Complet list of 1exk con file
Complete list of 1exk.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 297
C A 0001 GLY C 2.479 C A 0002 VAL CA
C A 0001 GLY C 3.038 C A 0002 VAL C
C A 0001 GLY C 3.750 C A 0002 VAL CB
C A 0002 VAL C 2.489 C A 0003 THR CA
C A 0002 VAL C 3.125 C A 0003 THR C
C A 0002 VAL C 3.691 C A 0003 THR CB
C A 0003 THR C 2.472 C A 0004 LYS CA
C A 0003 THR C 3.287 C A 0004 LYS C
C A 0003 THR C 3.656 C A 0004 LYS CB
C A 0004 LYS C 2.476 C A 0005 GLU CA
C A 0004 LYS C 3.132 C A 0005 GLU C
C A 0004 LYS C 3.701 C A 0005 GLU CB
C A 0005 GLU C 2.467 C A 0006 ILE CA
C A 0005 GLU C 3.150 C A 0006 ILE C
C A 0005 GLU C 3.731 C A 0006 ILE CB
C A 0006 ILE CA 3.735 C A 0007 ARG CZ
C A 0006 ILE C 2.502 C A 0007 ARG CA
C A 0006 ILE C 3.219 C A 0007 ARG C
C A 0006 ILE C 3.741 C A 0007 ARG CB
C A 0006 ILE C 3.696 C A 0007 ARG CZ
C A 0007 ARG C 2.476 C A 0008 ILE CA
C A 0007 ARG C 3.541 C A 0008 ILE C
C A 0007 ARG C 3.410 C A 0008 ILE CB
C A 0007 ARG C 3.794 C A 0009 PRO CD
C A 0008 ILE CA 2.944 C A 0009 PRO CD
C A 0008 ILE C 2.478 C A 0009 PRO CA
C A 0008 ILE C 3.017 C A 0009 PRO C
C A 0008 ILE C 3.661 C A 0009 PRO CB
C A 0008 ILE C 3.691 C A 0009 PRO CG
C A 0008 ILE C 2.497 C A 0009 PRO CD
C A 0009 PRO C 2.464 C A 0010 THR CA
C A 0009 PRO C 3.652 C A 0010 THR C
C A 0009 PRO C 3.215 C A 0010 THR CB
C A 0010 THR C 2.450 E A 0011 LEU CA
C A 0010 THR C 3.250 E A 0011 LEU C
C A 0010 THR C 3.658 E A 0011 LEU CB
E A 0011 LEU C 2.466 E A 0012 GLU CA
E A 0011 LEU C 3.585 E A 0012 GLU C
E A 0011 LEU C 3.376 E A 0012 GLU CB
E A 0011 LEU C 3.339 E A 0012 GLU CG
E A 0012 GLU CA 3.798 E A 0013 GLU CA
E A 0012 GLU C 2.435 E A 0013 GLU CA
E A 0012 GLU C 3.051 E A 0013 GLU C
E A 0012 GLU C 3.718 E A 0013 GLU CB
E A 0012 GLU CD 3.639 C A 0078 ARG CB
E A 0012 GLU CD 3.587 C A 0078 ARG CG
E A 0013 GLU CA 3.798 C A 0014 CYS CA
E A 0013 GLU C 2.411 C A 0014 CYS CA
E A 0013 GLU C 3.060 C A 0014 CYS C
E A 0013 GLU C 3.665 C A 0014 CYS CB
C A 0014 CYS C 2.498 H A 0015 ASP CA
C A 0014 CYS C 2.978 H A 0015 ASP C
C A 0014 CYS C 3.736 H A 0015 ASP CB
C A 0014 CYS CB 3.707 C A 0074 GLY C
H A 0015 ASP C 2.476 H A 0016 VAL CA
H A 0015 ASP C 3.010 H A 0016 VAL C
H A 0015 ASP C 3.716 H A 0016 VAL CB
H A 0016 VAL C 2.460 H A 0017 CYS CA
H A 0016 VAL C 3.362 H A 0017 CYS C
H A 0016 VAL C 3.622 H A 0017 CYS CB
H A 0016 VAL CG1 3.725 C A 0024 PRO CG
H A 0016 VAL CG1 3.723 C A 0024 PRO CD
H A 0016 VAL CG2 3.765 H A 0069 LYS CD
H A 0017 CYS C 2.472 H A 0018 HIS CA
H A 0017 CYS C 2.998 H A 0018 HIS C
H A 0017 CYS C 3.110 H A 0018 HIS CB
H A 0017 CYS C 3.438 H A 0018 HIS CG
H A 0017 CYS CB 3.787 H A 0067 CYS CB
H A 0018 HIS C 2.447 C A 0019 GLY CA
H A 0018 HIS C 3.199 C A 0019 GLY C
