Complet list of 1wfe con file
Complete list of 1wfe.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 359
C A 0001 GLY CA 3.797 C A 0002 SER CA
C A 0001 GLY C 2.434 C A 0002 SER CA
C A 0001 GLY C 3.674 C A 0002 SER C
C A 0001 GLY C 3.195 C A 0002 SER CB
C A 0002 SER C 2.435 C A 0003 SER CA
C A 0002 SER C 3.682 C A 0003 SER C
C A 0002 SER C 3.172 C A 0003 SER CB
C A 0003 SER CA 3.791 C A 0004 GLY CA
C A 0003 SER C 2.418 C A 0004 GLY CA
C A 0003 SER C 3.717 C A 0004 GLY C
C A 0004 GLY CA 3.797 C A 0005 SER CA
C A 0004 GLY C 2.434 C A 0005 SER CA
C A 0004 GLY C 3.627 C A 0005 SER C
C A 0004 GLY C 3.295 C A 0005 SER CB
C A 0005 SER C 2.434 C A 0006 SER CA
C A 0005 SER C 3.551 C A 0006 SER C
C A 0005 SER C 3.410 C A 0006 SER CB
C A 0006 SER CA 3.792 C A 0007 GLY CA
C A 0006 SER C 2.419 C A 0007 GLY CA
C A 0006 SER C 3.561 C A 0007 GLY C
C A 0007 GLY CA 3.796 C A 0008 CYS CA
C A 0007 GLY C 2.434 C A 0008 CYS CA
C A 0007 GLY C 3.707 C A 0008 CYS C
C A 0007 GLY C 3.073 C A 0008 CYS CB
C A 0008 CYS C 2.434 C A 0009 SER CA
C A 0008 CYS C 3.635 C A 0009 SER C
C A 0008 CYS C 3.282 C A 0009 SER CB
C A 0009 SER C 2.434 C A 0010 GLU CA
C A 0009 SER C 3.083 C A 0010 GLU C
C A 0009 SER C 3.705 C A 0010 GLU CB
C A 0010 GLU C 2.435 C A 0011 VAL CA
C A 0010 GLU C 3.719 C A 0011 VAL C
C A 0010 GLU C 3.041 C A 0011 VAL CB
C A 0010 GLU C 3.614 C A 0011 VAL CG1
C A 0011 VAL C 2.434 C A 0012 ASN CA
C A 0011 VAL C 3.573 C A 0012 ASN C
C A 0011 VAL C 3.380 C A 0012 ASN CB
C A 0011 VAL C 3.301 C A 0012 ASN CG
C A 0012 ASN C 2.435 C A 0013 VAL CA
C A 0012 ASN C 3.581 C A 0013 VAL C
C A 0012 ASN C 3.400 C A 0013 VAL CB
C A 0012 ASN C 3.359 C A 0013 VAL CG2
C A 0013 VAL C 2.435 C A 0014 VAL CA
C A 0013 VAL C 2.982 C A 0014 VAL C
C A 0013 VAL C 3.737 C A 0014 VAL CB
C A 0014 VAL C 2.434 C A 0015 LYS CA
C A 0014 VAL C 2.807 C A 0015 LYS C
C A 0014 VAL C 3.672 C A 0015 LYS CB
C A 0014 VAL CG1 3.703 C A 0015 LYS CD
C A 0015 LYS C 2.434 C A 0016 GLU CA
C A 0015 LYS C 3.177 C A 0016 GLU C
C A 0015 LYS C 3.680 C A 0016 GLU CB
C A 0016 GLU C 2.434 C A 0017 ARG CA
C A 0016 GLU C 3.151 C A 0017 ARG C
C A 0016 GLU C 3.688 C A 0017 ARG CB
C A 0017 ARG CA 2.866 C A 0018 PRO CD
C A 0017 ARG C 2.463 C A 0018 PRO CA
C A 0017 ARG C 3.135 C A 0018 PRO C
C A 0017 ARG C 3.646 C A 0018 PRO CB
C A 0017 ARG C 3.635 C A 0018 PRO CG
C A 0017 ARG C 2.499 C A 0018 PRO CD
C A 0017 ARG CB 3.289 C A 0018 PRO CD
C A 0018 PRO C 2.435 C A 0019 LYS CA
C A 0018 PRO C 2.826 C A 0019 LYS C
C A 0018 PRO C 3.683 C A 0019 LYS CB
C A 0019 LYS C 2.434 C A 0020 THR CA
C A 0019 LYS C 3.436 C A 0020 THR C
C A 0019 LYS C 3.555 C A 0020 THR CB
C A 0019 LYS C 3.670 C A 0020 THR CG2
C A 0020 THR C 2.434 C A 0021 ASP CA
C A 0020 THR C 2.903 C A 0021 ASP C
C A 0020 THR C 3.708 C A 0021 ASP CB
C A 0021 ASP C 2.434 C A 0022 GLU CA
C A 0021 ASP C 3.042 C A 0022 GLU C
C A 0021 ASP C 3.712 C A 0022 GLU CB
C A 0022 GLU C 2.435 C A 0023 HIS CA
C A 0022 GLU C 3.412 C A 0023 HIS C
C A 0022 GLU C 3.549 C A 0023 HIS CB
C A 0023 HIS C 2.434 C A 0024 LYS CA
