Complet list of 1iw4 con file
Complete list of 1iw4.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 312
C A 0001 ALA C 2.434 C A 0002 HIS CA
C A 0001 ALA C 3.056 C A 0002 HIS C
C A 0001 ALA C 3.708 C A 0002 HIS CB
C A 0001 ALA CA 3.231 E A 0048 GLU CG
C A 0001 ALA CA 3.602 E A 0048 GLU CD
C A 0001 ALA C 3.541 E A 0048 GLU CG
C A 0002 HIS CA 3.799 C A 0003 MET CA
C A 0002 HIS C 2.439 C A 0003 MET CA
C A 0002 HIS C 3.201 C A 0003 MET C
C A 0002 HIS C 3.683 C A 0003 MET CB
C A 0002 HIS CD2 3.743 C A 0046 GLY C
C A 0003 MET C 2.464 C A 0004 ASP CA
C A 0003 MET C 2.916 C A 0004 ASP C
C A 0003 MET C 3.714 C A 0004 ASP CB
C A 0003 MET CA 3.585 E A 0049 TYR CE1
C A 0003 MET C 3.471 E A 0049 TYR CE1
C A 0003 MET C 3.609 E A 0049 TYR CZ
C A 0003 MET CB 3.575 E A 0049 TYR CD1
C A 0003 MET CB 3.124 E A 0049 TYR CE1
C A 0004 ASP C 2.438 C A 0005 CYS CA
C A 0004 ASP C 3.467 C A 0005 CYS C
C A 0004 ASP C 3.522 C A 0005 CYS CB
C A 0005 CYS C 2.443 C A 0006 THR CA
C A 0005 CYS C 3.076 C A 0006 THR C
C A 0005 CYS C 3.712 C A 0006 THR CB
C A 0005 CYS CB 3.726 C A 0007 GLU CG
C A 0005 CYS CA 3.655 H A 0036 MET CE
C A 0005 CYS CB 3.667 H A 0040 CYS CB
C A 0006 THR C 2.470 C A 0007 GLU CA
C A 0006 THR C 2.942 C A 0007 GLU C
C A 0006 THR C 3.729 C A 0007 GLU CB
C A 0006 THR CA 3.399 C A 0008 PHE CE2
C A 0006 THR CA 3.373 C A 0008 PHE CZ
C A 0006 THR C 3.584 C A 0008 PHE CG
C A 0006 THR C 3.721 C A 0008 PHE CD1
C A 0006 THR C 3.495 C A 0008 PHE CD2
C A 0006 THR C 3.782 C A 0008 PHE CE1
C A 0006 THR C 3.559 C A 0008 PHE CE2
C A 0006 THR C 3.704 C A 0008 PHE CZ
C A 0006 THR CG2 3.171 C A 0008 PHE CE1
C A 0006 THR CG2 3.211 C A 0008 PHE CZ
C A 0006 THR CG2 3.539 C A 0011 LEU CA
C A 0006 THR CG2 3.355 C A 0011 LEU C
C A 0007 GLU C 2.442 C A 0008 PHE CA
C A 0007 GLU C 3.690 C A 0008 PHE C
C A 0007 GLU C 3.145 C A 0008 PHE CB
C A 0007 GLU C 3.556 C A 0008 PHE CG
C A 0008 PHE C 2.424 C A 0009 ASN CA
C A 0008 PHE C 3.078 C A 0009 ASN C
C A 0008 PHE C 3.701 C A 0009 ASN CB
C A 0008 PHE CD1 3.621 C A 0010 PRO CG
C A 0008 PHE CD1 3.256 C A 0010 PRO CD
C A 0008 PHE CE1 3.531 C A 0010 PRO C
C A 0008 PHE CE1 3.389 C A 0010 PRO CG
C A 0008 PHE CE1 3.619 C A 0010 PRO CD
C A 0009 ASN CA 2.972 C A 0010 PRO CD
C A 0009 ASN C 2.462 C A 0010 PRO CA
C A 0009 ASN C 3.184 C A 0010 PRO C
C A 0009 ASN C 3.635 C A 0010 PRO CB
C A 0009 ASN C 3.662 C A 0010 PRO CG
C A 0009 ASN C 2.522 C A 0010 PRO CD
