Complet list of 1ihq con file
Complete list of 1ihq.con file
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 167
C A 0001 GLY CA 3.785 C A 0002 ALA CA
C A 0001 GLY C 2.419 C A 0002 ALA CA
C A 0001 GLY C 2.926 C A 0002 ALA C
C A 0001 GLY C 3.013 C A 0002 ALA CB
C A 0002 ALA CA 3.785 C A 0003 GLY CA
C A 0002 ALA C 2.418 C A 0003 GLY CA
C A 0002 ALA C 3.629 C A 0003 GLY C
C A 0003 GLY CA 3.785 C A 0004 SER CA
C A 0003 GLY C 2.418 C A 0004 SER CA
C A 0003 GLY C 3.191 C A 0004 SER C
C A 0003 GLY C 2.818 C A 0004 SER CB
C A 0004 SER CA 3.785 C A 0005 SER CA
C A 0004 SER C 2.418 C A 0005 SER CA
C A 0004 SER C 3.700 C A 0005 SER C
C A 0004 SER C 2.960 C A 0005 SER CB
C A 0005 SER CA 3.785 H A 0006 SER CA
C A 0005 SER C 2.419 H A 0006 SER CA
C A 0005 SER C 2.991 H A 0006 SER C
C A 0005 SER C 2.982 H A 0006 SER CB
H A 0006 SER CA 3.785 H A 0007 LEU CA
H A 0006 SER C 2.419 H A 0007 LEU CA
H A 0006 SER C 2.839 H A 0007 LEU C
H A 0006 SER C 3.701 H A 0007 LEU CB
H A 0007 LEU CA 3.785 H A 0008 GLU CA
H A 0007 LEU C 2.418 H A 0008 GLU CA
H A 0007 LEU C 3.103 H A 0008 GLU C
H A 0007 LEU C 3.688 H A 0008 GLU CB
H A 0007 LEU C 3.684 H A 0011 ARG CB
H A 0008 GLU CA 3.785 H A 0009 ALA CA
H A 0008 GLU C 2.419 H A 0009 ALA CA
H A 0008 GLU C 3.011 H A 0009 ALA C
H A 0008 GLU C 3.687 H A 0009 ALA CB
H A 0009 ALA CA 3.785 H A 0010 VAL CA
H A 0009 ALA C 2.419 H A 0010 VAL CA
H A 0009 ALA C 3.051 H A 0010 VAL C
H A 0009 ALA C 3.683 H A 0010 VAL CB
H A 0010 VAL CA 3.785 H A 0011 ARG CA
H A 0010 VAL C 2.419 H A 0011 ARG CA
H A 0010 VAL C 2.987 H A 0011 ARG C
H A 0010 VAL C 3.712 H A 0011 ARG CB
H A 0011 ARG CA 3.785 H A 0012 ARG CA
H A 0011 ARG C 2.418 H A 0012 ARG CA
H A 0011 ARG C 3.147 H A 0012 ARG C
H A 0011 ARG C 3.683 H A 0012 ARG CB
H A 0011 ARG CA 3.570 H A 0014 ILE CG2
H A 0011 ARG C 3.516 H A 0014 ILE CG2
H A 0012 ARG CA 3.785 H A 0013 LYS CA
H A 0012 ARG C 2.418 H A 0013 LYS CA
H A 0012 ARG C 3.060 H A 0013 LYS C
H A 0012 ARG C 3.684 H A 0013 LYS CB
H A 0013 LYS CA 3.785 H A 0014 ILE CA
H A 0013 LYS C 2.419 H A 0014 ILE CA
H A 0013 LYS C 3.091 H A 0014 ILE C
H A 0013 LYS C 3.674 H A 0014 ILE CB
H A 0014 ILE CA 3.785 H A 0015 ARG CA
H A 0014 ILE C 2.419 H A 0015 ARG CA
H A 0014 ILE C 3.002 H A 0015 ARG C
H A 0014 ILE C 3.711 H A 0015 ARG CB
H A 0015 ARG CA 3.785 H A 0016 SER CA
H A 0015 ARG C 2.418 H A 0016 SER CA
H A 0015 ARG C 3.031 H A 0016 SER C
H A 0015 ARG C 3.707 H A 0016 SER CB
H A 0016 SER CA 3.784 H A 0017 LEU CA
H A 0016 SER C 2.419 H A 0017 LEU CA
H A 0016 SER C 2.899 H A 0017 LEU C
H A 0016 SER C 3.707 H A 0017 LEU CB
H A 0017 LEU CA 3.784 H A 0018 GLN CA
H A 0017 LEU C 2.419 H A 0018 GLN CA
H A 0017 LEU C 2.974 H A 0018 GLN C
H A 0017 LEU C 3.711 H A 0018 GLN CB
H A 0018 GLN CA 3.784 H A 0019 GLU CA
H A 0018 GLN C 2.419 H A 0019 GLU CA
H A 0018 GLN C 2.963 H A 0019 GLU C
H A 0018 GLN C 3.711 H A 0019 GLU CB
H A 0019 GLU CA 3.785 H A 0020 GLN CA
H A 0019 GLU C 2.418 H A 0020 GLN CA
H A 0019 GLU C 3.050 H A 0020 GLN C
H A 0019 GLU C 3.701 H A 0020 GLN CB
H A 0019 GLU C 3.748 H A 0023 HIS CD2
H A 0020 GLN CA 3.784 H A 0021 ASN CA
H A 0020 GLN C 2.418 H A 0021 ASN CA
H A 0020 GLN C 2.985 H A 0021 ASN C
H A 0020 GLN C 3.712 H A 0021 ASN CB
H A 0020 GLN CG 3.623 H A 0024 LEU CD1
H A 0020 GLN CG 3.368 H A 0024 LEU CD2
