Complet list of 1nei con file
Complete list of 1nei.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 296
C A 0001 MET CA 3.785 C A 0002 GLY CA
C A 0001 MET C 2.418 C A 0002 GLY CA
C A 0001 MET C 3.533 C A 0002 GLY C
C A 0002 GLY CA 3.785 C A 0003 LYS CA
C A 0002 GLY C 2.418 C A 0003 LYS CA
C A 0002 GLY C 3.352 C A 0003 LYS C
C A 0002 GLY C 3.536 C A 0003 LYS CB
C A 0002 GLY C 3.692 C A 0003 LYS CG
C A 0002 GLY C 3.330 C A 0003 LYS CD
C A 0003 LYS CA 3.784 C A 0004 ALA CA
C A 0003 LYS C 2.418 C A 0004 ALA CA
C A 0003 LYS C 3.355 C A 0004 ALA C
C A 0003 LYS C 3.534 C A 0004 ALA CB
C A 0004 ALA CA 3.785 C A 0005 THR CA
C A 0004 ALA C 2.419 C A 0005 THR CA
C A 0004 ALA C 3.585 C A 0005 THR C
C A 0004 ALA C 3.270 C A 0005 THR CB
C A 0004 ALA C 3.106 C A 0005 THR CG2
C A 0005 THR CA 3.784 E A 0006 TYR CA
C A 0005 THR C 2.419 E A 0006 TYR CA
C A 0005 THR C 3.594 E A 0006 TYR C
C A 0005 THR C 3.292 E A 0006 TYR CB
C A 0005 THR C 3.555 E A 0006 TYR CD1
C A 0005 THR CA 3.629 C A 0024 GLU CA
C A 0005 THR CA 3.375 C A 0024 GLU CB
C A 0005 THR CB 3.635 C A 0024 GLU CB
C A 0005 THR CG2 3.637 C A 0024 GLU CB
E A 0006 TYR CA 3.786 E A 0007 THR CA
E A 0006 TYR C 2.419 E A 0007 THR CA
E A 0006 TYR C 3.466 E A 0007 THR C
E A 0006 TYR C 3.423 E A 0007 THR CB
E A 0006 TYR CG 3.428 H A 0029 LEU CD1
E A 0006 TYR CD1 3.501 H A 0029 LEU CD1
E A 0006 TYR CD2 3.286 H A 0029 LEU CD1
E A 0006 TYR CE1 3.448 H A 0029 LEU CD1
E A 0006 TYR CE2 3.228 H A 0029 LEU CD1
E A 0006 TYR CZ 3.303 H A 0029 LEU CD1
E A 0007 THR CA 3.785 E A 0008 VAL CA
E A 0007 THR C 2.419 E A 0008 VAL CA
E A 0007 THR C 3.333 E A 0008 VAL C
E A 0007 THR C 3.552 E A 0008 VAL CB
E A 0007 THR C 3.752 E A 0008 VAL CG2
E A 0008 VAL CA 3.784 E A 0009 THR CA
E A 0008 VAL C 2.418 E A 0009 THR CA
E A 0008 VAL C 3.417 E A 0009 THR C
E A 0008 VAL C 3.470 E A 0009 THR CB
E A 0008 VAL CG1 3.139 H A 0042 LEU CD1
E A 0009 THR CA 3.785 E A 0010 VAL CA
E A 0009 THR C 2.419 E A 0010 VAL CA
E A 0009 THR C 3.453 E A 0010 VAL C
E A 0009 THR C 3.450 E A 0010 VAL CB
E A 0009 THR C 3.669 E A 0010 VAL CG2
E A 0009 THR CG2 3.602 E A 0020 ASP CB
E A 0009 THR CG2 3.530 E A 0020 ASP CG
E A 0010 VAL CA 3.785 E A 0011 THR CA
E A 0010 VAL C 2.418 E A 0011 THR CA
E A 0010 VAL C 3.555 E A 0011 THR C
E A 0010 VAL C 3.316 E A 0011 THR CB
E A 0010 VAL CB 3.697 H A 0042 LEU CB
E A 0010 VAL CB 3.295 H A 0042 LEU CD2
E A 0010 VAL CG2 3.696 H A 0042 LEU CB
E A 0010 VAL CG2 3.513 H A 0042 LEU CD2
E A 0011 THR CA 3.785 E A 0012 ASN CA
E A 0011 THR C 2.419 E A 0012 ASN CA
E A 0011 THR C 3.296 E A 0012 ASN C
E A 0011 THR C 3.619 E A 0012 ASN CB
E A 0011 THR C 3.775 E A 0012 ASN CG
E A 0011 THR CG2 3.513 C A 0017 VAL C
E A 0011 THR CB 3.590 E A 0018 SER CA
E A 0011 THR CG2 3.266 E A 0018 SER CA
E A 0011 THR CG2 3.319 E A 0018 SER CB
E A 0012 ASN CA 3.785 C A 0013 ASN CA
E A 0012 ASN C 2.419 C A 0013 ASN CA
E A 0012 ASN C 3.143 C A 0013 ASN C
E A 0012 ASN C 3.685 C A 0013 ASN CB
E A 0012 ASN CG 3.386 H A 0046 VAL CG1
C A 0013 ASN CA 3.784 C A 0014 SER CA
C A 0013 ASN C 2.418 C A 0014 SER CA
C A 0013 ASN C 3.170 C A 0014 SER C
C A 0013 ASN C 3.670 C A 0014 SER CB
C A 0014 SER CA 3.784 C A 0015 ASN CA
C A 0014 SER C 2.418 C A 0015 ASN CA
C A 0014 SER C 3.390 C A 0015 ASN C
C A 0014 SER C 3.556 C A 0015 ASN CB
C A 0015 ASN CA 3.784 C A 0016 GLY CA
C A 0015 ASN C 2.418 C A 0016 GLY CA
C A 0015 ASN C 3.021 C A 0016 GLY C
C A 0016 GLY CA 3.785 C A 0017 VAL CA
C A 0016 GLY C 2.420 C A 0017 VAL CA
C A 0016 GLY C 3.223 C A 0017 VAL C
C A 0016 GLY C 3.619 C A 0017 VAL CB
C A 0017 VAL CA 3.786 E A 0018 SER CA
C A 0017 VAL C 2.420 E A 0018 SER CA
C A 0017 VAL C 3.356 E A 0018 SER C
C A 0017 VAL C 3.570 E A 0018 SER CB
C A 0017 VAL CG1 3.285 H A 0046 VAL CG1
E A 0018 SER CA 3.786 E A 0019 VAL CA
E A 0018 SER C 2.419 E A 0019 VAL CA
E A 0018 SER C 3.642 E A 0019 VAL C
E A 0018 SER C 3.164 E A 0019 VAL CB
E A 0018 SER C 3.266 E A 0019 VAL CG2
E A 0019 VAL CA 3.785 E A 0020 ASP CA
E A 0019 VAL C 2.418 E A 0020 ASP CA
E A 0019 VAL C 3.467 E A 0020 ASP C
E A 0019 VAL C 3.490 E A 0020 ASP CB
E A 0019 VAL C 3.574 E A 0020 ASP CG
E A 0019 VAL CG1 3.537 H A 0045 THR CG2
E A 0019 VAL CB 3.198 H A 0046 VAL CG2
E A 0019 VAL CG2 3.779 H A 0046 VAL CA
E A 0019 VAL CG2 3.219 H A 0046 VAL CG2
E A 0020 ASP CA 3.785 E A 0021 TYR CA
E A 0020 ASP C 2.418 E A 0021 TYR CA
E A 0020 ASP C 3.611 E A 0021 TYR C
E A 0020 ASP C 3.262 E A 0021 TYR CB
E A 0020 ASP C 3.775 E A 0021 TYR CG
E A 0020 ASP C 3.396 E A 0021 TYR CD1
E A 0021 TYR CA 3.785 E A 0022 GLU CA
E A 0021 TYR C 2.419 E A 0022 GLU CA
E A 0021 TYR C 3.241 E A 0022 GLU C
E A 0021 TYR C 3.635 E A 0022 GLU CB
E A 0021 TYR CE1 3.374 H A 0045 THR CG2
E A 0022 GLU CA 3.784 C A 0023 THR CA