C A 0009 ASN CB 2.916 C A 0010 PRO CD
C A 0010 PRO C 2.446 C A 0011 LEU CA
C A 0010 PRO C 2.915 C A 0011 LEU C
C A 0010 PRO C 3.729 C A 0011 LEU CB
C A 0010 PRO C 3.769 C A 0011 LEU CD1
C A 0011 LEU C 2.463 C A 0012 CYS CA
C A 0011 LEU C 2.863 C A 0012 CYS C
C A 0011 LEU C 3.692 C A 0012 CYS CB
C A 0011 LEU CD2 3.733 C A 0012 CYS CA
C A 0011 LEU CD2 3.704 C A 0012 CYS C
C A 0012 CYS CA 3.776 C A 0013 ARG CA
C A 0012 CYS C 2.425 C A 0013 ARG CA
C A 0012 CYS C 3.220 C A 0013 ARG C
C A 0012 CYS C 3.637 C A 0013 ARG CB
C A 0012 CYS CA 3.478 H A 0037 CYS CB
C A 0012 CYS CB 2.989 H A 0037 CYS C
C A 0012 CYS CB 3.689 H A 0037 CYS CB
C A 0012 CYS CB 3.162 H A 0038 ALA CA
C A 0012 CYS CB 3.162 H A 0041 CYS CB
C A 0013 ARG CA 3.776 C A 0014 CYS CA
C A 0013 ARG C 2.431 C A 0014 CYS CA
C A 0013 ARG C 3.616 C A 0014 CYS C
C A 0013 ARG C 3.294 C A 0014 CYS CB
C A 0014 CYS C 2.433 C A 0015 ASN CA
C A 0014 CYS C 3.346 C A 0015 ASN C
C A 0014 CYS C 3.598 C A 0015 ASN CB
C A 0015 ASN C 2.484 C A 0016 LYS CA
C A 0015 ASN C 2.863 C A 0016 LYS C
C A 0015 ASN C 3.660 C A 0016 LYS CB
C A 0015 ASN C 3.564 H A 0035 ASN CG
C A 0016 LYS CA 3.792 C A 0017 MET CA
C A 0016 LYS C 2.427 C A 0017 MET CA
C A 0016 LYS C 3.040 C A 0017 MET C
C A 0016 LYS C 3.710 C A 0017 MET CB
C A 0017 MET CA 3.781 C A 0018 LEU CA
C A 0017 MET C 2.425 C A 0018 LEU CA
C A 0017 MET C 3.702 C A 0018 LEU C
C A 0017 MET C 3.032 C A 0018 LEU CB
C A 0017 MET C 3.799 C A 0018 LEU CG
C A 0017 MET CB 3.720 H A 0035 ASN CG
C A 0018 LEU CA 3.785 C A 0019 GLY CA
C A 0018 LEU C 2.409 C A 0019 GLY CA
C A 0018 LEU C 3.713 C A 0019 GLY C
C A 0019 GLY CA 3.799 C A 0020 ASP CA
C A 0019 GLY C 2.435 C A 0020 ASP CA
C A 0019 GLY C 2.969 C A 0020 ASP C
C A 0019 GLY C 3.716 C A 0020 ASP CB
C A 0020 ASP CA 3.794 C A 0021 LEU CA
C A 0020 ASP C 2.438 C A 0021 LEU CA
C A 0020 ASP C 3.694 C A 0021 LEU C
C A 0020 ASP C 3.057 C A 0021 LEU CB
C A 0020 ASP CB 3.785 C A 0034 ARG CA
C A 0020 ASP CB 3.683 C A 0034 ARG C
C A 0021 LEU CA 3.795 E A 0022 ILE CA
C A 0021 LEU C 2.436 E A 0022 ILE CA
C A 0021 LEU C 3.183 E A 0022 ILE C
C A 0021 LEU C 3.702 E A 0022 ILE CB
C A 0021 LEU CD1 3.582 E A 0032 GLU CB
E A 0022 ILE CA 3.788 E A 0023 CYS CA
E A 0022 ILE C 2.435 E A 0023 CYS CA
E A 0022 ILE C 3.497 E A 0023 CYS C
E A 0022 ILE C 3.461 E A 0023 CYS CB
E A 0022 ILE CG2 3.732 E A 0033 HIS CB
E A 0022 ILE CG2 3.782 E A 0033 HIS CD2
E A 0022 ILE CD1 3.585 H A 0036 MET CB