C A 0019 GLY C 2.439 C A 0020 SER CA
C A 0019 GLY C 3.163 C A 0020 SER C
C A 0019 GLY C 3.707 C A 0020 SER CB
C A 0020 SER C 2.479 C A 0021 GLY CA
C A 0020 SER C 3.718 C A 0021 GLY C
C A 0020 SER CB 3.635 C A 0028 PRO CG
C A 0020 SER C 3.772 C A 0074 GLY CA
C A 0021 GLY C 2.447 C A 0022 ALA CA
C A 0021 GLY C 3.210 C A 0022 ALA C
C A 0021 GLY C 3.675 C A 0022 ALA CB
C A 0021 GLY CA 3.759 C A 0063 ILE CD1
C A 0021 GLY C 3.704 C A 0063 ILE CD1
C A 0021 GLY C 3.765 H A 0067 CYS CB
C A 0021 GLY CA 3.727 C A 0074 GLY CA
C A 0022 ALA C 2.456 C A 0023 LYS CA
C A 0022 ALA C 2.997 C A 0023 LYS C
C A 0022 ALA C 3.754 C A 0023 LYS CB
C A 0022 ALA CB 3.618 C A 0027 GLN C
C A 0022 ALA CB 3.619 C A 0028 PRO CA
C A 0022 ALA CB 3.697 C A 0028 PRO CG
C A 0022 ALA CB 3.616 C A 0028 PRO CD
C A 0022 ALA C 3.753 H A 0067 CYS CB
C A 0023 LYS CA 2.984 C A 0024 PRO CD
C A 0023 LYS C 2.475 C A 0024 PRO CA
C A 0023 LYS C 2.997 C A 0024 PRO C
C A 0023 LYS C 3.699 C A 0024 PRO CB
C A 0023 LYS C 3.634 C A 0024 PRO CG
C A 0023 LYS C 2.507 C A 0024 PRO CD
C A 0023 LYS CB 3.483 C A 0024 PRO CD
C A 0023 LYS CG 3.670 C A 0066 PRO C
C A 0024 PRO C 2.482 C A 0025 GLY CA
C A 0024 PRO C 3.191 C A 0025 GLY C
C A 0025 GLY C 2.498 C A 0026 THR CA
C A 0025 GLY C 3.122 C A 0026 THR C
C A 0025 GLY C 3.696 C A 0026 THR CB
C A 0026 THR C 2.457 C A 0027 GLN CA
C A 0026 THR C 3.043 C A 0027 GLN C
C A 0026 THR C 3.717 C A 0027 GLN CB
C A 0026 THR CG2 3.397 C A 0065 ASP CG
C A 0027 GLN CA 2.980 C A 0028 PRO CD
C A 0027 GLN C 2.445 C A 0028 PRO CA
C A 0027 GLN C 2.927 C A 0028 PRO C
C A 0027 GLN C 3.674 C A 0028 PRO CB
C A 0027 GLN C 3.683 C A 0028 PRO CG
C A 0027 GLN C 2.521 C A 0028 PRO CD
C A 0027 GLN CB 3.420 C A 0028 PRO CD
C A 0028 PRO CA 3.798 E A 0029 GLN CA
C A 0028 PRO C 2.421 E A 0029 GLN CA
C A 0028 PRO C 3.158 E A 0029 GLN C
C A 0028 PRO C 3.640 E A 0029 GLN CB
C A 0028 PRO CB 3.642 E A 0061 THR CB
E A 0029 GLN C 2.461 E A 0030 THR CA
E A 0029 GLN C 2.938 E A 0030 THR C
E A 0029 GLN C 3.695 E A 0030 THR CB
E A 0029 GLN CG 3.622 C A 0064 LYS CB
E A 0029 GLN CG 3.746 C A 0064 LYS CE
E A 0030 THR C 2.421 C A 0031 CYS CA
E A 0030 THR C 2.985 C A 0031 CYS C
E A 0030 THR C 3.708 C A 0031 CYS CB
E A 0030 THR CG2 3.528 C A 0036 GLY CA
C A 0031 CYS CA 2.999 C A 0032 PRO CD
C A 0031 CYS C 2.439 C A 0032 PRO CA
C A 0031 CYS C 3.086 C A 0032 PRO C
C A 0031 CYS C 3.646 C A 0032 PRO CB
C A 0031 CYS C 3.693 C A 0032 PRO CG
C A 0031 CYS C 2.513 C A 0032 PRO CD
C A 0031 CYS CB 3.739 C A 0060 GLY C
C A 0032 PRO C 2.490 C A 0033 THR CA
C A 0032 PRO C 3.025 C A 0033 THR C
C A 0032 PRO C 3.711 C A 0033 THR CB
C A 0033 THR C 2.472 C A 0034 CYS CA
C A 0033 THR C 3.506 C A 0034 CYS C
C A 0033 THR C 3.526 C A 0034 CYS CB
C A 0034 CYS C 2.471 C A 0035 HIS CA
