Complet list of 1pe4 con file
Complete list of 1pe4.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 334
C A 0001 ARG C 2.435 E A 0002 ASP CA
C A 0001 ARG C 2.977 E A 0002 ASP C
C A 0001 ARG C 3.719 E A 0002 ASP CB
C A 0001 ARG CB 3.596 C A 0052 GLU CA
C A 0001 ARG CB 3.800 C A 0052 GLU CB
C A 0001 ARG CB 3.781 C A 0052 GLU CG
E A 0002 ASP CA 3.786 E A 0003 GLY CA
E A 0002 ASP C 2.411 E A 0003 GLY CA
E A 0002 ASP C 3.516 E A 0003 GLY C
E A 0003 GLY CA 3.789 C A 0004 TYR CA
E A 0003 GLY C 2.432 C A 0004 TYR CA
E A 0003 GLY C 3.537 C A 0004 TYR C
E A 0003 GLY C 3.446 C A 0004 TYR CB
E A 0003 GLY C 3.730 C A 0004 TYR CG
E A 0003 GLY C 3.401 C A 0004 TYR CD1
E A 0003 GLY CA 3.568 C A 0005 PRO CD
E A 0003 GLY C 3.003 C A 0005 PRO CD
E A 0003 GLY CA 3.477 C A 0050 VAL CG2
C A 0004 TYR CA 2.982 C A 0005 PRO CD
C A 0004 TYR C 2.466 C A 0005 PRO CA
C A 0004 TYR C 3.235 C A 0005 PRO C
C A 0004 TYR C 3.615 C A 0005 PRO CB
C A 0004 TYR C 3.672 C A 0005 PRO CG
C A 0004 TYR C 2.533 C A 0005 PRO CD
C A 0004 TYR CE2 3.749 E A 0039 TYR CG
C A 0004 TYR CE2 3.221 E A 0039 TYR CD2
C A 0004 TYR CZ 3.556 E A 0039 TYR CB
C A 0004 TYR CA 3.470 E A 0046 TYR CD2
C A 0004 TYR CA 3.683 E A 0046 TYR CE2
C A 0004 TYR CB 3.767 E A 0046 TYR CD2
C A 0004 TYR CG 3.399 E A 0046 TYR CD2
C A 0004 TYR CD2 3.134 E A 0046 TYR CD2
C A 0004 TYR CD2 3.696 E A 0046 TYR CE2
C A 0004 TYR CE2 3.658 E A 0046 TYR CD2
C A 0005 PRO C 2.444 C A 0006 LEU CA
C A 0005 PRO C 2.908 C A 0006 LEU C
C A 0005 PRO C 3.158 C A 0006 LEU CB
C A 0005 PRO C 3.225 C A 0006 LEU CG
C A 0005 PRO C 3.143 C A 0006 LEU CD2
C A 0005 PRO CG 3.462 C A 0056 LEU CD2
C A 0006 LEU C 2.449 C A 0007 ALA CA
C A 0006 LEU C 2.902 C A 0007 ALA C
C A 0006 LEU C 3.697 C A 0007 ALA CB
C A 0006 LEU CA 3.740 C A 0012 LYS CD
C A 0006 LEU CA 3.287 C A 0012 LYS CE
C A 0007 ALA CA 3.783 C A 0008 SER CA
C A 0007 ALA C 2.422 C A 0008 SER CA
C A 0007 ALA C 3.101 C A 0008 SER C
C A 0007 ALA C 3.686 C A 0008 SER CB
C A 0007 ALA CA 3.506 C A 0057 TRP CZ3
C A 0007 ALA C 3.581 C A 0057 TRP CE3
C A 0007 ALA C 3.128 C A 0057 TRP CZ3
C A 0007 ALA CB 3.464 C A 0057 TRP CE3
C A 0007 ALA CB 2.913 C A 0057 TRP CZ3
C A 0007 ALA CB 3.232 C A 0057 TRP CH2
C A 0008 SER C 2.433 C A 0009 ASN CA
C A 0008 SER C 2.990 C A 0009 ASN C
C A 0008 SER C 3.714 C A 0009 ASN CB
C A 0008 SER CB 3.711 C A 0011 CYS C
C A 0008 SER CA 3.664 C A 0057 TRP CE3
C A 0008 SER CB 3.390 C A 0057 TRP CA
C A 0008 SER CB 3.474 C A 0057 TRP C
C A 0009 ASN CA 3.794 C A 0010 GLY CA
C A 0009 ASN C 2.418 C A 0010 GLY CA