E A 0022 ILE CD1 3.359 H A 0036 MET CG
E A 0022 ILE CG1 3.556 E A 0049 TYR CB
E A 0022 ILE CG2 3.557 E A 0049 TYR CB
E A 0022 ILE CD1 3.387 E A 0049 TYR CB
E A 0022 ILE CD1 3.222 E A 0049 TYR CG
E A 0022 ILE CD1 2.936 E A 0049 TYR CD1
E A 0022 ILE CD1 3.684 E A 0049 TYR CE1
E A 0022 ILE CG1 3.651 C A 0050 SER C
E A 0022 ILE CG1 3.420 C A 0051 ASN CA
E A 0022 ILE CG1 3.644 C A 0051 ASN CG
E A 0022 ILE CD1 3.514 C A 0051 ASN CG
E A 0023 CYS C 2.429 E A 0024 ALA CA
E A 0023 CYS C 3.377 E A 0024 ALA C
E A 0023 CYS C 3.575 E A 0024 ALA CB
E A 0023 CYS C 3.737 E A 0049 TYR CA
E A 0024 ALA CA 3.780 E A 0025 VAL CA
E A 0024 ALA C 2.439 E A 0025 VAL CA
E A 0024 ALA C 3.587 E A 0025 VAL C
E A 0024 ALA C 3.371 E A 0025 VAL CB
E A 0024 ALA CB 3.049 E A 0033 HIS CD2
E A 0024 ALA CB 3.672 H A 0039 LEU CD2
E A 0024 ALA CA 3.777 E A 0048 GLU C
E A 0024 ALA CA 3.534 E A 0049 TYR CA
E A 0024 ALA CA 3.776 E A 0049 TYR CB
E A 0024 ALA CB 3.531 E A 0049 TYR CB
E A 0025 VAL CA 3.791 C A 0026 ILE CA
E A 0025 VAL CA 3.598 C A 0026 ILE CD1
E A 0025 VAL C 2.428 C A 0026 ILE CA
E A 0025 VAL C 3.640 C A 0026 ILE C
E A 0025 VAL C 3.311 C A 0026 ILE CB
E A 0025 VAL C 3.468 C A 0026 ILE CG1
E A 0025 VAL C 3.714 C A 0026 ILE CG2
E A 0025 VAL C 2.997 C A 0026 ILE CD1
E A 0025 VAL CG2 3.720 C A 0030 LYS CA
E A 0025 VAL CG2 3.451 C A 0030 LYS CB
C A 0026 ILE CA 3.791 C A 0027 GLY CA
C A 0026 ILE C 2.429 C A 0027 GLY CA
C A 0026 ILE C 3.096 C A 0027 GLY C
C A 0026 ILE CG1 3.348 C A 0029 ALA CB
C A 0026 ILE CG1 3.474 C A 0047 PHE CE1
C A 0026 ILE CG1 3.428 C A 0047 PHE CZ
C A 0026 ILE CG2 3.070 C A 0047 PHE CD1
C A 0026 ILE CG2 3.101 C A 0047 PHE CE1
C A 0026 ILE CD1 3.747 C A 0047 PHE CD1
C A 0026 ILE CD1 3.572 C A 0047 PHE CD2
C A 0026 ILE CD1 3.398 C A 0047 PHE CE1
C A 0026 ILE CD1 3.202 C A 0047 PHE CE2
C A 0026 ILE CD1 3.108 C A 0047 PHE CZ
C A 0027 GLY CA 3.775 C A 0028 ASP CA
C A 0027 GLY C 2.426 C A 0028 ASP CA
C A 0027 GLY C 3.657 C A 0028 ASP C
C A 0027 GLY C 3.191 C A 0028 ASP CB
C A 0028 ASP CA 3.798 C A 0029 ALA CA
C A 0028 ASP C 2.426 C A 0029 ALA CA
C A 0028 ASP C 3.531 C A 0029 ALA C
C A 0028 ASP C 3.401 C A 0029 ALA CB
C A 0029 ALA CA 3.792 C A 0030 LYS CA
C A 0029 ALA C 2.429 C A 0030 LYS CA
C A 0029 ALA C 3.315 C A 0030 LYS C
C A 0029 ALA C 3.608 C A 0030 LYS CB
C A 0030 LYS C 2.435 E A 0031 GLU CA
C A 0030 LYS C 3.675 E A 0031 GLU C
C A 0030 LYS C 3.190 E A 0031 GLU CB
C A 0030 LYS CD 3.393 C A 0055 GLU CG