E A 0022 GLU C 2.419 C A 0023 THR CA
E A 0022 GLU C 3.578 C A 0023 THR C
E A 0022 GLU C 3.282 C A 0023 THR CB
C A 0023 THR CA 3.784 C A 0024 GLU CA
C A 0023 THR C 2.418 C A 0024 GLU CA
C A 0023 THR C 3.222 C A 0024 GLU C
C A 0023 THR C 3.644 C A 0024 GLU CB
C A 0024 GLU CA 3.785 C A 0025 THR CA
C A 0024 GLU C 2.419 C A 0025 THR CA
C A 0024 GLU C 3.563 C A 0025 THR C
C A 0024 GLU C 3.302 C A 0025 THR CB
C A 0024 GLU C 3.303 C A 0025 THR CG2
C A 0025 THR CA 2.872 H A 0026 PRO CD
C A 0025 THR C 2.450 H A 0026 PRO CA
C A 0025 THR C 3.137 H A 0026 PRO C
C A 0025 THR C 3.643 H A 0026 PRO CB
C A 0025 THR C 3.684 H A 0026 PRO CG
C A 0025 THR C 2.513 H A 0026 PRO CD
C A 0025 THR CB 3.734 H A 0028 THR CB
H A 0026 PRO CA 3.784 H A 0027 MET CA
H A 0026 PRO C 2.417 H A 0027 MET CA
H A 0026 PRO C 3.119 H A 0027 MET C
H A 0026 PRO C 3.675 H A 0027 MET CB
H A 0027 MET CA 3.786 H A 0028 THR CA
H A 0027 MET C 2.419 H A 0028 THR CA
H A 0027 MET C 2.910 H A 0028 THR C
H A 0027 MET C 3.675 H A 0028 THR CB
H A 0028 THR CA 3.786 H A 0029 LEU CA
H A 0028 THR C 2.420 H A 0029 LEU CA
H A 0028 THR C 2.992 H A 0029 LEU C
H A 0028 THR C 3.699 H A 0029 LEU CB
H A 0028 THR CA 3.419 H A 0031 VAL CG2
H A 0028 THR C 3.726 H A 0031 VAL CB
H A 0028 THR C 3.799 H A 0034 VAL CG1
H A 0028 THR CG2 3.796 H A 0034 VAL CG1
H A 0028 THR CG2 3.144 H A 0034 VAL CG2
H A 0029 LEU CA 3.786 H A 0030 LEU CA
H A 0029 LEU C 2.419 H A 0030 LEU CA
H A 0029 LEU C 3.073 H A 0030 LEU C
H A 0029 LEU C 3.680 H A 0030 LEU CB
H A 0030 LEU CA 3.784 H A 0031 VAL CA
H A 0030 LEU C 2.418 H A 0031 VAL CA
H A 0030 LEU C 2.955 H A 0031 VAL C
H A 0030 LEU C 3.698 H A 0031 VAL CB
H A 0031 VAL CA 2.871 H A 0032 PRO CD
H A 0031 VAL C 2.449 H A 0032 PRO CA
H A 0031 VAL C 3.136 H A 0032 PRO C
H A 0031 VAL C 3.641 H A 0032 PRO CB
H A 0031 VAL C 3.683 H A 0032 PRO CG
H A 0031 VAL C 2.512 H A 0032 PRO CD
H A 0031 VAL CB 3.726 H A 0032 PRO CD
H A 0031 VAL CG1 3.410 H A 0032 PRO CD
H A 0032 PRO CA 3.784 H A 0033 GLU CA
H A 0032 PRO C 2.419 H A 0033 GLU CA
H A 0032 PRO C 2.954 H A 0033 GLU C
H A 0032 PRO C 3.712 H A 0033 GLU CB
H A 0033 GLU CA 3.785 H A 0034 VAL CA
H A 0033 GLU C 2.418 H A 0034 VAL CA
H A 0033 GLU C 3.138 H A 0034 VAL C
H A 0033 GLU C 3.655 H A 0034 VAL CB
H A 0034 VAL CA 3.785 H A 0035 ALA CA
H A 0034 VAL C 2.419 H A 0035 ALA CA
H A 0034 VAL C 2.966 H A 0035 ALA C
H A 0034 VAL C 3.693 H A 0035 ALA CB
H A 0035 ALA CA 3.785 H A 0036 ALA CA
H A 0035 ALA C 2.419 H A 0036 ALA CA
H A 0035 ALA C 2.951 H A 0036 ALA C
H A 0035 ALA C 3.693 H A 0036 ALA CB
H A 0036 ALA CA 3.786 H A 0037 GLU CA
H A 0036 ALA C 2.420 H A 0037 GLU CA
H A 0036 ALA C 2.988 H A 0037 GLU C
H A 0036 ALA C 3.709 H A 0037 GLU CB
H A 0037 GLU CA 3.785 H A 0038 VAL CA
H A 0037 GLU C 2.419 H A 0038 VAL CA
H A 0037 GLU C 3.035 H A 0038 VAL C
H A 0037 GLU C 3.687 H A 0038 VAL CB
H A 0037 GLU C 3.688 H A 0041 ASP CB
H A 0038 VAL CA 3.785 H A 0039 ILE CA
H A 0038 VAL C 2.419 H A 0039 ILE CA
H A 0038 VAL C 2.955 H A 0039 ILE C
H A 0038 VAL C 3.703 H A 0039 ILE CB
H A 0038 VAL C 3.764 H A 0042 LEU CD1
H A 0038 VAL CG1 3.662 H A 0042 LEU CD1
H A 0039 ILE CA 3.785 H A 0040 LYS CA
H A 0039 ILE C 2.419 H A 0040 LYS CA
H A 0039 ILE C 3.046 H A 0040 LYS C
H A 0039 ILE C 3.687 H A 0040 LYS CB
H A 0040 LYS CA 3.785 H A 0041 ASP CA
H A 0040 LYS C 2.419 H A 0041 ASP CA
H A 0040 LYS C 2.938 H A 0041 ASP C
H A 0040 LYS C 3.712 H A 0041 ASP CB
H A 0041 ASP CA 3.786 H A 0042 LEU CA
H A 0041 ASP C 2.419 H A 0042 LEU CA
H A 0041 ASP C 2.988 H A 0042 LEU C
H A 0041 ASP C 3.700 H A 0042 LEU CB
H A 0042 LEU CA 3.785 H A 0043 VAL CA
H A 0042 LEU C 2.419 H A 0043 VAL CA
H A 0042 LEU C 2.954 H A 0043 VAL C
H A 0042 LEU C 3.698 H A 0043 VAL CB
H A 0043 VAL CA 3.785 H A 0044 ASN CA
H A 0043 VAL C 2.419 H A 0044 ASN CA
H A 0043 VAL C 2.917 H A 0044 ASN C
H A 0043 VAL C 3.712 H A 0044 ASN CB
H A 0044 ASN CA 3.786 H A 0045 THR CA
H A 0044 ASN C 2.420 H A 0045 THR CA
H A 0044 ASN C 3.080 H A 0045 THR C
H A 0044 ASN C 3.658 H A 0045 THR CB
H A 0045 THR CA 3.785 H A 0046 VAL CA
H A 0045 THR C 2.419 H A 0046 VAL CA
H A 0045 THR C 2.960 H A 0046 VAL C
H A 0045 THR C 3.699 H A 0046 VAL CB
H A 0045 THR CA 3.767 H A 0048 SER CB
H A 0045 THR C 3.676 H A 0048 SER CB
H A 0046 VAL CA 3.786 H A 0047 ARG CA
H A 0046 VAL C 2.420 H A 0047 ARG CA
H A 0046 VAL C 3.082 H A 0047 ARG C
H A 0046 VAL C 3.700 H A 0047 ARG CB
H A 0047 ARG CA 3.785 H A 0048 SER CA
H A 0047 ARG C 2.418 H A 0048 SER CA
H A 0047 ARG C 2.924 H A 0048 SER C
H A 0047 ARG C 3.713 H A 0048 SER CB
H A 0047 ARG CZ 3.483 C A 0060 TRP CE3
H A 0047 ARG CZ 3.798 C A 0060 TRP CZ3
H A 0048 SER CA 3.785 H A 0049 TYR CA
H A 0048 SER C 2.419 H A 0049 TYR CA
H A 0048 SER C 3.104 H A 0049 TYR C