C A 0034 CYS C 2.933 C A 0035 HIS C
C A 0034 CYS C 3.177 C A 0035 HIS CB
C A 0034 CYS C 3.779 C A 0035 HIS CG
C A 0034 CYS CB 3.764 C A 0038 GLY C
C A 0034 CYS CB 3.377 E A 0039 GLN C
C A 0035 HIS C 2.480 C A 0036 GLY CA
C A 0035 HIS C 3.135 C A 0036 GLY C
C A 0036 GLY C 2.470 C A 0037 SER CA
C A 0036 GLY C 3.334 C A 0037 SER C
C A 0036 GLY C 3.631 C A 0037 SER CB
C A 0037 SER C 2.467 C A 0038 GLY CA
C A 0037 SER C 3.228 C A 0038 GLY C
C A 0038 GLY C 2.466 E A 0039 GLN CA
C A 0038 GLY C 3.539 E A 0039 GLN C
C A 0038 GLY C 3.444 E A 0039 GLN CB
E A 0039 GLN C 2.456 E A 0040 VAL CA
E A 0039 GLN C 3.185 E A 0040 VAL C
E A 0039 GLN C 3.699 E A 0040 VAL CB
E A 0039 GLN CD 3.584 E A 0050 GLN CB
E A 0039 GLN CD 3.762 E A 0050 GLN CG
E A 0040 VAL C 2.436 E A 0041 GLN CA
E A 0040 VAL C 3.282 E A 0041 GLN C
E A 0040 VAL C 3.606 E A 0041 GLN CB
E A 0040 VAL CG2 3.694 E A 0051 GLN CB
E A 0041 GLN C 2.463 E A 0042 MET CA
E A 0041 GLN C 3.105 E A 0042 MET C
E A 0041 GLN C 3.697 E A 0042 MET CB
E A 0042 MET C 2.497 E A 0043 ARG CA
E A 0042 MET C 3.200 E A 0043 ARG C
E A 0042 MET C 3.712 E A 0043 ARG CB
E A 0042 MET CG 3.629 E A 0044 GLN CD
E A 0043 ARG C 2.473 E A 0044 GLN CA
E A 0043 ARG C 3.165 E A 0044 GLN C
E A 0043 ARG C 3.689 E A 0044 GLN CB
E A 0044 GLN C 2.445 C A 0045 GLY CA
E A 0044 GLN C 3.037 C A 0045 GLY C
C A 0045 GLY C 2.468 C A 0046 PHE CA
C A 0045 GLY C 3.043 C A 0046 PHE C
C A 0045 GLY C 3.729 C A 0046 PHE CB
C A 0046 PHE C 2.454 E A 0047 PHE CA
C A 0046 PHE C 3.193 E A 0047 PHE C
C A 0046 PHE C 3.673 E A 0047 PHE CB
E A 0047 PHE C 2.454 E A 0048 ALA CA
E A 0047 PHE C 3.210 E A 0048 ALA C
E A 0047 PHE C 3.675 E A 0048 ALA CB
E A 0048 ALA C 2.459 E A 0049 VAL CA
E A 0048 ALA C 3.213 E A 0049 VAL C
E A 0048 ALA C 3.690 E A 0049 VAL CB
E A 0049 VAL C 2.446 E A 0050 GLN CA
E A 0049 VAL C 3.508 E A 0050 GLN C
E A 0049 VAL C 3.485 E A 0050 GLN CB
E A 0050 GLN C 2.480 E A 0051 GLN CA
E A 0050 GLN C 3.584 E A 0051 GLN C
E A 0050 GLN C 3.397 E A 0051 GLN CB
E A 0050 GLN C 3.354 E A 0051 GLN CG
E A 0051 GLN C 2.428 E A 0052 THR CA
E A 0051 GLN C 2.979 E A 0052 THR C
E A 0051 GLN C 3.697 E A 0052 THR CB
E A 0052 THR C 2.428 C A 0053 CYS CA
E A 0052 THR C 3.063 C A 0053 CYS C
E A 0052 THR C 3.697 C A 0053 CYS CB
E A 0052 THR CG2 3.504 C A 0058 GLY CA
C A 0053 CYS CA 2.995 C A 0054 PRO CD
C A 0053 CYS C 2.445 C A 0054 PRO CA
C A 0053 CYS C 3.110 C A 0054 PRO C
C A 0053 CYS C 3.653 C A 0054 PRO CB
C A 0053 CYS C 3.697 C A 0054 PRO CG
C A 0053 CYS C 2.513 C A 0054 PRO CD
C A 0054 PRO C 2.484 C A 0055 HIS CA
C A 0054 PRO C 3.016 C A 0055 HIS C
C A 0054 PRO C 3.735 C A 0055 HIS CB
C A 0055 HIS C 2.470 C A 0056 CYS CA
C A 0055 HIS C 3.505 C A 0056 CYS C