C A 0009 ASN C 3.232 C A 0010 GLY C
C A 0010 GLY CA 3.800 C A 0011 CYS CA
C A 0010 GLY C 2.434 C A 0011 CYS CA
C A 0010 GLY C 3.724 C A 0011 CYS C
C A 0010 GLY C 3.001 C A 0011 CYS CB
C A 0010 GLY C 3.788 C A 0065 CYS CB
C A 0011 CYS C 2.433 C A 0012 LYS CA
C A 0011 CYS C 3.280 C A 0012 LYS C
C A 0011 CYS C 3.638 C A 0012 LYS CB
C A 0011 CYS C 3.792 C A 0058 GLY CA
C A 0011 CYS CB 3.345 C A 0062 THR CA
C A 0011 CYS CB 3.635 C A 0062 THR CB
C A 0011 CYS CB 3.229 C A 0065 CYS CB
C A 0012 LYS C 2.436 C A 0013 PHE CA
C A 0012 LYS C 3.459 C A 0013 PHE C
C A 0012 LYS C 3.500 C A 0013 PHE CB
C A 0012 LYS C 3.587 C A 0013 PHE CG
C A 0012 LYS CD 3.676 E A 0046 TYR CD1
C A 0012 LYS CD 3.650 E A 0046 TYR CE1
C A 0012 LYS CE 3.651 C A 0056 LEU CD2
C A 0012 LYS C 3.664 C A 0058 GLY CA
C A 0013 PHE C 2.416 C A 0014 GLY CA
C A 0013 PHE C 3.023 C A 0014 GLY C
C A 0013 PHE CD1 3.444 H A 0028 VAL CG1
C A 0013 PHE CE1 3.702 H A 0028 VAL CG1
C A 0013 PHE CE2 3.535 E A 0047 CYS CB
C A 0013 PHE CZ 3.712 C A 0050 VAL CB
C A 0013 PHE CZ 3.674 C A 0050 VAL CG1
C A 0013 PHE CE1 3.546 C A 0056 LEU CD1
C A 0013 PHE CE2 3.745 C A 0056 LEU CD1
C A 0013 PHE CZ 3.009 C A 0056 LEU CD1
C A 0013 PHE CA 3.423 C A 0059 ASP CB
C A 0013 PHE C 3.739 C A 0059 ASP CB
C A 0014 GLY CA 3.795 C A 0015 CYS CA
C A 0014 GLY C 2.434 C A 0015 CYS CA
C A 0014 GLY C 2.981 C A 0015 CYS C
C A 0014 GLY C 3.013 C A 0015 CYS CB
C A 0014 GLY C 3.755 C A 0045 CYS CB
C A 0015 CYS CA 3.799 C A 0016 SER CA
C A 0015 CYS C 2.426 C A 0016 SER CA
C A 0015 CYS C 3.689 C A 0016 SER C
C A 0015 CYS C 3.116 C A 0016 SER CB
C A 0015 CYS CB 3.510 C A 0044 THR C
C A 0015 CYS CB 3.502 C A 0045 CYS CB
C A 0016 SER CA 3.791 C A 0017 GLY CA
C A 0016 SER C 2.415 C A 0017 GLY CA
C A 0016 SER C 2.935 C A 0017 GLY C
C A 0017 GLY CA 3.794 C A 0018 LEU CA
C A 0017 GLY C 2.434 C A 0018 LEU CA
C A 0017 GLY C 3.155 C A 0018 LEU C
C A 0017 GLY C 3.693 C A 0018 LEU CB
C A 0017 GLY C 3.556 C A 0018 LEU CD1
C A 0017 GLY CA 3.507 C A 0043 TRP CD1
C A 0018 LEU CA 3.795 C A 0019 GLY CA
C A 0018 LEU C 2.416 C A 0019 GLY CA
C A 0018 LEU C 3.684 C A 0019 GLY C
C A 0018 LEU CD2 3.279 C A 0043 TRP CG
C A 0018 LEU CD2 3.476 C A 0043 TRP CD1
C A 0018 LEU CD2 2.988 C A 0043 TRP CD2
C A 0018 LEU CD2 3.059 C A 0043 TRP CE2
C A 0018 LEU CD2 3.500 C A 0043 TRP CE3
C A 0018 LEU CD2 3.630 C A 0043 TRP CZ2
C A 0019 GLY CA 3.798 C A 0020 GLU CA
C A 0019 GLY C 2.439 C A 0020 GLU CA
C A 0019 GLY C 3.211 C A 0020 GLU C
C A 0019 GLY C 3.672 C A 0020 GLU CB