H A 0048 SER C 3.641 H A 0049 TYR CB
H A 0049 TYR CA 3.785 C A 0050 ASP CA
H A 0049 TYR C 2.419 C A 0050 ASP CA
H A 0049 TYR C 3.110 C A 0050 ASP C
H A 0049 TYR C 3.693 C A 0050 ASP CB
C A 0050 ASP CA 3.785 C A 0051 THR CA
C A 0050 ASP C 2.418 C A 0051 THR CA
C A 0050 ASP C 3.179 C A 0051 THR C
C A 0050 ASP C 3.623 C A 0051 THR CB
C A 0050 ASP C 3.785 C A 0051 THR CG2
C A 0051 THR CA 3.785 C A 0052 GLU CA
C A 0051 THR C 2.419 C A 0052 GLU CA
C A 0051 THR C 3.147 C A 0052 GLU C
C A 0051 THR C 2.859 C A 0052 GLU CB
C A 0052 GLU CA 3.784 C A 0053 ASN CA
C A 0052 GLU C 2.418 C A 0053 ASN CA
C A 0052 GLU C 3.312 C A 0053 ASN C
C A 0052 GLU C 3.609 C A 0053 ASN CB
C A 0053 ASN CA 3.786 C A 0054 GLU CA
C A 0053 ASN C 2.419 C A 0054 GLU CA
C A 0053 ASN C 2.748 C A 0054 GLU C
C A 0053 ASN C 3.300 C A 0054 GLU CB
C A 0053 ASN C 3.263 C A 0054 GLU CG
C A 0054 GLU CA 3.786 C A 0055 HIS CA
C A 0054 GLU C 2.420 C A 0055 HIS CA
C A 0054 GLU C 3.136 C A 0055 HIS C
C A 0054 GLU C 2.865 C A 0055 HIS CB
C A 0055 HIS CA 3.785 C A 0056 ASP CA
C A 0055 HIS C 2.419 C A 0056 ASP CA
C A 0055 HIS C 3.168 C A 0056 ASP C
C A 0055 HIS C 3.676 C A 0056 ASP CB
C A 0056 ASP CA 3.785 C A 0057 VAL CA
C A 0056 ASP C 2.419 C A 0057 VAL CA
C A 0056 ASP C 2.985 C A 0057 VAL C
C A 0056 ASP C 3.695 C A 0057 VAL CB
C A 0057 VAL CA 3.784 C A 0058 CYS CA
C A 0057 VAL C 2.419 C A 0058 CYS CA
C A 0057 VAL C 3.632 C A 0058 CYS C
C A 0057 VAL C 3.192 C A 0058 CYS CB
C A 0057 VAL CG2 3.760 C A 0060 TRP CG
C A 0057 VAL CG2 3.223 C A 0060 TRP CD1
C A 0058 CYS CA 3.786 C A 0059 GLY CA
C A 0058 CYS C 2.419 C A 0059 GLY CA
C A 0058 CYS C 2.875 C A 0059 GLY C
C A 0059 GLY CA 3.785 C A 0060 TRP CA
C A 0059 GLY C 2.418 C A 0060 TRP CA
C A 0059 GLY C 2.836 C A 0060 TRP C
C A 0059 GLY C 3.709 C A 0060 TRP CB
CHARGE_ATTR 2.00 12.00 24
E A 0022 GLU OE2 11.21 C A 0003 LYS NZ
C A 0024 GLU OE1 7.804 C A 0003 LYS NZ
C A 0024 GLU OE2 9.084 C A 0003 LYS NZ
H A 0037 GLU OE1 4.779 H A 0040 LYS NZ
H A 0037 GLU OE2 6.198 H A 0040 LYS NZ
H A 0041 ASP OD1 7.121 H A 0040 LYS NZ
H A 0041 ASP OD2 8.574 H A 0040 LYS NZ
C A 0050 ASP OD1 8.842 H A 0047 ARG NH1
C A 0050 ASP OD1 10.59 H A 0047 ARG NH2
C A 0050 ASP OD2 7.271 H A 0047 ARG NH1
C A 0050 ASP OD2 9.091 H A 0047 ARG NH2
C A 0050 ASP OD1 6.790 C A 0055 HIS ND1
C A 0050 ASP OD1 8.895 C A 0055 HIS NE2
C A 0050 ASP OD2 7.508 C A 0055 HIS ND1
C A 0050 ASP OD2 9.540 C A 0055 HIS NE2
C A 0054 GLU OE2 11.89 H A 0047 ARG NH1
C A 0054 GLU OE1 7.413 C A 0055 HIS ND1
C A 0054 GLU OE1 8.954 C A 0055 HIS NE2
C A 0054 GLU OE2 5.860 C A 0055 HIS ND1
C A 0054 GLU OE2 7.595 C A 0055 HIS NE2
C A 0056 ASP OD1 5.048 C A 0055 HIS ND1
C A 0056 ASP OD1 4.733 C A 0055 HIS NE2
C A 0056 ASP OD2 7.014 C A 0055 HIS ND1
C A 0056 ASP OD2 6.857 C A 0055 HIS NE2
CHARGE_REPU 2.00 12.00 33
E A 0020 ASP OD1 10.79 E A 0022 GLU OE1
E A 0020 ASP OD2 10.57 E A 0022 GLU OE1
E A 0020 ASP OD1 10.83 H A 0041 ASP OD2
E A 0020 ASP OD2 11.96 H A 0041 ASP OD2
E A 0022 GLU OE1 8.125 C A 0024 GLU OE1
E A 0022 GLU OE1 9.871 C A 0024 GLU OE2
E A 0022 GLU OE2 6.229 C A 0024 GLU OE1
E A 0022 GLU OE2 7.963 C A 0024 GLU OE2
H A 0033 GLU OE1 11.00 H A 0037 GLU OE1
H A 0033 GLU OE1 9.888 H A 0037 GLU OE2
H A 0033 GLU OE2 10.76 H A 0037 GLU OE2
H A 0037 GLU OE1 4.619 H A 0041 ASP OD1
H A 0037 GLU OE1 5.576 H A 0041 ASP OD2
H A 0037 GLU OE2 6.244 H A 0041 ASP OD1
H A 0037 GLU OE2 7.119 H A 0041 ASP OD2
H A 0040 LYS NZ 10.49 H A 0047 ARG NH1
H A 0040 LYS NZ 8.587 H A 0047 ARG NH2
C A 0050 ASP OD2 11.13 C A 0052 GLU OE1
C A 0050 ASP OD2 11.35 C A 0052 GLU OE2
C A 0050 ASP OD1 4.697 C A 0054 GLU OE1
C A 0050 ASP OD1 3.191 C A 0054 GLU OE2
C A 0050 ASP OD2 6.577 C A 0054 GLU OE1
C A 0050 ASP OD2 4.791 C A 0054 GLU OE2
C A 0050 ASP OD1 9.435 C A 0056 ASP OD1
C A 0050 ASP OD1 10.51 C A 0056 ASP OD2
C A 0050 ASP OD2 8.983 C A 0056 ASP OD1
C A 0050 ASP OD2 9.607 C A 0056 ASP OD2
C A 0052 GLU OE1 11.83 C A 0054 GLU OE2
C A 0052 GLU OE2 11.90 C A 0054 GLU OE1
C A 0052 GLU OE2 11.14 C A 0054 GLU OE2
C A 0054 GLU OE1 10.73 C A 0056 ASP OD1
C A 0054 GLU OE2 8.791 C A 0056 ASP OD1
C A 0054 GLU OE2 10.32 C A 0056 ASP OD2
HB_MM 2.00 3.20 99
C A 0002 GLY N 2.262 C A 0001 MET O
C A 0003 LYS N 2.261 C A 0002 GLY O
C A 0004 ALA N 2.262 C A 0003 LYS O
C A 0005 THR N 2.262 C A 0004 ALA O
E A 0006 TYR N 2.261 C A 0005 THR O
E A 0006 TYR N 3.075 C A 0023 THR O
E A 0007 THR N 2.262 E A 0006 TYR O
E A 0008 VAL N 2.262 E A 0007 THR O
E A 0008 VAL N 3.001 E A 0021 TYR O
E A 0009 THR N 2.262 E A 0008 VAL O
E A 0010 VAL N 2.261 E A 0009 THR O
E A 0010 VAL N 2.522 E A 0019 VAL O
E A 0011 THR N 2.261 E A 0010 VAL O
E A 0012 ASN N 2.262 E A 0011 THR O
E A 0012 ASN N 2.500 C A 0017 VAL O
C A 0013 ASN N 2.261 E A 0012 ASN O
