0019 VAL N 2.250 C A 0018 ASN O
H A 0020 LYS N 2.250 H A 0019 VAL O
H A 0021 GLU N 3.002 C A 0018 ASN O
H A 0021 GLU N 3.111 H A 0019 VAL O
H A 0021 GLU N 2.247 H A 0020 LYS O
H A 0022 LEU N 2.926 C A 0018 ASN O
H A 0022 LEU N 3.056 H A 0019 VAL O
H A 0022 LEU N 2.250 H A 0021 GLU O
H A 0023 SER N 2.730 H A 0019 VAL O
H A 0023 SER N 2.251 H A 0022 LEU O
H A 0024 HIS N 2.687 H A 0020 LYS O
H A 0024 HIS N 2.247 H A 0023 SER O
H A 0025 LYS N 2.643 H A 0021 GLU O
H A 0025 LYS N 2.247 H A 0024 HIS O
C A 0026 PHE N 2.922 H A 0022 LEU O
C A 0026 PHE N 2.249 H A 0025 LYS O
C A 0027 GLY N 2.735 H A 0023 SER O
C A 0027 GLY N 2.249 C A 0026 PHE O
C A 0028 ILE N 2.252 C A 0027 GLY O
C A 0029 PRO N 2.249 C A 0028 ILE O
H A 0030 ASN N 2.250 C A 0029 PRO O
H A 0031 LEU N 3.156 C A 0029 PRO O
H A 0031 LEU N 2.238 H A 0030 ASN O
H A 0032 VAL N 2.245 H A 0031 LEU O
H A 0033 ALA N 3.123 C A 0029 PRO O
H A 0033 ALA N 3.123 H A 0031 LEU O
H A 0033 ALA N 2.251 H A 0032 VAL O
H A 0034 ARG N 3.109 H A 0030 ASN O
H A 0034 ARG N 3.065 H A 0031 LEU O
H A 0034 ARG N 2.252 H A 0033 ALA O
H A 0035 GLN N 3.036 H A 0031 LEU O
H A 0035 GLN N 3.161 H A 0033 ALA O
H A 0035 GLN N 2.251 H A 0034 ARG O
H A 0036 ILE N 2.951 H A 0033 ALA O
H A 0036 ILE N 2.253 H A 0035 GLN O
H A 0037 VAL N 3.193 H A 0034 ARG O
H A 0037 VAL N 2.250 H A 0036 ILE O
H A 0038 ASN N 2.628 H A 0034 ARG O
H A 0038 ASN N 2.252 H A 0037 VAL O
H A 0039 SER N 3.032 H A 0035 GLN O
H A 0039 SER N 2.249 H A 0038 ASN O
C A 0040 CYS N 3.093 H A 0037 VAL O
C A 0040 CYS N 2.250 H A 0039 SER O
H A 0041 ALA N 2.249 C A 0040 CYS O
H A 0042 GLN N 2.250 H A 0041 ALA O
H A 0043 CYS N 3.072 H A 0041 ALA O
H A 0043 CYS N 2.249 H A 0042 GLN O
H A 0044 GLN N 2.740 C A 0040 CYS O
H A 0044 GLN N 3.044 H A 0041 ALA O
H A 0044 GLN N 2.251 H A 0043 CYS O
C A 0045 GLN N 2.249 H A 0044 GLN O
C A 0046 LYS N 2.250 C A 0045 GLN O
C A 0047 GLY N 2.200 C A 0046 LYS O
HB_MS 2.00 3.20 3
C A 0017 SER O 2.699 H A 0012 HIS ND1
C A 0028 ILE O 2.551 H A 0023 SER OG
H A 0035 GLN O 2.950 H A 0039 SER OG
AROMATIC 0.00 8.00 2
H A 0025 LYS 7.172 H A 0015 TYR
H A 0012 HIS 5.166 C A 0016 HIS
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 12
C A 0001 PHE CE1 3.635 C B 0001 PHE CE1
C A 0001 PHE CG 3.684 C B 0029 PRO CG
C A 0001 PHE CD1 3.760 H B 0032 VAL CG2
C A 0001 PHE CE1 3.019 H B 0032 VAL CG2