C A 0030 LYS CD 3.686 C A 0055 GLU CD
E A 0031 GLU C 2.432 E A 0032 GLU CA
E A 0031 GLU C 3.157 E A 0032 GLU C
E A 0031 GLU C 3.691 E A 0032 GLU CB
E A 0031 GLU CD 3.754 E A 0032 GLU C
E A 0031 GLU C 3.688 E A 0033 HIS CD2
E A 0032 GLU C 2.432 E A 0033 HIS CA
E A 0032 GLU C 3.616 E A 0033 HIS C
E A 0032 GLU C 3.325 E A 0033 HIS CB
E A 0032 GLU C 3.237 E A 0033 HIS CG
E A 0032 GLU C 3.205 E A 0033 HIS CD2
E A 0032 GLU CG 3.157 C A 0055 GLU C
E A 0032 GLU CG 3.438 C A 0055 GLU CB
E A 0032 GLU CG 3.641 C A 0055 GLU CD
E A 0032 GLU CD 3.367 C A 0055 GLU C
E A 0033 HIS CA 3.796 C A 0034 ARG CA
E A 0033 HIS C 2.428 C A 0034 ARG CA
E A 0033 HIS C 3.134 C A 0034 ARG C
E A 0033 HIS C 3.686 C A 0034 ARG CB
E A 0033 HIS CB 3.517 H A 0039 LEU CD2
E A 0033 HIS CG 2.981 H A 0039 LEU CD2
E A 0033 HIS CD2 3.204 H A 0039 LEU CD2
E A 0033 HIS CE1 3.498 H A 0039 LEU CD1
E A 0033 HIS CE1 3.419 H A 0039 LEU CD2
E A 0033 HIS CE1 3.741 C A 0047 PHE CE2
C A 0034 ARG CA 3.791 H A 0035 ASN CA
C A 0034 ARG C 2.427 H A 0035 ASN CA
C A 0034 ARG C 3.135 H A 0035 ASN C
C A 0034 ARG C 3.679 H A 0035 ASN CB
H A 0035 ASN CA 3.793 H A 0036 MET CA
H A 0035 ASN C 2.440 H A 0036 MET CA
H A 0035 ASN C 2.890 H A 0036 MET C
H A 0035 ASN C 3.701 H A 0036 MET CB
H A 0035 ASN CB 3.554 H A 0038 ALA CB
H A 0036 MET CA 3.787 H A 0037 CYS CA
H A 0036 MET C 2.416 H A 0037 CYS CA
H A 0036 MET C 3.051 H A 0037 CYS C
H A 0036 MET C 3.697 H A 0037 CYS CB
H A 0036 MET CE 3.728 H A 0037 CYS CA
H A 0037 CYS C 2.439 H A 0038 ALA CA
H A 0037 CYS C 2.920 H A 0038 ALA C
H A 0037 CYS C 3.714 H A 0038 ALA CB
H A 0038 ALA CA 3.784 H A 0039 LEU CA
H A 0038 ALA C 2.437 H A 0039 LEU CA
H A 0038 ALA C 3.116 H A 0039 LEU C
H A 0038 ALA C 3.670 H A 0039 LEU CB
H A 0039 LEU CA 3.763 H A 0040 CYS CA
H A 0039 LEU C 2.416 H A 0040 CYS CA
H A 0039 LEU C 3.031 H A 0040 CYS C
H A 0039 LEU C 3.673 H A 0040 CYS CB
H A 0039 LEU CG 3.145 C A 0047 PHE CD2
H A 0039 LEU CD1 3.180 C A 0047 PHE CD2
H A 0039 LEU CD1 3.425 C A 0047 PHE CE2
H A 0039 LEU CD2 3.446 C A 0047 PHE CD2
H A 0040 CYS CA 3.780 H A 0041 CYS CA
H A 0040 CYS C 2.415 H A 0041 CYS CA
H A 0040 CYS C 3.228 H A 0041 CYS C
H A 0040 CYS C 3.619 H A 0041 CYS CB
H A 0040 CYS CA 3.275 H A 0043 HIS CD2
H A 0040 CYS C 3.572 H A 0043 HIS CD2
H A 0040 CYS C 3.674 H A 0043 HIS CE1
H A 0041 CYS C 2.437 H A 0042 GLU CA
H A 0041 CYS C 3.498 H A 0042 GLU C
H A 0041 CYS C 3.513 H A 0042 GLU CB