C A 0014 SER N 2.262 C A 0013 ASN O
C A 0015 ASN N 2.261 C A 0014 SER O
C A 0016 GLY N 2.384 E A 0012 ASN O
C A 0016 GLY N 2.262 C A 0015 ASN O
C A 0017 VAL N 3.026 E A 0012 ASN O
C A 0017 VAL N 3.154 C A 0015 ASN O
C A 0017 VAL N 2.262 C A 0016 GLY O
E A 0018 SER N 2.261 C A 0017 VAL O
E A 0019 VAL N 2.646 E A 0010 VAL O
E A 0019 VAL N 2.262 E A 0018 SER O
E A 0020 ASP N 2.260 E A 0019 VAL O
E A 0021 TYR N 2.910 E A 0008 VAL O
E A 0021 TYR N 2.261 E A 0020 ASP O
E A 0022 GLU N 2.262 E A 0021 TYR O
C A 0023 THR N 2.655 E A 0006 TYR O
C A 0023 THR N 2.261 E A 0022 GLU O
C A 0024 GLU N 2.261 C A 0023 THR O
C A 0025 THR N 2.262 C A 0024 GLU O
H A 0026 PRO N 2.293 C A 0025 THR O
H A 0027 MET N 2.262 H A 0026 PRO O
H A 0028 THR N 2.261 H A 0027 MET O
H A 0029 LEU N 2.729 H A 0027 MET O
H A 0029 LEU N 2.261 H A 0028 THR O
H A 0030 LEU N 2.670 H A 0027 MET O
H A 0030 LEU N 2.260 H A 0029 LEU O
H A 0031 VAL N 3.075 H A 0028 THR O
H A 0031 VAL N 2.262 H A 0030 LEU O
H A 0032 PRO N 2.292 H A 0031 VAL O
H A 0033 GLU N 2.261 H A 0032 PRO O
H A 0034 VAL N 3.198 H A 0032 PRO O
H A 0034 VAL N 2.261 H A 0033 GLU O
H A 0035 ALA N 2.752 H A 0031 VAL O
H A 0035 ALA N 3.179 H A 0032 PRO O
H A 0035 ALA N 2.261 H A 0034 VAL O
H A 0036 ALA N 2.436 H A 0032 PRO O
H A 0036 ALA N 2.261 H A 0035 ALA O
H A 0037 GLU N 3.187 H A 0033 GLU O
H A 0037 GLU N 2.263 H A 0036 ALA O
H A 0038 VAL N 2.709 H A 0034 VAL O
H A 0038 VAL N 3.078 H A 0035 ALA O
H A 0038 VAL N 2.262 H A 0037 GLU O
H A 0039 ILE N 2.642 H A 0035 ALA O
H A 0039 ILE N 2.263 H A 0038 VAL O
H A 0040 LYS N 2.634 H A 0036 ALA O
H A 0040 LYS N 2.261 H A 0039 ILE O
H A 0041 ASP N 2.469 H A 0037 GLU O
H A 0041 ASP N 3.150 H A 0038 VAL O
H A 0041 ASP N 2.262 H A 0040 LYS O
H A 0042 LEU N 2.724 H A 0038 VAL O
H A 0042 LEU N 2.262 H A 0041 ASP O
H A 0043 VAL N 2.960 H A 0039 ILE O
H A 0043 VAL N 2.261 H A 0042 LEU O
H A 0044 ASN N 2.459 H A 0040 LYS O
H A 0044 ASN N 2.261 H A 0043 VAL O
H A 0045 THR N 2.837 H A 0041 ASP O
H A 0045 THR N 3.004 H A 0042 LEU O
H A 0045 THR N 3.111 H A 0043 VAL O
H A 0045 THR N 2.261 H A 0044 ASN O
H A 0046 VAL N 2.746 H A 0042 LEU O
H A 0046 VAL N 2.923 H A 0043 VAL O
H A 0046 VAL N 2.262 H A 0045 THR O
H A 0047 ARG N 2.763 H A 0043 VAL O
H A 0047 ARG N 2.261 H A 0046 VAL O
H A 0048 SER N 2.832 H A 0044 ASN O
H A 0048 SER N 3.032 H A 0045 THR O
H A 0048 SER N 2.262 H A 0047 ARG O
H A 0049 TYR N 3.111 H A 0047 ARG O
H A 0049 TYR N 2.262 H A 0048 SER O
C A 0050 ASP N 2.716 H A 0047 ARG O
C A 0050 ASP N 2.262 H A 0049 TYR O
C A 0051 THR N 2.807 H A 0047 ARG O
C A 0051 THR N 2.262 C A 0050 ASP O
C A 0052 GLU N 2.261 C A 0051 THR O
C A 0053 ASN N 2.783 C A 0051 THR O
C A 0053 ASN N 2.263 C A 0052 GLU O
C A 0054 GLU N 2.261 C A 0053 ASN O
C A 0055 HIS N 3.134 C A 0053 ASN O
C A 0055 HIS N 2.262 C A 0054 GLU O
C A 0056 ASP N 2.261 C A 0055 HIS O
C A 0057 VAL N 2.263 C A 0056 ASP O
C A 0058 CYS N 2.262 C A 0057 VAL O
C A 0059 GLY N 2.262 C A 0058 CYS O
C A 0060 TRP N 2.262 C A 0059 GLY O
HB_MS 2.00 3.20 4
E A 0010 VAL O 3.136 E A 0011 THR OG1
C A 0015 ASN N 2.946 C A 0014 SER OG
H A 0040 LYS O 3.005 H A 0044 ASN ND2
H A 0041 ASP O 2.974 H A 0045 THR OG1
AROMATIC 0.00 8.00 1
H A 0047 ARG 4.606 C A 0060 TRP
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 47
C A 0004 ALA CA 3.570 C B 0214 SER CB
E A 0006 TYR CE2 3.591 E B 0210 VAL CG1
E A 0006 TYR CE1 3.418 E B 0212 ASN CB
E A 0006 TYR CE1 3.373 E B 0212 ASN CG
E A 0006 TYR CE2 3.289 E B 0212 ASN CG
E A 0006 TYR CZ 3.460 E B 0212 ASN CB
E A 0006 TYR CZ 2.814 E B 0212 ASN CG
E A 0006 TYR CE2 3.540 H B 0243 VAL CG2
E A 0008 VAL CG2 3.626 E B 0210 VAL CG2
E A 0010 VAL CG1 3.574 E B 0206 TYR CD1
E A 0010 VAL CG1 3.376 E B 0206 TYR CE1
E A 0010 VAL CG2 3.162 E B 0208 VAL CG2
E A 0012 ASN CG 3.218 E B 0206 TYR CE1
E A 0012 ASN CG 3.591 E B 0206 TYR CE2
E A 0012 ASN CG 2.968 E B 0206 TYR CZ
C A 0014 SER CB 3.489 C B 0204 ALA CA
H A 0029 LEU C 3.655 H B 0239 ILE CG2
H A 0029 LEU CB 3.633 H B 0243 VAL CG2
H A 0029 LEU CD1 3.428 H B 0243 VAL CG2
H A 0030 LEU CD2 3.345 H B 0243 VAL CG1
H A 0032 PRO CA 3.206 H B 0236 ALA CB
H A 0032 PRO CB 3.153 H B 0236 ALA CB
H A 0035 ALA CB 3.410 H B 0236 ALA CA
H A 0035 ALA CA 3.656 H B 0239 ILE CG1
H A 0035 ALA CB 3.185 H B 0239 ILE CB
H A 0035 ALA CB 3.338 H B 0239 ILE CG1
H A 0035 ALA CB 3.500 H B 0239 ILE CG2
H A 0036 ALA CB 3.130 H B 0232 PRO CA
H A 0036 ALA CB 3.156 H B 0232 PRO CB
H A 0036 ALA CA 3.429 H B 0235 ALA CB
H A 0038 VAL CG1 3.213 H B 0239 ILE CD1
H A 0039 ILE CG2 3.542 H B 0229 LEU CA
H A 0039 ILE CG2 3.427 H B 0229 LEU C
H A 0039 ILE CG2 3.297 H B 0229 LEU CD2
H A 0039 ILE CB 3.177 H B 0235 ALA CB
H A 0039 ILE CG1 3.623 H B 0235 ALA CA
