Complet list of 1yww con file
Complete list of 1yww.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 277
C A 0001 MET C 2.430 C A 0002 ASN CA
C A 0001 MET C 3.422 C A 0002 ASN C
C A 0001 MET C 3.524 C A 0002 ASN CB
C A 0002 ASN CA 3.791 C A 0003 SER CA
C A 0002 ASN C 2.427 C A 0003 SER CA
C A 0002 ASN C 3.636 C A 0003 SER C
C A 0002 ASN C 3.218 C A 0003 SER CB
C A 0003 SER CA 3.793 C A 0004 ASP CA
C A 0003 SER C 2.423 C A 0004 ASP CA
C A 0003 SER C 3.161 C A 0004 ASP C
C A 0003 SER C 3.674 C A 0004 ASP CB
C A 0004 ASP CA 3.789 C A 0005 VAL CA
C A 0004 ASP C 2.426 C A 0005 VAL CA
C A 0004 ASP C 3.198 C A 0005 VAL C
C A 0004 ASP C 3.684 C A 0005 VAL CB
C A 0004 ASP CB 3.478 C A 0007 LYS CE
C A 0004 ASP CG 3.657 C A 0007 LYS CG
C A 0005 VAL CA 3.782 C A 0006 ILE CA
C A 0005 VAL C 2.425 C A 0006 ILE CA
C A 0005 VAL C 3.096 C A 0006 ILE C
C A 0005 VAL C 3.711 C A 0006 ILE CB
C A 0006 ILE C 2.442 C A 0007 LYS CA
C A 0006 ILE C 3.052 C A 0007 LYS C
C A 0006 ILE C 3.727 C A 0007 LYS CB
C A 0006 ILE CG2 3.483 H A 0010 TRP CE3
C A 0006 ILE CG2 3.620 H A 0010 TRP CZ3
C A 0006 ILE CG2 3.688 H A 0039 LEU CD1
C A 0006 ILE CD1 3.739 H A 0058 VAL CG1
C A 0007 LYS CA 3.791 C A 0008 GLY CA
C A 0007 LYS C 2.414 C A 0008 GLY CA
C A 0007 LYS C 3.107 C A 0008 GLY C
C A 0007 LYS CB 3.636 H A 0035 HIS CA
C A 0007 LYS CB 3.659 H A 0035 HIS CB
C A 0008 GLY CA 3.790 H A 0009 LYS CA
C A 0008 GLY C 2.433 H A 0009 LYS CA
C A 0008 GLY C 3.338 H A 0009 LYS C
C A 0008 GLY C 3.593 H A 0009 LYS CB
H A 0009 LYS C 2.441 H A 0010 TRP CA
H A 0009 LYS C 3.010 H A 0010 TRP C
H A 0009 LYS C 3.710 H A 0010 TRP CB
H A 0009 LYS C 3.746 H A 0013 LEU CG
H A 0009 LYS CB 3.698 H A 0013 LEU CG
H A 0010 TRP C 2.429 H A 0011 LYS CA
H A 0010 TRP C 3.087 H A 0011 LYS C
H A 0010 TRP C 3.697 H A 0011 LYS CB
H A 0010 TRP CZ3 3.278 H A 0017 ILE CD1
H A 0010 TRP CH2 3.792 H A 0017 ILE CD1
H A 0010 TRP CZ2 3.775 H A 0029 LEU CA
H A 0010 TRP CZ2 3.618 H A 0029 LEU C
H A 0010 TRP CG 3.571 C A 0034 GLY CA
H A 0010 TRP CD1 3.651 C A 0034 GLY CA
H A 0010 TRP CD2 3.368 C A 0034 GLY CA
H A 0010 TRP CE2 3.340 C A 0034 GLY CA
H A 0010 TRP CZ3 3.393 H A 0039 LEU CD1
H A 0010 TRP CH2 3.775 H A 0039 LEU CD1
H A 0011 LYS C 2.427 H A 0012 GLN CA
H A 0011 LYS C 3.287 H A 0012 GLN C
H A 0011 LYS C 3.607 H A 0012 GLN CB
H A 0012 GLN C 2.439 H A 0013 LEU CA
H A 0012 GLN C 3.158 H A 0013 LEU C
H A 0012 GLN C 3.698 H A 0013 LEU CB
H A 0013 LEU C 2.448 H A 0014 THR CA
H A 0013 LEU C 2.942 H A 0014 THR C
H A 0013 LEU C 3.726 H A 0014 THR CB
H A 0013 LEU CD1 3.685 C A 0065 LEU CD1
H A 0013 LEU CD2 3.580 C A 0065 LEU CD2
H A 0014 THR CA 3.794 H A 0015 GLY CA
H A 0014 THR C 2.420 H A 0015 GLY CA
H A 0014 THR C 3.031 H A 0015 GLY C
H A 0015 GLY CA 3.794 H A 0016 LYS CA
H A 0015 GLY C 2.430 H A 0016 LYS CA
H A 0015 GLY C 3.106 H A 0016 LYS C
H A 0015 GLY C 3.698 H A 0016 LYS CB
H A 0016 LYS CA 3.797 H A 0017 ILE CA
H A 0016 LYS C 2.429 H A 0017 ILE CA
H A 0016 LYS C 3.082 H A 0017 ILE C