H A 0020 GLN CD 3.791 H A 0024 LEU CD2
H A 0021 ASN CA 3.785 H A 0022 TYR CA
H A 0021 ASN C 2.419 H A 0022 TYR CA
H A 0021 ASN C 3.120 H A 0022 TYR C
H A 0021 ASN C 3.638 H A 0022 TYR CB
H A 0021 ASN C 3.797 H A 0025 GLU CB
H A 0022 TYR CA 3.785 H A 0023 HIS CA
H A 0022 TYR C 2.418 H A 0023 HIS CA
H A 0022 TYR C 3.090 H A 0023 HIS C
H A 0022 TYR C 3.682 H A 0023 HIS CB
H A 0023 HIS CA 3.785 H A 0024 LEU CA
H A 0023 HIS C 2.419 H A 0024 LEU CA
H A 0023 HIS C 3.122 H A 0024 LEU C
H A 0023 HIS C 3.664 H A 0024 LEU CB
H A 0023 HIS C 3.575 H A 0024 LEU CD1
H A 0024 LEU CA 3.785 H A 0025 GLU CA
H A 0024 LEU C 2.419 H A 0025 GLU CA
H A 0024 LEU C 3.047 H A 0025 GLU C
H A 0024 LEU C 3.701 H A 0025 GLU CB
H A 0025 GLU CA 3.785 H A 0026 ASN CA
H A 0025 GLU C 2.419 H A 0026 ASN CA
H A 0025 GLU C 3.095 H A 0026 ASN C
H A 0025 GLU C 3.697 H A 0026 ASN CB
H A 0026 ASN CA 3.785 H A 0027 GLU CA
H A 0026 ASN C 2.419 H A 0027 GLU CA
H A 0026 ASN C 3.049 H A 0027 GLU C
H A 0026 ASN C 3.702 H A 0027 GLU CB
H A 0027 GLU CA 3.784 H A 0028 VAL CA
H A 0027 GLU C 2.418 H A 0028 VAL CA
H A 0027 GLU C 2.918 H A 0028 VAL C
H A 0027 GLU C 3.700 H A 0028 VAL CB
H A 0028 VAL CA 3.784 H A 0029 ALA CA
H A 0028 VAL C 2.418 H A 0029 ALA CA
H A 0028 VAL C 2.847 H A 0029 ALA C
H A 0028 VAL C 3.688 H A 0029 ALA CB
H A 0028 VAL CG1 3.795 H A 0029 ALA CA
H A 0028 VAL CA 3.648 H A 0031 LEU CB
H A 0028 VAL C 3.529 H A 0031 LEU CB
H A 0028 VAL C 3.604 H A 0032 LYS CD
H A 0028 VAL CG1 3.793 H A 0032 LYS CE
H A 0028 VAL CG2 3.418 H A 0032 LYS CE
H A 0029 ALA CA 3.786 H A 0030 ARG CA
H A 0029 ALA C 2.419 H A 0030 ARG CA
H A 0029 ALA C 2.937 H A 0030 ARG C
H A 0029 ALA C 3.712 H A 0030 ARG CB
H A 0030 ARG CA 3.785 H A 0031 LEU CA
H A 0030 ARG C 2.418 H A 0031 LEU CA
H A 0030 ARG C 3.037 H A 0031 LEU C
H A 0030 ARG C 3.688 H A 0031 LEU CB
H A 0031 LEU CA 3.785 H A 0032 LYS CA
H A 0031 LEU C 2.419 H A 0032 LYS CA
H A 0031 LEU C 2.868 H A 0032 LYS C
H A 0031 LEU C 3.705 H A 0032 LYS CB
H A 0031 LEU C 3.592 H A 0035 VAL CG2
H A 0031 LEU CD1 3.429 H A 0035 VAL CG1
H A 0032 LYS CA 3.785 H A 0033 LYS CA
H A 0032 LYS C 2.419 H A 0033 LYS CA
H A 0032 LYS C 3.122 H A 0033 LYS C
H A 0032 LYS C 3.664 H A 0033 LYS CB
H A 0032 LYS CA 3.175 H A 0035 VAL CG2
H A 0032 LYS C 3.383 H A 0035 VAL CG2
H A 0033 LYS CA 3.785 H A 0034 LEU CA
H A 0033 LYS C 2.419 H A 0034 LEU CA
H A 0033 LYS C 3.123 H A 0034 LEU C
H A 0033 LYS C 3.663 H A 0034 LEU CB
H A 0034 LEU CA 3.785 H A 0035 VAL CA
H A 0034 LEU C 2.418 H A 0035 VAL CA
H A 0034 LEU C 2.916 H A 0035 VAL C
H A 0034 LEU C 3.700 H A 0035 VAL CB
H A 0035 VAL CA 3.785 H A 0036 GLY CA
H A 0035 VAL C 2.419 H A 0036 GLY CA
H A 0035 VAL C 2.786 H A 0036 GLY C
H A 0036 GLY CA 3.784 C A 0037 GLU CA
H A 0036 GLY C 2.418 C A 0037 GLU CA
H A 0036 GLY C 3.067 C A 0037 GLU C
H A 0036 GLY C 3.697 C A 0037 GLU CB
C A 0037 GLU CA 3.785 C A 0038 ARG CA
C A 0037 GLU C 2.418 C A 0038 ARG CA
C A 0037 GLU C 2.856 C A 0038 ARG C
C A 0037 GLU C 3.123 C A 0038 ARG CB
C A 0037 GLU CD 3.466 C A 0038 ARG CA
C A 0037 GLU CD 3.088 C A 0038 ARG CB
CHARGE_ATTR 2.00 12.00 42
H A 0008 GLU OE1 10.05 H A 0011 ARG NH1
H A 0008 GLU OE1 11.57 H A 0011 ARG NH2
H A 0008 GLU OE2 11.34 H A 0011 ARG NH1
H A 0008 GLU OE1 8.089 H A 0012 ARG NH1
H A 0008 GLU OE1 10.31 H A 0012 ARG NH2
H A 0008 GLU OE2 9.990 H A 0012 ARG NH1
