Complet list of 1bc6 con file
Complete list of 1bc6.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 ALA C 2.480 E A 0002 TYR CA
C A 0001 ALA C 3.337 E A 0002 TYR C
C A 0001 ALA C 3.606 E A 0002 TYR CB
C A 0001 ALA C 3.779 E A 0003 VAL CG2
C A 0001 ALA CB 3.611 C A 0036 PRO CA
C A 0001 ALA CB 3.618 C A 0036 PRO C
C A 0001 ALA CB 3.623 C A 0036 PRO CB
C A 0001 ALA CA 3.457 C A 0041 ASP CG
C A 0001 ALA C 3.490 E A 0056 HIS CD2
E A 0002 TYR C 2.458 E A 0003 VAL CA
E A 0002 TYR C 3.569 E A 0003 VAL C
E A 0002 TYR C 3.408 E A 0003 VAL CB
E A 0002 TYR C 3.265 E A 0003 VAL CG2
E A 0002 TYR CE2 3.516 H A 0046 GLU CD
E A 0002 TYR CZ 3.654 H A 0046 GLU CD
E A 0002 TYR C 3.714 C A 0054 ILE CG2
E A 0002 TYR CB 3.686 C A 0054 ILE CG2
E A 0003 VAL CA 3.790 C A 0004 ILE CA
E A 0003 VAL C 2.432 C A 0004 ILE CA
E A 0003 VAL C 3.044 C A 0004 ILE C
E A 0003 VAL C 3.699 C A 0004 ILE CB
E A 0003 VAL CG2 3.654 C A 0036 PRO CB
E A 0003 VAL CG2 3.491 C A 0057 GLU CB
E A 0003 VAL CB 3.650 H A 0068 ILE CG1
E A 0003 VAL CB 3.562 H A 0068 ILE CD1
E A 0003 VAL CG1 3.678 H A 0068 ILE CG1
E A 0003 VAL CG1 3.581 H A 0068 ILE CD1
C A 0004 ILE CA 3.765 C A 0005 THR CA
C A 0004 ILE C 2.437 C A 0005 THR CA
C A 0004 ILE C 3.543 C A 0005 THR C
C A 0004 ILE C 3.392 C A 0005 THR CB
C A 0004 ILE C 3.496 C A 0005 THR CG2
C A 0004 ILE CG1 3.663 C A 0031 GLN CD
C A 0004 ILE CG2 3.771 H A 0071 ASN CG
C A 0005 THR CA 3.732 C A 0006 GLU CA
C A 0005 THR C 2.460 C A 0006 GLU CA
C A 0005 THR C 3.669 C A 0006 GLU C
C A 0005 THR C 3.187 C A 0006 GLU CB
C A 0005 THR CG2 3.341 C A 0060 VAL CG2
C A 0005 THR CB 3.711 H A 0064 TRP CE3
C A 0005 THR CG2 3.791 H A 0064 TRP CE3
C A 0006 GLU CA 3.050 C A 0007 PRO CD
C A 0006 GLU C 2.452 C A 0007 PRO CA
C A 0006 GLU C 3.055 C A 0007 PRO C
C A 0006 GLU C 3.695 C A 0007 PRO CB
C A 0006 GLU C 3.724 C A 0007 PRO CG
C A 0006 GLU C 2.510 C A 0007 PRO CD
C A 0006 GLU CB 3.219 C A 0007 PRO CD
C A 0006 GLU CB 3.625 H A 0064 TRP CE2
C A 0006 GLU CB 3.596 H A 0064 TRP CZ2
C A 0006 GLU CG 3.781 H A 0064 TRP CE2
C A 0006 GLU CG 3.407 H A 0064 TRP CZ2
C A 0006 GLU CD 3.709 H A 0064 TRP CE2
C A 0006 GLU CD 3.662 H A 0064 TRP CZ2
C A 0007 PRO C 2.458 C A 0008 CYS CA
C A 0007 PRO C 3.117 C A 0008 CYS C
C A 0007 PRO C 3.699 C A 0008 CYS CB
C A 0008 CYS C 2.485 C A 0009 ILE CA
C A 0008 CYS C 2.952 C A 0009 ILE C
C A 0008 CYS C 3.764 C A 0009 ILE CB
C A 0009 ILE C 2.486 C A 0010 GLY CA