C A 0055 HIS C 3.520 C A 0056 CYS CB
C A 0055 HIS CE1 3.478 E A 0062 LEU CD2
C A 0056 CYS C 2.474 C A 0057 GLN CA
C A 0056 CYS C 2.970 C A 0057 GLN C
C A 0056 CYS C 3.181 C A 0057 GLN CB
C A 0056 CYS C 3.743 C A 0057 GLN CG
C A 0056 CYS C 3.304 C A 0057 GLN CD
C A 0057 GLN C 2.459 C A 0058 GLY CA
C A 0057 GLN C 3.207 C A 0058 GLY C
C A 0058 GLY C 2.468 C A 0059 ARG CA
C A 0058 GLY C 3.238 C A 0059 ARG C
C A 0058 GLY C 3.699 C A 0059 ARG CB
C A 0059 ARG C 2.477 C A 0060 GLY CA
C A 0059 ARG C 3.137 C A 0060 GLY C
C A 0060 GLY C 2.472 E A 0061 THR CA
C A 0060 GLY C 3.592 E A 0061 THR C
C A 0060 GLY C 3.394 E A 0061 THR CB
C A 0060 GLY C 3.593 E A 0061 THR CG2
E A 0061 THR C 2.466 E A 0062 LEU CA
E A 0061 THR C 3.395 E A 0062 LEU C
E A 0061 THR C 3.600 E A 0062 LEU CB
E A 0062 LEU C 2.478 C A 0063 ILE CA
E A 0062 LEU C 3.143 C A 0063 ILE C
E A 0062 LEU C 3.710 C A 0063 ILE CB
C A 0063 ILE C 2.455 C A 0064 LYS CA
C A 0063 ILE C 2.972 C A 0064 LYS C
C A 0063 ILE C 3.717 C A 0064 LYS CB
C A 0063 ILE CG2 3.693 C A 0066 PRO CA
C A 0064 LYS C 2.482 C A 0065 ASP CA
C A 0064 LYS C 3.461 C A 0065 ASP C
C A 0064 LYS C 3.520 C A 0065 ASP CB
C A 0065 ASP CA 2.986 C A 0066 PRO CD
C A 0065 ASP C 2.444 C A 0066 PRO CA
C A 0065 ASP C 3.126 C A 0066 PRO C
C A 0065 ASP C 3.653 C A 0066 PRO CB
C A 0065 ASP C 3.684 C A 0066 PRO CG
C A 0065 ASP C 2.502 C A 0066 PRO CD
C A 0066 PRO C 2.467 H A 0067 CYS CA
C A 0066 PRO C 3.024 H A 0067 CYS C
C A 0066 PRO C 3.718 H A 0067 CYS CB
C A 0066 PRO CB 3.593 C A 0072 GLY CA
H A 0067 CYS C 2.485 H A 0068 ASN CA
H A 0067 CYS C 2.975 H A 0068 ASN C
H A 0067 CYS C 3.745 H A 0068 ASN CB
H A 0068 ASN C 2.482 H A 0069 LYS CA
H A 0068 ASN C 2.999 H A 0069 LYS C
H A 0068 ASN C 3.735 H A 0069 LYS CB
H A 0069 LYS C 2.463 H A 0070 CYS CA
H A 0069 LYS C 3.511 H A 0070 CYS C
H A 0069 LYS C 3.485 H A 0070 CYS CB
H A 0070 CYS C 2.472 H A 0071 HIS CA
H A 0070 CYS C 2.953 H A 0071 HIS C
H A 0070 CYS C 3.188 H A 0071 HIS CB
H A 0070 CYS CB 3.591 E A 0076 VAL CG1
H A 0071 HIS C 2.447 C A 0072 GLY CA
H A 0071 HIS C 3.223 C A 0072 GLY C
C A 0072 GLY C 2.445 C A 0073 HIS CA
C A 0072 GLY C 3.045 C A 0073 HIS C
C A 0072 GLY C 3.731 C A 0073 HIS CB
C A 0073 HIS C 2.476 C A 0074 GLY CA
C A 0073 HIS C 3.552 C A 0074 GLY C
C A 0074 GLY CA 3.721 E A 0075 ARG CZ
C A 0074 GLY C 2.461 E A 0075 ARG CA
C A 0074 GLY C 3.620 E A 0075 ARG C
C A 0074 GLY C 3.256 E A 0075 ARG CB
C A 0074 GLY C 3.548 E A 0075 ARG CZ
E A 0075 ARG C 2.452 E A 0076 VAL CA
E A 0075 ARG C 3.638 E A 0076 VAL C
E A 0075 ARG C 3.295 E A 0076 VAL CB
E A 0075 ARG C 3.277 E A 0076 VAL CG1
E A 0076 VAL CA 3.799 E A 0077 GLU CA
E A 0076 VAL C 2.437 E A 0077 GLU CA
E A 0076 VAL C 3.085 E A 0077 GLU C
E A 0076 VAL C 3.692 E A 0077 GLU CB