H A 0016 LYS C 3.722 H A 0017 ILE CB
H A 0016 LYS C 3.785 H A 0061 PHE CE1
H A 0017 ILE C 2.438 H A 0018 LYS CA
H A 0017 ILE C 3.019 H A 0018 LYS C
H A 0017 ILE C 3.721 H A 0018 LYS CB
H A 0017 ILE CG2 3.476 H A 0021 TRP CE3
H A 0017 ILE CG2 3.768 H A 0021 TRP CZ3
H A 0017 ILE CG2 3.725 C A 0024 LEU CD1
H A 0017 ILE CG2 3.667 H A 0029 LEU CD1
H A 0017 ILE CG1 3.627 H A 0061 PHE CE2
H A 0017 ILE CG1 3.503 H A 0061 PHE CZ
H A 0018 LYS CA 3.795 H A 0019 GLU CA
H A 0018 LYS C 2.425 H A 0019 GLU CA
H A 0018 LYS C 3.090 H A 0019 GLU C
H A 0018 LYS C 3.691 H A 0019 GLU CB
H A 0018 LYS CD 3.565 H A 0026 ASP CB
H A 0019 GLU C 2.437 H A 0020 ARG CA
H A 0019 GLU C 3.035 H A 0020 ARG C
H A 0019 GLU C 3.706 H A 0020 ARG CB
H A 0020 ARG CA 3.795 H A 0021 TRP CA
H A 0020 ARG C 2.429 H A 0021 TRP CA
H A 0020 ARG C 3.480 H A 0021 TRP C
H A 0020 ARG C 3.473 H A 0021 TRP CB
H A 0020 ARG C 3.587 H A 0021 TRP CG
H A 0021 TRP CA 3.791 C A 0022 GLY CA
H A 0021 TRP C 2.425 C A 0022 GLY CA
H A 0021 TRP C 3.077 C A 0022 GLY C
H A 0021 TRP CB 3.719 C A 0024 LEU CG
H A 0021 TRP CB 3.673 C A 0024 LEU CD1
H A 0021 TRP CE3 3.456 C A 0024 LEU CD1
H A 0021 TRP CZ2 3.594 H A 0057 GLU C
H A 0021 TRP CZ2 3.553 H A 0057 GLU CB
C A 0022 GLY CA 3.797 C A 0023 ASP CA
C A 0022 GLY C 2.428 C A 0023 ASP CA
C A 0022 GLY C 3.107 C A 0023 ASP C
C A 0022 GLY C 3.698 C A 0023 ASP CB
C A 0023 ASP C 2.427 C A 0024 LEU CA
C A 0023 ASP C 3.139 C A 0024 LEU C
C A 0023 ASP C 3.691 C A 0024 LEU CB
C A 0023 ASP CB 3.669 H A 0047 TYR CZ
C A 0024 LEU CA 3.783 H A 0025 THR CA
C A 0024 LEU C 2.427 H A 0025 THR CA
C A 0024 LEU C 3.160 H A 0025 THR C
C A 0024 LEU C 3.688 H A 0025 THR CB
C A 0024 LEU CD1 3.774 H A 0043 LEU CD2
C A 0024 LEU CD2 3.726 H A 0046 ARG CG
H A 0025 THR C 2.450 H A 0026 ASP CA
H A 0025 THR C 2.989 H A 0026 ASP C
H A 0025 THR C 3.730 H A 0026 ASP CB
H A 0026 ASP C 2.448 H A 0027 ASP CA
H A 0026 ASP C 3.004 H A 0027 ASP C
H A 0026 ASP C 3.725 H A 0027 ASP CB
H A 0027 ASP C 2.442 H A 0028 ASP CA
H A 0027 ASP C 3.108 H A 0028 ASP C
H A 0027 ASP C 3.710 H A 0028 ASP CB
H A 0028 ASP CA 3.781 H A 0029 LEU CA
H A 0028 ASP C 2.422 H A 0029 LEU CA
H A 0028 ASP C 3.043 H A 0029 LEU C
H A 0028 ASP C 3.695 H A 0029 LEU CB
H A 0029 LEU C 2.443 H A 0030 GLN CA
H A 0029 LEU C 3.157 H A 0030 GLN C
H A 0029 LEU C 3.683 H A 0030 GLN CB
H A 0030 GLN C 2.434 C A 0031 ALA CA
H A 0030 GLN C 3.373 C A 0031 ALA C
H A 0030 GLN C 3.582 C A 0031 ALA CB
C A 0031 ALA C 2.431 C A 0032 ALA CA
C A 0031 ALA C 3.654 C A 0032 ALA C
C A 0031 ALA C 3.295 C A 0032 ALA CB
C A 0032 ALA C 2.465 C A 0033 ASP CA
C A 0032 ALA C 3.013 C A 0033 ASP C
C A 0032 ALA C 3.736 C A 0033 ASP CB
C A 0033 ASP CA 3.792 C A 0034 GLY CA
C A 0033 ASP C 2.415 C A 0034 GLY CA
C A 0033 ASP C 3.190 C A 0034 GLY C
C A 0033 ASP CB 3.765 H A 0038 TYR CB
C A 0033 ASP CB 3.679 H A 0038 TYR CG
C A 0033 ASP CB 3.450 H A 0038 TYR CD1
C A 0034 GLY C 2.465 H A 0035 HIS CA