C A 0020 GLU C 2.440 C A 0021 ASN CA
C A 0020 GLU C 3.142 C A 0021 ASN C
C A 0020 GLU C 3.696 C A 0021 ASN CB
C A 0021 ASN CA 3.798 C A 0022 ASN CA
C A 0021 ASN C 2.437 C A 0022 ASN CA
C A 0021 ASN C 3.490 C A 0022 ASN C
C A 0021 ASN C 3.495 C A 0022 ASN CB
C A 0021 ASN C 2.982 C A 0023 PRO CD
C A 0022 ASN CA 2.928 C A 0023 PRO CD
C A 0022 ASN C 2.470 C A 0023 PRO CA
C A 0022 ASN C 3.237 C A 0023 PRO C
C A 0022 ASN C 3.621 C A 0023 PRO CB
C A 0022 ASN C 3.660 C A 0023 PRO CG
C A 0022 ASN C 2.514 C A 0023 PRO CD
C A 0022 ASN CB 3.683 C A 0060 SER C
C A 0022 ASN CB 2.965 C A 0061 GLY CA
C A 0022 ASN CG 3.068 C A 0061 GLY CA
C A 0023 PRO C 2.441 H A 0024 THR CA
C A 0023 PRO C 2.944 H A 0024 THR C
C A 0023 PRO C 3.717 H A 0024 THR CB
H A 0024 THR C 2.445 H A 0025 CYS CA
H A 0024 THR C 2.897 H A 0025 CYS C
H A 0024 THR C 3.707 H A 0025 CYS CB
H A 0024 THR C 3.264 H A 0028 VAL CG2
H A 0024 THR CB 3.609 H A 0028 VAL CG2
H A 0024 THR CG2 3.540 H A 0028 VAL CG2
H A 0025 CYS C 2.433 H A 0026 ASN CA
H A 0025 CYS C 3.055 H A 0026 ASN C
H A 0025 CYS C 3.711 H A 0026 ASN CB
H A 0025 CYS CB 3.652 C A 0045 CYS CB
H A 0026 ASN C 2.435 H A 0027 HIS CA
H A 0026 ASN C 2.999 H A 0027 HIS C
H A 0026 ASN C 3.715 H A 0027 HIS CB
H A 0027 HIS C 2.439 H A 0028 VAL CA
H A 0027 HIS C 2.933 H A 0028 VAL C
H A 0027 HIS C 3.736 H A 0028 VAL CB
H A 0027 HIS CA 3.456 H A 0030 GLU CG
H A 0027 HIS C 3.650 H A 0030 GLU CG
H A 0028 VAL C 2.434 H A 0029 CYS CA
H A 0028 VAL C 3.019 H A 0029 CYS C
H A 0028 VAL C 3.711 H A 0029 CYS CB
H A 0028 VAL CG1 3.561 H A 0032 LYS CD
H A 0028 VAL CG2 3.754 C A 0059 ASP CG
H A 0029 CYS C 2.437 H A 0030 GLU CA
H A 0029 CYS C 3.188 H A 0030 GLU C
H A 0029 CYS C 3.685 H A 0030 GLU CB
H A 0029 CYS C 3.704 C A 0033 ALA CB
H A 0030 GLU C 2.430 H A 0031 LYS CA
H A 0030 GLU C 3.376 H A 0031 LYS C
H A 0030 GLU C 3.579 H A 0031 LYS CB
H A 0030 GLU C 3.633 C A 0034 GLY CA
H A 0031 LYS C 2.436 H A 0032 LYS CA
H A 0031 LYS C 3.204 H A 0032 LYS C
H A 0031 LYS C 3.672 H A 0032 LYS CB
H A 0032 LYS CA 3.792 C A 0033 ALA CA
H A 0032 LYS C 2.425 C A 0033 ALA CA
H A 0032 LYS C 3.290 C A 0033 ALA C
H A 0032 LYS C 3.599 C A 0033 ALA CB
C A 0033 ALA CA 3.787 C A 0034 GLY CA
C A 0033 ALA C 2.428 C A 0034 GLY CA
C A 0033 ALA C 2.907 C A 0034 GLY C
C A 0033 ALA CB 3.000 C A 0050 VAL CG1
C A 0034 GLY CA 3.798 C A 0035 SER CA
C A 0034 GLY C 2.432 C A 0035 SER CA
C A 0034 GLY C 3.587 C A 0035 SER C
C A 0034 GLY C 3.357 C A 0035 SER CB
C A 0035 SER C 2.434 C A 0036 ASP CA
C A 0035 SER C 3.335 C A 0036 ASP C