E A 0077 GLU C 2.445 C A 0078 ARG CA
E A 0077 GLU C 2.915 C A 0078 ARG C
E A 0077 GLU C 3.706 C A 0078 ARG CB
C A 0078 ARG C 2.464 C A 0079 SER CA
C A 0078 ARG C 3.695 C A 0079 SER C
C A 0078 ARG C 3.098 C A 0079 SER CB
CHARGE_ATTR 2.00 12.00 46
C A 0005 GLU OE1 6.140 C A 0004 LYS NZ
C A 0005 GLU OE2 6.786 C A 0004 LYS NZ
C A 0005 GLU OE1 7.153 C A 0007 ARG NH1
C A 0005 GLU OE1 9.286 C A 0007 ARG NH2
C A 0005 GLU OE2 7.985 C A 0007 ARG NH1
C A 0005 GLU OE2 10.01 C A 0007 ARG NH2
C A 0005 GLU OE2 11.94 C A 0078 ARG NH2
E A 0012 GLU OE1 7.489 H A 0069 LYS NZ
E A 0012 GLU OE2 9.433 H A 0069 LYS NZ
E A 0012 GLU OE1 6.103 C A 0078 ARG NH1
E A 0012 GLU OE1 7.675 C A 0078 ARG NH2
E A 0012 GLU OE2 4.835 C A 0078 ARG NH1
E A 0012 GLU OE2 6.652 C A 0078 ARG NH2
E A 0013 GLU OE1 10.00 H A 0018 HIS ND1
E A 0013 GLU OE2 9.558 H A 0018 HIS ND1
E A 0013 GLU OE2 11.61 H A 0018 HIS NE2
E A 0013 GLU OE1 9.371 H A 0069 LYS NZ
E A 0013 GLU OE2 10.97 H A 0069 LYS NZ
E A 0013 GLU OE1 10.46 E A 0075 ARG NH1
E A 0013 GLU OE1 9.439 E A 0075 ARG NH2
E A 0013 GLU OE2 10.88 E A 0075 ARG NH1
E A 0013 GLU OE2 9.525 E A 0075 ARG NH2
E A 0013 GLU OE1 10.45 C A 0078 ARG NH1
H A 0015 ASP OD1 7.257 H A 0018 HIS ND1
H A 0015 ASP OD1 9.199 H A 0018 HIS NE2
H A 0015 ASP OD2 6.872 H A 0018 HIS ND1
H A 0015 ASP OD2 8.728 H A 0018 HIS NE2
H A 0015 ASP OD1 3.292 H A 0069 LYS NZ
H A 0015 ASP OD2 4.769 H A 0069 LYS NZ
H A 0015 ASP OD1 11.55 E A 0075 ARG NH2
C A 0065 ASP OD1 11.48 H A 0018 HIS NE2
C A 0065 ASP OD2 11.24 H A 0018 HIS ND1
C A 0065 ASP OD2 10.26 H A 0018 HIS NE2
C A 0065 ASP OD1 8.036 C A 0023 LYS NZ
C A 0065 ASP OD2 6.088 C A 0023 LYS NZ
C A 0065 ASP OD1 10.72 C A 0059 ARG NH1
C A 0065 ASP OD1 11.18 C A 0059 ARG NH2
C A 0065 ASP OD2 11.72 C A 0059 ARG NH1
C A 0065 ASP OD1 5.454 C A 0064 LYS NZ
C A 0065 ASP OD2 7.226 C A 0064 LYS NZ
E A 0077 GLU OE2 11.86 C A 0007 ARG NH1
E A 0077 GLU OE2 11.28 C A 0007 ARG NH2
E A 0077 GLU OE1 8.530 C A 0078 ARG NH1
E A 0077 GLU OE1 8.757 C A 0078 ARG NH2
E A 0077 GLU OE2 7.493 C A 0078 ARG NH1
E A 0077 GLU OE2 7.242 C A 0078 ARG NH2
CHARGE_REPU 2.00 12.00 52
C A 0004 LYS NZ 10.68 C A 0007 ARG NH1
C A 0007 ARG NH1 9.708 C A 0078 ARG NH1
C A 0007 ARG NH1 7.483 C A 0078 ARG NH2
C A 0007 ARG NH2 8.169 C A 0078 ARG NH1
C A 0007 ARG NH2 6.128 C A 0078 ARG NH2
E A 0012 GLU OE1 6.262 E A 0013 GLU OE1
E A 0012 GLU OE1 8.434 E A 0013 GLU OE2
E A 0012 GLU OE2 6.409 E A 0013 GLU OE1
E A 0012 GLU OE2 8.367 E A 0013 GLU OE2
E A 0012 GLU OE1 7.220 H A 0015 ASP OD1
E A 0012 GLU OE1 8.486 H A 0015 ASP OD2
E A 0012 GLU OE2 8.740 H A 0015 ASP OD1
E A 0012 GLU OE2 9.646 H A 0015 ASP OD2
E A 0012 GLU OE1 10.19 E A 0077 GLU OE1
E A 0012 GLU OE1 9.668 E A 0077 GLU OE2