C A 0023 HIS C 3.701 C A 0024 LYS C
C A 0023 HIS C 3.108 C A 0024 LYS CB
C A 0024 LYS C 2.434 C A 0025 SER CA
C A 0024 LYS C 3.550 C A 0025 SER C
C A 0024 LYS C 3.411 C A 0025 SER CB
C A 0025 SER C 2.433 E A 0026 TYR CA
C A 0025 SER C 3.384 E A 0026 TYR C
C A 0025 SER C 3.570 E A 0026 TYR CB
C A 0025 SER C 3.743 E A 0026 TYR CG
C A 0025 SER C 3.677 E A 0026 TYR CD1
E A 0026 TYR C 2.434 E A 0027 SER CA
E A 0026 TYR C 3.212 E A 0027 SER C
E A 0026 TYR C 3.667 E A 0027 SER CB
E A 0026 TYR C 3.769 E A 0036 VAL CB
E A 0026 TYR C 3.591 E A 0036 VAL CG1
E A 0026 TYR CD1 3.349 C A 0039 VAL C
E A 0026 TYR CE1 3.615 C A 0039 VAL C
E A 0026 TYR CG 3.712 C A 0040 ALA CA
E A 0026 TYR CG 3.224 C A 0040 ALA CB
E A 0026 TYR CD1 3.594 C A 0040 ALA CA
E A 0026 TYR CD1 3.343 C A 0040 ALA CB
E A 0026 TYR CD2 3.130 C A 0040 ALA CB
E A 0026 TYR CE1 3.393 C A 0040 ALA CB
E A 0026 TYR CE2 3.181 C A 0040 ALA CB
E A 0026 TYR CZ 3.310 C A 0040 ALA CB
E A 0026 TYR CB 3.586 E A 0049 ASN CG
E A 0027 SER C 2.434 C A 0028 CYS CA
E A 0027 SER C 3.076 C A 0028 CYS C
E A 0027 SER C 3.706 C A 0028 CYS CB
E A 0027 SER CA 3.419 E A 0036 VAL CG1
C A 0028 CYS C 2.434 C A 0029 SER CA
C A 0028 CYS C 3.335 C A 0029 SER C
C A 0028 CYS C 3.603 C A 0029 SER CB
C A 0029 SER C 2.434 C A 0030 PHE CA
C A 0029 SER C 3.363 C A 0030 PHE C
C A 0029 SER C 3.586 C A 0030 PHE CB
C A 0029 SER C 3.783 E A 0050 PHE CD2
C A 0029 SER C 3.614 E A 0050 PHE CE2
C A 0029 SER CB 3.614 E A 0050 PHE CE2
C A 0030 PHE C 2.435 C A 0031 LYS CA
C A 0030 PHE C 3.091 C A 0031 LYS C
C A 0030 PHE C 3.704 C A 0031 LYS CB
C A 0030 PHE CD2 3.628 C A 0031 LYS C
C A 0030 PHE CE2 3.700 C A 0031 LYS C
C A 0030 PHE CD2 3.787 C A 0032 GLY C
C A 0030 PHE CD2 3.611 C A 0033 CYS CB
C A 0030 PHE CD2 3.697 H A 0054 HIS CE1
C A 0030 PHE CD1 3.541 H A 0060 HIS CA
C A 0030 PHE CD1 3.773 H A 0060 HIS C
C A 0031 LYS CA 3.792 C A 0032 GLY CA
C A 0031 LYS C 2.417 C A 0032 GLY CA
C A 0031 LYS C 3.459 C A 0032 GLY C
C A 0032 GLY CA 3.797 C A 0033 CYS CA
C A 0032 GLY C 2.434 C A 0033 CYS CA
C A 0032 GLY C 3.657 C A 0033 CYS C
C A 0032 GLY C 3.236 C A 0033 CYS CB
C A 0033 CYS C 2.435 C A 0034 THR CA
C A 0033 CYS C 3.547 C A 0034 THR C
C A 0033 CYS C 3.445 C A 0034 THR CB
C A 0033 CYS C 3.515 C A 0034 THR CG2
C A 0034 THR C 2.435 C A 0035 ASP CA
C A 0034 THR C 3.374 C A 0035 ASP C
C A 0034 THR C 3.577 C A 0035 ASP CB
C A 0035 ASP C 2.435 E A 0036 VAL CA
C A 0035 ASP C 3.550 E A 0036 VAL C
C A 0035 ASP C 3.440 E A 0036 VAL CB
C A 0035 ASP C 3.450 E A 0036 VAL CG1
E A 0036 VAL C 2.434 E A 0037 GLU CA
E A 0036 VAL C 3.662 E A 0037 GLU C
E A 0036 VAL C 3.226 E A 0037 GLU CB
E A 0036 VAL C 3.196 E A 0037 GLU CG
E A 0036 VAL C 3.512 E A 0037 GLU CD
E A 0037 GLU C 2.434 C A 0038 LEU CA
E A 0037 GLU C 2.973 C A 0038 LEU C
E A 0037 GLU C 3.714 C A 0038 LEU CB
C A 0038 LEU C 2.434 C A 0039 VAL CA
C A 0038 LEU C 3.249 C A 0039 VAL C
C A 0038 LEU C 3.675 C A 0039 VAL CB
C A 0039 VAL C 2.433 C A 0040 ALA CA
C A 0039 VAL C 3.485 C A 0040 ALA C
C A 0039 VAL C 3.475 C A 0040 ALA CB