H A 0042 GLU C 2.434 H A 0043 HIS CA
H A 0042 GLU C 3.207 H A 0043 HIS C
H A 0042 GLU C 3.686 H A 0043 HIS CB
H A 0043 HIS CA 2.908 C A 0044 PRO CD
H A 0043 HIS C 2.467 C A 0044 PRO CA
H A 0043 HIS C 3.134 C A 0044 PRO C
H A 0043 HIS C 3.662 C A 0044 PRO CB
H A 0043 HIS C 3.586 C A 0044 PRO CG
H A 0043 HIS C 2.501 C A 0044 PRO CD
H A 0043 HIS CB 3.124 C A 0044 PRO CD
H A 0043 HIS CG 3.779 C A 0046 GLY CA
H A 0043 HIS CD2 3.408 C A 0046 GLY CA
H A 0043 HIS CB 3.774 C A 0047 PHE CB
C A 0044 PRO CA 3.785 C A 0045 GLY CA
C A 0044 PRO C 2.417 C A 0045 GLY CA
C A 0044 PRO C 3.587 C A 0045 GLY C
C A 0044 PRO CG 3.688 C A 0047 PHE CD1
C A 0044 PRO CG 3.283 C A 0047 PHE CE1
C A 0044 PRO CD 2.982 C A 0047 PHE CD1
C A 0044 PRO CD 3.019 C A 0047 PHE CE1
C A 0045 GLY CA 3.776 C A 0046 GLY CA
C A 0045 GLY C 2.418 C A 0046 GLY CA
C A 0045 GLY C 3.404 C A 0046 GLY C
C A 0046 GLY CA 3.800 C A 0047 PHE CA
C A 0046 GLY C 2.437 C A 0047 PHE CA
C A 0046 GLY C 2.922 C A 0047 PHE C
C A 0046 GLY C 3.720 C A 0047 PHE CB
C A 0047 PHE C 2.432 E A 0048 GLU CA
C A 0047 PHE C 3.316 E A 0048 GLU C
C A 0047 PHE C 3.609 E A 0048 GLU CB
E A 0048 GLU CA 3.777 E A 0049 TYR CA
E A 0048 GLU C 2.410 E A 0049 TYR CA
E A 0048 GLU C 3.440 E A 0049 TYR C
E A 0048 GLU C 3.484 E A 0049 TYR CB
E A 0049 TYR CA 3.761 C A 0050 SER CA
E A 0049 TYR C 2.423 C A 0050 SER CA
E A 0049 TYR C 3.551 C A 0050 SER C
E A 0049 TYR C 3.339 C A 0050 SER CB
C A 0050 SER CA 3.771 C A 0051 ASN CA
C A 0050 SER C 2.418 C A 0051 ASN CA
C A 0050 SER C 2.946 C A 0051 ASN C
C A 0050 SER C 3.703 C A 0051 ASN CB
C A 0051 ASN CA 3.763 C A 0052 GLY CA
C A 0051 ASN C 2.415 C A 0052 GLY CA
C A 0051 ASN C 3.603 C A 0052 GLY C
C A 0052 GLY CA 2.913 C A 0053 PRO CD
C A 0052 GLY C 2.466 C A 0053 PRO CA
C A 0052 GLY C 3.134 C A 0053 PRO C
C A 0052 GLY C 3.647 C A 0053 PRO CB
C A 0052 GLY C 3.647 C A 0053 PRO CG
C A 0052 GLY C 2.507 C A 0053 PRO CD
C A 0053 PRO CA 3.799 C A 0054 CYS CA
C A 0053 PRO C 2.438 C A 0054 CYS CA
C A 0053 PRO C 3.463 C A 0054 CYS C
C A 0053 PRO C 3.528 C A 0054 CYS CB
C A 0054 CYS C 2.430 C A 0055 GLU CA
C A 0054 CYS C 3.573 C A 0055 GLU C
C A 0054 CYS C 3.366 C A 0055 GLU CB
CHARGE_ATTR 2.00 12.00 64
C A 0004 ASP OD1 11.89 H A 0043 HIS NE2
C A 0004 ASP OD2 11.97 H A 0043 HIS NE2
C A 0007 GLU OE1 9.950 C A 0002 HIS ND1
C A 0007 GLU OE1 9.971 C A 0002 HIS NE2
C A 0007 GLU OE2 11.27 C A 0002 HIS ND1
C A 0007 GLU OE2 11.60 C A 0002 HIS NE2