E A 0012 GLU OE2 10.75 E A 0077 GLU OE1
E A 0012 GLU OE2 10.14 E A 0077 GLU OE2
E A 0013 GLU OE1 6.952 H A 0015 ASP OD1
E A 0013 GLU OE1 7.795 H A 0015 ASP OD2
E A 0013 GLU OE2 8.182 H A 0015 ASP OD1
E A 0013 GLU OE2 8.656 H A 0015 ASP OD2
H A 0018 HIS ND1 9.683 H A 0069 LYS NZ
H A 0018 HIS NE2 11.31 H A 0069 LYS NZ
H A 0018 HIS ND1 11.17 E A 0075 ARG NH2
C A 0023 LYS NZ 9.885 H A 0071 HIS ND1
C A 0023 LYS NZ 11.89 H A 0071 HIS NE2
C A 0035 HIS ND1 8.160 E A 0043 ARG NH1
C A 0035 HIS ND1 8.060 E A 0043 ARG NH2
C A 0035 HIS NE2 7.760 E A 0043 ARG NH1
C A 0035 HIS NE2 7.712 E A 0043 ARG NH2
C A 0055 HIS ND1 8.885 C A 0059 ARG NH1
C A 0055 HIS ND1 7.200 C A 0059 ARG NH2
C A 0055 HIS NE2 10.40 C A 0059 ARG NH1
C A 0055 HIS NE2 8.978 C A 0059 ARG NH2
C A 0055 HIS NE2 11.56 C A 0064 LYS NZ
C A 0059 ARG NH1 11.70 C A 0073 HIS ND1
C A 0059 ARG NH1 11.82 C A 0073 HIS NE2
C A 0059 ARG NH2 11.28 C A 0073 HIS ND1
C A 0059 ARG NH2 11.07 C A 0073 HIS NE2
C A 0059 ARG NH1 8.245 E A 0075 ARG NH1
C A 0059 ARG NH1 7.646 E A 0075 ARG NH2
C A 0059 ARG NH2 8.949 E A 0075 ARG NH1
C A 0059 ARG NH2 8.902 E A 0075 ARG NH2
H A 0069 LYS NZ 11.14 H A 0071 HIS ND1
H A 0071 HIS ND1 5.928 C A 0073 HIS ND1
H A 0071 HIS ND1 7.535 C A 0073 HIS NE2
H A 0071 HIS NE2 6.539 C A 0073 HIS ND1
H A 0071 HIS NE2 7.666 C A 0073 HIS NE2
C A 0073 HIS ND1 7.019 E A 0075 ARG NH1
C A 0073 HIS ND1 8.581 E A 0075 ARG NH2
C A 0073 HIS NE2 7.495 E A 0075 ARG NH1
C A 0073 HIS NE2 9.389 E A 0075 ARG NH2
HB_MM 2.00 3.20 142
C A 0002 VAL N 2.254 C A 0001 GLY O
C A 0003 THR N 2.967 C A 0001 GLY O
C A 0003 THR N 2.256 C A 0002 VAL O
C A 0004 LYS N 2.813 C A 0001 GLY O
C A 0004 LYS N 2.251 C A 0003 THR O
C A 0005 GLU N 2.795 C A 0001 GLY O
C A 0005 GLU N 2.249 C A 0004 LYS O
C A 0006 ILE N 2.772 C A 0004 LYS O
C A 0006 ILE N 2.249 C A 0005 GLU O
C A 0007 ARG N 2.730 C A 0005 GLU O
C A 0007 ARG N 2.251 C A 0006 ILE O
C A 0008 ILE N 2.769 C A 0006 ILE O
C A 0008 ILE N 2.237 C A 0007 ARG O
C A 0009 PRO N 2.250 C A 0008 ILE O
C A 0010 THR N 2.245 C A 0009 PRO O
E A 0011 LEU N 2.256 C A 0010 THR O
E A 0012 GLU N 2.259 E A 0011 LEU O
E A 0012 GLU N 2.809 E A 0076 VAL O
E A 0013 GLU N 2.260 E A 0012 GLU O
C A 0014 CYS N 2.239 E A 0013 GLU O
C A 0014 CYS N 2.827 C A 0074 GLY O
H A 0015 ASP N 2.799 E A 0013 GLU O
H A 0015 ASP N 2.261 C A 0014 CYS O
H A 0016 VAL N 2.996 C A 0014 CYS O
H A 0016 VAL N 2.251 H A 0015 ASP O
H A 0017 CYS N 2.810 C A 0014 CYS O
H A 0017 CYS N 2.245 H A 0016 VAL O
H A 0018 HIS N 3.006 C A 0014 CYS O
H A 0018 HIS N 2.783 H A 0015 ASP O
H A 0018 HIS N 2.243 H A 0017 CYS O
C A 0019 GLY N 2.955 C A 0014 CYS O
C A 0019 GLY N 3.102 H A 0017 CYS O
C A 0019 GLY N 2.251 H A 0018 HIS O
C A 0020 SER N 2.910 H A 0017 CYS O