C A 0040 ALA C 2.434 E A 0041 VAL CA
C A 0040 ALA C 3.120 E A 0041 VAL C
C A 0040 ALA C 3.720 E A 0041 VAL CB
E A 0041 VAL C 2.433 E A 0042 ILE CA
E A 0041 VAL C 3.311 E A 0042 ILE C
E A 0041 VAL C 3.643 E A 0042 ILE CB
E A 0041 VAL CG1 3.646 H A 0055 ARG CB
E A 0042 ILE C 2.434 C A 0043 CYS CA
E A 0042 ILE C 3.277 C A 0043 CYS C
E A 0042 ILE C 3.638 C A 0043 CYS CB
E A 0042 ILE CD1 3.523 C A 0048 LYS C
E A 0042 ILE CD1 3.375 E A 0049 ASN CA
E A 0042 ILE CD1 3.387 E A 0049 ASN CB
C A 0043 CYS CA 2.866 C A 0044 PRO CD
C A 0043 CYS C 2.464 C A 0044 PRO CA
C A 0043 CYS C 3.136 C A 0044 PRO C
C A 0043 CYS C 3.645 C A 0044 PRO CB
C A 0043 CYS C 3.635 C A 0044 PRO CG
C A 0043 CYS C 2.498 C A 0044 PRO CD
C A 0043 CYS CB 3.798 E A 0050 PHE CE1
C A 0044 PRO C 2.434 C A 0045 TYR CA
C A 0044 PRO C 3.429 C A 0045 TYR C
C A 0044 PRO C 3.536 C A 0045 TYR CB
C A 0044 PRO C 3.701 C A 0045 TYR CG
C A 0044 PRO C 3.485 C A 0045 TYR CD1
C A 0044 PRO CG 3.451 C A 0045 TYR CD1
C A 0044 PRO CG 3.469 C A 0045 TYR CE1
C A 0045 TYR C 2.434 C A 0046 CYS CA
C A 0045 TYR C 3.263 C A 0046 CYS C
C A 0045 TYR C 3.645 C A 0046 CYS CB
C A 0045 TYR CG 3.470 H A 0057 GLN CD
C A 0045 TYR CD1 3.391 H A 0057 GLN CD
C A 0045 TYR CD2 3.426 H A 0057 GLN CD
C A 0045 TYR CE1 3.295 H A 0057 GLN CD
C A 0045 TYR CE2 3.330 H A 0057 GLN CD
C A 0045 TYR CZ 3.261 H A 0057 GLN CD
C A 0045 TYR C 3.344 C A 0064 LYS CG
C A 0046 CYS C 2.433 C A 0047 GLU CA
C A 0046 CYS C 2.960 C A 0047 GLU C
C A 0046 CYS C 3.043 C A 0047 GLU CB
C A 0047 GLU C 2.434 C A 0048 LYS CA
C A 0047 GLU C 3.553 C A 0048 LYS C
C A 0047 GLU C 3.408 C A 0048 LYS CB
C A 0047 GLU C 3.536 C A 0048 LYS CG
C A 0048 LYS C 2.434 E A 0049 ASN CA
C A 0048 LYS C 3.263 E A 0049 ASN C
C A 0048 LYS C 3.644 E A 0049 ASN CB
C A 0048 LYS CA 3.686 E A 0050 PHE CE1
C A 0048 LYS C 3.541 E A 0050 PHE CD1
C A 0048 LYS C 3.264 E A 0050 PHE CE1
C A 0048 LYS CB 3.178 E A 0050 PHE CE1
C A 0048 LYS CB 3.157 E A 0050 PHE CZ
E A 0049 ASN C 2.433 E A 0050 PHE CA
E A 0049 ASN C 3.607 E A 0050 PHE C
E A 0049 ASN C 3.329 E A 0050 PHE CB
E A 0049 ASN C 3.247 E A 0050 PHE CG
E A 0049 ASN C 3.297 E A 0050 PHE CD1
E A 0050 PHE C 2.434 H A 0051 CYS CA
E A 0050 PHE C 3.283 H A 0051 CYS C
E A 0050 PHE C 3.635 H A 0051 CYS CB
E A 0050 PHE CD2 3.449 H A 0060 HIS CB
E A 0050 PHE CD2 3.657 H A 0060 HIS CG
E A 0050 PHE CE1 3.774 H A 0060 HIS CE1
E A 0050 PHE CE2 3.577 H A 0060 HIS CB
E A 0050 PHE CE2 3.523 H A 0060 HIS CG
E A 0050 PHE CZ 3.779 H A 0060 HIS CG
H A 0051 CYS C 2.434 H A 0052 LEU CA
H A 0051 CYS C 2.875 H A 0052 LEU C
H A 0051 CYS C 3.701 H A 0052 LEU CB
H A 0052 LEU C 2.434 H A 0053 ARG CA
H A 0052 LEU C 3.038 H A 0053 ARG C
H A 0052 LEU C 3.711 H A 0053 ARG CB
H A 0052 LEU CD1 3.722 H A 0055 ARG CD
H A 0053 ARG C 2.435 H A 0054 HIS CA
H A 0053 ARG C 3.494 H A 0054 HIS C
H A 0053 ARG C 3.475 H A 0054 HIS CB
H A 0053 ARG C 3.578 H A 0054 HIS CG
H A 0053 ARG C 3.397 H A 0054 HIS CD2
H A 0054 HIS C 2.434 H A 0055 ARG CA
H A 0054 HIS C 3.123 H A 0055 ARG C