H A 0008 GLU OE1 10.80 H A 0013 LYS NZ
H A 0008 GLU OE2 11.58 H A 0013 LYS NZ
H A 0019 GLU OE1 10.29 H A 0011 ARG NH1
H A 0019 GLU OE1 11.19 H A 0011 ARG NH2
H A 0019 GLU OE2 10.64 H A 0011 ARG NH1
H A 0019 GLU OE2 11.90 H A 0011 ARG NH2
H A 0019 GLU OE1 11.50 H A 0012 ARG NH2
H A 0019 GLU OE2 10.98 H A 0012 ARG NH1
H A 0019 GLU OE2 9.992 H A 0012 ARG NH2
H A 0019 GLU OE1 4.699 H A 0015 ARG NH1
H A 0019 GLU OE1 3.737 H A 0015 ARG NH2
H A 0019 GLU OE2 5.212 H A 0015 ARG NH1
H A 0019 GLU OE2 3.318 H A 0015 ARG NH2
H A 0019 GLU OE1 6.885 H A 0023 HIS ND1
H A 0019 GLU OE1 5.600 H A 0023 HIS NE2
H A 0019 GLU OE2 6.294 H A 0023 HIS ND1
H A 0019 GLU OE2 4.471 H A 0023 HIS NE2
H A 0025 GLU OE1 10.78 H A 0023 HIS ND1
H A 0025 GLU OE2 9.766 H A 0023 HIS ND1
H A 0025 GLU OE2 11.15 H A 0023 HIS NE2
H A 0025 GLU OE1 11.00 H A 0032 LYS NZ
H A 0025 GLU OE2 11.73 H A 0032 LYS NZ
H A 0027 GLU OE1 7.909 H A 0023 HIS ND1
H A 0027 GLU OE1 9.749 H A 0023 HIS NE2
H A 0027 GLU OE2 6.592 H A 0023 HIS ND1
H A 0027 GLU OE2 8.233 H A 0023 HIS NE2
H A 0027 GLU OE1 7.197 H A 0030 ARG NH1
H A 0027 GLU OE1 8.189 H A 0030 ARG NH2
H A 0027 GLU OE2 9.027 H A 0030 ARG NH1
H A 0027 GLU OE2 10.21 H A 0030 ARG NH2
C A 0037 GLU OE2 10.83 H A 0032 LYS NZ
C A 0037 GLU OE2 11.02 H A 0033 LYS NZ
C A 0037 GLU OE1 6.821 C A 0038 ARG NH1
C A 0037 GLU OE1 8.157 C A 0038 ARG NH2
C A 0037 GLU OE2 7.408 C A 0038 ARG NH1
C A 0037 GLU OE2 8.511 C A 0038 ARG NH2
CHARGE_REPU 2.00 12.00 24
H A 0011 ARG NH1 9.197 H A 0012 ARG NH1
H A 0011 ARG NH1 10.57 H A 0012 ARG NH2
H A 0011 ARG NH2 11.51 H A 0012 ARG NH1
H A 0011 ARG NH1 5.945 H A 0015 ARG NH1
H A 0011 ARG NH1 7.697 H A 0015 ARG NH2
H A 0011 ARG NH2 6.835 H A 0015 ARG NH1
H A 0011 ARG NH2 8.926 H A 0015 ARG NH2
H A 0012 ARG NH1 6.814 H A 0013 LYS NZ
H A 0012 ARG NH2 6.498 H A 0013 LYS NZ
H A 0012 ARG NH1 10.20 H A 0015 ARG NH1
H A 0012 ARG NH1 9.657 H A 0015 ARG NH2
H A 0012 ARG NH2 10.35 H A 0015 ARG NH1
H A 0012 ARG NH2 9.356 H A 0015 ARG NH2
H A 0012 ARG NH2 11.89 H A 0023 HIS NE2
H A 0015 ARG NH1 11.33 H A 0023 HIS ND1
H A 0015 ARG NH1 9.658 H A 0023 HIS NE2
H A 0015 ARG NH2 9.607 H A 0023 HIS ND1
H A 0015 ARG NH2 7.757 H A 0023 HIS NE2
H A 0019 GLU OE1 11.65 H A 0025 GLU OE1
H A 0019 GLU OE1 10.88 H A 0025 GLU OE2
H A 0023 HIS ND1 10.97 H A 0030 ARG NH1
H A 0030 ARG NH1 11.87 H A 0033 LYS NZ
H A 0030 ARG NH2 11.94 H A 0033 LYS NZ
H A 0032 LYS NZ 9.623 H A 0033 LYS NZ
HB_MM 2.00 3.20 77
C A 0002 ALA N 2.262 C A 0001 GLY O
C A 0003 GLY N 2.262 C A 0002 ALA O
C A 0004 SER N 2.262 C A 0003 GLY O
C A 0005 SER N 2.262 C A 0004 SER O
H A 0006 SER N 2.262 C A 0005 SER O
H A 0007 LEU N 2.948 C A 0005 SER O
H A 0007 LEU N 2.262 H A 0006 SER O
H A 0008 GLU N 2.691 H A 0006 SER O
H A 0008 GLU N 2.262 H A 0007 LEU O
H A 0009 ALA N 2.502 H A 0006 SER O
H A 0009 ALA N 2.261 H A 0008 GLU O
H A 0010 VAL N 2.710 H A 0006 SER O
H A 0010 VAL N 2.262 H A 0009 ALA O
H A 0011 ARG N 2.654 H A 0007 LEU O
H A 0011 ARG N 2.262 H A 0010 VAL O
H A 0012 ARG N 2.841 H A 0008 GLU O
H A 0012 ARG N 2.262 H A 0011 ARG O
H A 0013 LYS N 2.928 H A 0009 ALA O
H A 0013 LYS N 3.067 H A 0010 VAL O
H A 0013 LYS N 2.261 H A 0012 ARG O
H A 0014 ILE N 2.707 H A 0010 VAL O
H A 0014 ILE N 2.262 H A 0013 LYS O
H A 0015 ARG N 2.967 H A 0011 ARG O