C A 0001 PHE CE2 3.738 H B 0032 VAL CG2
C A 0001 PHE CZ 3.007 H B 0032 VAL CG2
C A 0029 PRO CG 3.674 C B 0001 PHE CG
H A 0032 VAL CG2 3.787 C B 0001 PHE CD1
H A 0032 VAL CG2 3.042 C B 0001 PHE CE1
H A 0032 VAL CG2 3.726 C B 0001 PHE CE2
H A 0032 VAL CG2 3.004 C B 0001 PHE CZ
H A 0035 GLN CD 3.475 H B 0035 GLN CD
CHARGE_REPU 2.00 12.00 1
H A 0034 ARG NH1 11.27 H B 0034 ARG NH1
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 202
C B 0001 PHE C 2.436 C B 0002 LEU CA
C B 0001 PHE C 3.269 C B 0002 LEU C
C B 0001 PHE C 3.653 C B 0002 LEU CB
C B 0001 PHE C 3.695 H B 0005 ILE CD1
C B 0001 PHE CG 3.674 H B 0005 ILE CD1
C B 0001 PHE CD2 3.441 H B 0005 ILE CD1
C B 0001 PHE CE1 3.729 H B 0005 ILE CD1
C B 0001 PHE CE2 3.355 H B 0005 ILE CD1
C B 0001 PHE CZ 3.505 H B 0005 ILE CD1
C B 0002 LEU C 2.434 C B 0003 GLU CA
C B 0002 LEU C 3.188 C B 0003 GLU C
C B 0002 LEU C 3.679 C B 0003 GLU CB
C B 0003 GLU C 2.437 C B 0004 LYS CA
C B 0003 GLU C 3.264 C B 0004 LYS C
C B 0003 GLU C 3.649 C B 0004 LYS CB
C B 0003 GLU C 3.777 H B 0007 PRO CD
C B 0004 LYS C 2.434 H B 0005 ILE CA
C B 0004 LYS C 3.116 H B 0005 ILE C
C B 0004 LYS C 3.723 H B 0005 ILE CB
C B 0004 LYS C 3.536 H B 0007 PRO CD
H B 0005 ILE C 2.436 H B 0006 GLU CA
H B 0005 ILE C 2.974 H B 0006 GLU C
H B 0005 ILE C 3.721 H B 0006 GLU CB
H B 0005 ILE C 3.681 H B 0007 PRO CD
H B 0005 ILE CG2 3.544 H B 0032 VAL CG1
H B 0005 ILE CD1 3.622 H B 0032 VAL CG1
H B 0006 GLU CA 2.949 H B 0007 PRO CD
H B 0006 GLU C 2.476 H B 0007 PRO CA
H B 0006 GLU C 2.964 H B 0007 PRO C
H B 0006 GLU C 3.639 H B 0007 PRO CB
H B 0006 GLU C 3.672 H B 0007 PRO CG
H B 0006 GLU C 2.524 H B 0007 PRO CD
H B 0006 GLU CB 3.070 H B 0007 PRO CD
H B 0007 PRO C 2.434 H B 0008 ALA CA
H B 0007 PRO C 3.096 H B 0008 ALA C
H B 0007 PRO C 3.692 H B 0008 ALA CB
H B 0007 PRO C 3.711 C B 0026 PHE CZ
H B 0007 PRO CB 3.791 C B 0026 PHE CE2
H B 0008 ALA C 2.431 H B 0009 GLN CA
H B 0008 ALA C 3.026 H B 0009 GLN C
H B 0008 ALA C 3.711 H B 0009 GLN CB
H B 0008 ALA CA 3.460 C B 0026 PHE CE1
H B 0008 ALA CA 3.487 C B 0026 PHE CZ
H B 0008 ALA CB 3.656 C B 0026 PHE CD1
H B 0008 ALA CB 3.749 C B 0026 PHE CE1
H B 0008 ALA C 3.648 H B 0036 ILE CD1
H B 0008 ALA CB 3.532 H B 0036 ILE CD1
H B 0009 GLN C 2.433 H B 0010 GLU CA
H B 0009 GLN C 3.119 H B 0010 GLU C
H B 0009 GLN C 3.696 H B 0010 GLU CB
H B 0009 GLN CA 3.730 H B 0036 ILE CG2