H A 0054 HIS C 3.695 H A 0055 ARG CB
H A 0055 ARG C 2.434 C A 0056 HIS CA
H A 0055 ARG C 2.994 C A 0056 HIS C
H A 0055 ARG C 3.715 C A 0056 HIS CB
C A 0056 HIS C 2.433 H A 0057 GLN CA
C A 0056 HIS C 3.034 H A 0057 GLN C
C A 0056 HIS C 3.712 H A 0057 GLN CB
C A 0056 HIS CB 3.446 H A 0059 ASP CB
C A 0056 HIS CB 3.388 H A 0059 ASP CG
C A 0056 HIS C 3.587 H A 0060 HIS CE1
H A 0057 GLN C 2.434 H A 0058 SER CA
H A 0057 GLN C 2.919 H A 0058 SER C
H A 0057 GLN C 3.711 H A 0058 SER CB
H A 0057 GLN CA 3.380 H A 0060 HIS CE1
H A 0057 GLN CA 3.772 C A 0062 CYS CB
H A 0057 GLN C 3.643 C A 0062 CYS CB
H A 0057 GLN CB 3.682 C A 0062 CYS CB
H A 0057 GLN C 3.745 C A 0065 LEU CD1
H A 0057 GLN CB 3.787 C A 0065 LEU CD1
H A 0058 SER C 2.434 H A 0059 ASP CA
H A 0058 SER C 2.907 H A 0059 ASP C
H A 0058 SER C 3.708 H A 0059 ASP CB
H A 0058 SER CA 3.273 C A 0065 LEU CD1
H A 0058 SER CB 3.670 C A 0065 LEU CD1
H A 0059 ASP C 2.435 H A 0060 HIS CA
H A 0059 ASP C 3.287 H A 0060 HIS C
H A 0059 ASP C 3.632 H A 0060 HIS CB
H A 0060 HIS C 2.433 H A 0061 ASP CA
H A 0060 HIS C 2.963 H A 0061 ASP C
H A 0060 HIS C 3.040 H A 0061 ASP CB
H A 0060 HIS CD2 3.791 H A 0061 ASP C
H A 0060 HIS CD2 3.317 C A 0062 CYS CA
H A 0060 HIS CD2 3.710 C A 0062 CYS CB
H A 0061 ASP C 2.434 C A 0062 CYS CA
H A 0061 ASP C 2.879 C A 0062 CYS C
H A 0061 ASP C 3.702 C A 0062 CYS CB
C A 0062 CYS C 2.433 C A 0063 GLU CA
C A 0062 CYS C 3.058 C A 0063 GLU C
C A 0062 CYS C 3.709 C A 0063 GLU CB
C A 0062 CYS CB 3.690 C A 0065 LEU CG
C A 0062 CYS CB 3.653 C A 0065 LEU CD1
C A 0063 GLU C 2.434 C A 0064 LYS CA
C A 0063 GLU C 3.052 C A 0064 LYS C
C A 0063 GLU C 3.711 C A 0064 LYS CB
C A 0064 LYS C 2.434 C A 0065 LEU CA
C A 0064 LYS C 2.835 C A 0065 LEU C
C A 0064 LYS C 3.686 C A 0065 LEU CB
C A 0065 LEU C 2.433 C A 0066 GLU CA
C A 0065 LEU C 3.283 C A 0066 GLU C
C A 0065 LEU C 3.635 C A 0066 GLU CB
C A 0066 GLU C 2.435 C A 0067 VAL CA
C A 0066 GLU C 3.617 C A 0067 VAL C
C A 0066 GLU C 3.346 C A 0067 VAL CB
C A 0066 GLU C 3.241 C A 0067 VAL CG2
C A 0067 VAL C 2.433 C A 0068 ALA CA
C A 0067 VAL C 3.106 C A 0068 ALA C
C A 0067 VAL C 3.691 C A 0068 ALA CB
C A 0068 ALA C 2.435 C A 0069 LYS CA
C A 0068 ALA C 3.109 C A 0069 LYS C
C A 0068 ALA C 3.700 C A 0069 LYS CB
C A 0069 LYS CA 2.867 C A 0070 PRO CD
C A 0069 LYS C 2.464 C A 0070 PRO CA
C A 0069 LYS C 3.136 C A 0070 PRO C
C A 0069 LYS C 3.646 C A 0070 PRO CB
C A 0069 LYS C 3.636 C A 0070 PRO CG
C A 0069 LYS C 2.498 C A 0070 PRO CD
C A 0069 LYS CB 3.602 C A 0070 PRO CD
C A 0070 PRO C 2.434 C A 0071 ARG CA
C A 0070 PRO C 3.568 C A 0071 ARG C
C A 0070 PRO C 3.386 C A 0071 ARG CB
C A 0071 ARG C 2.433 C A 0072 MET CA
C A 0071 ARG C 3.373 C A 0072 MET C
C A 0071 ARG C 3.578 C A 0072 MET CB
C A 0072 MET C 2.433 C A 0073 ALA CA
C A 0072 MET C 3.061 C A 0073 ALA C
C A 0072 MET C 3.701 C A 0073 ALA CB
C A 0073 ALA C 2.433 C A 0074 ALA CA
C A 0073 ALA C 3.128 C A 0074 ALA C
C A 0073 ALA C 3.685 C A 0074 ALA CB
C A 0074 ALA C 2.434 C A 0075 THR CA
C A 0074 ALA C 3.498 C A 0075 THR C
C A 0074 ALA C 3.498 C A 0075 THR CB