C A 0035 SER C 3.603 C A 0036 ASP CB
C A 0036 ASP C 2.434 C A 0037 TYR CA
C A 0036 ASP C 3.377 C A 0037 TYR C
C A 0036 ASP C 3.576 C A 0037 TYR CB
C A 0037 TYR CA 3.791 E A 0038 GLY CA
C A 0037 TYR C 2.420 E A 0038 GLY CA
C A 0037 TYR C 3.547 E A 0038 GLY C
C A 0037 TYR CB 3.568 E A 0048 GLU CB
C A 0037 TYR CD2 3.698 E A 0048 GLU CB
E A 0038 GLY CA 3.797 E A 0039 TYR CA
E A 0038 GLY C 2.432 E A 0039 TYR CA
E A 0038 GLY C 3.584 E A 0039 TYR C
E A 0038 GLY C 3.360 E A 0039 TYR CB
E A 0039 TYR C 2.435 C A 0040 CYS CA
E A 0039 TYR C 3.520 C A 0040 CYS C
E A 0039 TYR C 3.445 C A 0040 CYS CB
E A 0039 TYR CE1 3.526 C A 0041 TYR CB
E A 0039 TYR CZ 3.552 C A 0041 TYR CB
E A 0039 TYR CB 3.726 E A 0046 TYR CB
E A 0039 TYR CD2 3.477 E A 0046 TYR CB
E A 0039 TYR CD2 3.397 E A 0046 TYR CG
E A 0039 TYR CD2 3.666 E A 0046 TYR CD1
C A 0040 CYS C 2.432 C A 0041 TYR CA
C A 0040 CYS C 3.516 C A 0041 TYR C
C A 0040 CYS C 3.442 C A 0041 TYR CB
C A 0041 TYR CA 3.792 C A 0042 ALA CA
C A 0041 TYR C 2.427 C A 0042 ALA CA
C A 0041 TYR C 3.294 C A 0042 ALA C
C A 0041 TYR C 3.597 C A 0042 ALA CB
C A 0042 ALA C 2.429 C A 0043 TRP CA
C A 0042 ALA C 3.212 C A 0043 TRP C
C A 0042 ALA C 3.658 C A 0043 TRP CB
C A 0042 ALA CB 3.761 C A 0066 ARG CZ
C A 0043 TRP C 2.439 C A 0044 THR CA
C A 0043 TRP C 3.717 C A 0044 THR C
C A 0043 TRP C 2.992 C A 0044 THR CB
C A 0043 TRP C 3.542 C A 0044 THR CG2
C A 0043 TRP CB 3.615 C A 0065 CYS C
C A 0043 TRP CB 3.710 C A 0066 ARG CG
C A 0043 TRP CE3 3.743 C A 0066 ARG CA
C A 0043 TRP CE3 3.705 C A 0066 ARG CG
C A 0044 THR C 2.428 C A 0045 CYS CA
C A 0044 THR C 3.585 C A 0045 CYS C
C A 0044 THR C 3.363 C A 0045 CYS CB
C A 0044 THR CG2 3.581 C A 0066 ARG CD
C A 0045 CYS CA 3.796 E A 0046 TYR CA
C A 0045 CYS C 2.434 E A 0046 TYR CA
C A 0045 CYS C 3.413 E A 0046 TYR C
C A 0045 CYS C 3.528 E A 0046 TYR CB
C A 0045 CYS C 3.422 E A 0046 TYR CD1
E A 0046 TYR C 2.421 E A 0047 CYS CA
E A 0046 TYR C 3.703 E A 0047 CYS C
E A 0046 TYR C 3.078 E A 0047 CYS CB
E A 0047 CYS C 2.438 E A 0048 GLU CA
E A 0047 CYS C 3.457 E A 0048 GLU C
E A 0047 CYS C 3.514 E A 0048 GLU CB
E A 0047 CYS C 3.496 C A 0050 VAL CG2
E A 0047 CYS CB 3.766 C A 0050 VAL CG1
E A 0047 CYS CB 3.546 C A 0050 VAL CG2
E A 0048 GLU C 2.437 C A 0049 HIS CA
E A 0048 GLU C 3.045 C A 0049 HIS C
E A 0048 GLU C 2.978 C A 0049 HIS CB
E A 0048 GLU C 3.512 C A 0049 HIS CG
E A 0048 GLU CG 3.763 C A 0049 HIS CE1
E A 0048 GLU CD 3.612 C A 0049 HIS CE1
C A 0049 HIS C 2.437 C A 0050 VAL CA
C A 0049 HIS C 3.392 C A 0050 VAL C