H B 0010 GLU C 2.436 H B 0011 GLU CA
H B 0010 GLU C 3.050 H B 0011 GLU C
H B 0010 GLU C 3.713 H B 0011 GLU CB
H B 0011 GLU CA 3.797 H B 0012 HIS CA
H B 0011 GLU C 2.421 H B 0012 HIS CA
H B 0011 GLU C 3.021 H B 0012 HIS C
H B 0011 GLU C 3.726 H B 0012 HIS CB
H B 0011 GLU CD 3.543 H B 0025 LYS CE
H B 0011 GLU CB 3.642 C B 0026 PHE CE1
H B 0012 HIS C 2.427 H B 0013 GLU CA
H B 0012 HIS C 3.060 H B 0013 GLU C
H B 0012 HIS C 3.698 H B 0013 GLU CB
H B 0012 HIS CD2 3.458 C B 0016 HIS CA
H B 0012 HIS CE1 3.574 C B 0016 HIS CA
H B 0012 HIS CE1 3.532 C B 0016 HIS C
H B 0012 HIS CB 3.436 H B 0036 ILE CG2
H B 0012 HIS CE1 3.772 H B 0037 VAL CG2
H B 0013 GLU C 2.431 H B 0014 LYS CA
H B 0013 GLU C 3.427 H B 0014 LYS C
H B 0013 GLU C 3.553 H B 0014 LYS CB
H B 0014 LYS C 2.431 H B 0015 TYR CA
H B 0014 LYS C 3.682 H B 0015 TYR C
H B 0014 LYS C 3.234 H B 0015 TYR CB
H B 0014 LYS C 3.084 H B 0015 TYR CG
H B 0014 LYS C 3.644 H B 0015 TYR CD1
H B 0014 LYS C 3.305 H B 0015 TYR CD2
H B 0014 LYS CB 3.513 H B 0015 TYR CD2
H B 0014 LYS CB 3.533 H B 0015 TYR CE2
H B 0014 LYS CG 3.753 H B 0015 TYR CE2
H B 0014 LYS CD 3.341 H B 0015 TYR CE2
H B 0014 LYS CD 3.539 H B 0015 TYR CZ
H B 0015 TYR C 2.465 C B 0016 HIS CA
H B 0015 TYR C 2.929 C B 0016 HIS C
H B 0015 TYR C 3.233 C B 0016 HIS CB
C B 0016 HIS C 2.438 C B 0017 SER CA
C B 0016 HIS C 2.999 C B 0017 SER C
C B 0016 HIS C 3.714 C B 0017 SER CB
C B 0017 SER C 2.437 C B 0018 ASN CA
C B 0017 SER C 3.112 C B 0018 ASN C
C B 0017 SER C 3.700 C B 0018 ASN CB
C B 0017 SER CB 3.650 H B 0021 GLU CB
C B 0017 SER CB 3.297 H B 0021 GLU CG
C B 0017 SER C 3.257 H B 0022 LEU CD2
C B 0017 SER CB 3.288 H B 0022 LEU CD2
C B 0018 ASN C 2.439 H B 0019 VAL CA
C B 0018 ASN C 2.973 H B 0019 VAL C
C B 0018 ASN C 3.745 H B 0019 VAL CB
C B 0018 ASN C 3.567 H B 0022 LEU CD2
H B 0019 VAL C 2.436 H B 0020 LYS CA
H B 0019 VAL C 2.964 H B 0020 LYS C
H B 0019 VAL C 3.721 H B 0020 LYS CB
H B 0019 VAL CG1 3.461 H B 0030 ASN CA
H B 0019 VAL CG1 3.458 H B 0030 ASN C
H B 0019 VAL CA 3.761 H B 0033 ALA CB
H B 0019 VAL CG1 3.146 H B 0033 ALA CB
H B 0019 VAL CG2 3.257 H B 0034 ARG CA
H B 0019 VAL CG2 3.480 H B 0034 ARG CB
H B 0020 LYS C 2.430 H B 0021 GLU CA
H B 0020 LYS C 3.060 H B 0021 GLU C
H B 0020 LYS C 3.699 H B 0021 GLU CB
H B 0021 GLU C 2.435 H B 0022 LEU CA
H B 0021 GLU C 3.026 H B 0022 LEU C
H B 0021 GLU C 3.719 H B 0022 LEU CB