C A 0034 GLY C 3.010 H A 0035 HIS C
C A 0034 GLY C 3.735 H A 0035 HIS CB
H A 0035 HIS C 2.475 H A 0036 ALA CA
H A 0035 HIS C 3.007 H A 0036 ALA C
H A 0035 HIS C 3.718 H A 0036 ALA CB
H A 0035 HIS CD2 3.655 H A 0037 GLU CB
H A 0036 ALA C 2.439 H A 0037 GLU CA
H A 0036 ALA C 3.041 H A 0037 GLU C
H A 0036 ALA C 3.717 H A 0037 GLU CB
H A 0036 ALA CA 3.730 H A 0039 LEU CD1
H A 0037 GLU C 2.423 H A 0038 TYR CA
H A 0037 GLU C 3.151 H A 0038 TYR C
H A 0037 GLU C 3.684 H A 0038 TYR CB
H A 0037 GLU CD 3.774 H A 0051 LYS CE
H A 0038 TYR C 2.434 H A 0039 LEU CA
H A 0038 TYR C 2.967 H A 0039 LEU C
H A 0038 TYR C 3.746 H A 0039 LEU CB
H A 0038 TYR CZ 3.743 H A 0042 LYS CE
H A 0039 LEU CA 3.787 H A 0040 VAL CA
H A 0039 LEU C 2.436 H A 0040 VAL CA
H A 0039 LEU C 2.956 H A 0040 VAL C
H A 0039 LEU C 3.742 H A 0040 VAL CB
H A 0040 VAL CA 3.792 H A 0041 GLY CA
H A 0040 VAL C 2.420 H A 0041 GLY CA
H A 0040 VAL C 3.002 H A 0041 GLY C
H A 0040 VAL CG1 3.651 H A 0051 LYS CG
H A 0041 GLY C 2.433 H A 0042 LYS CA
H A 0041 GLY C 3.115 H A 0042 LYS C
H A 0041 GLY C 3.704 H A 0042 LYS CB
H A 0042 LYS C 2.432 H A 0043 LEU CA
H A 0042 LYS C 3.024 H A 0043 LEU C
H A 0042 LYS C 3.720 H A 0043 LEU CB
H A 0043 LEU CA 3.798 H A 0044 GLN CA
H A 0043 LEU C 2.433 H A 0044 GLN CA
H A 0043 LEU C 3.103 H A 0044 GLN C
H A 0043 LEU C 3.702 H A 0044 GLN CB
H A 0043 LEU CD2 3.763 H A 0047 TYR CD2
H A 0043 LEU CD2 3.669 H A 0047 TYR CE2
H A 0043 LEU CD1 3.730 H A 0058 VAL CG2
H A 0044 GLN CA 3.797 H A 0045 GLU CA
H A 0044 GLN C 2.436 H A 0045 GLU CA
H A 0044 GLN C 3.048 H A 0045 GLU C
H A 0044 GLN C 3.708 H A 0045 GLU CB
H A 0045 GLU CA 3.799 H A 0046 ARG CA
H A 0045 GLU C 2.429 H A 0046 ARG CA
H A 0045 GLU C 3.151 H A 0046 ARG C
H A 0045 GLU C 3.685 H A 0046 ARG CB
H A 0046 ARG C 2.427 H A 0047 TYR CA
H A 0046 ARG C 3.162 H A 0047 TYR C
H A 0046 ARG C 3.684 H A 0047 TYR CB
H A 0047 TYR CA 3.782 C A 0048 GLY CA
H A 0047 TYR C 2.414 C A 0048 GLY CA
H A 0047 TYR C 3.375 C A 0048 GLY C
H A 0047 TYR CB 3.593 C A 0049 TRP CE2
H A 0047 TYR CG 3.673 C A 0049 TRP CE2
H A 0047 TYR CG 3.536 C A 0049 TRP CZ2
H A 0047 TYR CD1 3.627 C A 0049 TRP CZ2
H A 0047 TYR CD2 3.779 C A 0049 TRP CZ2
C A 0048 GLY CA 3.791 C A 0049 TRP CA
C A 0048 GLY C 2.433 C A 0049 TRP CA
C A 0048 GLY C 3.347 C A 0049 TRP C
C A 0048 GLY C 3.599 C A 0049 TRP CB
C A 0048 GLY C 3.716 C A 0049 TRP CD1
C A 0049 TRP CA 3.762 H A 0050 SER CA
C A 0049 TRP C 2.411 H A 0050 SER CA
C A 0049 TRP C 3.154 H A 0050 SER C
C A 0049 TRP C 3.643 H A 0050 SER CB
C A 0049 TRP CB 3.792 H A 0053 ARG CD
C A 0049 TRP CG 3.783 H A 0053 ARG CD
C A 0049 TRP CD1 3.394 H A 0053 ARG CZ
C A 0049 TRP CZ3 3.691 H A 0057 GLU CG
H A 0050 SER C 2.426 H A 0051 LYS CA
H A 0050 SER C 2.975 H A 0051 LYS C
H A 0050 SER C 3.734 H A 0051 LYS CB
H A 0051 LYS C 2.431 H A 0052 GLU CA
H A 0051 LYS C 3.014 H A 0052 GLU C
H A 0051 LYS C 3.693 H A 0052 GLU CB
H A 0052 GLU C 2.434 H A 0053 ARG CA
H A 0052 GLU C 3.042 H A 0053 ARG C