H A 0039 ILE CG1 3.231 H B 0235 ALA CB
H A 0039 ILE CG2 3.571 H B 0235 ALA CB
H A 0039 ILE CD1 3.305 H B 0238 VAL CG1
H A 0039 ILE CG1 3.199 H B 0239 ILE CG1
H A 0039 ILE CG1 3.586 H B 0239 ILE CD1
H A 0039 ILE CD1 3.522 H B 0239 ILE CG1
H A 0039 ILE CD1 3.464 H B 0239 ILE CD1
H A 0043 VAL CG2 3.450 H B 0229 LEU CB
H A 0043 VAL CG2 3.700 H B 0229 LEU CG
H A 0043 VAL CG2 3.216 H B 0229 LEU CD1
H A 0043 VAL CG1 3.354 H B 0230 LEU CD2
CHARGE_REPU 2.00 12.00 3
E A 0020 ASP OD2 10.20 E B 0220 ASP OD2
H A 0033 GLU OE1 11.50 H B 0233 GLU OE1
H A 0033 GLU OE1 11.63 H B 0233 GLU OE2
HB_MM 2.00 3.20 8
C A 0005 THR O 2.815 C B 0213 ASN N
E A 0007 THR N 2.808 E B 0211 THR O
E A 0007 THR O 3.083 E B 0211 THR N
E A 0009 THR N 2.995 E B 0209 THR O
E A 0009 THR O 2.588 E B 0209 THR N
E A 0011 THR N 2.758 E B 0207 THR O
E A 0011 THR O 2.582 E B 0207 THR N
C A 0013 ASN N 2.768 C B 0205 THR O
HB_MS 2.00 3.20 1
C A 0003 LYS O 2.844 C B 0214 SER OG
HB_SS 2.00 3.20 6
E A 0006 TYR OH 2.542 E B 0212 ASN ND2
E A 0006 TYR OH 2.787 E B 0212 ASN OD1
E A 0007 THR OG1 3.164 C B 0213 ASN ND2
E A 0012 ASN ND2 2.490 E B 0206 TYR OH
E A 0012 ASN OD1 2.954 E B 0206 TYR OH
C A 0013 ASN ND2 2.977 E B 0207 THR OG1
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 301
C B 0201 MET CA 3.785 C B 0202 GLY CA
C B 0201 MET C 2.420 C B 0202 GLY CA
C B 0201 MET C 3.677 C B 0202 GLY C
C B 0202 GLY CA 3.785 C B 0203 LYS CA
C B 0202 GLY C 2.419 C B 0203 LYS CA
C B 0202 GLY C 3.455 C B 0203 LYS C
C B 0202 GLY C 3.445 C B 0203 LYS CB
C B 0203 LYS CA 3.785 C B 0204 ALA CA
C B 0203 LYS C 2.418 C B 0204 ALA CA
C B 0203 LYS C 3.326 C B 0204 ALA C
C B 0203 LYS C 3.555 C B 0204 ALA CB
C B 0204 ALA CA 3.785 C B 0205 THR CA
C B 0204 ALA C 2.419 C B 0205 THR CA
C B 0204 ALA C 3.638 C B 0205 THR C
C B 0204 ALA C 3.173 C B 0205 THR CB
C B 0204 ALA C 3.075 C B 0205 THR CG2
C B 0205 THR CA 3.785 E B 0206 TYR CA
C B 0205 THR C 2.419 E B 0206 TYR CA
C B 0205 THR C 3.592 E B 0206 TYR C
C B 0205 THR C 3.293 E B 0206 TYR CB
E B 0206 TYR CA 3.784 E B 0207 THR CA
E B 0206 TYR C 2.418 E B 0207 THR CA
E B 0206 TYR C 3.451 E B 0207 THR C
E B 0206 TYR C 3.438 E B 0207 THR CB
E B 0206 TYR CG 3.441 H B 0229 LEU CD1
E B 0206 TYR CD1 3.576 H B 0229 LEU CD1
E B 0206 TYR CD2 3.283 H B 0229 LEU CD1
E B 0206 TYR CE1 3.571 H B 0229 LEU CD1
E B 0206 TYR CE2 3.279 H B 0229 LEU CD1
E B 0206 TYR CZ 3.416 H B 0229 LEU CD1
E B 0207 THR CA 3.785 E B 0208 VAL CA
E B 0207 THR C 2.418 E B 0208 VAL CA
E B 0207 THR C 3.386 E B 0208 VAL C
E B 0207 THR C 3.510 E B 0208 VAL CB
E B 0207 THR C 3.667 E B 0208 VAL CG2
E B 0208 VAL CA 3.785 E B 0209 THR CA
E B 0208 VAL C 2.419 E B 0209 THR CA
E B 0208 VAL C 3.364 E B 0209 THR C
E B 0208 VAL C 3.515 E B 0209 THR CB
E B 0208 VAL CG1 3.287 H B 0242 LEU CD1
E B 0209 THR CA 3.785 E B 0210 VAL CA
E B 0209 THR C 2.419 E B 0210 VAL CA
E B 0209 THR C 3.585 E B 0210 VAL C
E B 0209 THR C 3.279 E B 0210 VAL CB
E B 0209 THR C 3.477 E B 0210 VAL CG2
E B 0209 THR CG2 3.776 E B 0219 VAL C
E B 0209 THR CG2 3.604 E B 0220 ASP CA
E B 0209 THR CG2 3.590 E B 0220 ASP CB
E B 0209 THR CG2 3.678 E B 0220 ASP CG
E B 0210 VAL CA 3.786 E B 0211 THR CA
E B 0210 VAL C 2.419 E B 0211 THR CA
E B 0210 VAL C 3.513 E B 0211 THR C
E B 0210 VAL C 3.371 E B 0211 THR CB
E B 0210 VAL CB 3.695 H B 0242 LEU CB
E B 0210 VAL CB 3.390 H B 0242 LEU CD2
E B 0210 VAL CG2 3.524 H B 0242 LEU CB
E B 0210 VAL CG2 3.546 H B 0242 LEU CD2
E B 0210 VAL CG1 3.450 H B 0246 VAL CG2
E B 0211 THR CA 3.785 E B 0212 ASN CA
E B 0211 THR C 2.419 E B 0212 ASN CA
E B 0211 THR C 3.276 E B 0212 ASN C
E B 0211 THR C 3.630 E B 0212 ASN CB
E B 0211 THR C 3.746 E B 0212 ASN CG
E B 0211 THR CB 3.793 E B 0218 SER CA
E B 0211 THR CB 3.783 E B 0218 SER CB
E B 0212 ASN CA 3.784 C B 0213 ASN CA
E B 0212 ASN C 2.417 C B 0213 ASN CA
E B 0212 ASN C 2.954 C B 0213 ASN C
E B 0212 ASN C 3.712 C B 0213 ASN CB
E B 0212 ASN CG 3.328 H B 0246 VAL CG1
C B 0213 ASN CA 3.785 C B 0214 SER CA
C B 0213 ASN C 2.419 C B 0214 SER CA
C B 0213 ASN C 3.149 C B 0214 SER C
C B 0213 ASN C 3.676 C B 0214 SER CB
C B 0214 SER CA 3.784 C B 0215 ASN CA
C B 0214 SER C 2.419 C B 0215 ASN CA
C B 0214 SER C 3.392 C B 0215 ASN C
C B 0214 SER C 3.556 C B 0215 ASN CB
C B 0215 ASN CA 3.784 C B 0216 GLY CA
C B 0215 ASN C 2.419 C B 0216 GLY CA
C B 0215 ASN C 2.998 C B 0216 GLY C
C B 0215 ASN CB 3.773 C B 0217 VAL CG2
C B 0216 GLY CA 3.785 C B 0217 VAL CA
C B 0216 GLY C 2.419 C B 0217 VAL CA
C B 0216 GLY C 3.210 C B 0217 VAL C
C B 0216 GLY C 3.625 C B 0217 VAL CB
C B 0217 VAL CA 3.784 E B 0218 SER CA
C B 0217 VAL C 2.419 E B 0218 SER CA
C B 0217 VAL C 3.522 E B 0218 SER C
C B 0217 VAL C 3.416 E B 0218 SER CB
C B 0217 VAL CG1 3.242 H B 0246 VAL CG1
E B 0218 SER CA 3.784 E B 0219 VAL CA