H B 0022 LEU C 2.435 H B 0023 SER CA
H B 0022 LEU C 3.107 H B 0023 SER C
H B 0022 LEU C 3.699 H B 0023 SER CB
H B 0022 LEU CB 3.690 H B 0033 ALA CB
H B 0023 SER C 2.429 H B 0024 HIS CA
H B 0023 SER C 3.139 H B 0024 HIS C
H B 0023 SER C 3.689 H B 0024 HIS CB
H B 0024 HIS C 2.430 H B 0025 LYS CA
H B 0024 HIS C 3.171 H B 0025 LYS C
H B 0024 HIS C 3.682 H B 0025 LYS CB
H B 0025 LYS C 2.434 C B 0026 PHE CA
H B 0025 LYS C 3.300 C B 0026 PHE C
H B 0025 LYS C 3.626 C B 0026 PHE CB
H B 0025 LYS CD 3.666 C B 0026 PHE CE1
C B 0026 PHE CA 3.796 C B 0027 GLY CA
C B 0026 PHE C 2.419 C B 0027 GLY CA
C B 0026 PHE C 3.601 C B 0027 GLY C
C B 0027 GLY C 2.440 C B 0028 ILE CA
C B 0027 GLY C 2.993 C B 0028 ILE C
C B 0027 GLY C 3.748 C B 0028 ILE CB
C B 0028 ILE CA 2.950 C B 0029 PRO CD
C B 0028 ILE C 2.464 C B 0029 PRO CA
C B 0028 ILE C 2.997 C B 0029 PRO C
C B 0028 ILE C 3.669 C B 0029 PRO CB
C B 0028 ILE C 3.615 C B 0029 PRO CG
C B 0028 ILE C 2.517 C B 0029 PRO CD
C B 0028 ILE CB 3.634 C B 0029 PRO CD
C B 0028 ILE CD1 3.537 H B 0033 ALA CA
C B 0028 ILE CD1 3.699 H B 0033 ALA CB
C B 0029 PRO C 2.435 H B 0030 ASN CA
C B 0029 PRO C 3.053 H B 0030 ASN C
C B 0029 PRO C 3.711 H B 0030 ASN CB
C B 0029 PRO CG 3.455 H B 0032 VAL CG2
H B 0030 ASN C 2.422 H B 0031 LEU CA
H B 0030 ASN C 3.158 H B 0031 LEU C
H B 0030 ASN C 3.674 H B 0031 LEU CB
H B 0031 LEU C 2.428 H B 0032 VAL CA
H B 0031 LEU C 2.978 H B 0032 VAL C
H B 0031 LEU C 3.738 H B 0032 VAL CB
H B 0031 LEU CA 3.757 H B 0034 ARG CG
H B 0031 LEU C 3.723 H B 0034 ARG CG
H B 0032 VAL C 2.429 H B 0033 ALA CA
H B 0032 VAL C 3.118 H B 0033 ALA C
H B 0032 VAL C 3.684 H B 0033 ALA CB
H B 0033 ALA CA 3.799 H B 0034 ARG CA
H B 0033 ALA C 2.432 H B 0034 ARG CA
H B 0033 ALA C 3.002 H B 0034 ARG C
H B 0033 ALA C 3.722 H B 0034 ARG CB
H B 0034 ARG C 2.435 H B 0035 GLN CA
H B 0034 ARG C 2.993 H B 0035 GLN C
H B 0034 ARG C 3.716 H B 0035 GLN CB
H B 0035 GLN CA 3.798 H B 0036 ILE CA
H B 0035 GLN C 2.435 H B 0036 ILE CA
H B 0035 GLN C 3.068 H B 0036 ILE C
H B 0035 GLN C 3.728 H B 0036 ILE CB
H B 0036 ILE CA 3.800 H B 0037 VAL CA
H B 0036 ILE C 2.432 H B 0037 VAL CA
H B 0036 ILE C 3.052 H B 0037 VAL C
H B 0036 ILE C 3.729 H B 0037 VAL CB
H B 0037 VAL CA 3.799 H B 0038 ASN CA
H B 0037 VAL C 2.436 H B 0038 ASN CA
H B 0037 VAL C 3.028 H B 0038 ASN C
H B 0037 VAL C 3.712 H B 0038 ASN CB