H A 0052 GLU C 3.702 H A 0053 ARG CB
H A 0053 ARG CA 3.798 H A 0054 ALA CA
H A 0053 ARG C 2.433 H A 0054 ALA CA
H A 0053 ARG C 3.009 H A 0054 ALA C
H A 0053 ARG C 3.706 H A 0054 ALA CB
H A 0054 ALA C 2.452 H A 0055 GLU CA
H A 0054 ALA C 2.962 H A 0055 GLU C
H A 0054 ALA C 3.736 H A 0055 GLU CB
H A 0055 GLU C 2.438 H A 0056 GLN CA
H A 0055 GLU C 3.010 H A 0056 GLN C
H A 0055 GLU C 3.717 H A 0056 GLN CB
H A 0055 GLU CB 3.698 H A 0059 ARG CZ
H A 0056 GLN CA 3.799 H A 0057 GLU CA
H A 0056 GLN C 2.426 H A 0057 GLU CA
H A 0056 GLN C 3.098 H A 0057 GLU C
H A 0056 GLN C 3.692 H A 0057 GLU CB
H A 0057 GLU C 2.436 H A 0058 VAL CA
H A 0057 GLU C 3.034 H A 0058 VAL C
H A 0057 GLU C 3.744 H A 0058 VAL CB
H A 0057 GLU C 3.784 H A 0060 ASP CB
H A 0058 VAL C 2.431 H A 0059 ARG CA
H A 0058 VAL C 3.086 H A 0059 ARG C
H A 0058 VAL C 3.698 H A 0059 ARG CB
H A 0059 ARG CA 3.787 H A 0060 ASP CA
H A 0059 ARG C 2.428 H A 0060 ASP CA
H A 0059 ARG C 3.000 H A 0060 ASP C
H A 0059 ARG C 3.714 H A 0060 ASP CB
H A 0060 ASP CA 3.794 H A 0061 PHE CA
H A 0060 ASP C 2.430 H A 0061 PHE CA
H A 0060 ASP C 3.023 H A 0061 PHE C
H A 0060 ASP C 3.713 H A 0061 PHE CB
H A 0061 PHE C 2.434 H A 0062 SER CA
H A 0061 PHE C 3.036 H A 0062 SER C
H A 0061 PHE C 3.708 H A 0062 SER CB
H A 0062 SER C 2.439 H A 0063 ASP CA
H A 0062 SER C 3.070 H A 0063 ASP C
H A 0062 SER C 3.703 H A 0063 ASP CB
H A 0063 ASP CA 3.798 H A 0064 ARG CA
H A 0063 ASP C 2.441 H A 0064 ARG CA
H A 0063 ASP C 3.175 H A 0064 ARG C
H A 0063 ASP C 3.673 H A 0064 ARG CB
H A 0064 ARG C 2.429 C A 0065 LEU CA
H A 0064 ARG C 3.283 C A 0065 LEU C
H A 0064 ARG C 3.622 C A 0065 LEU CB
CHARGE_ATTR 2.00 12.00 116
C A 0004 ASP OD1 4.991 C A 0007 LYS NZ
C A 0004 ASP OD2 5.828 C A 0007 LYS NZ
C A 0004 ASP OD1 6.542 H A 0035 HIS ND1
C A 0004 ASP OD1 7.360 H A 0035 HIS NE2
C A 0004 ASP OD2 5.501 H A 0035 HIS ND1
C A 0004 ASP OD2 5.744 H A 0035 HIS NE2
C A 0004 ASP OD2 10.70 H A 0051 LYS NZ
C A 0004 ASP OD1 11.89 H A 0059 ARG NH1
C A 0004 ASP OD2 10.65 H A 0059 ARG NH1
H A 0019 GLU OE1 8.954 H A 0016 LYS NZ
H A 0019 GLU OE2 8.530 H A 0016 LYS NZ
H A 0019 GLU OE1 11.45 H A 0018 LYS NZ
H A 0019 GLU OE2 11.93 H A 0018 LYS NZ
H A 0019 GLU OE1 3.325 H A 0020 ARG NH1
H A 0019 GLU OE1 4.867 H A 0020 ARG NH2
H A 0019 GLU OE2 4.578 H A 0020 ARG NH1
H A 0019 GLU OE2 6.141 H A 0020 ARG NH2
H A 0019 GLU OE1 2.586 H A 0064 ARG NH1
H A 0019 GLU OE1 3.208 H A 0064 ARG NH2
H A 0019 GLU OE2 3.650 H A 0064 ARG NH1
H A 0019 GLU OE2 2.687 H A 0064 ARG NH2
C A 0023 ASP OD1 11.63 H A 0018 LYS NZ
C A 0023 ASP OD1 11.85 H A 0042 LYS NZ
C A 0023 ASP OD2 10.40 H A 0042 LYS NZ
C A 0023 ASP OD1 4.752 H A 0046 ARG NH1
C A 0023 ASP OD1 2.655 H A 0046 ARG NH2
C A 0023 ASP OD2 4.706 H A 0046 ARG NH1
C A 0023 ASP OD2 3.277 H A 0046 ARG NH2
C A 0023 ASP OD1 11.83 H A 0053 ARG NH2
C A 0023 ASP OD2 11.91 H A 0053 ARG NH1
C A 0023 ASP OD2 10.84 H A 0053 ARG NH2
H A 0026 ASP OD1 10.07 H A 0011 LYS NZ
H A 0026 ASP OD2 9.384 H A 0011 LYS NZ