E B 0218 SER C 2.418 E B 0219 VAL CA
E B 0218 SER C 3.650 E B 0219 VAL C
E B 0218 SER C 3.142 E B 0219 VAL CB
E B 0218 SER C 3.053 E B 0219 VAL CG2
E B 0219 VAL CA 3.785 E B 0220 ASP CA
E B 0219 VAL C 2.419 E B 0220 ASP CA
E B 0219 VAL C 3.410 E B 0220 ASP C
E B 0219 VAL C 3.542 E B 0220 ASP CB
E B 0219 VAL C 3.666 E B 0220 ASP CG
E B 0219 VAL CG1 3.651 E B 0221 TYR CD2
E B 0219 VAL CG1 3.568 E B 0221 TYR CE2
E B 0219 VAL CG1 3.738 H B 0245 THR CG2
E B 0219 VAL CB 3.213 H B 0246 VAL CG2
E B 0219 VAL CG2 3.481 H B 0246 VAL CA
E B 0219 VAL CG2 3.672 H B 0246 VAL CB
E B 0219 VAL CG2 3.173 H B 0246 VAL CG2
E B 0220 ASP CA 3.785 E B 0221 TYR CA
E B 0220 ASP C 2.418 E B 0221 TYR CA
E B 0220 ASP C 3.611 E B 0221 TYR C
E B 0220 ASP C 3.260 E B 0221 TYR CB
E B 0220 ASP C 3.699 E B 0221 TYR CG
E B 0221 TYR CA 3.785 E B 0222 GLU CA
E B 0221 TYR C 2.419 E B 0222 GLU CA
E B 0221 TYR C 3.333 E B 0222 GLU C
E B 0221 TYR C 3.583 E B 0222 GLU CB
E B 0221 TYR CD2 3.519 H B 0242 LEU CG
E B 0221 TYR CD2 3.569 H B 0242 LEU CD2
E B 0221 TYR CE2 3.363 H B 0245 THR CB
E B 0221 TYR CE2 3.324 H B 0245 THR CG2
E B 0221 TYR CZ 3.552 H B 0245 THR CG2
E B 0222 GLU CA 3.785 E B 0223 THR CA
E B 0222 GLU C 2.419 E B 0223 THR CA
E B 0222 GLU C 3.591 E B 0223 THR C
E B 0222 GLU C 3.261 E B 0223 THR CB
E B 0223 THR CA 3.785 C B 0224 GLU CA
E B 0223 THR C 2.418 C B 0224 GLU CA
E B 0223 THR C 3.372 C B 0224 GLU C
E B 0223 THR C 3.553 C B 0224 GLU CB
E B 0223 THR CG2 3.719 C B 0225 THR CG2
C B 0224 GLU CA 3.785 C B 0225 THR CA
C B 0224 GLU C 2.419 C B 0225 THR CA
C B 0224 GLU C 3.565 C B 0225 THR C
C B 0224 GLU C 3.300 C B 0225 THR CB
C B 0224 GLU C 3.286 C B 0225 THR CG2
C B 0225 THR CA 2.872 C B 0226 PRO CD
C B 0225 THR C 2.448 C B 0226 PRO CA
C B 0225 THR C 3.137 C B 0226 PRO C
C B 0225 THR C 3.643 C B 0226 PRO CB
C B 0225 THR C 3.683 C B 0226 PRO CG
C B 0225 THR C 2.513 C B 0226 PRO CD
C B 0225 THR CB 3.615 H B 0228 THR CB
C B 0226 PRO CA 3.785 H B 0227 MET CA
C B 0226 PRO C 2.418 H B 0227 MET CA
C B 0226 PRO C 3.114 H B 0227 MET C
C B 0226 PRO C 3.676 H B 0227 MET CB
H B 0227 MET CA 3.785 H B 0228 THR CA
H B 0227 MET C 2.417 H B 0228 THR CA
H B 0227 MET C 2.909 H B 0228 THR C
H B 0227 MET C 3.675 H B 0228 THR CB
H B 0228 THR CA 3.784 H B 0229 LEU CA
H B 0228 THR C 2.418 H B 0229 LEU CA
H B 0228 THR C 2.879 H B 0229 LEU C
H B 0228 THR C 3.705 H B 0229 LEU CB
H B 0228 THR CA 3.733 H B 0231 VAL CB
H B 0228 THR CA 3.425 H B 0231 VAL CG2
H B 0228 THR C 3.713 H B 0231 VAL CB
H B 0228 THR CB 3.570 H B 0234 VAL CG1
H B 0228 THR CG2 3.715 H B 0234 VAL CB
H B 0228 THR CG2 3.514 H B 0234 VAL CG1
H B 0228 THR CG2 3.180 H B 0234 VAL CG2
H B 0229 LEU CA 3.786 H B 0230 LEU CA
H B 0229 LEU C 2.419 H B 0230 LEU CA
H B 0229 LEU C 3.153 H B 0230 LEU C
H B 0229 LEU C 3.651 H B 0230 LEU CB
H B 0230 LEU CA 3.785 H B 0231 VAL CA
H B 0230 LEU C 2.419 H B 0231 VAL CA
H B 0230 LEU C 2.984 H B 0231 VAL C
H B 0230 LEU C 3.695 H B 0231 VAL CB
H B 0231 VAL CA 2.871 H B 0232 PRO CD
H B 0231 VAL C 2.449 H B 0232 PRO CA
H B 0231 VAL C 3.136 H B 0232 PRO C
H B 0231 VAL C 3.642 H B 0232 PRO CB
H B 0231 VAL C 3.684 H B 0232 PRO CG
H B 0231 VAL C 2.513 H B 0232 PRO CD
H B 0231 VAL CB 3.713 H B 0232 PRO CD
H B 0231 VAL CG1 3.392 H B 0232 PRO CD
H B 0231 VAL CB 3.678 H B 0234 VAL CG2
H B 0231 VAL CG1 3.333 H B 0234 VAL CG2
H B 0232 PRO CA 3.784 H B 0233 GLU CA
H B 0232 PRO C 2.419 H B 0233 GLU CA
H B 0232 PRO C 2.969 H B 0233 GLU C
H B 0232 PRO C 3.712 H B 0233 GLU CB
H B 0232 PRO C 3.750 H B 0236 ALA CB
H B 0233 GLU CA 3.784 H B 0234 VAL CA
H B 0233 GLU C 2.418 H B 0234 VAL CA
H B 0233 GLU C 3.144 H B 0234 VAL C
H B 0233 GLU C 3.655 H B 0234 VAL CB
H B 0234 VAL CA 3.784 H B 0235 ALA CA
H B 0234 VAL C 2.418 H B 0235 ALA CA
H B 0234 VAL C 2.991 H B 0235 ALA C
H B 0234 VAL C 3.690 H B 0235 ALA CB
H B 0235 ALA CA 3.784 H B 0236 ALA CA
H B 0235 ALA C 2.419 H B 0236 ALA CA
H B 0235 ALA C 2.935 H B 0236 ALA C
H B 0235 ALA C 3.695 H B 0236 ALA CB
H B 0236 ALA CA 3.785 H B 0237 GLU CA
H B 0236 ALA C 2.418 H B 0237 GLU CA
H B 0236 ALA C 3.041 H B 0237 GLU C
H B 0236 ALA C 3.703 H B 0237 GLU CB
H B 0237 GLU CA 3.785 H B 0238 VAL CA
H B 0237 GLU C 2.419 H B 0238 VAL CA
H B 0237 GLU C 3.025 H B 0238 VAL C
H B 0237 GLU C 3.689 H B 0238 VAL CB
H B 0237 GLU C 3.706 H B 0241 ASP CB
H B 0238 VAL CA 3.785 H B 0239 ILE CA
H B 0238 VAL C 2.419 H B 0239 ILE CA
H B 0238 VAL C 3.086 H B 0239 ILE C
H B 0238 VAL C 3.677 H B 0239 ILE CB
H B 0238 VAL C 3.655 H B 0242 LEU CD1
H B 0238 VAL CG1 3.696 H B 0242 LEU CD1
H B 0239 ILE CA 3.785 H B 0240 LYS CA
H B 0239 ILE C 2.420 H B 0240 LYS CA
H B 0239 ILE C 3.025 H B 0240 LYS C
H B 0239 ILE C 3.693 H B 0240 LYS CB
H B 0240 LYS CA 3.784 H B 0241 ASP CA