H B 0038 ASN C 2.431 H B 0039 SER CA
H B 0038 ASN C 3.108 H B 0039 SER C
H B 0038 ASN C 3.697 H B 0039 SER CB
H B 0038 ASN C 3.727 H B 0044 GLN CG
H B 0039 SER C 2.435 C B 0040 CYS CA
H B 0039 SER C 3.030 C B 0040 CYS C
H B 0039 SER C 3.711 C B 0040 CYS CB
C B 0040 CYS C 2.436 H B 0041 ALA CA
C B 0040 CYS C 3.094 H B 0041 ALA C
C B 0040 CYS C 3.696 H B 0041 ALA CB
H B 0041 ALA C 2.437 H B 0042 GLN CA
H B 0041 ALA C 2.992 H B 0042 GLN C
H B 0041 ALA C 3.716 H B 0042 GLN CB
H B 0042 GLN C 2.435 H B 0043 CYS CA
H B 0042 GLN C 3.301 H B 0043 CYS C
H B 0042 GLN C 3.628 H B 0043 CYS CB
H B 0043 CYS C 2.441 H B 0044 GLN CA
H B 0043 CYS C 2.984 H B 0044 GLN C
H B 0043 CYS C 3.721 H B 0044 GLN CB
H B 0044 GLN C 2.435 C B 0045 GLN CA
H B 0044 GLN C 3.140 C B 0045 GLN C
H B 0044 GLN C 3.691 C B 0045 GLN CB
C B 0045 GLN C 2.436 C B 0046 LYS CA
C B 0045 GLN C 3.351 C B 0046 LYS C
C B 0045 GLN C 3.597 C B 0046 LYS CB
CHARGE_ATTR 2.00 12.00 38
C B 0003 GLU OE1 7.696 C B 0004 LYS NZ
C B 0003 GLU OE2 7.706 C B 0004 LYS NZ
H B 0010 GLU OE1 6.578 H B 0014 LYS NZ
H B 0010 GLU OE2 6.471 H B 0014 LYS NZ
H B 0010 GLU OE1 10.60 H B 0025 LYS NZ
H B 0011 GLU OE1 9.731 H B 0012 HIS ND1
H B 0011 GLU OE1 10.83 H B 0012 HIS NE2
H B 0011 GLU OE2 9.133 H B 0012 HIS ND1
H B 0011 GLU OE2 10.15 H B 0012 HIS NE2
H B 0011 GLU OE1 7.482 H B 0014 LYS NZ
H B 0011 GLU OE2 8.075 H B 0014 LYS NZ
H B 0011 GLU OE1 11.99 C B 0016 HIS ND1
H B 0011 GLU OE2 11.06 C B 0016 HIS ND1
H B 0011 GLU OE2 11.37 C B 0016 HIS NE2
H B 0011 GLU OE1 4.208 H B 0025 LYS NZ
H B 0011 GLU OE2 3.554 H B 0025 LYS NZ
H B 0013 GLU OE1 9.351 H B 0012 HIS ND1
H B 0013 GLU OE1 8.587 H B 0012 HIS NE2
H B 0013 GLU OE2 8.540 H B 0012 HIS ND1
H B 0013 GLU OE2 7.750 H B 0012 HIS NE2
H B 0013 GLU OE1 9.361 H B 0014 LYS NZ
H B 0013 GLU OE2 11.36 H B 0014 LYS NZ
H B 0013 GLU OE1 8.655 C B 0016 HIS ND1
H B 0013 GLU OE1 8.507 C B 0016 HIS NE2
H B 0013 GLU OE2 8.258 C B 0016 HIS ND1
H B 0013 GLU OE2 8.559 C B 0016 HIS NE2
H B 0021 GLU OE1 9.827 H B 0012 HIS ND1
H B 0021 GLU OE1 11.15 H B 0012 HIS NE2
H B 0021 GLU OE2 10.23 H B 0012 HIS ND1
H B 0021 GLU OE2 11.84 H B 0012 HIS NE2
H B 0021 GLU OE1 10.21 H B 0020 LYS NZ
H B 0021 GLU OE2 9.381 H B 0020 LYS NZ
H B 0021 GLU OE1 7.039 H B 0024 HIS ND1
H B 0021 GLU OE1 8.904 H B 0024 HIS NE2
H B 0021 GLU OE2 5.871 H B 0024 HIS ND1
H B 0021 GLU OE2 7.474 H B 0024 HIS NE2