C A 0020 SER N 2.249 C A 0019 GLY O
C A 0021 GLY N 2.262 C A 0020 SER O
C A 0022 ALA N 2.240 C A 0021 GLY O
C A 0023 LYS N 2.234 C A 0022 ALA O
C A 0023 LYS N 3.065 C A 0065 ASP O
C A 0024 PRO N 2.246 C A 0023 LYS O
C A 0025 GLY N 2.261 C A 0024 PRO O
C A 0026 THR N 3.181 C A 0023 LYS O
C A 0026 THR N 2.762 C A 0024 PRO O
C A 0026 THR N 2.249 C A 0025 GLY O
C A 0027 GLN N 2.732 C A 0025 GLY O
C A 0027 GLN N 2.240 C A 0026 THR O
C A 0028 PRO N 2.256 C A 0027 GLN O
E A 0029 GLN N 2.250 C A 0028 PRO O
E A 0029 GLN N 2.855 E A 0062 LEU O
E A 0030 THR N 2.249 E A 0029 GLN O
C A 0031 CYS N 3.135 E A 0029 GLN O
C A 0031 CYS N 2.245 E A 0030 THR O
C A 0031 CYS N 2.860 C A 0060 GLY O
C A 0032 PRO N 3.095 E A 0030 THR O
C A 0032 PRO N 2.246 C A 0031 CYS O
C A 0033 THR N 2.251 C A 0032 PRO O
C A 0034 CYS N 3.042 C A 0032 PRO O
C A 0034 CYS N 2.253 C A 0033 THR O
C A 0035 HIS N 2.828 C A 0032 PRO O
C A 0035 HIS N 2.245 C A 0034 CYS O
C A 0036 GLY N 2.821 C A 0031 CYS O
C A 0036 GLY N 3.159 C A 0034 CYS O
C A 0036 GLY N 2.250 C A 0035 HIS O
C A 0037 SER N 2.779 C A 0034 CYS O
C A 0037 SER N 2.839 C A 0035 HIS O
C A 0037 SER N 2.240 C A 0036 GLY O
C A 0038 GLY N 2.242 C A 0037 SER O
E A 0039 GLN N 3.021 C A 0037 SER O
E A 0039 GLN N 2.242 C A 0038 GLY O
E A 0040 VAL N 2.250 E A 0039 GLN O
E A 0040 VAL N 2.788 E A 0051 GLN O
E A 0041 GLN N 2.250 E A 0040 VAL O
E A 0042 MET N 2.254 E A 0041 GLN O
E A 0042 MET N 2.673 E A 0049 VAL O
E A 0043 ARG N 2.767 E A 0041 GLN O
E A 0043 ARG N 2.251 E A 0042 MET O
E A 0044 GLN N 2.736 E A 0042 MET O
E A 0044 GLN N 2.243 E A 0043 ARG O
C A 0045 GLY N 2.809 E A 0043 ARG O
C A 0045 GLY N 2.248 E A 0044 GLN O
C A 0046 PHE N 2.252 C A 0045 GLY O
E A 0047 PHE N 2.245 C A 0046 PHE O
E A 0048 ALA N 2.804 C A 0046 PHE O
E A 0048 ALA N 2.248 E A 0047 PHE O
E A 0049 VAL N 2.818 E A 0047 PHE O
E A 0049 VAL N 2.252 E A 0048 ALA O
E A 0050 GLN N 2.247 E A 0049 VAL O
E A 0051 GLN N 2.842 E A 0040 VAL O
E A 0051 GLN N 2.261 E A 0050 GLN O
E A 0052 THR N 2.240 E A 0051 GLN O
C A 0053 CYS N 2.832 C A 0038 GLY O
C A 0053 CYS N 2.240 E A 0052 THR O
C A 0054 PRO N 2.249 C A 0053 CYS O
C A 0055 HIS N 2.256 C A 0054 PRO O
C A 0056 CYS N 3.082 C A 0054 PRO O
C A 0056 CYS N 2.262 C A 0055 HIS O
C A 0057 GLN N 3.168 C A 0053 CYS O
C A 0057 GLN N 2.876 C A 0054 PRO O
C A 0057 GLN N 2.244 C A 0056 CYS O
C A 0058 GLY N 2.820 C A 0053 CYS O
C A 0058 GLY N 3.041 C A 0056 CYS O
C A 0058 GLY N 2.242 C A 0057 GLN O
C A 0059 ARG N 2.791 C A 0056 CYS O
C A 0059 ARG N 3.102 C A 0057 GLN O
C A 0059 ARG N 2.234 C A 0058 GLY O
C A 0060 GLY N 2.243 C A 0059 ARG O
E A 0061 THR N 2.908 C A 0059 ARG O
E A 0061 THR N 2.245 C A 0060 GLY O
E A 0062 LEU N 2.780 E A 0029 GLN O