H B 0240 LYS C 2.418 H B 0241 ASP CA
H B 0240 LYS C 2.952 H B 0241 ASP C
H B 0240 LYS C 3.714 H B 0241 ASP CB
H B 0240 LYS CE 3.722 H B 0244 ASN CG
H B 0241 ASP CA 3.785 H B 0242 LEU CA
H B 0241 ASP C 2.419 H B 0242 LEU CA
H B 0241 ASP C 2.960 H B 0242 LEU C
H B 0241 ASP C 3.703 H B 0242 LEU CB
H B 0242 LEU CA 3.784 H B 0243 VAL CA
H B 0242 LEU C 2.419 H B 0243 VAL CA
H B 0242 LEU C 2.992 H B 0243 VAL C
H B 0242 LEU C 3.695 H B 0243 VAL CB
H B 0242 LEU C 3.601 H B 0246 VAL CG2
H B 0243 VAL CA 3.784 H B 0244 ASN CA
H B 0243 VAL C 2.418 H B 0244 ASN CA
H B 0243 VAL C 2.921 H B 0244 ASN C
H B 0243 VAL C 3.711 H B 0244 ASN CB
H B 0244 ASN CA 3.785 H B 0245 THR CA
H B 0244 ASN C 2.418 H B 0245 THR CA
H B 0244 ASN C 3.076 H B 0245 THR C
H B 0244 ASN C 3.657 H B 0245 THR CB
H B 0245 THR CA 3.785 H B 0246 VAL CA
H B 0245 THR C 2.419 H B 0246 VAL CA
H B 0245 THR C 2.954 H B 0246 VAL C
H B 0245 THR C 3.699 H B 0246 VAL CB
H B 0245 THR CA 3.768 H B 0248 SER CB
H B 0245 THR C 3.670 H B 0248 SER CB
H B 0246 VAL CA 3.785 H B 0247 ARG CA
H B 0246 VAL C 2.418 H B 0247 ARG CA
H B 0246 VAL C 3.084 H B 0247 ARG C
H B 0246 VAL C 3.698 H B 0247 ARG CB
H B 0247 ARG CA 3.785 H B 0248 SER CA
H B 0247 ARG C 2.418 H B 0248 SER CA
H B 0247 ARG C 2.911 H B 0248 SER C
H B 0247 ARG C 3.711 H B 0248 SER CB
H B 0247 ARG CA 3.771 C B 0250 ASP CG
H B 0248 SER CA 3.785 H B 0249 TYR CA
H B 0248 SER C 2.418 H B 0249 TYR CA
H B 0248 SER C 3.085 H B 0249 TYR C
H B 0248 SER C 3.644 H B 0249 TYR CB
H B 0249 TYR CA 3.785 C B 0250 ASP CA
H B 0249 TYR C 2.418 C B 0250 ASP CA
H B 0249 TYR C 3.097 C B 0250 ASP C
H B 0249 TYR C 3.697 C B 0250 ASP CB
C B 0250 ASP CA 3.786 C B 0251 THR CA
C B 0250 ASP C 2.419 C B 0251 THR CA
C B 0250 ASP C 3.263 C B 0251 THR C
C B 0250 ASP C 3.582 C B 0251 THR CB
C B 0250 ASP C 3.687 C B 0251 THR CG2
C B 0251 THR CA 3.786 C B 0252 GLU CA
C B 0251 THR C 2.419 C B 0252 GLU CA
C B 0251 THR C 2.888 C B 0252 GLU C
C B 0251 THR C 3.709 C B 0252 GLU CB
C B 0252 GLU CA 3.786 C B 0253 ASN CA
C B 0252 GLU C 2.419 C B 0253 ASN CA
C B 0252 GLU C 3.105 C B 0253 ASN C
C B 0252 GLU C 3.695 C B 0253 ASN CB
C B 0253 ASN CA 3.785 C B 0254 GLU CA
C B 0253 ASN C 2.419 C B 0254 GLU CA
C B 0253 ASN C 3.433 C B 0254 GLU C
C B 0253 ASN C 3.504 C B 0254 GLU CB
C B 0254 GLU CA 3.784 C B 0255 HIS CA
C B 0254 GLU C 2.420 C B 0255 HIS CA
C B 0254 GLU C 3.349 C B 0255 HIS C
C B 0254 GLU C 3.552 C B 0255 HIS CB
C B 0255 HIS CA 3.785 C B 0256 ASP CA
C B 0255 HIS C 2.419 C B 0256 ASP CA
C B 0255 HIS C 3.428 C B 0256 ASP C
C B 0255 HIS C 3.525 C B 0256 ASP CB
C B 0256 ASP CA 3.784 C B 0257 VAL CA
C B 0256 ASP C 2.418 C B 0257 VAL CA
C B 0256 ASP C 2.984 C B 0257 VAL C
C B 0256 ASP C 3.695 C B 0257 VAL CB
C B 0257 VAL CA 3.785 C B 0258 CYS CA
C B 0257 VAL C 2.418 C B 0258 CYS CA
C B 0257 VAL C 3.661 C B 0258 CYS C
C B 0257 VAL C 3.108 C B 0258 CYS CB
C B 0258 CYS CA 3.784 C B 0259 GLY CA
C B 0258 CYS C 2.418 C B 0259 GLY CA
C B 0258 CYS C 2.998 C B 0259 GLY C
C B 0259 GLY CA 3.785 C B 0260 TRP CA
C B 0259 GLY C 2.418 C B 0260 TRP CA
C B 0259 GLY C 3.667 C B 0260 TRP C
C B 0259 GLY C 3.041 C B 0260 TRP CB
CHARGE_ATTR 2.00 12.00 26
E B 0222 GLU OE2 10.01 C B 0203 LYS NZ
C B 0224 GLU OE1 9.425 C B 0203 LYS NZ
C B 0224 GLU OE2 10.05 C B 0203 LYS NZ
H B 0233 GLU OE1 11.96 H B 0240 LYS NZ
H B 0237 GLU OE1 5.702 H B 0240 LYS NZ
H B 0237 GLU OE2 6.930 H B 0240 LYS NZ
H B 0241 ASP OD1 6.964 H B 0240 LYS NZ
H B 0241 ASP OD2 8.458 H B 0240 LYS NZ
C B 0250 ASP OD1 9.253 H B 0247 ARG NH1
C B 0250 ASP OD1 8.769 H B 0247 ARG NH2
C B 0250 ASP OD2 7.819 H B 0247 ARG NH1
C B 0250 ASP OD2 6.929 H B 0247 ARG NH2
C B 0252 GLU OE1 10.65 C B 0255 HIS ND1
C B 0252 GLU OE1 9.704 C B 0255 HIS NE2
C B 0252 GLU OE2 9.720 C B 0255 HIS ND1
C B 0252 GLU OE2 8.746 C B 0255 HIS NE2
C B 0254 GLU OE1 5.775 C B 0255 HIS ND1
C B 0254 GLU OE1 5.696 C B 0255 HIS NE2
C B 0254 GLU OE2 6.332 C B 0255 HIS ND1
C B 0254 GLU OE2 6.556 C B 0255 HIS NE2
C B 0256 ASP OD1 9.973 H B 0240 LYS NZ
C B 0256 ASP OD2 8.660 H B 0240 LYS NZ
C B 0256 ASP OD1 6.526 C B 0255 HIS ND1
C B 0256 ASP OD1 8.611 C B 0255 HIS NE2
C B 0256 ASP OD2 7.849 C B 0255 HIS ND1
C B 0256 ASP OD2 9.987 C B 0255 HIS NE2
CHARGE_REPU 2.00 12.00 33
E B 0220 ASP OD1 9.215 E B 0222 GLU OE1
E B 0220 ASP OD1 10.99 E B 0222 GLU OE2
E B 0220 ASP OD2 9.035 E B 0222 GLU OE1
E B 0220 ASP OD2 11.07 E B 0222 GLU OE2
E B 0220 ASP OD1 11.37 H B 0241 ASP OD2
E B 0222 GLU OE1 11.23 C B 0224 GLU OE1
E B 0222 GLU OE1 10.04 C B 0224 GLU OE2
E B 0222 GLU OE2 10.01 C B 0224 GLU OE1
E B 0222 GLU OE2 8.909 C B 0224 GLU OE2
C B 0224 GLU OE2 10.66 H B 0241 ASP OD2
H B 0233 GLU OE1 7.270 H B 0237 GLU OE1
H B 0233 GLU OE1 5.452 H B 0237 GLU OE2