H A 0015 ARG N 2.261 H A 0014 ILE O
H A 0016 SER N 2.753 H A 0012 ARG O
H A 0016 SER N 2.261 H A 0015 ARG O
H A 0017 LEU N 2.863 H A 0013 LYS O
H A 0017 LEU N 2.261 H A 0016 SER O
H A 0018 GLN N 2.763 H A 0014 ILE O
H A 0018 GLN N 3.079 H A 0016 SER O
H A 0018 GLN N 2.262 H A 0017 LEU O
H A 0019 GLU N 3.018 H A 0015 ARG O
H A 0019 GLU N 2.938 H A 0016 SER O
H A 0019 GLU N 2.261 H A 0018 GLN O
H A 0020 GLN N 2.867 H A 0016 SER O
H A 0020 GLN N 2.262 H A 0019 GLU O
H A 0021 ASN N 2.700 H A 0017 LEU O
H A 0021 ASN N 2.960 H A 0018 GLN O
H A 0021 ASN N 2.261 H A 0020 GLN O
H A 0022 TYR N 2.992 H A 0018 GLN O
H A 0022 TYR N 2.262 H A 0021 ASN O
H A 0023 HIS N 2.765 H A 0019 GLU O
H A 0023 HIS N 2.262 H A 0022 TYR O
H A 0024 LEU N 2.685 H A 0020 GLN O
H A 0024 LEU N 2.261 H A 0023 HIS O
H A 0025 GLU N 2.743 H A 0021 ASN O
H A 0025 GLU N 2.261 H A 0024 LEU O
H A 0026 ASN N 2.965 H A 0022 TYR O
H A 0026 ASN N 2.262 H A 0025 GLU O
H A 0027 GLU N 2.880 H A 0023 HIS O
H A 0027 GLU N 2.261 H A 0026 ASN O
H A 0028 VAL N 2.703 H A 0024 LEU O
H A 0028 VAL N 2.262 H A 0027 GLU O
H A 0029 ALA N 3.030 H A 0025 GLU O
H A 0029 ALA N 2.261 H A 0028 VAL O
H A 0030 ARG N 3.007 H A 0026 ASN O
H A 0030 ARG N 2.262 H A 0029 ALA O
H A 0031 LEU N 2.723 H A 0027 GLU O
H A 0031 LEU N 2.636 H A 0028 VAL O
H A 0031 LEU N 2.908 H A 0029 ALA O
H A 0031 LEU N 2.262 H A 0030 ARG O
H A 0032 LYS N 2.674 H A 0028 VAL O
H A 0032 LYS N 3.082 H A 0029 ALA O
H A 0032 LYS N 2.261 H A 0031 LEU O
H A 0033 LYS N 3.043 H A 0029 ALA O
H A 0033 LYS N 2.869 H A 0031 LEU O
H A 0033 LYS N 2.261 H A 0032 LYS O
H A 0034 LEU N 2.686 H A 0030 ARG O
H A 0034 LEU N 2.509 H A 0031 LEU O
H A 0034 LEU N 2.261 H A 0033 LYS O
H A 0035 VAL N 2.402 H A 0031 LEU O
H A 0035 VAL N 2.262 H A 0034 LEU O
H A 0036 GLY N 3.079 H A 0032 LYS O
H A 0036 GLY N 2.261 H A 0035 VAL O
C A 0037 GLU N 2.478 H A 0035 VAL O
C A 0037 GLU N 2.261 H A 0036 GLY O
C A 0038 ARG N 2.262 C A 0037 GLU O
HB_MS 2.00 3.20 5
C A 0004 SER O 2.704 C A 0005 SER OG
H A 0012 ARG O 2.801 H A 0016 SER OG
H A 0017 LEU O 3.074 H A 0021 ASN ND2
H A 0022 TYR O 2.617 H A 0026 ASN ND2
C A 0038 ARG N 2.695 C A 0037 GLU OE1
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 56
C A 0001 GLY CA 3.340 H B 0006 SER CA
C A 0001 GLY CA 3.614 H B 0006 SER CB
C A 0003 GLY CA 3.707 H B 0007 LEU CB
C A 0003 GLY CA 3.553 H B 0007 LEU CD2
H A 0007 LEU CD1 3.662 C B 0005 SER CA
H A 0007 LEU CD1 3.783 C B 0005 SER C
H A 0007 LEU CD1 3.331 C B 0005 SER CB
H A 0010 VAL CG1 3.421 H B 0010 VAL CG1
H A 0013 LYS CB 3.458 H B 0014 ILE CG1
H A 0014 ILE CB 3.469 H B 0010 VAL CG1
H A 0014 ILE CG1 3.796 H B 0010 VAL CG1
H A 0014 ILE CG2 3.459 H B 0010 VAL CG1
H A 0014 ILE CG1 3.454 H B 0013 LYS CB
H A 0014 ILE CD1 3.264 H B 0017 LEU CD1
H A 0017 LEU CD1 3.772 H B 0014 ILE CG1
H A 0017 LEU CD1 3.329 H B 0014 ILE CD1
H A 0017 LEU CB 3.648 H B 0017 LEU CB
H A 0017 LEU CD1 3.795 H B 0018 GLN CA
H A 0017 LEU CD2 3.766 H B 0021 ASN CB
H A 0017 LEU CD2 3.011 H B 0021 ASN CG
H A 0018 GLN CA 3.700 H B 0017 LEU CD1
H A 0018 GLN CB 3.700 H B 0017 LEU CD1
H A 0020 GLN CD 3.634 H B 0021 ASN CG
H A 0021 ASN CG 3.300 H B 0017 LEU CD2
H A 0021 ASN CG 3.172 H B 0020 GLN CG
H A 0021 ASN CG 3.156 H B 0020 GLN CD
H A 0024 LEU C 3.797 H B 0024 LEU CD1
H A 0024 LEU C 3.291 H B 0024 LEU CD2