C A 0009 ILE C 3.113 C A 0010 GLY C
C A 0009 ILE CG1 3.800 C A 0031 GLN CG
C A 0009 ILE CG1 3.363 C A 0031 GLN CD
C A 0010 GLY C 2.462 C A 0011 THR CA
C A 0010 GLY C 3.393 C A 0011 THR C
C A 0010 GLY C 3.562 C A 0011 THR CB
C A 0011 THR C 2.491 C A 0012 LYS CA
C A 0011 THR C 3.133 C A 0012 LYS C
C A 0011 THR C 3.182 C A 0012 LYS CB
C A 0011 THR C 3.329 C A 0012 LYS CG
C A 0012 LYS C 2.495 C A 0013 ASP CA
C A 0012 LYS C 3.664 C A 0013 ASP C
C A 0012 LYS C 3.234 C A 0013 ASP CB
C A 0013 ASP C 2.488 C A 0014 ALA CA
C A 0013 ASP C 3.123 C A 0014 ALA C
C A 0013 ASP C 3.080 C A 0014 ALA CB
C A 0014 ALA C 2.497 C A 0015 SER CA
C A 0014 ALA C 3.099 C A 0015 SER C
C A 0014 ALA C 3.194 C A 0015 SER CB
C A 0015 SER C 2.490 C A 0016 CYS CA
C A 0015 SER C 3.716 C A 0016 CYS C
C A 0015 SER C 3.152 C A 0016 CYS CB
C A 0015 SER CA 3.589 C A 0018 GLU CD
C A 0016 CYS C 2.463 C A 0017 VAL CA
C A 0016 CYS C 3.027 C A 0017 VAL C
C A 0016 CYS C 3.736 C A 0017 VAL CB
C A 0017 VAL C 2.464 C A 0018 GLU CA
C A 0017 VAL C 3.235 C A 0018 GLU C
C A 0017 VAL C 3.692 C A 0018 GLU CB
C A 0018 GLU C 2.444 C A 0019 VAL CA
C A 0018 GLU C 3.279 C A 0019 VAL C
C A 0018 GLU C 3.677 C A 0019 VAL CB
C A 0019 VAL C 2.442 C A 0020 CYS CA
C A 0019 VAL C 3.169 C A 0020 CYS C
C A 0019 VAL C 3.659 C A 0020 CYS CB
C A 0020 CYS CA 2.956 C A 0021 PRO CD
C A 0020 CYS C 2.470 C A 0021 PRO CA
C A 0020 CYS C 3.139 C A 0021 PRO C
C A 0020 CYS C 3.687 C A 0021 PRO CB
C A 0020 CYS C 3.687 C A 0021 PRO CG
C A 0020 CYS C 2.500 C A 0021 PRO CD
C A 0020 CYS CB 3.396 E A 0025 ILE CD1
C A 0021 PRO C 2.463 C A 0022 VAL CA
C A 0021 PRO C 3.543 C A 0022 VAL C
C A 0021 PRO C 3.456 C A 0022 VAL CB
C A 0021 PRO C 3.502 C A 0022 VAL CG1
C A 0022 VAL C 2.491 C A 0023 ASP CA
C A 0022 VAL C 3.075 C A 0023 ASP C
C A 0022 VAL C 3.150 C A 0023 ASP CB
C A 0022 VAL C 3.704 C A 0023 ASP CG
C A 0023 ASP C 2.446 C A 0024 CYS CA
C A 0023 ASP C 3.332 C A 0024 CYS C
C A 0023 ASP C 3.640 C A 0024 CYS CB
C A 0024 CYS C 2.455 E A 0025 ILE CA
C A 0024 CYS C 3.131 E A 0025 ILE C
C A 0024 CYS C 3.720 E A 0025 ILE CB
C A 0024 CYS C 3.755 E A 0025 ILE CD1
C A 0024 CYS CA 3.799 E A 0026 HIS CE1
C A 0024 CYS C 3.721 E A 0026 HIS CD2
C A 0024 CYS CB 3.506 C A 0038 VAL CG1
E A 0025 ILE C 2.463 E A 0026 HIS CA
E A 0025 ILE C 3.546 E A 0026 HIS C
E A 0025 ILE C 3.358 E A 0026 HIS CB
E A 0025 ILE C 3.372 E A 0026 HIS CG
E A 0025 ILE CG1 3.761 E A 0034 ILE CG1
E A 0026 HIS C 2.431 E A 0027 GLU CA