C A 0049 HIS C 3.599 C A 0050 VAL CB
C A 0050 VAL CA 3.793 C A 0051 ALA CA
C A 0050 VAL C 2.432 C A 0051 ALA CA
C A 0050 VAL C 3.225 C A 0051 ALA C
C A 0050 VAL C 3.649 C A 0051 ALA CB
C A 0051 ALA C 2.436 C A 0052 GLU CA
C A 0051 ALA C 3.163 C A 0052 GLU C
C A 0051 ALA C 3.685 C A 0052 GLU CB
C A 0052 GLU CA 3.791 C A 0053 GLY CA
C A 0052 GLU C 2.417 C A 0053 GLY CA
C A 0052 GLU C 3.297 C A 0053 GLY C
C A 0053 GLY C 2.435 C A 0054 THR CA
C A 0053 GLY C 3.007 C A 0054 THR C
C A 0053 GLY C 3.718 C A 0054 THR CB
C A 0054 THR C 2.434 C A 0055 VAL CA
C A 0054 THR C 3.334 C A 0055 VAL C
C A 0054 THR C 3.632 C A 0055 VAL CB
C A 0055 VAL C 2.436 C A 0056 LEU CA
C A 0055 VAL C 3.696 C A 0056 LEU C
C A 0055 VAL C 3.125 C A 0056 LEU CB
C A 0055 VAL C 3.735 C A 0056 LEU CD1
C A 0056 LEU C 2.429 C A 0057 TRP CA
C A 0056 LEU C 3.650 C A 0057 TRP C
C A 0056 LEU C 3.255 C A 0057 TRP CB
C A 0056 LEU C 3.154 C A 0057 TRP CG
C A 0056 LEU C 3.738 C A 0057 TRP CD1
C A 0056 LEU C 3.397 C A 0057 TRP CD2
C A 0056 LEU C 3.797 C A 0057 TRP CE3
C A 0057 TRP CA 3.800 C A 0058 GLY CA
C A 0057 TRP C 2.420 C A 0058 GLY CA
C A 0057 TRP C 3.413 C A 0058 GLY C
C A 0058 GLY C 2.439 C A 0059 ASP CA
C A 0058 GLY C 3.300 C A 0059 ASP C
C A 0058 GLY C 3.625 C A 0059 ASP CB
C A 0058 GLY CA 3.265 C A 0062 THR CB
C A 0058 GLY CA 3.463 C A 0062 THR CG2
C A 0058 GLY C 3.650 C A 0062 THR CB
C A 0058 GLY C 3.257 C A 0062 THR CG2
C A 0059 ASP C 2.433 C A 0060 SER CA
C A 0059 ASP C 3.357 C A 0060 SER C
C A 0059 ASP C 3.588 C A 0060 SER CB
C A 0059 ASP C 3.511 C A 0062 THR CG2
C A 0060 SER CA 3.790 C A 0061 GLY CA
C A 0060 SER C 2.417 C A 0061 GLY CA
C A 0060 SER C 3.139 C A 0061 GLY C
C A 0061 GLY CA 3.800 C A 0062 THR CA
C A 0061 GLY C 2.433 C A 0062 THR CA
C A 0061 GLY C 3.006 C A 0062 THR C
C A 0061 GLY C 3.717 C A 0062 THR CB
C A 0062 THR CA 3.787 C A 0063 GLY CA
C A 0062 THR C 2.420 C A 0063 GLY CA
C A 0062 THR C 3.429 C A 0063 GLY C
C A 0062 THR C 3.575 C A 0064 PRO CD
C A 0063 GLY CA 2.916 C A 0064 PRO CD
C A 0063 GLY C 2.463 C A 0064 PRO CA
C A 0063 GLY C 3.294 C A 0064 PRO C
C A 0063 GLY C 3.579 C A 0064 PRO CB
C A 0063 GLY C 3.660 C A 0064 PRO CG
C A 0063 GLY C 2.508 C A 0064 PRO CD
C A 0064 PRO C 2.440 C A 0065 CYS CA
C A 0064 PRO C 2.983 C A 0065 CYS C
C A 0064 PRO C 3.717 C A 0065 CYS CB
C A 0065 CYS C 2.435 C A 0066 ARG CA
C A 0065 CYS C 3.504 C A 0066 ARG C
C A 0065 CYS C 3.464 C A 0066 ARG CB
C A 0065 CYS C 3.449 C A 0066 ARG CG
C A 0066 ARG C 2.434 C A 0067 SER CA
C A 0066 ARG C 3.243 C A 0067 SER C