H A 0024 LEU CB 3.683 H B 0024 LEU CB
H A 0025 GLU CA 3.485 H B 0024 LEU CD1
H A 0025 GLU CB 3.638 H B 0024 LEU CD1
H A 0028 VAL CB 3.397 H B 0024 LEU CD2
H A 0028 VAL CG1 3.102 H B 0024 LEU CD2
H A 0028 VAL CA 3.340 H B 0028 VAL CG2
H A 0028 VAL CB 3.270 H B 0028 VAL CG2
H A 0028 VAL CG2 3.276 H B 0028 VAL CA
H A 0028 VAL CG2 3.293 H B 0028 VAL CB
H A 0028 VAL CG2 2.971 H B 0028 VAL CG2
H A 0028 VAL CG2 3.378 H B 0031 LEU CD2
H A 0031 LEU CD2 3.649 H B 0028 VAL CG2
H A 0031 LEU CB 3.434 H B 0031 LEU CD2
H A 0031 LEU CG 3.426 H B 0031 LEU CD2
H A 0031 LEU CD2 3.673 H B 0031 LEU CD2
H A 0031 LEU CD2 3.394 H B 0032 LYS CG
H A 0031 LEU CD2 3.366 H B 0032 LYS CE
H A 0032 LYS CG 3.544 H B 0031 LEU CD1
H A 0032 LYS CG 3.370 H B 0031 LEU CD2
H A 0032 LYS CD 3.782 H B 0031 LEU CD2
H A 0035 VAL CB 3.139 H B 0035 VAL CG1
H A 0035 VAL CB 3.464 H B 0035 VAL CG2
H A 0035 VAL CG1 3.681 H B 0035 VAL CB
H A 0035 VAL CG1 3.276 H B 0035 VAL CG1
H A 0035 VAL CG1 3.502 H B 0035 VAL CG2
H A 0035 VAL CG2 3.705 H B 0035 VAL CG2
C A 0037 GLU CB 3.792 H B 0035 VAL CG1
C A 0037 GLU CG 3.671 H B 0035 VAL CG1
CHARGE_ATTR 2.00 12.00 7
H A 0025 GLU OE1 11.82 H B 0023 HIS ND1
H A 0025 GLU OE1 10.55 H B 0023 HIS NE2
H A 0027 GLU OE1 5.831 H B 0032 LYS NZ
H A 0027 GLU OE2 5.982 H B 0032 LYS NZ
H A 0032 LYS NZ 4.494 H B 0027 GLU OE1
H A 0032 LYS NZ 4.347 H B 0027 GLU OE2
C A 0037 GLU OE2 11.17 H B 0030 ARG NH2
CHARGE_REPU 2.00 12.00 12
H A 0025 GLU OE1 11.43 H B 0027 GLU OE1
H A 0027 GLU OE2 11.04 H B 0025 GLU OE2
H A 0032 LYS NZ 9.933 H B 0023 HIS ND1
H A 0032 LYS NZ 8.062 H B 0023 HIS NE2
H A 0032 LYS NZ 10.71 H B 0030 ARG NH1
H A 0032 LYS NZ 11.10 H B 0030 ARG NH2
H A 0032 LYS NZ 11.83 H B 0032 LYS NZ
C A 0037 GLU OE2 11.57 H B 0027 GLU OE2
C A 0037 GLU OE1 7.264 C B 0037 GLU OE1
C A 0037 GLU OE1 8.891 C B 0037 GLU OE2
C A 0037 GLU OE2 8.566 C B 0037 GLU OE1
C A 0037 GLU OE2 10.01 C B 0037 GLU OE2
HB_MM 2.00 3.20 1
C A 0002 ALA O 3.003 H B 0007 LEU N
HB_MS 2.00 3.20 1
H A 0017 LEU O 3.146 H B 0021 ASN ND2
HB_SS 2.00 3.20 2
H A 0020 GLN NE2 2.568 H B 0021 ASN OD1
H A 0021 ASN OD1 2.584 H B 0020 GLN NE2
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 158
C B 0001 GLY CA 3.786 C B 0002 ALA CA
C B 0001 GLY C 2.419 C B 0002 ALA CA
C B 0001 GLY C 3.307 C B 0002 ALA C
C B 0001 GLY C 3.569 C B 0002 ALA CB
C B 0002 ALA CA 3.785 C B 0003 GLY CA
C B 0002 ALA C 2.419 C B 0003 GLY CA
C B 0002 ALA C 3.710 C B 0003 GLY C
C B 0003 GLY CA 3.784 C B 0004 SER CA
C B 0003 GLY C 2.418 C B 0004 SER CA
C B 0003 GLY C 3.133 C B 0004 SER C
C B 0003 GLY C 2.859 C B 0004 SER CB
C B 0004 SER CA 3.786 C B 0005 SER CA
C B 0004 SER C 2.419 C B 0005 SER CA
C B 0004 SER C 3.621 C B 0005 SER C
C B 0004 SER C 3.270 C B 0005 SER CB
C B 0005 SER CA 3.785 H B 0006 SER CA
C B 0005 SER C 2.418 H B 0006 SER CA
C B 0005 SER C 2.918 H B 0006 SER C
C B 0005 SER C 3.056 H B 0006 SER CB
H B 0006 SER CA 3.785 H B 0007 LEU CA
H B 0006 SER C 2.418 H B 0007 LEU CA
H B 0006 SER C 3.123 H B 0007 LEU C
H B 0006 SER C 3.664 H B 0007 LEU CB
H B 0006 SER CB 3.163 H B 0009 ALA CB
H B 0007 LEU CA 3.785 H B 0008 GLU CA
H B 0007 LEU C 2.418 H B 0008 GLU CA
H B 0007 LEU C 3.073 H B 0008 GLU C
H B 0007 LEU C 3.696 H B 0008 GLU CB
H B 0007 LEU C 3.700 H B 0011 ARG CB
H B 0008 GLU CA 3.785 H B 0009 ALA CA