C A 0007 GLU OE1 8.377 H A 0043 HIS ND1
C A 0007 GLU OE1 6.627 H A 0043 HIS NE2
C A 0007 GLU OE2 10.15 H A 0043 HIS ND1
C A 0007 GLU OE2 8.308 H A 0043 HIS NE2
C A 0020 ASP OD1 7.725 C A 0016 LYS NZ
C A 0020 ASP OD2 8.659 C A 0016 LYS NZ
C A 0020 ASP OD1 10.17 E A 0033 HIS ND1
C A 0020 ASP OD1 11.49 E A 0033 HIS NE2
C A 0020 ASP OD2 11.08 E A 0033 HIS ND1
C A 0020 ASP OD1 7.955 C A 0034 ARG NH1
C A 0020 ASP OD1 7.039 C A 0034 ARG NH2
C A 0020 ASP OD2 8.937 C A 0034 ARG NH1
C A 0020 ASP OD2 8.011 C A 0034 ARG NH2
C A 0028 ASP OD1 7.917 C A 0030 LYS NZ
C A 0028 ASP OD2 9.381 C A 0030 LYS NZ
E A 0031 GLU OE1 10.85 C A 0030 LYS NZ
E A 0031 GLU OE2 10.92 C A 0030 LYS NZ
E A 0031 GLU OE1 3.843 E A 0033 HIS ND1
E A 0031 GLU OE1 3.844 E A 0033 HIS NE2
E A 0031 GLU OE2 5.285 E A 0033 HIS ND1
E A 0031 GLU OE2 5.434 E A 0033 HIS NE2
E A 0031 GLU OE1 9.529 C A 0034 ARG NH1
E A 0031 GLU OE1 11.48 C A 0034 ARG NH2
E A 0031 GLU OE2 7.786 C A 0034 ARG NH1
E A 0031 GLU OE2 9.854 C A 0034 ARG NH2
E A 0032 GLU OE1 10.42 C A 0030 LYS NZ
E A 0032 GLU OE2 8.332 C A 0030 LYS NZ
E A 0032 GLU OE1 8.688 E A 0033 HIS ND1
E A 0032 GLU OE1 8.439 E A 0033 HIS NE2
E A 0032 GLU OE2 9.203 E A 0033 HIS ND1
E A 0032 GLU OE2 8.474 E A 0033 HIS NE2
E A 0032 GLU OE1 5.104 C A 0034 ARG NH1
E A 0032 GLU OE1 7.377 C A 0034 ARG NH2
E A 0032 GLU OE2 7.264 C A 0034 ARG NH1
E A 0032 GLU OE2 9.513 C A 0034 ARG NH2
H A 0042 GLU OE1 11.48 E A 0033 HIS ND1
H A 0042 GLU OE2 10.06 E A 0033 HIS ND1
H A 0042 GLU OE2 11.59 E A 0033 HIS NE2
H A 0042 GLU OE1 8.952 H A 0043 HIS ND1
H A 0042 GLU OE1 10.48 H A 0043 HIS NE2
H A 0042 GLU OE2 9.527 H A 0043 HIS ND1
H A 0042 GLU OE2 11.08 H A 0043 HIS NE2
E A 0048 GLU OE1 5.742 C A 0002 HIS ND1
E A 0048 GLU OE1 5.748 C A 0002 HIS NE2
E A 0048 GLU OE2 3.759 C A 0002 HIS ND1
E A 0048 GLU OE2 4.353 C A 0002 HIS NE2
E A 0048 GLU OE1 11.90 C A 0030 LYS NZ
E A 0048 GLU OE1 11.22 E A 0033 HIS NE2
E A 0048 GLU OE2 11.47 H A 0043 HIS NE2
C A 0055 GLU OE1 6.115 C A 0030 LYS NZ
C A 0055 GLU OE2 5.361 C A 0030 LYS NZ
C A 0055 GLU OE1 8.653 E A 0033 HIS ND1
C A 0055 GLU OE1 7.393 E A 0033 HIS NE2
C A 0055 GLU OE2 10.83 E A 0033 HIS ND1
C A 0055 GLU OE2 9.502 E A 0033 HIS NE2
C A 0055 GLU OE1 9.276 C A 0034 ARG NH1
C A 0055 GLU OE1 11.49 C A 0034 ARG NH2
C A 0055 GLU OE2 10.24 C A 0034 ARG NH1
CHARGE_REPU 2.00 12.00 36
C A 0002 HIS ND1 10.38 H A 0043 HIS ND1
C A 0002 HIS ND1 9.139 H A 0043 HIS NE2