H A 0026 ASP OD1 10.45 H A 0016 LYS NZ
H A 0026 ASP OD1 5.598 H A 0018 LYS NZ
H A 0026 ASP OD2 5.729 H A 0018 LYS NZ
H A 0026 ASP OD2 11.82 H A 0042 LYS NZ
H A 0027 ASP OD2 11.53 H A 0011 LYS NZ
H A 0027 ASP OD1 6.000 H A 0018 LYS NZ
H A 0027 ASP OD2 7.817 H A 0018 LYS NZ
H A 0027 ASP OD1 10.36 H A 0042 LYS NZ
H A 0027 ASP OD2 10.84 H A 0042 LYS NZ
H A 0027 ASP OD1 11.65 H A 0046 ARG NH1
H A 0028 ASP OD1 9.988 H A 0018 LYS NZ
H A 0028 ASP OD2 11.90 H A 0018 LYS NZ
H A 0028 ASP OD1 4.858 H A 0042 LYS NZ
H A 0028 ASP OD2 2.750 H A 0042 LYS NZ
H A 0028 ASP OD1 7.557 H A 0046 ARG NH1
H A 0028 ASP OD1 9.010 H A 0046 ARG NH2
H A 0028 ASP OD2 7.549 H A 0046 ARG NH1
H A 0028 ASP OD2 9.222 H A 0046 ARG NH2
C A 0033 ASP OD1 5.939 H A 0035 HIS ND1
C A 0033 ASP OD1 6.853 H A 0035 HIS NE2
C A 0033 ASP OD2 4.655 H A 0035 HIS ND1
C A 0033 ASP OD2 5.244 H A 0035 HIS NE2
C A 0033 ASP OD1 8.691 H A 0042 LYS NZ
C A 0033 ASP OD2 10.57 H A 0042 LYS NZ
H A 0037 GLU OE1 7.818 H A 0035 HIS ND1
H A 0037 GLU OE1 6.235 H A 0035 HIS NE2
H A 0037 GLU OE2 7.910 H A 0035 HIS ND1
H A 0037 GLU OE2 5.997 H A 0035 HIS NE2
H A 0037 GLU OE1 3.304 H A 0051 LYS NZ
H A 0037 GLU OE2 2.674 H A 0051 LYS NZ
H A 0037 GLU OE1 8.216 H A 0059 ARG NH1
H A 0037 GLU OE1 9.918 H A 0059 ARG NH2
H A 0037 GLU OE2 9.984 H A 0059 ARG NH1
H A 0037 GLU OE2 11.66 H A 0059 ARG NH2
H A 0045 GLU OE1 2.734 H A 0042 LYS NZ
H A 0045 GLU OE2 3.317 H A 0042 LYS NZ
H A 0045 GLU OE1 8.249 H A 0046 ARG NH1
H A 0045 GLU OE1 10.01 H A 0046 ARG NH2
H A 0045 GLU OE2 6.303 H A 0046 ARG NH1
H A 0045 GLU OE2 8.216 H A 0046 ARG NH2
H A 0052 GLU OE1 11.83 H A 0051 LYS NZ
H A 0052 GLU OE2 11.40 H A 0051 LYS NZ
H A 0052 GLU OE1 10.41 H A 0053 ARG NH1
H A 0052 GLU OE1 11.83 H A 0053 ARG NH2
H A 0052 GLU OE1 9.392 H A 0059 ARG NH1
H A 0052 GLU OE1 7.850 H A 0059 ARG NH2
H A 0052 GLU OE2 8.117 H A 0059 ARG NH1
H A 0052 GLU OE2 6.675 H A 0059 ARG NH2
H A 0055 GLU OE1 6.665 H A 0051 LYS NZ
H A 0055 GLU OE2 5.383 H A 0051 LYS NZ
H A 0055 GLU OE1 2.865 H A 0059 ARG NH1
H A 0055 GLU OE1 3.951 H A 0059 ARG NH2
H A 0055 GLU OE2 4.948 H A 0059 ARG NH1
H A 0055 GLU OE2 5.518 H A 0059 ARG NH2
H A 0057 GLU OE1 9.745 H A 0020 ARG NH1
H A 0057 GLU OE1 8.775 H A 0020 ARG NH2
H A 0057 GLU OE2 11.28 H A 0020 ARG NH1
H A 0057 GLU OE2 10.56 H A 0020 ARG NH2
H A 0057 GLU OE1 8.430 H A 0053 ARG NH1
H A 0057 GLU OE1 6.948 H A 0053 ARG NH2
H A 0057 GLU OE2 8.625 H A 0053 ARG NH1
H A 0057 GLU OE2 7.646 H A 0053 ARG NH2
H A 0057 GLU OE1 11.74 H A 0059 ARG NH1
H A 0057 GLU OE1 10.48 H A 0059 ARG NH2
H A 0057 GLU OE2 9.924 H A 0059 ARG NH1
H A 0057 GLU OE2 8.471 H A 0059 ARG NH2
H A 0057 GLU OE1 11.49 H A 0064 ARG NH1
H A 0060 ASP OD1 7.801 H A 0020 ARG NH1
H A 0060 ASP OD1 7.997 H A 0020 ARG NH2
H A 0060 ASP OD2 6.288 H A 0020 ARG NH1
H A 0060 ASP OD2 6.672 H A 0020 ARG NH2
H A 0060 ASP OD1 11.80 H A 0059 ARG NH1
H A 0060 ASP OD1 10.80 H A 0059 ARG NH2
H A 0060 ASP OD2 11.40 H A 0059 ARG NH2