H B 0008 GLU C 2.419 H B 0009 ALA CA
H B 0008 GLU C 3.008 H B 0009 ALA C
H B 0008 GLU C 3.687 H B 0009 ALA CB
H B 0008 GLU CA 3.732 H B 0011 ARG CB
H B 0008 GLU C 3.762 H B 0011 ARG CB
H B 0009 ALA CA 3.785 H B 0010 VAL CA
H B 0009 ALA C 2.418 H B 0010 VAL CA
H B 0009 ALA C 3.060 H B 0010 VAL C
H B 0009 ALA C 3.681 H B 0010 VAL CB
H B 0009 ALA C 3.659 H B 0012 ARG CG
H B 0010 VAL CA 3.785 H B 0011 ARG CA
H B 0010 VAL C 2.419 H B 0011 ARG CA
H B 0010 VAL C 3.041 H B 0011 ARG C
H B 0010 VAL C 3.707 H B 0011 ARG CB
H B 0011 ARG CA 3.785 H B 0012 ARG CA
H B 0011 ARG C 2.419 H B 0012 ARG CA
H B 0011 ARG C 3.128 H B 0012 ARG C
H B 0011 ARG C 3.688 H B 0012 ARG CB
H B 0011 ARG CA 3.527 H B 0014 ILE CG2
H B 0011 ARG C 3.458 H B 0014 ILE CG2
H B 0012 ARG CA 3.785 H B 0013 LYS CA
H B 0012 ARG C 2.418 H B 0013 LYS CA
H B 0012 ARG C 3.123 H B 0013 LYS C
H B 0012 ARG C 3.663 H B 0013 LYS CB
H B 0013 LYS CA 3.784 H B 0014 ILE CA
H B 0013 LYS C 2.418 H B 0014 ILE CA
H B 0013 LYS C 3.041 H B 0014 ILE C
H B 0013 LYS C 3.688 H B 0014 ILE CB
H B 0014 ILE CA 3.785 H B 0015 ARG CA
H B 0014 ILE C 2.418 H B 0015 ARG CA
H B 0014 ILE C 3.026 H B 0015 ARG C
H B 0014 ILE C 3.709 H B 0015 ARG CB
H B 0015 ARG CA 3.784 H B 0016 SER CA
H B 0015 ARG C 2.418 H B 0016 SER CA
H B 0015 ARG C 2.988 H B 0016 SER C
H B 0015 ARG C 3.712 H B 0016 SER CB
H B 0016 SER CA 3.785 H B 0017 LEU CA
H B 0016 SER C 2.419 H B 0017 LEU CA
H B 0016 SER C 2.917 H B 0017 LEU C
H B 0016 SER C 3.706 H B 0017 LEU CB
H B 0017 LEU CA 3.786 H B 0018 GLN CA
H B 0017 LEU C 2.419 H B 0018 GLN CA
H B 0017 LEU C 2.931 H B 0018 GLN C
H B 0017 LEU C 3.712 H B 0018 GLN CB
H B 0018 GLN CA 3.785 H B 0019 GLU CA
H B 0018 GLN C 2.419 H B 0019 GLU CA
H B 0018 GLN C 2.958 H B 0019 GLU C
H B 0018 GLN C 3.712 H B 0019 GLU CB
H B 0019 GLU CA 3.785 H B 0020 GLN CA
H B 0019 GLU C 2.419 H B 0020 GLN CA
H B 0019 GLU C 3.050 H B 0020 GLN C
H B 0019 GLU C 3.701 H B 0020 GLN CB
H B 0020 GLN CA 3.785 H B 0021 ASN CA
H B 0020 GLN C 2.418 H B 0021 ASN CA
H B 0020 GLN C 2.962 H B 0021 ASN C
H B 0020 GLN C 3.712 H B 0021 ASN CB
H B 0021 ASN CA 3.785 H B 0022 TYR CA
H B 0021 ASN C 2.419 H B 0022 TYR CA
H B 0021 ASN C 3.150 H B 0022 TYR C
H B 0021 ASN C 3.631 H B 0022 TYR CB
H B 0022 TYR CA 3.784 H B 0023 HIS CA
H B 0022 TYR C 2.419 H B 0023 HIS CA
H B 0022 TYR C 3.103 H B 0023 HIS C
H B 0022 TYR C 3.678 H B 0023 HIS CB
H B 0023 HIS CA 3.784 H B 0024 LEU CA
H B 0023 HIS C 2.418 H B 0024 LEU CA
H B 0023 HIS C 3.124 H B 0024 LEU C
H B 0023 HIS C 3.662 H B 0024 LEU CB
H B 0024 LEU CA 3.785 H B 0025 GLU CA
H B 0024 LEU C 2.419 H B 0025 GLU CA
H B 0024 LEU C 3.043 H B 0025 GLU C
H B 0024 LEU C 3.703 H B 0025 GLU CB
H B 0025 GLU CA 3.785 H B 0026 ASN CA
H B 0025 GLU C 2.418 H B 0026 ASN CA
H B 0025 GLU C 3.121 H B 0026 ASN C
H B 0025 GLU C 3.691 H B 0026 ASN CB
H B 0026 ASN CA 3.786 H B 0027 GLU CA
H B 0026 ASN C 2.419 H B 0027 GLU CA
H B 0026 ASN C 3.051 H B 0027 GLU C
H B 0026 ASN C 3.701 H B 0027 GLU CB
H B 0027 GLU CA 3.784 H B 0028 VAL CA
H B 0027 GLU C 2.418 H B 0028 VAL CA
H B 0027 GLU C 3.037 H B 0028 VAL C
H B 0027 GLU C 3.687 H B 0028 VAL CB
H B 0028 VAL CA 3.785 H B 0029 ALA CA
H B 0028 VAL C 2.419 H B 0029 ALA CA
H B 0028 VAL C 2.933 H B 0029 ALA C
H B 0028 VAL C 3.694 H B 0029 ALA CB
H B 0028 VAL CA 3.706 H B 0031 LEU CB