C A 0066 ARG C 3.652 C A 0067 SER CB
CHARGE_ATTR 2.00 12.00 44
E A 0002 ASP OD1 10.77 C A 0001 ARG NH1
E A 0002 ASP OD2 10.10 C A 0001 ARG NH1
E A 0002 ASP OD2 11.33 C A 0001 ARG NH2
E A 0002 ASP OD1 9.952 C A 0012 LYS NZ
E A 0002 ASP OD2 10.70 C A 0012 LYS NZ
E A 0002 ASP OD1 5.682 C A 0049 HIS ND1
E A 0002 ASP OD1 6.492 C A 0049 HIS NE2
E A 0002 ASP OD2 6.915 C A 0049 HIS ND1
E A 0002 ASP OD2 7.970 C A 0049 HIS NE2
H A 0030 GLU OE1 7.043 H A 0027 HIS ND1
H A 0030 GLU OE1 6.175 H A 0027 HIS NE2
H A 0030 GLU OE2 4.859 H A 0027 HIS ND1
H A 0030 GLU OE2 4.165 H A 0027 HIS NE2
H A 0030 GLU OE1 7.219 H A 0031 LYS NZ
H A 0030 GLU OE2 7.240 H A 0031 LYS NZ
H A 0030 GLU OE1 10.35 H A 0032 LYS NZ
H A 0030 GLU OE2 9.326 H A 0032 LYS NZ
C A 0036 ASP OD1 10.83 C A 0049 HIS ND1
C A 0036 ASP OD1 9.335 C A 0049 HIS NE2
C A 0036 ASP OD2 10.68 C A 0049 HIS ND1
C A 0036 ASP OD2 9.107 C A 0049 HIS NE2
E A 0048 GLU OE2 11.61 C A 0001 ARG NH1
E A 0048 GLU OE1 11.36 C A 0012 LYS NZ
E A 0048 GLU OE2 11.97 C A 0012 LYS NZ
E A 0048 GLU OE1 5.104 C A 0049 HIS ND1
E A 0048 GLU OE1 4.701 C A 0049 HIS NE2
E A 0048 GLU OE2 3.619 C A 0049 HIS ND1
E A 0048 GLU OE2 2.684 C A 0049 HIS NE2
C A 0052 GLU OE1 4.560 C A 0001 ARG NH1
C A 0052 GLU OE1 6.298 C A 0001 ARG NH2
C A 0052 GLU OE2 4.458 C A 0001 ARG NH1
C A 0052 GLU OE2 5.626 C A 0001 ARG NH2
C A 0052 GLU OE1 4.925 C A 0049 HIS ND1
C A 0052 GLU OE1 6.363 C A 0049 HIS NE2
C A 0052 GLU OE2 7.033 C A 0049 HIS ND1
C A 0052 GLU OE2 8.434 C A 0049 HIS NE2
C A 0059 ASP OD1 10.96 C A 0012 LYS NZ
C A 0059 ASP OD2 11.56 C A 0012 LYS NZ
C A 0059 ASP OD1 9.346 H A 0027 HIS ND1
C A 0059 ASP OD1 11.32 H A 0027 HIS NE2
C A 0059 ASP OD2 8.618 H A 0027 HIS ND1
C A 0059 ASP OD2 10.72 H A 0027 HIS NE2
C A 0059 ASP OD1 4.680 H A 0032 LYS NZ
C A 0059 ASP OD2 6.301 H A 0032 LYS NZ
CHARGE_REPU 2.00 12.00 33
C A 0001 ARG NH1 8.303 C A 0049 HIS ND1
C A 0001 ARG NH1 9.883 C A 0049 HIS NE2
C A 0001 ARG NH2 10.16 C A 0049 HIS ND1
C A 0001 ARG NH2 11.90 C A 0049 HIS NE2
E A 0002 ASP OD1 3.569 E A 0048 GLU OE1
E A 0002 ASP OD1 4.975 E A 0048 GLU OE2
E A 0002 ASP OD2 5.602 E A 0048 GLU OE1
E A 0002 ASP OD2 6.889 E A 0048 GLU OE2
E A 0002 ASP OD1 9.418 C A 0052 GLU OE1
E A 0002 ASP OD1 11.42 C A 0052 GLU OE2
E A 0002 ASP OD2 9.727 C A 0052 GLU OE1
E A 0002 ASP OD2 11.60 C A 0052 GLU OE2
C A 0012 LYS NZ 11.73 C A 0049 HIS ND1
C A 0012 LYS NZ 9.751 C A 0066 ARG NH1
C A 0012 LYS NZ 11.91 C A 0066 ARG NH2
H A 0027 HIS ND1 8.858 H A 0031 LYS NZ
H A 0027 HIS NE2 8.411 H A 0031 LYS NZ