C A 0075 THR C 2.434 C A 0076 GLN CA
C A 0075 THR C 3.627 C A 0076 GLN C
C A 0075 THR C 3.295 C A 0076 GLN CB
C A 0075 THR C 3.243 C A 0076 GLN CG
C A 0076 GLN C 2.434 C A 0077 LYS CA
C A 0076 GLN C 3.038 C A 0077 LYS C
C A 0076 GLN C 3.712 C A 0077 LYS CB
C A 0077 LYS C 2.435 C A 0078 LEU CA
C A 0077 LYS C 2.848 C A 0078 LEU C
C A 0077 LYS C 3.692 C A 0078 LEU CB
C A 0078 LEU C 2.435 C A 0079 VAL CA
C A 0078 LEU C 3.401 C A 0079 VAL C
C A 0078 LEU C 3.586 C A 0079 VAL CB
C A 0079 VAL C 2.434 C A 0080 ARG CA
C A 0079 VAL C 3.015 C A 0080 ARG C
C A 0079 VAL C 2.985 C A 0080 ARG CB
C A 0080 ARG C 2.434 C A 0081 SER CA
C A 0080 ARG C 3.530 C A 0081 SER C
C A 0080 ARG C 3.435 C A 0081 SER CB
C A 0081 SER CA 3.791 C A 0082 GLY CA
C A 0081 SER C 2.418 C A 0082 GLY CA
C A 0081 SER C 3.633 C A 0082 GLY C
C A 0082 GLY CA 2.865 C A 0083 PRO CD
C A 0082 GLY C 2.464 C A 0083 PRO CA
C A 0082 GLY C 3.136 C A 0083 PRO C
C A 0082 GLY C 3.645 C A 0083 PRO CB
C A 0082 GLY C 3.635 C A 0083 PRO CG
C A 0082 GLY C 2.497 C A 0083 PRO CD
C A 0083 PRO C 2.434 C A 0084 SER CA
C A 0083 PRO C 3.327 C A 0084 SER C
C A 0083 PRO C 3.610 C A 0084 SER CB
C A 0084 SER C 2.435 C A 0085 SER CA
C A 0084 SER C 3.140 C A 0085 SER C
C A 0084 SER C 3.693 C A 0085 SER CB
C A 0085 SER CA 3.792 C A 0086 GLY CA
C A 0085 SER C 2.419 C A 0086 GLY CA
C A 0085 SER C 3.702 C A 0086 GLY C
CHARGE_ATTR 2.00 12.00 82
C A 0016 GLU OE2 11.66 C A 0017 ARG NH1
C A 0016 GLU OE1 10.18 C A 0019 LYS NZ
C A 0016 GLU OE2 9.165 C A 0019 LYS NZ
C A 0021 ASP OD1 8.767 C A 0019 LYS NZ
C A 0021 ASP OD2 9.751 C A 0019 LYS NZ
C A 0021 ASP OD1 11.84 C A 0023 HIS NE2
C A 0022 GLU OE1 9.948 C A 0023 HIS ND1
C A 0022 GLU OE1 11.16 C A 0023 HIS NE2
C A 0022 GLU OE2 10.05 C A 0023 HIS ND1
C A 0022 GLU OE2 11.40 C A 0023 HIS NE2
C A 0022 GLU OE2 11.62 C A 0024 LYS NZ
C A 0035 ASP OD1 10.22 H A 0053 ARG NH1
C A 0035 ASP OD1 9.089 H A 0053 ARG NH2
C A 0035 ASP OD2 9.363 H A 0053 ARG NH1
C A 0035 ASP OD2 8.601 H A 0053 ARG NH2
C A 0035 ASP OD1 8.304 H A 0054 HIS ND1
C A 0035 ASP OD1 8.797 H A 0054 HIS NE2
C A 0035 ASP OD2 6.263 H A 0054 HIS ND1
C A 0035 ASP OD2 6.687 H A 0054 HIS NE2
E A 0037 GLU OE1 11.33 H A 0053 ARG NH1
E A 0037 GLU OE1 10.83 H A 0053 ARG NH2
E A 0037 GLU OE2 10.30 H A 0053 ARG NH1
E A 0037 GLU OE2 9.669 H A 0053 ARG NH2
E A 0037 GLU OE1 11.84 H A 0054 HIS ND1
E A 0037 GLU OE2 10.17 H A 0054 HIS ND1
E A 0037 GLU OE2 10.94 H A 0054 HIS NE2
E A 0037 GLU OE1 11.28 H A 0055 ARG NH1
E A 0037 GLU OE2 11.98 H A 0055 ARG NH1
C A 0047 GLU OE1 9.099 C A 0048 LYS NZ
C A 0047 GLU OE2 8.937 C A 0048 LYS NZ
C A 0047 GLU OE2 11.86 H A 0060 HIS NE2
C A 0047 GLU OE1 9.506 C A 0064 LYS NZ
C A 0047 GLU OE2 7.342 C A 0064 LYS NZ
H A 0059 ASP OD1 10.09 H A 0053 ARG NH1
H A 0059 ASP OD2 8.225 H A 0053 ARG NH1
H A 0059 ASP OD2 10.20 H A 0053 ARG NH2
H A 0059 ASP OD1 8.302 H A 0054 HIS ND1
H A 0059 ASP OD1 7.440 H A 0054 HIS NE2
H A 0059 ASP OD2 6.789 H A 0054 HIS ND1
H A 0059 ASP OD2 5.891 H A 0054 HIS NE2
H A 0059 ASP OD1 10.63 H A 0055 ARG NH1