C A 0002 HIS NE2 8.958 H A 0043 HIS ND1
C A 0002 HIS NE2 8.071 H A 0043 HIS NE2
C A 0004 ASP OD1 9.104 C A 0007 GLU OE1
C A 0004 ASP OD1 7.813 C A 0007 GLU OE2
C A 0004 ASP OD2 9.967 C A 0007 GLU OE1
C A 0004 ASP OD2 8.701 C A 0007 GLU OE2
C A 0004 ASP OD2 10.41 C A 0020 ASP OD2
C A 0013 ARG NH1 10.98 C A 0016 LYS NZ
C A 0013 ARG NH2 8.835 C A 0016 LYS NZ
C A 0016 LYS NZ 11.91 C A 0034 ARG NH2
C A 0020 ASP OD1 11.89 E A 0031 GLU OE2
C A 0020 ASP OD1 11.60 E A 0032 GLU OE1
C A 0028 ASP OD1 11.96 E A 0048 GLU OE1
C A 0030 LYS NZ 10.93 E A 0033 HIS NE2
E A 0031 GLU OE1 6.724 E A 0032 GLU OE1
E A 0031 GLU OE1 6.817 E A 0032 GLU OE2
E A 0031 GLU OE2 4.852 E A 0032 GLU OE1
E A 0031 GLU OE2 5.261 E A 0032 GLU OE2
E A 0031 GLU OE1 11.89 H A 0042 GLU OE2
E A 0031 GLU OE1 6.401 C A 0055 GLU OE1
E A 0031 GLU OE1 8.549 C A 0055 GLU OE2
E A 0031 GLU OE2 5.616 C A 0055 GLU OE1
E A 0031 GLU OE2 7.621 C A 0055 GLU OE2
E A 0032 GLU OE1 4.398 C A 0055 GLU OE1
E A 0032 GLU OE1 5.390 C A 0055 GLU OE2
E A 0032 GLU OE2 2.538 C A 0055 GLU OE1
E A 0032 GLU OE2 3.286 C A 0055 GLU OE2
E A 0033 HIS ND1 10.05 C A 0034 ARG NH1
E A 0033 HIS ND1 11.53 C A 0034 ARG NH2
E A 0033 HIS NE2 10.69 C A 0034 ARG NH1
E A 0033 HIS ND1 10.68 H A 0043 HIS ND1
E A 0033 HIS ND1 10.95 H A 0043 HIS NE2
E A 0033 HIS NE2 10.98 H A 0043 HIS ND1
E A 0033 HIS NE2 11.17 H A 0043 HIS NE2
HB_MM 2.00 3.20 82
C A 0002 HIS N 2.250 C A 0001 ALA O
C A 0003 MET N 2.705 C A 0001 ALA O
C A 0003 MET N 2.251 C A 0002 HIS O
C A 0004 ASP N 2.262 C A 0003 MET O
C A 0005 CYS N 2.968 C A 0003 MET O
C A 0005 CYS N 2.252 C A 0004 ASP O
C A 0006 THR N 2.259 C A 0005 CYS O
C A 0007 GLU N 3.086 C A 0005 CYS O
C A 0007 GLU N 2.262 C A 0006 THR O
C A 0008 PHE N 2.310 C A 0006 THR O
C A 0008 PHE N 2.250 C A 0007 GLU O
C A 0009 ASN N 2.242 C A 0008 PHE O
C A 0010 PRO N 2.246 C A 0009 ASN O
C A 0011 LEU N 2.768 C A 0009 ASN O
C A 0011 LEU N 2.251 C A 0010 PRO O
C A 0012 CYS N 2.265 C A 0011 LEU O
C A 0013 ARG N 2.010 C A 0011 LEU O
C A 0013 ARG N 2.241 C A 0012 CYS O
C A 0014 CYS N 3.096 C A 0012 CYS O
C A 0014 CYS N 2.255 C A 0013 ARG O
C A 0015 ASN N 2.250 C A 0014 CYS O
C A 0016 LYS N 2.267 C A 0015 ASN O
C A 0017 MET N 2.004 C A 0015 ASN O
C A 0017 MET N 2.246 C A 0016 LYS O
C A 0018 LEU N 2.570 C A 0016 LYS O
C A 0018 LEU N 2.243 C A 0017 MET O
C A 0019 GLY N 2.246 C A 0018 LEU O
C A 0020 ASP N 2.250 C A 0019 GLY O
C A 0021 LEU N 2.251 C A 0020 ASP O