H A 0027 HIS ND1 8.503 H A 0032 LYS NZ
H A 0027 HIS NE2 9.899 H A 0032 LYS NZ
H A 0030 GLU OE1 8.984 C A 0036 ASP OD1
H A 0030 GLU OE1 7.679 C A 0036 ASP OD2
H A 0030 GLU OE2 10.33 C A 0036 ASP OD1
H A 0030 GLU OE2 9.339 C A 0036 ASP OD2
H A 0030 GLU OE2 11.77 C A 0059 ASP OD1
H A 0030 GLU OE2 11.68 C A 0059 ASP OD2
H A 0031 LYS NZ 7.970 H A 0032 LYS NZ
C A 0036 ASP OD1 8.779 E A 0048 GLU OE1
C A 0036 ASP OD1 8.081 E A 0048 GLU OE2
C A 0036 ASP OD2 9.656 E A 0048 GLU OE1
C A 0036 ASP OD2 8.480 E A 0048 GLU OE2
E A 0048 GLU OE1 9.900 C A 0052 GLU OE1
E A 0048 GLU OE2 8.512 C A 0052 GLU OE1
E A 0048 GLU OE2 10.63 C A 0052 GLU OE2
HB_MM 2.00 3.20 101
E A 0002 ASP N 2.250 C A 0001 ARG O
E A 0003 GLY N 2.249 E A 0002 ASP O
E A 0003 GLY N 2.754 E A 0047 CYS O
C A 0004 TYR N 2.255 E A 0003 GLY O
C A 0005 PRO N 2.252 C A 0004 TYR O
C A 0006 LEU N 2.254 C A 0005 PRO O
C A 0007 ALA N 3.074 C A 0005 PRO O
C A 0007 ALA N 2.256 C A 0006 LEU O
C A 0008 SER N 3.162 C A 0006 LEU O
C A 0008 SER N 2.242 C A 0007 ALA O
C A 0009 ASN N 3.193 C A 0007 ALA O
C A 0009 ASN N 2.250 C A 0008 SER O
C A 0010 GLY N 2.969 C A 0008 SER O
C A 0010 GLY N 2.250 C A 0009 ASN O
C A 0011 CYS N 2.250 C A 0010 GLY O
C A 0012 LYS N 2.248 C A 0011 CYS O
C A 0013 PHE N 2.251 C A 0012 LYS O
C A 0014 GLY N 2.248 C A 0013 PHE O
C A 0015 CYS N 2.252 C A 0014 GLY O
C A 0015 CYS N 2.856 C A 0022 ASN O
C A 0016 SER N 2.244 C A 0015 CYS O
C A 0017 GLY N 2.249 C A 0016 SER O
C A 0018 LEU N 2.251 C A 0017 GLY O
C A 0019 GLY N 2.788 C A 0017 GLY O
C A 0019 GLY N 2.249 C A 0018 LEU O
C A 0020 GLU N 2.253 C A 0019 GLY O
C A 0021 ASN N 2.253 C A 0020 GLU O
C A 0022 ASN N 2.965 C A 0020 GLU O
C A 0022 ASN N 2.248 C A 0021 ASN O
C A 0023 PRO N 2.253 C A 0022 ASN O
H A 0024 THR N 3.181 C A 0022 ASN O
H A 0024 THR N 2.251 C A 0023 PRO O
H A 0025 CYS N 2.818 C A 0023 PRO O
H A 0025 CYS N 2.253 H A 0024 THR O
H A 0026 ASN N 3.022 C A 0023 PRO O
H A 0026 ASN N 2.741 H A 0024 THR O
H A 0026 ASN N 2.251 H A 0025 CYS O
H A 0027 HIS N 2.977 H A 0024 THR O
H A 0027 HIS N 2.251 H A 0026 ASN O
H A 0028 VAL N 2.700 H A 0024 THR O
H A 0028 VAL N 2.251 H A 0027 HIS O
H A 0029 CYS N 2.249 H A 0028 VAL O
H A 0030 GLU N 3.102 H A 0027 HIS O
H A 0030 GLU N 2.249 H A 0029 CYS O
H A 0031 LYS N 2.695 H A 0027 HIS O
H A 0031 LYS N 3.135 H A 0028 VAL O
H A 0031 LYS N 2.246 H A 0030 GLU O
H A 0032 LYS N 3.145 H A 0028 VAL O
H A 0032 LYS N 2.249 H A 0031 LYS O
C A 0033 ALA N 3.134 H A 0029 CYS O
C A 0033 ALA N 2.247 H A 0032 LYS O
C A 0034 GLY N 2.582 H A 0029 CYS O