H B 0028 VAL C 3.666 H B 0031 LEU CB
H B 0028 VAL C 3.681 H B 0032 LYS CD
H B 0029 ALA CA 3.785 H B 0030 ARG CA
H B 0029 ALA C 2.418 H B 0030 ARG CA
H B 0029 ALA C 3.007 H B 0030 ARG C
H B 0029 ALA C 3.710 H B 0030 ARG CB
H B 0030 ARG CA 3.785 H B 0031 LEU CA
H B 0030 ARG C 2.418 H B 0031 LEU CA
H B 0030 ARG C 2.979 H B 0031 LEU C
H B 0030 ARG C 3.700 H B 0031 LEU CB
H B 0031 LEU CA 3.784 H B 0032 LYS CA
H B 0031 LEU C 2.419 H B 0032 LYS CA
H B 0031 LEU C 2.981 H B 0032 LYS C
H B 0031 LEU C 3.700 H B 0032 LYS CB
H B 0031 LEU C 3.671 H B 0035 VAL CG2
H B 0031 LEU CD1 3.538 H B 0035 VAL CG2
H B 0032 LYS CA 3.785 H B 0033 LYS CA
H B 0032 LYS C 2.418 H B 0033 LYS CA
H B 0032 LYS C 2.895 H B 0033 LYS C
H B 0032 LYS C 3.705 H B 0033 LYS CB
H B 0033 LYS CA 3.784 H B 0034 LEU CA
H B 0033 LYS C 2.418 H B 0034 LEU CA
H B 0033 LYS C 3.021 H B 0034 LEU C
H B 0033 LYS C 3.692 H B 0034 LEU CB
H B 0034 LEU CA 3.785 H B 0035 VAL CA
H B 0034 LEU C 2.419 H B 0035 VAL CA
H B 0034 LEU C 3.128 H B 0035 VAL C
H B 0034 LEU C 3.659 H B 0035 VAL CB
H B 0035 VAL CA 3.784 H B 0036 GLY CA
H B 0035 VAL C 2.419 H B 0036 GLY CA
H B 0035 VAL C 2.849 H B 0036 GLY C
H B 0036 GLY CA 3.784 C B 0037 GLU CA
H B 0036 GLY C 2.418 C B 0037 GLU CA
H B 0036 GLY C 3.022 C B 0037 GLU C
H B 0036 GLY C 3.705 C B 0037 GLU CB
C B 0037 GLU CA 3.785 C B 0038 ARG CA
C B 0037 GLU C 2.418 C B 0038 ARG CA
C B 0037 GLU C 2.856 C B 0038 ARG C
C B 0037 GLU C 3.125 C B 0038 ARG CB
CHARGE_ATTR 2.00 12.00 38
H B 0008 GLU OE1 7.647 H B 0011 ARG NH1
H B 0008 GLU OE1 9.290 H B 0011 ARG NH2
H B 0008 GLU OE2 6.829 H B 0011 ARG NH1
H B 0008 GLU OE2 8.611 H B 0011 ARG NH2
H B 0008 GLU OE1 9.593 H B 0012 ARG NH1
H B 0008 GLU OE1 7.901 H B 0012 ARG NH2
H B 0008 GLU OE2 11.72 H B 0012 ARG NH1
H B 0008 GLU OE2 10.09 H B 0012 ARG NH2
H B 0008 GLU OE1 8.792 H B 0015 ARG NH1
H B 0008 GLU OE1 10.56 H B 0015 ARG NH2
H B 0008 GLU OE2 10.14 H B 0015 ARG NH1
H B 0019 GLU OE2 11.87 H B 0012 ARG NH1
H B 0019 GLU OE1 8.539 H B 0015 ARG NH1
H B 0019 GLU OE1 6.818 H B 0015 ARG NH2
H B 0019 GLU OE2 6.433 H B 0015 ARG NH1
H B 0019 GLU OE2 4.663 H B 0015 ARG NH2
H B 0019 GLU OE1 7.104 H B 0023 HIS ND1
H B 0019 GLU OE1 8.964 H B 0023 HIS NE2
H B 0019 GLU OE2 8.570 H B 0023 HIS ND1
H B 0019 GLU OE2 10.17 H B 0023 HIS NE2
H B 0025 GLU OE1 10.58 H B 0023 HIS ND1
H B 0025 GLU OE1 11.69 H B 0023 HIS NE2
H B 0025 GLU OE1 11.98 H B 0032 LYS NZ
H B 0025 GLU OE2 10.69 H B 0032 LYS NZ
H B 0027 GLU OE1 5.725 H B 0023 HIS ND1
H B 0027 GLU OE1 4.125 H B 0023 HIS NE2
H B 0027 GLU OE2 7.332 H B 0023 HIS ND1
H B 0027 GLU OE2 6.112 H B 0023 HIS NE2
H B 0027 GLU OE1 8.124 H B 0030 ARG NH1
H B 0027 GLU OE1 9.181 H B 0030 ARG NH2
H B 0027 GLU OE2 6.688 H B 0030 ARG NH1
H B 0027 GLU OE2 7.603 H B 0030 ARG NH2
H B 0027 GLU OE2 11.79 H B 0032 LYS NZ
C B 0037 GLU OE2 11.98 H B 0032 LYS NZ
C B 0037 GLU OE1 7.491 C B 0038 ARG NH1
C B 0037 GLU OE1 9.249 C B 0038 ARG NH2
C B 0037 GLU OE2 5.798 C B 0038 ARG NH1
C B 0037 GLU OE2 7.728 C B 0038 ARG NH2
CHARGE_REPU 2.00 12.00 18
H B 0011 ARG NH1 8.371 H B 0015 ARG NH1
H B 0011 ARG NH1 10.31 H B 0015 ARG NH2
H B 0011 ARG NH2 8.603 H B 0015 ARG NH1
H B 0011 ARG NH2 10.58 H B 0015 ARG NH2
H B 0012 ARG NH1 5.186 H B 0013 LYS NZ
H B 0012 ARG NH2 6.893 H B 0013 LYS NZ
H B 0012 ARG NH1 8.320 H B 0015 ARG NH1