E A 0022 ILE N 2.251 C A 0021 LEU O
E A 0022 ILE N 3.191 E A 0033 HIS O
E A 0023 CYS N 2.251 E A 0022 ILE O
E A 0023 CYS N 3.150 C A 0050 SER O
E A 0024 ALA N 2.250 E A 0023 CYS O
E A 0024 ALA N 3.079 E A 0031 GLU O
E A 0025 VAL N 2.257 E A 0024 ALA O
E A 0025 VAL N 2.657 E A 0048 GLU O
C A 0026 ILE N 2.255 E A 0025 VAL O
C A 0026 ILE N 3.108 C A 0029 ALA O
C A 0027 GLY N 2.252 C A 0026 ILE O
C A 0028 ASP N 2.564 C A 0026 ILE O
C A 0028 ASP N 2.247 C A 0027 GLY O
C A 0029 ALA N 3.168 C A 0026 ILE O
C A 0029 ALA N 2.250 C A 0028 ASP O
C A 0030 LYS N 2.249 C A 0029 ALA O
E A 0031 GLU N 2.688 E A 0024 ALA O
E A 0031 GLU N 2.250 C A 0030 LYS O
E A 0032 GLU N 2.250 E A 0031 GLU O
E A 0033 HIS N 2.249 E A 0032 GLU O
C A 0034 ARG N 2.250 E A 0033 HIS O
H A 0035 ASN N 2.249 C A 0034 ARG O
H A 0036 MET N 2.772 C A 0034 ARG O
H A 0036 MET N 2.255 H A 0035 ASN O
H A 0037 CYS N 2.725 H A 0035 ASN O
H A 0037 CYS N 2.246 H A 0036 MET O
H A 0038 ALA N 2.590 H A 0035 ASN O
H A 0038 ALA N 2.250 H A 0037 CYS O
H A 0039 LEU N 2.864 H A 0037 CYS O
H A 0039 LEU N 2.252 H A 0038 ALA O
H A 0040 CYS N 3.089 H A 0036 MET O
H A 0040 CYS N 2.791 H A 0037 CYS O
H A 0040 CYS N 2.239 H A 0039 LEU O
H A 0041 CYS N 2.742 H A 0037 CYS O
H A 0041 CYS N 2.245 H A 0040 CYS O
H A 0042 GLU N 2.830 H A 0038 ALA O
H A 0042 GLU N 2.250 H A 0041 CYS O
H A 0043 HIS N 2.642 H A 0039 LEU O
H A 0043 HIS N 2.240 H A 0042 GLU O
C A 0044 PRO N 2.251 H A 0043 HIS O
C A 0045 GLY N 2.249 C A 0044 PRO O
C A 0046 GLY N 2.254 C A 0045 GLY O
C A 0047 PHE N 2.251 C A 0046 GLY O
E A 0048 GLU N 2.247 C A 0047 PHE O
E A 0049 TYR N 2.240 E A 0048 GLU O
C A 0050 SER N 2.881 E A 0023 CYS O
C A 0050 SER N 2.247 E A 0049 TYR O
C A 0051 ASN N 2.246 C A 0050 SER O
C A 0052 GLY N 2.250 C A 0051 ASN O
C A 0053 PRO N 2.251 C A 0052 GLY O
C A 0054 CYS N 2.689 C A 0052 GLY O
C A 0054 CYS N 2.250 C A 0053 PRO O
C A 0055 GLU N 2.247 C A 0054 CYS O
HB_MS 2.00 3.20 7
C A 0003 MET O 2.476 E A 0049 TYR OH
C A 0004 ASP O 2.328 E A 0049 TYR OH
C A 0005 CYS N 3.056 E A 0049 TYR OH
C A 0015 ASN O 2.472 H A 0035 ASN ND2
C A 0020 ASP O 2.962 C A 0034 ARG NH2
E A 0031 GLU O 2.864 E A 0033 HIS NE2
H A 0040 CYS O 2.707 H A 0043 HIS NE2
AROMATIC 0.00 8.00 1
E A 0033 HIS 5.819 C A 0047 PHE
SS_BOND 1.50 2.80 4
C A 0005 CYS SG 2.028 H A 0040 CYS SG
C A 0012 CYS SG 2.024 H A 0041 CYS SG
C A 0014 CYS SG 2.032 H A 0037 CYS SG
E A 0023 CYS SG 2.030 C A 0054 CYS SG