H B 0021 GLU OE1 6.660 H B 0025 LYS NZ
H B 0021 GLU OE2 5.538 H B 0025 LYS NZ
CHARGE_REPU 2.00 12.00 38
C B 0003 GLU OE1 7.889 H B 0006 GLU OE1
C B 0003 GLU OE1 10.07 H B 0006 GLU OE2
C B 0003 GLU OE2 8.879 H B 0006 GLU OE1
C B 0003 GLU OE2 11.05 H B 0006 GLU OE2
H B 0006 GLU OE1 9.516 H B 0010 GLU OE1
H B 0006 GLU OE1 9.736 H B 0010 GLU OE2
H B 0006 GLU OE2 8.827 H B 0010 GLU OE1
H B 0006 GLU OE2 8.646 H B 0010 GLU OE2
H B 0006 GLU OE2 10.95 H B 0013 GLU OE1
H B 0006 GLU OE2 10.81 H B 0013 GLU OE2
H B 0010 GLU OE1 6.713 H B 0011 GLU OE1
H B 0010 GLU OE1 8.655 H B 0011 GLU OE2
H B 0010 GLU OE2 8.380 H B 0011 GLU OE1
H B 0010 GLU OE2 10.10 H B 0011 GLU OE2
H B 0010 GLU OE1 8.544 H B 0013 GLU OE1
H B 0010 GLU OE1 9.918 H B 0013 GLU OE2
H B 0010 GLU OE2 7.291 H B 0013 GLU OE1
H B 0010 GLU OE2 8.865 H B 0013 GLU OE2
H B 0011 GLU OE1 10.97 H B 0013 GLU OE1
H B 0011 GLU OE1 11.93 H B 0013 GLU OE2
H B 0011 GLU OE2 11.63 H B 0013 GLU OE1
H B 0011 GLU OE1 8.997 H B 0021 GLU OE1
H B 0011 GLU OE1 8.247 H B 0021 GLU OE2
H B 0011 GLU OE2 7.194 H B 0021 GLU OE1
H B 0011 GLU OE2 6.829 H B 0021 GLU OE2
H B 0012 HIS ND1 5.296 C B 0016 HIS ND1
H B 0012 HIS ND1 7.225 C B 0016 HIS NE2
H B 0012 HIS NE2 3.275 C B 0016 HIS ND1
H B 0012 HIS NE2 5.320 C B 0016 HIS NE2
H B 0012 HIS ND1 11.63 H B 0025 LYS NZ
H B 0014 LYS NZ 11.96 C B 0016 HIS NE2
H B 0014 LYS NZ 10.66 H B 0025 LYS NZ
H B 0020 LYS NZ 4.865 H B 0024 HIS ND1
H B 0020 LYS NZ 5.538 H B 0024 HIS NE2
H B 0024 HIS ND1 10.26 H B 0025 LYS NZ
H B 0024 HIS NE2 11.03 H B 0025 LYS NZ
H B 0034 ARG NH1 9.286 C B 0046 LYS NZ
H B 0034 ARG NH2 9.023 C B 0046 LYS NZ
HB_MM 2.00 3.20 79
C B 0002 LEU N 2.250 C B 0001 PHE O
C B 0003 GLU N 2.248 C B 0002 LEU O
C B 0004 LYS N 2.250 C B 0003 GLU O
H B 0005 ILE N 2.248 C B 0004 LYS O
H B 0006 GLU N 2.250 H B 0005 ILE O
H B 0007 PRO N 2.255 H B 0006 GLU O
H B 0008 ALA N 3.143 H B 0005 ILE O
H B 0008 ALA N 2.816 H B 0006 GLU O
H B 0008 ALA N 2.250 H B 0007 PRO O
H B 0009 GLN N 2.596 H B 0006 GLU O
H B 0009 GLN N 2.249 H B 0008 ALA O
H B 0010 GLU N 2.251 H B 0009 GLN O
H B 0011 GLU N 3.133 H B 0008 ALA O
H B 0011 GLU N 2.251 H B 0010 GLU O
H B 0012 HIS N 2.249 H B 0011 GLU O
H B 0013 GLU N 2.238 H B 0012 HIS O
H B 0014 LYS N 3.182 H B 0011 GLU O
H B 0014 LYS N 3.026 H B 0012 HIS O
H B 0014 LYS N 2.247 H B 0013 GLU O
H B 0015 TYR N 3.200 H B 0011 GLU O