H B 0012 ARG NH1 8.811 H B 0015 ARG NH2
H B 0012 ARG NH2 8.646 H B 0015 ARG NH1
H B 0012 ARG NH2 9.365 H B 0015 ARG NH2
H B 0013 LYS NZ 10.36 H B 0015 ARG NH1
H B 0013 LYS NZ 11.23 H B 0015 ARG NH2
H B 0023 HIS ND1 10.14 H B 0030 ARG NH1
H B 0023 HIS ND1 11.91 H B 0030 ARG NH2
H B 0023 HIS NE2 10.21 H B 0030 ARG NH1
H B 0023 HIS NE2 11.71 H B 0030 ARG NH2
H B 0030 ARG NH1 8.488 H B 0033 LYS NZ
H B 0030 ARG NH2 9.018 H B 0033 LYS NZ
HB_MM 2.00 3.20 75
C B 0002 ALA N 2.261 C B 0001 GLY O
C B 0003 GLY N 2.261 C B 0002 ALA O
C B 0004 SER N 2.262 C B 0003 GLY O
C B 0005 SER N 2.261 C B 0004 SER O
H B 0006 SER N 2.262 C B 0005 SER O
H B 0007 LEU N 2.261 H B 0006 SER O
H B 0008 GLU N 2.262 H B 0007 LEU O
H B 0009 ALA N 2.261 H B 0008 GLU O
H B 0010 VAL N 2.996 H B 0006 SER O
H B 0010 VAL N 2.261 H B 0009 ALA O
H B 0011 ARG N 2.630 H B 0007 LEU O
H B 0011 ARG N 2.261 H B 0010 VAL O
H B 0012 ARG N 2.930 H B 0008 GLU O
H B 0012 ARG N 2.262 H B 0011 ARG O
H B 0013 LYS N 2.981 H B 0009 ALA O
H B 0013 LYS N 2.261 H B 0012 ARG O
H B 0014 ILE N 2.679 H B 0010 VAL O
H B 0014 ILE N 2.261 H B 0013 LYS O
H B 0015 ARG N 3.061 H B 0011 ARG O
H B 0015 ARG N 2.261 H B 0014 ILE O
H B 0016 SER N 2.909 H B 0012 ARG O
H B 0016 SER N 2.261 H B 0015 ARG O
H B 0017 LEU N 2.737 H B 0013 LYS O
H B 0017 LEU N 2.262 H B 0016 SER O
H B 0018 GLN N 2.803 H B 0014 ILE O
H B 0018 GLN N 3.199 H B 0016 SER O
H B 0018 GLN N 2.261 H B 0017 LEU O
H B 0019 GLU N 3.026 H B 0015 ARG O
H B 0019 GLU N 3.016 H B 0016 SER O
H B 0019 GLU N 2.261 H B 0018 GLN O
H B 0020 GLN N 2.987 H B 0016 SER O
H B 0020 GLN N 3.019 H B 0017 LEU O
H B 0020 GLN N 2.262 H B 0019 GLU O
H B 0021 ASN N 2.603 H B 0017 LEU O
H B 0021 ASN N 2.971 H B 0018 GLN O
H B 0021 ASN N 2.262 H B 0020 GLN O
H B 0022 TYR N 3.020 H B 0018 GLN O
H B 0022 TYR N 2.261 H B 0021 ASN O
H B 0023 HIS N 2.803 H B 0019 GLU O
H B 0023 HIS N 3.129 H B 0020 GLN O
H B 0023 HIS N 2.262 H B 0022 TYR O
H B 0024 LEU N 2.595 H B 0020 GLN O
H B 0024 LEU N 2.262 H B 0023 HIS O
H B 0025 GLU N 2.832 H B 0021 ASN O
H B 0025 GLU N 2.262 H B 0024 LEU O
H B 0026 ASN N 2.995 H B 0022 TYR O
H B 0026 ASN N 2.261 H B 0025 GLU O
H B 0027 GLU N 2.876 H B 0023 HIS O
H B 0027 GLU N 2.261 H B 0026 ASN O
H B 0028 VAL N 2.766 H B 0024 LEU O
H B 0028 VAL N 2.262 H B 0027 GLU O
H B 0029 ALA N 2.986 H B 0025 GLU O
H B 0029 ALA N 2.262 H B 0028 VAL O
H B 0030 ARG N 2.780 H B 0026 ASN O
H B 0030 ARG N 2.261 H B 0029 ALA O
H B 0031 LEU N 2.731 H B 0027 GLU O
H B 0031 LEU N 3.016 H B 0028 VAL O
H B 0031 LEU N 3.195 H B 0029 ALA O
H B 0031 LEU N 2.262 H B 0030 ARG O
H B 0032 LYS N 2.914 H B 0028 VAL O
H B 0032 LYS N 3.191 H B 0029 ALA O
H B 0032 LYS N 2.262 H B 0031 LEU O
H B 0033 LYS N 3.053 H B 0029 ALA O
H B 0033 LYS N 2.261 H B 0032 LYS O
H B 0034 LEU N 2.709 H B 0030 ARG O
H B 0034 LEU N 3.135 H B 0032 LYS O
H B 0034 LEU N 2.261 H B 0033 LYS O
H B 0035 VAL N 2.710 H B 0031 LEU O
H B 0035 VAL N 2.767 H B 0032 LYS O
H B 0035 VAL N 2.262 H B 0034 LEU O
H B 0036 GLY N 2.472 H B 0032 LYS O
H B 0036 GLY N 2.261 H B 0035 VAL O
C B 0037 GLU N 2.869 H B 0035 VAL O
C B 0037 GLU N 2.261 H B 0036 GLY O
C B 0038 ARG N 2.262 C B 0037 GLU O
HB_MS 2.00 3.20 3
C B 0005 SER O 2.895 H B 0006 SER OG
H B 0017 LEU O 2.477 H B 0021 ASN ND2
H B 0022 TYR O 2.489 H B 0026 ASN ND2