H A 0059 ASP OD1 9.711 H A 0055 ARG NH2
H A 0059 ASP OD2 9.691 H A 0055 ARG NH1
H A 0059 ASP OD2 9.095 H A 0055 ARG NH2
H A 0059 ASP OD1 4.090 C A 0056 HIS ND1
H A 0059 ASP OD1 5.935 C A 0056 HIS NE2
H A 0059 ASP OD2 4.941 C A 0056 HIS ND1
H A 0059 ASP OD2 6.199 C A 0056 HIS NE2
H A 0059 ASP OD1 7.368 H A 0060 HIS ND1
H A 0059 ASP OD1 8.419 H A 0060 HIS NE2
H A 0059 ASP OD2 7.290 H A 0060 HIS ND1
H A 0059 ASP OD2 8.808 H A 0060 HIS NE2
H A 0061 ASP OD1 9.767 C A 0031 LYS NZ
H A 0061 ASP OD2 7.984 C A 0031 LYS NZ
H A 0061 ASP OD2 11.24 C A 0048 LYS NZ
H A 0061 ASP OD1 11.17 H A 0054 HIS ND1
H A 0061 ASP OD1 11.30 H A 0054 HIS NE2
H A 0061 ASP OD2 11.04 H A 0054 HIS ND1
H A 0061 ASP OD2 11.56 H A 0054 HIS NE2
H A 0061 ASP OD1 9.150 H A 0060 HIS ND1
H A 0061 ASP OD1 8.289 H A 0060 HIS NE2
H A 0061 ASP OD2 8.773 H A 0060 HIS ND1
H A 0061 ASP OD2 7.776 H A 0060 HIS NE2
H A 0061 ASP OD1 7.753 C A 0069 LYS NZ
H A 0061 ASP OD2 7.605 C A 0069 LYS NZ
H A 0061 ASP OD1 10.73 C A 0071 ARG NH1
H A 0061 ASP OD1 9.219 C A 0071 ARG NH2
H A 0061 ASP OD2 10.60 C A 0071 ARG NH1
H A 0061 ASP OD2 8.846 C A 0071 ARG NH2
C A 0063 GLU OE1 9.478 C A 0031 LYS NZ
C A 0063 GLU OE2 11.62 C A 0031 LYS NZ
C A 0063 GLU OE1 4.933 C A 0048 LYS NZ
C A 0063 GLU OE2 6.113 C A 0048 LYS NZ
C A 0063 GLU OE1 9.978 H A 0060 HIS ND1
C A 0063 GLU OE1 8.354 H A 0060 HIS NE2
C A 0063 GLU OE2 10.84 H A 0060 HIS ND1
C A 0063 GLU OE2 8.984 H A 0060 HIS NE2
C A 0063 GLU OE1 8.354 C A 0064 LYS NZ
C A 0063 GLU OE2 6.268 C A 0064 LYS NZ
C A 0066 GLU OE2 11.18 H A 0060 HIS NE2
C A 0066 GLU OE1 9.513 C A 0064 LYS NZ
C A 0066 GLU OE2 7.627 C A 0064 LYS NZ
CHARGE_REPU 2.00 12.00 71
C A 0015 LYS NZ 9.581 C A 0017 ARG NH1
C A 0015 LYS NZ 11.32 C A 0017 ARG NH2
C A 0016 GLU OE2 11.72 C A 0021 ASP OD1
C A 0017 ARG NH2 11.64 C A 0019 LYS NZ
C A 0019 LYS NZ 8.311 C A 0023 HIS ND1
C A 0019 LYS NZ 6.618 C A 0023 HIS NE2
C A 0021 ASP OD1 9.483 C A 0022 GLU OE1
C A 0021 ASP OD1 9.687 C A 0022 GLU OE2
C A 0021 ASP OD2 8.335 C A 0022 GLU OE1
C A 0021 ASP OD2 8.842 C A 0022 GLU OE2
C A 0022 GLU OE1 11.38 C A 0035 ASP OD1
C A 0022 GLU OE2 10.40 C A 0035 ASP OD1
C A 0022 GLU OE1 9.692 E A 0037 GLU OE1
C A 0022 GLU OE1 9.702 E A 0037 GLU OE2
C A 0022 GLU OE2 7.797 E A 0037 GLU OE1
C A 0022 GLU OE2 7.994 E A 0037 GLU OE2
C A 0023 HIS ND1 5.382 C A 0024 LYS NZ
C A 0023 HIS NE2 7.170 C A 0024 LYS NZ
C A 0031 LYS NZ 9.926 C A 0048 LYS NZ
C A 0031 LYS NZ 11.54 H A 0054 HIS ND1
C A 0031 LYS NZ 9.739 C A 0069 LYS NZ
C A 0031 LYS NZ 10.41 C A 0071 ARG NH1
C A 0031 LYS NZ 8.228 C A 0071 ARG NH2
C A 0035 ASP OD1 8.134 E A 0037 GLU OE1
C A 0035 ASP OD1 5.964 E A 0037 GLU OE2
C A 0035 ASP OD2 9.103 E A 0037 GLU OE1
C A 0035 ASP OD2 6.919 E A 0037 GLU OE2
C A 0035 ASP OD2 11.60 H A 0059 ASP OD2
C A 0047 GLU OE1 10.99 C A 0063 GLU OE1
C A 0047 GLU OE1 10.09 C A 0063 GLU OE2
C A 0047 GLU OE2 9.821 C A 0063 GLU OE1
C A 0047 GLU OE2 8.586 C A 0063 GLU OE2
C A 0048 LYS NZ 10.40 H A 0060 HIS ND1
C A 0048 LYS NZ 9.511 H A 0060 HIS NE2