H A 0060 ASP OD1 8.877 H A 0064 ARG NH1
H A 0060 ASP OD1 10.17 H A 0064 ARG NH2
H A 0060 ASP OD2 7.150 H A 0064 ARG NH1
H A 0060 ASP OD2 8.748 H A 0064 ARG NH2
H A 0063 ASP OD2 10.56 H A 0020 ARG NH1
H A 0063 ASP OD2 11.74 H A 0020 ARG NH2
H A 0063 ASP OD1 11.64 H A 0059 ARG NH2
H A 0063 ASP OD2 10.29 H A 0064 ARG NH1
H A 0063 ASP OD2 10.86 H A 0064 ARG NH2
CHARGE_REPU 2.00 12.00 86
C A 0004 ASP OD1 11.92 C A 0033 ASP OD1
C A 0004 ASP OD1 11.07 C A 0033 ASP OD2
C A 0004 ASP OD2 11.24 C A 0033 ASP OD1
C A 0004 ASP OD2 10.15 C A 0033 ASP OD2
C A 0004 ASP OD1 9.522 H A 0037 GLU OE1
C A 0004 ASP OD1 10.82 H A 0037 GLU OE2
C A 0004 ASP OD2 7.500 H A 0037 GLU OE1
C A 0004 ASP OD2 8.708 H A 0037 GLU OE2
C A 0004 ASP OD2 11.05 H A 0055 GLU OE1
C A 0007 LYS NZ 8.412 H A 0035 HIS ND1
C A 0007 LYS NZ 9.214 H A 0035 HIS NE2
H A 0009 LYS NZ 9.425 H A 0016 LYS NZ
H A 0016 LYS NZ 11.35 H A 0020 ARG NH1
H A 0016 LYS NZ 8.265 H A 0064 ARG NH1
H A 0016 LYS NZ 8.222 H A 0064 ARG NH2
H A 0019 GLU OE1 11.50 H A 0026 ASP OD1
H A 0019 GLU OE1 10.58 H A 0060 ASP OD1
H A 0019 GLU OE1 8.768 H A 0060 ASP OD2
H A 0019 GLU OE2 11.99 H A 0060 ASP OD1
H A 0019 GLU OE2 10.37 H A 0060 ASP OD2
H A 0020 ARG NH1 3.155 H A 0064 ARG NH1
H A 0020 ARG NH1 3.931 H A 0064 ARG NH2
H A 0020 ARG NH2 5.368 H A 0064 ARG NH1
H A 0020 ARG NH2 6.071 H A 0064 ARG NH2
C A 0023 ASP OD1 9.993 H A 0028 ASP OD1
C A 0023 ASP OD1 10.42 H A 0028 ASP OD2
C A 0023 ASP OD2 9.322 H A 0028 ASP OD1
C A 0023 ASP OD2 9.371 H A 0028 ASP OD2
C A 0023 ASP OD1 11.48 H A 0045 GLU OE1
C A 0023 ASP OD1 9.890 H A 0045 GLU OE2
C A 0023 ASP OD2 9.920 H A 0045 GLU OE1
C A 0023 ASP OD2 8.602 H A 0045 GLU OE2
H A 0026 ASP OD1 6.410 H A 0027 ASP OD1
H A 0026 ASP OD1 7.383 H A 0027 ASP OD2
H A 0026 ASP OD2 4.769 H A 0027 ASP OD1
H A 0026 ASP OD2 5.359 H A 0027 ASP OD2
H A 0026 ASP OD1 9.482 H A 0028 ASP OD1
H A 0026 ASP OD1 10.86 H A 0028 ASP OD2
H A 0026 ASP OD2 8.692 H A 0028 ASP OD1
H A 0026 ASP OD2 10.26 H A 0028 ASP OD2
H A 0027 ASP OD1 5.938 H A 0028 ASP OD1
H A 0027 ASP OD1 8.020 H A 0028 ASP OD2
H A 0027 ASP OD2 6.792 H A 0028 ASP OD1
H A 0027 ASP OD2 8.681 H A 0028 ASP OD2
H A 0027 ASP OD1 11.24 H A 0045 GLU OE2
H A 0028 ASP OD2 10.99 C A 0033 ASP OD1
H A 0028 ASP OD1 6.648 H A 0045 GLU OE1
H A 0028 ASP OD1 5.314 H A 0045 GLU OE2
H A 0028 ASP OD2 4.512 H A 0045 GLU OE1
H A 0028 ASP OD2 3.498 H A 0045 GLU OE2
C A 0033 ASP OD1 11.51 H A 0037 GLU OE1
C A 0033 ASP OD1 11.03 H A 0037 GLU OE2
C A 0033 ASP OD2 10.45 H A 0037 GLU OE1
C A 0033 ASP OD2 9.784 H A 0037 GLU OE2
C A 0033 ASP OD1 9.832 H A 0045 GLU OE1
C A 0033 ASP OD1 11.63 H A 0045 GLU OE2
C A 0033 ASP OD2 11.44 H A 0045 GLU OE1
H A 0035 HIS ND1 10.48 H A 0051 LYS NZ
H A 0035 HIS NE2 8.640 H A 0051 LYS NZ
H A 0037 GLU OE1 6.612 H A 0055 GLU OE1
H A 0037 GLU OE1 6.249 H A 0055 GLU OE2
H A 0037 GLU OE2 8.039 H A 0055 GLU OE1
H A 0037 GLU OE2 7.330 H A 0055 GLU OE2
H A 0042 LYS NZ 9.025 H A 0046 ARG NH1