C A 0034 GLY N 2.258 C A 0033 ALA O
C A 0035 SER N 2.970 H A 0029 CYS O
C A 0035 SER N 2.703 C A 0033 ALA O
C A 0035 SER N 2.250 C A 0034 GLY O
C A 0036 ASP N 2.250 C A 0035 SER O
C A 0037 TYR N 2.250 C A 0036 ASP O
E A 0038 GLY N 2.254 C A 0037 TYR O
E A 0039 TYR N 2.249 E A 0038 GLY O
E A 0039 TYR N 3.153 E A 0046 TYR O
C A 0040 CYS N 2.251 E A 0039 TYR O
C A 0041 TYR N 2.250 C A 0040 CYS O
C A 0042 ALA N 2.250 C A 0041 TYR O
C A 0043 TRP N 2.245 C A 0042 ALA O
C A 0044 THR N 2.869 C A 0015 CYS O
C A 0044 THR N 2.965 C A 0042 ALA O
C A 0044 THR N 2.252 C A 0043 TRP O
C A 0045 CYS N 3.198 C A 0014 GLY O
C A 0045 CYS N 2.248 C A 0044 THR O
E A 0046 TYR N 2.669 E A 0039 TYR O
E A 0046 TYR N 2.250 C A 0045 CYS O
E A 0047 CYS N 2.245 E A 0046 TYR O
E A 0048 GLU N 3.019 C A 0037 TYR O
E A 0048 GLU N 2.250 E A 0047 CYS O
C A 0049 HIS N 2.921 C A 0001 ARG O
C A 0049 HIS N 2.250 E A 0048 GLU O
C A 0050 VAL N 3.194 E A 0048 GLU O
C A 0050 VAL N 2.251 C A 0049 HIS O
C A 0051 ALA N 2.246 C A 0050 VAL O
C A 0052 GLU N 2.250 C A 0051 ALA O
C A 0053 GLY N 2.794 C A 0051 ALA O
C A 0053 GLY N 2.249 C A 0052 GLU O
C A 0054 THR N 2.250 C A 0053 GLY O
C A 0055 VAL N 2.251 C A 0054 THR O
C A 0056 LEU N 2.251 C A 0055 VAL O
C A 0057 TRP N 2.246 C A 0056 LEU O
C A 0058 GLY N 2.956 C A 0011 CYS O
C A 0058 GLY N 3.028 C A 0012 LYS O
C A 0058 GLY N 2.250 C A 0057 TRP O
C A 0059 ASP N 2.728 C A 0012 LYS O
C A 0059 ASP N 2.252 C A 0058 GLY O
C A 0060 SER N 2.246 C A 0059 ASP O
C A 0061 GLY N 2.250 C A 0060 SER O
C A 0062 THR N 2.251 C A 0061 GLY O
C A 0063 GLY N 2.252 C A 0062 THR O
C A 0064 PRO N 2.250 C A 0063 GLY O
C A 0065 CYS N 2.253 C A 0064 PRO O
C A 0066 ARG N 2.929 C A 0010 GLY O
C A 0066 ARG N 2.251 C A 0065 CYS O
C A 0067 SER N 2.250 C A 0066 ARG O
HB_MS 2.00 3.20 9
E A 0003 GLY O 2.593 C A 0012 LYS NZ
C A 0023 PRO O 2.719 H A 0026 ASN ND2
C A 0033 ALA O 2.981 C A 0035 SER OG
C A 0045 CYS N 2.689 C A 0044 THR OG1
E A 0048 GLU O 2.870 C A 0035 SER OG
C A 0050 VAL O 2.486 C A 0054 THR OG1
C A 0057 TRP O 2.855 C A 0008 SER OG
C A 0060 SER N 2.598 C A 0059 ASP OD2
C A 0063 GLY N 2.677 C A 0062 THR OG1
AROMATIC 0.00 8.00 6
C A 0012 LYS 5.083 C A 0013 PHE
H A 0032 LYS 7.262 C A 0013 PHE
C A 0012 LYS 6.260 C A 0004 TYR
C A 0012 LYS 4.369 E A 0046 TYR
C A 0066 ARG 6.542 E A 0046 TYR
C A 0004 TYR 5.414 E A 0039 TYR
SS_BOND 1.50 2.80 4
C A 0011 CYS SG 2.029 C A 0065 CYS SG
C A 0015 CYS SG 2.031 C A 0040 CYS SG
H A 0025 CYS SG 2.030 C A 0045 CYS SG
H A 0029 CYS SG 2.030 E A 0047 CYS SG