C A 0048 LYS NZ 11.17 C A 0064 LYS NZ
H A 0053 ARG NH1 9.579 H A 0054 HIS ND1
H A 0053 ARG NH1 8.192 H A 0054 HIS NE2
H A 0053 ARG NH2 10.29 H A 0054 HIS ND1
H A 0053 ARG NH2 9.041 H A 0054 HIS NE2
H A 0053 ARG NH1 11.91 H A 0055 ARG NH2
H A 0053 ARG NH1 11.54 C A 0056 HIS ND1
H A 0053 ARG NH1 11.65 C A 0056 HIS NE2
H A 0054 HIS ND1 11.20 C A 0056 HIS ND1
H A 0054 HIS NE2 10.71 C A 0056 HIS ND1
H A 0054 HIS NE2 11.73 C A 0056 HIS NE2
H A 0054 HIS ND1 7.527 H A 0060 HIS ND1
H A 0054 HIS ND1 9.279 H A 0060 HIS NE2
H A 0054 HIS NE2 8.624 H A 0060 HIS ND1
H A 0054 HIS NE2 10.33 H A 0060 HIS NE2
H A 0055 ARG NH1 8.048 C A 0056 HIS ND1
H A 0055 ARG NH1 6.200 C A 0056 HIS NE2
H A 0055 ARG NH2 6.602 C A 0056 HIS ND1
H A 0055 ARG NH2 4.548 C A 0056 HIS NE2
H A 0055 ARG NH1 10.63 H A 0060 HIS ND1
H A 0055 ARG NH2 11.01 H A 0060 HIS ND1
C A 0056 HIS ND1 8.261 H A 0060 HIS ND1
C A 0056 HIS ND1 9.133 H A 0060 HIS NE2
C A 0056 HIS NE2 9.006 H A 0060 HIS ND1
C A 0056 HIS NE2 10.01 H A 0060 HIS NE2
H A 0059 ASP OD1 10.17 H A 0061 ASP OD1
H A 0059 ASP OD1 11.31 H A 0061 ASP OD2
H A 0059 ASP OD2 11.25 H A 0061 ASP OD1
H A 0060 HIS NE2 11.16 C A 0064 LYS NZ
H A 0061 ASP OD1 9.801 C A 0063 GLU OE1
H A 0061 ASP OD1 10.83 C A 0063 GLU OE2
H A 0061 ASP OD2 7.898 C A 0063 GLU OE1
H A 0061 ASP OD2 9.168 C A 0063 GLU OE2
H A 0061 ASP OD1 11.74 C A 0066 GLU OE2
C A 0063 GLU OE2 10.76 C A 0066 GLU OE2
C A 0069 LYS NZ 3.982 C A 0071 ARG NH1
C A 0069 LYS NZ 3.720 C A 0071 ARG NH2
HB_MM 2.00 3.20 110
C A 0002 SER N 2.250 C A 0001 GLY O
C A 0003 SER N 2.250 C A 0002 SER O
C A 0004 GLY N 2.251 C A 0003 SER O
C A 0005 SER N 2.251 C A 0004 GLY O
C A 0006 SER N 2.250 C A 0005 SER O
C A 0007 GLY N 2.251 C A 0006 SER O
C A 0008 CYS N 2.250 C A 0007 GLY O
C A 0009 SER N 2.251 C A 0008 CYS O
C A 0010 GLU N 2.250 C A 0009 SER O
C A 0011 VAL N 2.250 C A 0010 GLU O
C A 0012 ASN N 2.250 C A 0011 VAL O
C A 0013 VAL N 2.250 C A 0012 ASN O
C A 0014 VAL N 2.250 C A 0013 VAL O
C A 0015 LYS N 2.249 C A 0014 VAL O
C A 0016 GLU N 2.251 C A 0015 LYS O
C A 0017 ARG N 2.250 C A 0016 GLU O
C A 0018 PRO N 2.253 C A 0017 ARG O
C A 0019 LYS N 2.810 C A 0017 ARG O
C A 0019 LYS N 2.249 C A 0018 PRO O
C A 0020 THR N 2.250 C A 0019 LYS O
C A 0021 ASP N 2.250 C A 0020 THR O
C A 0022 GLU N 2.250 C A 0021 ASP O
C A 0023 HIS N 2.251 C A 0022 GLU O
C A 0024 LYS N 2.250 C A 0023 HIS O
C A 0025 SER N 2.249 C A 0024 LYS O
E A 0026 TYR N 2.250 C A 0025 SER O
E A 0026 TYR N 3.032 E A 0037 GLU O
E A 0027 SER N 2.250 E A 0026 TYR O
C A 0028 CYS N 2.250 E A 0027 SER O
C A 0028 CYS N 3.194 C A 0035 ASP O
C A 0029 SER N 2.251 C A 0028 CYS O
C A 0029 SER N 2.831 E A 0049 ASN O
C A 0030 PHE N 2.250 C A 0029 SER O
C A 0031 LYS N 2.249 C A 0030 PHE O
C A 0032 GLY N 2.894 C A 0030 PHE O
C A 0032 GLY N 2.251 C A 0031 LYS O
C A 0033 CYS N 2.250 C A 0032 GLY O
C A 0034 THR N 2.251 C A 0033 CYS O
C A 0035 ASP N 2.250 C A 0034 THR O
E A 0036 VAL N 2.250 C A 0035 ASP O
E A 0037 GLU N 2.250 E A 0036 VAL O
C A 0038 LEU N 2.250 E A 0037 GLU O
C A 0039 VAL N 2.250 C A 0038 LEU O