H A 0042 LYS NZ 10.69 H A 0046 ARG NH2
H A 0051 LYS NZ 9.119 H A 0059 ARG NH1
H A 0051 LYS NZ 10.44 H A 0059 ARG NH2
H A 0052 GLU OE1 8.193 H A 0055 GLU OE1
H A 0052 GLU OE1 7.303 H A 0055 GLU OE2
H A 0052 GLU OE2 7.027 H A 0055 GLU OE1
H A 0052 GLU OE2 6.516 H A 0055 GLU OE2
H A 0052 GLU OE1 10.53 H A 0057 GLU OE2
H A 0052 GLU OE2 11.15 H A 0057 GLU OE2
H A 0055 GLU OE1 10.94 H A 0057 GLU OE2
H A 0055 GLU OE2 11.30 H A 0057 GLU OE2
H A 0057 GLU OE1 6.029 H A 0060 ASP OD1
H A 0057 GLU OE1 5.728 H A 0060 ASP OD2
H A 0057 GLU OE2 5.984 H A 0060 ASP OD1
H A 0057 GLU OE2 6.213 H A 0060 ASP OD2
H A 0057 GLU OE1 11.82 H A 0063 ASP OD2
H A 0057 GLU OE2 11.75 H A 0063 ASP OD1
H A 0057 GLU OE2 11.37 H A 0063 ASP OD2
H A 0060 ASP OD1 7.004 H A 0063 ASP OD1
H A 0060 ASP OD1 5.891 H A 0063 ASP OD2
H A 0060 ASP OD2 8.113 H A 0063 ASP OD1
H A 0060 ASP OD2 6.873 H A 0063 ASP OD2
HB_MM 2.00 3.20 119
C A 0002 ASN N 2.246 C A 0001 MET O
C A 0003 SER N 2.244 C A 0002 ASN O
C A 0004 ASP N 2.248 C A 0003 SER O
C A 0005 VAL N 3.077 C A 0003 SER O
C A 0005 VAL N 2.245 C A 0004 ASP O
C A 0006 ILE N 2.253 C A 0005 VAL O
C A 0007 LYS N 2.249 C A 0006 ILE O
C A 0008 GLY N 2.245 C A 0007 LYS O
H A 0009 LYS N 2.245 C A 0008 GLY O
H A 0010 TRP N 2.909 C A 0006 ILE O
H A 0010 TRP N 2.247 H A 0009 LYS O
H A 0011 LYS N 2.243 H A 0010 TRP O
H A 0012 GLN N 2.953 H A 0009 LYS O
H A 0012 GLN N 2.987 H A 0010 TRP O
H A 0012 GLN N 2.244 H A 0011 LYS O
H A 0013 LEU N 2.685 H A 0009 LYS O
H A 0013 LEU N 3.035 H A 0010 TRP O
H A 0013 LEU N 2.252 H A 0012 GLN O
H A 0014 THR N 2.926 H A 0010 TRP O
H A 0014 THR N 2.252 H A 0013 LEU O
H A 0015 GLY N 3.193 H A 0013 LEU O
H A 0015 GLY N 2.250 H A 0014 THR O
H A 0016 LYS N 2.855 H A 0013 LEU O
H A 0016 LYS N 2.246 H A 0015 GLY O
H A 0017 ILE N 2.737 H A 0013 LEU O
H A 0017 ILE N 3.163 H A 0014 THR O
H A 0017 ILE N 2.244 H A 0016 LYS O
H A 0018 LYS N 2.888 H A 0014 THR O
H A 0018 LYS N 2.252 H A 0017 ILE O
H A 0019 GLU N 2.989 H A 0015 GLY O
H A 0019 GLU N 2.247 H A 0018 LYS O
H A 0020 ARG N 2.842 H A 0016 LYS O
H A 0020 ARG N 3.167 H A 0017 ILE O
H A 0020 ARG N 2.251 H A 0019 GLU O
H A 0021 TRP N 2.698 H A 0017 ILE O
H A 0021 TRP N 2.247 H A 0020 ARG O
C A 0022 GLY N 2.249 H A 0021 TRP O
C A 0023 ASP N 2.244 C A 0022 GLY O
C A 0024 LEU N 3.068 H A 0021 TRP O
C A 0024 LEU N 2.247 C A 0023 ASP O
H A 0025 THR N 2.247 C A 0024 LEU O
H A 0026 ASP N 2.254 H A 0025 THR O
H A 0027 ASP N 2.255 H A 0026 ASP O
H A 0028 ASP N 3.019 H A 0025 THR O
H A 0028 ASP N 2.249 H A 0027 ASP O
H A 0029 LEU N 3.002 H A 0025 THR O
H A 0029 LEU N 3.033 H A 0026 ASP O
H A 0029 LEU N 2.244 H A 0028 ASP O
H A 0030 GLN N 2.781 H A 0026 ASP O
H A 0030 GLN N 2.246 H A 0029 LEU O
C A 0031 ALA N 2.654 H A 0029 LEU O
C A 0031 ALA N 2.247 H A 0030 GLN O
C A 0032 ALA N 2.249 C A 0031 ALA O
C A 0033 ASP N 2.259 C A 0032 ALA O
C A 0034 GLY N 3.193 C A 0032 ALA O
C A 0034 GLY N 2.243 C A 0033 ASP O
H A 0035 HIS N 2.701 C A 0033 ASP O