E A 0026 HIS C 3.300 E A 0027 GLU C
E A 0026 HIS C 3.616 E A 0027 GLU CB
E A 0026 HIS CB 3.506 H A 0075 PHE CE1
E A 0026 HIS CB 3.414 H A 0075 PHE CZ
E A 0026 HIS CG 3.725 H A 0075 PHE CE1
E A 0026 HIS CD2 3.564 H A 0075 PHE CE1
E A 0026 HIS CD2 3.737 H A 0075 PHE CE2
E A 0026 HIS CD2 3.553 H A 0075 PHE CZ
E A 0027 GLU C 2.467 C A 0028 GLY CA
E A 0027 GLU C 3.405 C A 0028 GLY C
C A 0028 GLY C 2.469 C A 0029 GLU CA
C A 0028 GLY C 3.014 C A 0029 GLU C
C A 0028 GLY C 3.697 C A 0029 GLU CB
C A 0028 GLY CA 3.589 E A 0033 TYR CD2
C A 0028 GLY CA 3.322 E A 0033 TYR CE2
C A 0028 GLY CA 3.627 E A 0033 TYR CZ
C A 0029 GLU C 2.475 C A 0030 ASP CA
C A 0029 GLU C 3.381 C A 0030 ASP C
C A 0029 GLU C 3.577 C A 0030 ASP CB
C A 0030 ASP C 2.466 C A 0031 GLN CA
C A 0030 ASP C 3.267 C A 0031 GLN C
C A 0030 ASP C 3.686 C A 0031 GLN CB
C A 0031 GLN CA 3.787 E A 0032 TYR CA
C A 0031 GLN C 2.426 E A 0032 TYR CA
C A 0031 GLN C 3.131 E A 0032 TYR C
C A 0031 GLN C 3.688 E A 0032 TYR CB
E A 0032 TYR C 2.500 E A 0033 TYR CA
E A 0032 TYR C 3.558 E A 0033 TYR C
E A 0032 TYR C 3.489 E A 0033 TYR CB
E A 0032 TYR C 3.624 E A 0033 TYR CG
E A 0032 TYR C 3.330 E A 0033 TYR CD1
E A 0033 TYR C 2.479 E A 0034 ILE CA
E A 0033 TYR C 3.564 E A 0034 ILE C
E A 0033 TYR C 3.432 E A 0034 ILE CB
E A 0033 TYR C 3.422 E A 0034 ILE CG1
E A 0033 TYR C 3.793 E A 0034 ILE CD1
E A 0033 TYR CB 3.406 H A 0071 ASN CG
E A 0033 TYR CG 3.655 H A 0071 ASN CG
E A 0033 TYR CD2 3.664 H A 0074 PHE CD2
E A 0033 TYR CE2 3.663 H A 0074 PHE CE2
E A 0033 TYR CE2 3.644 H A 0074 PHE CZ
E A 0034 ILE C 2.409 C A 0035 ASP CA
E A 0034 ILE C 3.033 C A 0035 ASP C
E A 0034 ILE C 3.732 C A 0035 ASP CB
E A 0034 ILE CD1 3.795 C A 0054 ILE CG1
C A 0035 ASP CA 2.983 C A 0036 PRO CD
C A 0035 ASP C 2.435 C A 0036 PRO CA
C A 0035 ASP C 3.163 C A 0036 PRO C
C A 0035 ASP C 3.623 C A 0036 PRO CB
C A 0035 ASP C 3.702 C A 0036 PRO CG
C A 0035 ASP C 2.518 C A 0036 PRO CD
C A 0035 ASP CG 3.726 C A 0036 PRO CD
C A 0035 ASP CB 3.607 H A 0075 PHE CD2
C A 0036 PRO C 2.417 C A 0037 ASP CA
C A 0036 PRO C 3.111 C A 0037 ASP C
C A 0036 PRO C 3.596 C A 0037 ASP CB
C A 0036 PRO CG 3.575 H A 0072 ARG CG
C A 0037 ASP C 2.462 C A 0038 VAL CA
C A 0037 ASP C 3.148 C A 0038 VAL C
C A 0037 ASP C 3.705 C A 0038 VAL CB
C A 0038 VAL C 2.456 C A 0039 CYS CA
C A 0038 VAL C 2.959 C A 0039 CYS C
C A 0038 VAL C 3.697 C A 0039 CYS CB
C A 0039 CYS C 2.467 C A 0040 ILE CA
C A 0039 CYS C 3.329 C A 0040 ILE C