C A 0040 ALA N 2.249 C A 0039 VAL O
E A 0041 VAL N 2.250 C A 0040 ALA O
E A 0042 ILE N 3.073 C A 0040 ALA O
E A 0042 ILE N 2.251 E A 0041 VAL O
C A 0043 CYS N 2.249 E A 0042 ILE O
C A 0043 CYS N 2.854 C A 0048 LYS O
C A 0044 PRO N 2.252 C A 0043 CYS O
C A 0045 TYR N 2.907 C A 0043 CYS O
C A 0045 TYR N 2.250 C A 0044 PRO O
C A 0046 CYS N 2.250 C A 0045 TYR O
C A 0047 GLU N 2.658 C A 0043 CYS O
C A 0047 GLU N 2.251 C A 0046 CYS O
C A 0048 LYS N 2.249 C A 0047 GLU O
E A 0049 ASN N 2.250 C A 0048 LYS O
E A 0050 PHE N 2.811 E A 0041 VAL O
E A 0050 PHE N 2.250 E A 0049 ASN O
H A 0051 CYS N 2.250 E A 0050 PHE O
H A 0052 LEU N 2.250 H A 0051 CYS O
H A 0053 ARG N 2.845 H A 0051 CYS O
H A 0053 ARG N 2.251 H A 0052 LEU O
H A 0054 HIS N 2.512 H A 0051 CYS O
H A 0054 HIS N 2.251 H A 0053 ARG O
H A 0055 ARG N 2.611 H A 0051 CYS O
H A 0055 ARG N 2.250 H A 0054 HIS O
C A 0056 HIS N 2.251 H A 0055 ARG O
H A 0057 GLN N 2.250 C A 0056 HIS O
H A 0058 SER N 2.250 H A 0057 GLN O
H A 0059 ASP N 2.985 H A 0057 GLN O
H A 0059 ASP N 2.250 H A 0058 SER O
H A 0060 HIS N 2.929 H A 0057 GLN O
H A 0060 HIS N 3.189 H A 0058 SER O
H A 0060 HIS N 2.251 H A 0059 ASP O
H A 0061 ASP N 3.128 H A 0057 GLN O
H A 0061 ASP N 2.713 H A 0058 SER O
H A 0061 ASP N 2.250 H A 0060 HIS O
C A 0062 CYS N 2.935 H A 0057 GLN O
C A 0062 CYS N 2.250 H A 0061 ASP O
C A 0063 GLU N 3.071 H A 0061 ASP O
C A 0063 GLU N 2.250 C A 0062 CYS O
C A 0064 LYS N 2.250 C A 0063 GLU O
C A 0065 LEU N 2.251 C A 0064 LYS O
C A 0066 GLU N 2.250 C A 0065 LEU O
C A 0067 VAL N 3.191 C A 0065 LEU O
C A 0067 VAL N 2.250 C A 0066 GLU O
C A 0068 ALA N 2.250 C A 0067 VAL O
C A 0069 LYS N 2.250 C A 0068 ALA O
C A 0070 PRO N 2.253 C A 0069 LYS O
C A 0071 ARG N 2.996 C A 0069 LYS O
C A 0071 ARG N 2.250 C A 0070 PRO O
C A 0072 MET N 2.250 C A 0071 ARG O
C A 0073 ALA N 2.250 C A 0072 MET O
C A 0074 ALA N 2.250 C A 0073 ALA O
C A 0075 THR N 3.078 C A 0073 ALA O
C A 0075 THR N 2.250 C A 0074 ALA O
C A 0076 GLN N 2.250 C A 0075 THR O
C A 0077 LYS N 2.249 C A 0076 GLN O
C A 0078 LEU N 2.933 C A 0076 GLN O
C A 0078 LEU N 2.249 C A 0077 LYS O
C A 0079 VAL N 3.183 C A 0077 LYS O
C A 0079 VAL N 2.250 C A 0078 LEU O
C A 0080 ARG N 2.250 C A 0079 VAL O
C A 0081 SER N 2.250 C A 0080 ARG O
C A 0082 GLY N 2.250 C A 0081 SER O
C A 0083 PRO N 2.253 C A 0082 GLY O
C A 0084 SER N 2.249 C A 0083 PRO O
C A 0085 SER N 2.249 C A 0084 SER O
C A 0086 GLY N 2.250 C A 0085 SER O
HB_MS 2.00 3.20 8
C A 0002 SER O 2.827 C A 0003 SER OG
C A 0004 GLY O 3.167 C A 0005 SER OG
C A 0008 CYS O 3.179 C A 0009 SER OG
E A 0027 SER O 3.014 E A 0049 ASN ND2
E A 0041 VAL N 2.987 E A 0049 ASN OD1
E A 0049 ASN O 3.042 C A 0029 SER OG
C A 0056 HIS O 2.510 H A 0060 HIS ND1
H A 0057 GLN O 3.166 H A 0060 HIS NE2
HB_SS 2.00 3.20 2
C A 0022 GLU OE2 2.767 C A 0025 SER OG
C A 0045 TYR OH 2.941 H A 0057 GLN OE1
AROMATIC 0.00 8.00 5
E A 0050 PHE 3.766 H A 0060 HIS
C A 0019 LYS 7.129 C A 0023 HIS
C A 0024 LYS 6.554 C A 0023 HIS
C A 0024 LYS 7.092 E A 0026 TYR
H A 0055 ARG 5.474 C A 0056 HIS