H A 0035 HIS N 2.254 C A 0034 GLY O
H A 0036 ALA N 2.258 H A 0035 HIS O
H A 0037 GLU N 2.947 H A 0035 HIS O
H A 0037 GLU N 2.248 H A 0036 ALA O
H A 0038 TYR N 2.658 H A 0035 HIS O
H A 0038 TYR N 3.044 H A 0036 ALA O
H A 0038 TYR N 2.245 H A 0037 GLU O
H A 0039 LEU N 2.962 H A 0036 ALA O
H A 0039 LEU N 2.256 H A 0038 TYR O
H A 0040 VAL N 3.192 H A 0036 ALA O
H A 0040 VAL N 2.255 H A 0039 LEU O
H A 0041 GLY N 3.162 H A 0037 GLU O
H A 0041 GLY N 2.249 H A 0040 VAL O
H A 0042 LYS N 2.978 H A 0038 TYR O
H A 0042 LYS N 3.141 H A 0039 LEU O
H A 0042 LYS N 2.249 H A 0041 GLY O
H A 0043 LEU N 2.744 H A 0039 LEU O
H A 0043 LEU N 3.200 H A 0040 VAL O
H A 0043 LEU N 2.246 H A 0042 LYS O
H A 0044 GLN N 2.846 H A 0040 VAL O
H A 0044 GLN N 2.247 H A 0043 LEU O
H A 0045 GLU N 2.817 H A 0041 GLY O
H A 0045 GLU N 2.250 H A 0044 GLN O
H A 0046 ARG N 2.735 H A 0042 LYS O
H A 0046 ARG N 2.247 H A 0045 GLU O
H A 0047 TYR N 2.940 H A 0043 LEU O
H A 0047 TYR N 2.244 H A 0046 ARG O
C A 0048 GLY N 2.798 H A 0043 LEU O
C A 0048 GLY N 2.246 H A 0047 TYR O
C A 0049 TRP N 2.247 C A 0048 GLY O
H A 0050 SER N 2.241 C A 0049 TRP O
H A 0051 LYS N 2.249 H A 0050 SER O
H A 0052 GLU N 2.237 H A 0051 LYS O
H A 0053 ARG N 2.974 H A 0050 SER O
H A 0053 ARG N 2.251 H A 0052 GLU O
H A 0054 ALA N 2.871 H A 0050 SER O
H A 0054 ALA N 3.143 H A 0051 LYS O
H A 0054 ALA N 2.250 H A 0053 ARG O
H A 0055 GLU N 2.690 H A 0051 LYS O
H A 0055 GLU N 2.257 H A 0054 ALA O
H A 0056 GLN N 3.058 H A 0052 GLU O
H A 0056 GLN N 2.256 H A 0055 GLU O
H A 0057 GLU N 3.154 H A 0054 ALA O
H A 0057 GLU N 2.246 H A 0056 GLN O
H A 0058 VAL N 2.855 H A 0054 ALA O
H A 0058 VAL N 2.248 H A 0057 GLU O
H A 0059 ARG N 2.856 H A 0055 GLU O
H A 0059 ARG N 2.246 H A 0058 VAL O
H A 0060 ASP N 2.924 H A 0056 GLN O
H A 0060 ASP N 2.244 H A 0059 ARG O
H A 0061 PHE N 3.063 H A 0057 GLU O
H A 0061 PHE N 3.123 H A 0058 VAL O
H A 0061 PHE N 2.249 H A 0060 ASP O
H A 0062 SER N 2.918 H A 0058 VAL O
H A 0062 SER N 2.247 H A 0061 PHE O
H A 0063 ASP N 2.887 H A 0059 ARG O
H A 0063 ASP N 3.101 H A 0060 ASP O
H A 0063 ASP N 2.245 H A 0062 SER O
H A 0064 ARG N 3.014 H A 0061 PHE O
H A 0064 ARG N 2.249 H A 0063 ASP O
C A 0065 LEU N 3.168 H A 0062 SER O
C A 0065 LEU N 2.249 H A 0064 ARG O
HB_MS 2.00 3.20 12
C A 0002 ASN O 2.832 C A 0003 SER OG
C A 0004 ASP O 3.089 C A 0007 LYS NZ
C A 0006 ILE N 3.066 C A 0004 ASP OD1
C A 0007 LYS N 2.803 C A 0004 ASP OD1
H A 0011 LYS O 3.004 H A 0014 THR OG1
H A 0015 GLY N 3.034 H A 0014 THR OG1
H A 0020 ARG N 3.045 H A 0019 GLU OE1
H A 0029 LEU O 2.755 H A 0010 TRP NE1
H A 0036 ALA N 2.684 C A 0004 ASP OD2
C A 0049 TRP N 3.031 H A 0044 GLN OE1
C A 0049 TRP O 2.708 H A 0044 GLN NE2
H A 0058 VAL O 2.937 H A 0062 SER OG
HB_SS 2.00 3.20 1
H A 0016 LYS NZ 2.654 H A 0012 GLN OE1
AROMATIC 0.00 8.00 5
H A 0020 ARG 7.930 H A 0061 PHE
H A 0064 ARG 5.827 H A 0061 PHE
H A 0053 ARG 7.280 H A 0047 TYR
H A 0042 LYS 5.809 H A 0038 TYR
H A 0053 ARG 4.795 C A 0049 TRP