H B 0015 TYR N 2.244 H B 0014 LYS O
C B 0016 HIS N 2.552 H B 0012 HIS O
C B 0016 HIS N 2.253 H B 0015 TYR O
C B 0017 SER N 2.893 H B 0015 TYR O
C B 0017 SER N 2.251 C B 0016 HIS O
C B 0018 ASN N 2.251 C B 0017 SER O
H B 0019 VAL N 2.250 C B 0018 ASN O
H B 0020 LYS N 2.250 H B 0019 VAL O
H B 0021 GLU N 3.002 C B 0018 ASN O
H B 0021 GLU N 3.113 H B 0019 VAL O
H B 0021 GLU N 2.247 H B 0020 LYS O
H B 0022 LEU N 2.925 C B 0018 ASN O
H B 0022 LEU N 3.055 H B 0019 VAL O
H B 0022 LEU N 2.250 H B 0021 GLU O
H B 0023 SER N 2.729 H B 0019 VAL O
H B 0023 SER N 2.251 H B 0022 LEU O
H B 0024 HIS N 2.686 H B 0020 LYS O
H B 0024 HIS N 2.249 H B 0023 SER O
H B 0025 LYS N 2.643 H B 0021 GLU O
H B 0025 LYS N 2.248 H B 0024 HIS O
C B 0026 PHE N 2.923 H B 0022 LEU O
C B 0026 PHE N 2.250 H B 0025 LYS O
C B 0027 GLY N 2.735 H B 0023 SER O
C B 0027 GLY N 2.249 C B 0026 PHE O
C B 0028 ILE N 2.249 C B 0027 GLY O
C B 0029 PRO N 2.249 C B 0028 ILE O
H B 0030 ASN N 2.250 C B 0029 PRO O
H B 0031 LEU N 3.155 C B 0029 PRO O
H B 0031 LEU N 2.238 H B 0030 ASN O
H B 0032 VAL N 2.242 H B 0031 LEU O
H B 0033 ALA N 3.122 C B 0029 PRO O
H B 0033 ALA N 3.121 H B 0031 LEU O
H B 0033 ALA N 2.250 H B 0032 VAL O
H B 0034 ARG N 3.108 H B 0030 ASN O
H B 0034 ARG N 3.066 H B 0031 LEU O
H B 0034 ARG N 2.251 H B 0033 ALA O
H B 0035 GLN N 3.039 H B 0031 LEU O
H B 0035 GLN N 3.158 H B 0033 ALA O
H B 0035 GLN N 2.253 H B 0034 ARG O
H B 0036 ILE N 2.949 H B 0033 ALA O
H B 0036 ILE N 2.255 H B 0035 GLN O
H B 0037 VAL N 3.194 H B 0034 ARG O
H B 0037 VAL N 2.250 H B 0036 ILE O
H B 0038 ASN N 2.628 H B 0034 ARG O
H B 0038 ASN N 2.252 H B 0037 VAL O
H B 0039 SER N 3.031 H B 0035 GLN O
H B 0039 SER N 2.249 H B 0038 ASN O
C B 0040 CYS N 3.094 H B 0037 VAL O
C B 0040 CYS N 2.252 H B 0039 SER O
H B 0041 ALA N 2.251 C B 0040 CYS O
H B 0042 GLN N 2.250 H B 0041 ALA O
H B 0043 CYS N 3.071 H B 0041 ALA O
H B 0043 CYS N 2.249 H B 0042 GLN O
H B 0044 GLN N 2.739 C B 0040 CYS O
H B 0044 GLN N 3.043 H B 0041 ALA O
H B 0044 GLN N 2.252 H B 0043 CYS O
C B 0045 GLN N 2.249 H B 0044 GLN O
C B 0046 LYS N 2.249 C B 0045 GLN O
C B 0047 GLY N 2.202 C B 0046 LYS O
HB_MS 2.00 3.20 3
C B 0017 SER O 2.698 H B 0012 HIS ND1
C B 0028 ILE O 2.553 H B 0023 SER OG
H B 0035 GLN O 2.949 H B 0039 SER OG
AROMATIC 0.00 8.00 2
H B 0025 LYS 7.173 H B 0015 TYR
H B 0012 HIS 5.167 C B 0016 HIS