H B 0233 GLU OE2 8.906 H B 0237 GLU OE1
H B 0233 GLU OE2 7.136 H B 0237 GLU OE2
H B 0237 GLU OE1 9.065 H B 0241 ASP OD1
H B 0237 GLU OE1 9.239 H B 0241 ASP OD2
H B 0237 GLU OE2 10.11 H B 0241 ASP OD1
H B 0237 GLU OE2 10.23 H B 0241 ASP OD2
H B 0240 LYS NZ 9.734 H B 0247 ARG NH1
H B 0241 ASP OD1 6.186 C B 0256 ASP OD1
H B 0241 ASP OD1 4.242 C B 0256 ASP OD2
H B 0241 ASP OD2 7.893 C B 0256 ASP OD1
H B 0241 ASP OD2 6.045 C B 0256 ASP OD2
C B 0250 ASP OD1 11.86 C B 0254 GLU OE1
C B 0250 ASP OD1 10.97 C B 0256 ASP OD1
C B 0252 GLU OE1 6.823 C B 0254 GLU OE1
C B 0252 GLU OE1 8.803 C B 0254 GLU OE2
C B 0252 GLU OE2 5.236 C B 0254 GLU OE1
C B 0252 GLU OE2 6.991 C B 0254 GLU OE2
C B 0254 GLU OE1 8.649 C B 0256 ASP OD1
C B 0254 GLU OE1 10.77 C B 0256 ASP OD2
C B 0254 GLU OE2 8.699 C B 0256 ASP OD1
C B 0254 GLU OE2 10.77 C B 0256 ASP OD2
HB_MM 2.00 3.20 97
C B 0202 GLY N 2.261 C B 0201 MET O
C B 0203 LYS N 2.262 C B 0202 GLY O
C B 0204 ALA N 2.261 C B 0203 LYS O
C B 0205 THR N 2.263 C B 0204 ALA O
E B 0206 TYR N 2.262 C B 0205 THR O
E B 0206 TYR N 2.685 E B 0223 THR O
E B 0207 THR N 2.262 E B 0206 TYR O
E B 0208 VAL N 2.262 E B 0207 THR O
E B 0208 VAL N 2.912 E B 0221 TYR O
E B 0209 THR N 2.261 E B 0208 VAL O
E B 0210 VAL N 2.262 E B 0209 THR O
E B 0210 VAL N 2.542 E B 0219 VAL O
E B 0211 THR N 2.262 E B 0210 VAL O
E B 0212 ASN N 2.262 E B 0211 THR O
E B 0212 ASN N 2.590 C B 0217 VAL O
C B 0213 ASN N 2.261 E B 0212 ASN O
C B 0214 SER N 2.822 E B 0212 ASN O
C B 0214 SER N 2.261 C B 0213 ASN O
C B 0215 ASN N 2.795 E B 0212 ASN O
C B 0215 ASN N 2.262 C B 0214 SER O
C B 0216 GLY N 2.366 E B 0212 ASN O
C B 0216 GLY N 2.262 C B 0215 ASN O
C B 0217 VAL N 2.904 C B 0215 ASN O
C B 0217 VAL N 2.262 C B 0216 GLY O
E B 0218 SER N 2.262 C B 0217 VAL O
E B 0219 VAL N 2.703 E B 0210 VAL O
E B 0219 VAL N 2.262 E B 0218 SER O
E B 0220 ASP N 2.261 E B 0219 VAL O
E B 0221 TYR N 2.951 E B 0208 VAL O
E B 0221 TYR N 2.262 E B 0220 ASP O
E B 0222 GLU N 2.262 E B 0221 TYR O
E B 0223 THR N 2.791 E B 0206 TYR O
E B 0223 THR N 2.261 E B 0222 GLU O
C B 0224 GLU N 2.261 E B 0223 THR O
C B 0225 THR N 2.262 C B 0224 GLU O
C B 0226 PRO N 2.292 C B 0225 THR O
H B 0227 MET N 2.261 C B 0226 PRO O
H B 0228 THR N 2.261 H B 0227 MET O
H B 0229 LEU N 3.022 H B 0227 MET O
H B 0229 LEU N 2.262 H B 0228 THR O
H B 0230 LEU N 2.675 H B 0227 MET O
H B 0230 LEU N 2.898 H B 0228 THR O
H B 0230 LEU N 2.261 H B 0229 LEU O
H B 0231 VAL N 2.523 H B 0228 THR O
H B 0231 VAL N 2.261 H B 0230 LEU O
H B 0232 PRO N 2.292 H B 0231 VAL O
H B 0233 GLU N 2.261 H B 0232 PRO O
H B 0234 VAL N 2.261 H B 0233 GLU O
H B 0235 ALA N 2.735 H B 0231 VAL O
H B 0235 ALA N 2.261 H B 0234 VAL O
H B 0236 ALA N 2.386 H B 0232 PRO O
H B 0236 ALA N 2.263 H B 0235 ALA O
H B 0237 GLU N 2.262 H B 0236 ALA O
H B 0238 VAL N 2.685 H B 0234 VAL O
H B 0238 VAL N 3.060 H B 0235 ALA O
H B 0238 VAL N 2.262 H B 0237 GLU O
H B 0239 ILE N 2.564 H B 0235 ALA O
H B 0239 ILE N 2.261 H B 0238 VAL O
H B 0240 LYS N 2.607 H B 0236 ALA O
H B 0240 LYS N 2.263 H B 0239 ILE O
H B 0241 ASP N 2.473 H B 0237 GLU O
H B 0241 ASP N 2.262 H B 0240 LYS O
H B 0242 LEU N 3.020 H B 0238 VAL O
H B 0242 LEU N 2.262 H B 0241 ASP O
H B 0243 VAL N 2.934 H B 0239 ILE O
H B 0243 VAL N 2.261 H B 0242 LEU O
H B 0244 ASN N 2.442 H B 0240 LYS O
H B 0244 ASN N 2.261 H B 0243 VAL O
H B 0245 THR N 2.749 H B 0241 ASP O
H B 0245 THR N 3.153 H B 0242 LEU O
H B 0245 THR N 3.129 H B 0243 VAL O
H B 0245 THR N 2.261 H B 0244 ASN O
H B 0246 VAL N 2.843 H B 0242 LEU O
H B 0246 VAL N 2.984 H B 0243 VAL O
H B 0246 VAL N 2.262 H B 0245 THR O
H B 0247 ARG N 2.734 H B 0243 VAL O
H B 0247 ARG N 2.261 H B 0246 VAL O
H B 0248 SER N 2.781 H B 0244 ASN O
H B 0248 SER N 3.007 H B 0245 THR O
H B 0248 SER N 2.262 H B 0247 ARG O
H B 0249 TYR N 3.046 H B 0247 ARG O
H B 0249 TYR N 2.261 H B 0248 SER O
C B 0250 ASP N 2.629 H B 0247 ARG O
C B 0250 ASP N 2.262 H B 0249 TYR O
C B 0251 THR N 3.063 H B 0247 ARG O
C B 0251 THR N 2.261 C B 0250 ASP O
C B 0252 GLU N 2.262 C B 0251 THR O
C B 0253 ASN N 3.011 C B 0251 THR O
C B 0253 ASN N 2.261 C B 0252 GLU O
C B 0254 GLU N 2.262 C B 0253 ASN O
C B 0255 HIS N 2.261 C B 0254 GLU O
C B 0256 ASP N 2.262 C B 0255 HIS O
C B 0257 VAL N 2.262 C B 0256 ASP O
C B 0258 CYS N 3.113 C B 0256 ASP O
C B 0258 CYS N 2.262 C B 0257 VAL O
C B 0259 GLY N 2.262 C B 0258 CYS O
C B 0260 TRP N 2.262 C B 0259 GLY O
HB_MS 2.00 3.20 7
E B 0219 VAL N 2.925 E B 0218 SER OG
H B 0240 LYS O 2.955 H B 0244 ASN ND2
H B 0241 ASP O 2.593 H B 0245 THR OG1
H B 0245 THR O 2.588 H B 0248 SER OG
H B 0248 SER O 2.949 C B 0251 THR OG1
H B 0249 TYR N 2.902 H B 0248 SER OG
C B 0253 ASN O 2.679 C B 0251 THR OG1
HB_SS 2.00 3.20 1
C B 0251 THR OG1 2.657 C B 0253 ASN OD1