E A 0062 LEU N 2.246 E A 0061 THR O
C A 0063 ILE N 2.261 E A 0062 LEU O
C A 0064 LYS N 2.834 E A 0062 LEU O
C A 0064 LYS N 2.243 C A 0063 ILE O
C A 0065 ASP N 2.256 C A 0064 LYS O
C A 0066 PRO N 2.233 C A 0065 ASP O
H A 0067 CYS N 2.792 C A 0021 GLY O
H A 0067 CYS N 2.249 C A 0066 PRO O
H A 0068 ASN N 2.918 C A 0066 PRO O
H A 0068 ASN N 2.262 H A 0067 CYS O
H A 0069 LYS N 3.119 H A 0067 CYS O
H A 0069 LYS N 2.255 H A 0068 ASN O
H A 0070 CYS N 2.962 H A 0067 CYS O
H A 0070 CYS N 3.016 H A 0068 ASN O
H A 0070 CYS N 2.250 H A 0069 LYS O
H A 0071 HIS N 2.918 H A 0067 CYS O
H A 0071 HIS N 2.854 H A 0068 ASN O
H A 0071 HIS N 2.249 H A 0070 CYS O
C A 0072 GLY N 2.959 H A 0067 CYS O
C A 0072 GLY N 3.064 H A 0070 CYS O
C A 0072 GLY N 2.243 H A 0071 HIS O
C A 0073 HIS N 2.862 H A 0070 CYS O
C A 0073 HIS N 3.159 H A 0071 HIS O
C A 0073 HIS N 2.241 C A 0072 GLY O
C A 0074 GLY N 2.260 C A 0073 HIS O
E A 0075 ARG N 2.236 C A 0074 GLY O
E A 0076 VAL N 2.857 E A 0012 GLU O
E A 0076 VAL N 2.261 E A 0075 ARG O
E A 0077 GLU N 2.255 E A 0076 VAL O
C A 0078 ARG N 2.842 C A 0010 THR O
C A 0078 ARG N 2.256 E A 0077 GLU O
C A 0079 SER N 2.985 E A 0077 GLU O
C A 0079 SER N 2.249 C A 0078 ARG O
HB_MS 2.00 3.20 33
C A 0001 GLY N 2.932 C A 0003 THR OG1
C A 0002 VAL O 2.784 C A 0007 ARG NH1
C A 0005 GLU O 2.904 C A 0007 ARG NH1
C A 0006 ILE O 2.728 C A 0078 ARG NH2
C A 0008 ILE O 2.996 C A 0010 THR OG1
C A 0008 ILE O 2.688 C A 0078 ARG NH2
C A 0009 PRO O 2.788 C A 0010 THR OG1
H A 0015 ASP O 2.819 H A 0018 HIS ND1
H A 0016 VAL N 2.931 H A 0015 ASP OD1
H A 0017 CYS O 2.709 C A 0020 SER OG
C A 0019 GLY O 2.718 E A 0075 ARG NH2
C A 0020 SER O 3.062 E A 0075 ARG NH2
C A 0021 GLY N 2.691 C A 0020 SER OG
C A 0023 LYS N 2.935 C A 0065 ASP OD2
C A 0024 PRO O 3.154 C A 0026 THR OG1
C A 0027 GLN O 2.807 E A 0029 GLN NE2
C A 0028 PRO O 2.830 C A 0027 GLN NE2
C A 0032 PRO O 2.802 C A 0035 HIS ND1
C A 0035 HIS O 2.938 C A 0037 SER OG
E A 0041 GLN O 2.743 E A 0043 ARG NH1
E A 0042 MET O 3.071 E A 0044 GLN NE2
E A 0047 PHE O 2.820 E A 0044 GLN NE2
E A 0048 ALA O 2.808 E A 0041 GLN NE2
C A 0054 PRO O 2.732 C A 0057 GLN NE2
C A 0055 HIS O 2.783 C A 0057 GLN NE2
C A 0059 ARG O 2.806 E A 0061 THR OG1
E A 0061 THR O 2.702 C A 0059 ARG NH1
E A 0061 THR O 3.171 C A 0059 ARG NH2
H A 0068 ASN O 2.813 H A 0071 HIS ND1
H A 0069 LYS N 2.757 H A 0068 ASN OD1
H A 0070 CYS O 2.779 C A 0073 HIS ND1
C A 0073 HIS O 2.697 E A 0075 ARG NH1
E A 0077 GLU O 2.792 C A 0079 SER OG
HB_SS 2.00 3.20 5
E A 0050 GLN NE2 2.825 E A 0039 GLN OE1
C A 0059 ARG NH2 2.761 C A 0057 GLN OE1
C A 0059 ARG NH1 3.028 E A 0061 THR OG1
C A 0064 LYS NZ 2.967 E A 0029 GLN OE1
C A 0078 ARG NH1 2.735 C A 0010 THR OG1
AROMATIC 0.00 8.00 1
E A 0075 ARG 6.565 C A 0073 HIS