C A 0039 CYS C 3.648 C A 0040 ILE CB
C A 0040 ILE C 2.497 C A 0041 ASP CA
C A 0040 ILE C 3.045 C A 0041 ASP C
C A 0040 ILE C 3.216 C A 0041 ASP CB
C A 0040 ILE CD1 3.559 C A 0042 CYS CB
C A 0041 ASP C 2.450 C A 0042 CYS CA
C A 0041 ASP C 3.252 C A 0042 CYS C
C A 0041 ASP C 3.635 C A 0042 CYS CB
C A 0042 CYS C 2.447 C A 0043 GLY CA
C A 0042 CYS C 3.073 C A 0043 GLY C
C A 0043 GLY C 2.490 C A 0044 ALA CA
C A 0043 GLY C 3.116 C A 0044 ALA C
C A 0043 GLY C 3.129 C A 0044 ALA CB
C A 0044 ALA C 2.478 H A 0045 CYS CA
C A 0044 ALA C 2.941 H A 0045 CYS C
C A 0044 ALA C 3.724 H A 0045 CYS CB
H A 0045 CYS C 2.510 H A 0046 GLU CA
H A 0045 CYS C 2.972 H A 0046 GLU C
H A 0045 CYS C 3.652 H A 0046 GLU CB
H A 0046 GLU C 2.452 H A 0047 ALA CA
H A 0046 GLU C 3.139 H A 0047 ALA C
H A 0046 GLU C 3.703 H A 0047 ALA CB
H A 0047 ALA C 2.450 H A 0048 VAL CA
H A 0047 ALA C 3.236 H A 0048 VAL C
H A 0047 ALA C 3.687 H A 0048 VAL CB
H A 0048 VAL C 2.440 C A 0049 CYS CA
H A 0048 VAL C 3.006 C A 0049 CYS C
H A 0048 VAL C 3.698 C A 0049 CYS CB
C A 0049 CYS CA 2.972 H A 0050 PRO CD
C A 0049 CYS C 2.451 H A 0050 PRO CA
C A 0049 CYS C 2.961 H A 0050 PRO C
C A 0049 CYS C 3.692 H A 0050 PRO CB
C A 0049 CYS C 3.710 H A 0050 PRO CG
C A 0049 CYS C 2.496 H A 0050 PRO CD
H A 0050 PRO C 2.473 H A 0051 VAL CA
H A 0050 PRO C 3.062 H A 0051 VAL C
H A 0050 PRO C 3.118 H A 0051 VAL CB
H A 0050 PRO C 3.309 H A 0051 VAL CG2
H A 0051 VAL C 2.471 H A 0052 SER CA
H A 0051 VAL C 2.971 H A 0052 SER C
H A 0051 VAL C 3.141 H A 0052 SER CB
H A 0052 SER C 2.449 C A 0053 ALA CA
H A 0052 SER C 2.972 C A 0053 ALA C
H A 0052 SER C 3.737 C A 0053 ALA CB
H A 0052 SER C 3.748 C A 0054 ILE C
C A 0053 ALA CA 3.791 C A 0054 ILE CA
C A 0053 ALA C 2.451 C A 0054 ILE CA
C A 0053 ALA C 3.010 C A 0054 ILE C
C A 0053 ALA C 3.719 C A 0054 ILE CB
C A 0054 ILE C 2.467 E A 0055 TYR CA
C A 0054 ILE C 3.492 E A 0055 TYR C
C A 0054 ILE C 3.511 E A 0055 TYR CB
E A 0055 TYR CA 3.789 E A 0056 HIS CA
E A 0055 TYR C 2.427 E A 0056 HIS CA
E A 0055 TYR C 3.014 E A 0056 HIS C
E A 0055 TYR C 3.682 E A 0056 HIS CB
E A 0055 TYR CB 3.495 C A 0060 VAL CG2
E A 0056 HIS C 2.454 C A 0057 GLU CA
E A 0056 HIS C 3.083 C A 0057 GLU C
E A 0056 HIS C 3.737 C A 0057 GLU CB
C A 0057 GLU C 2.474 C A 0058 ASP CA
C A 0057 GLU C 3.472 C A 0058 ASP C
C A 0057 GLU C 3.538 C A 0058 ASP CB
C A 0057 GLU C 3.764 C A 0060 VAL CB
C A 0058 ASP C 2.446 C A 0059 PHE CA
C A 0058 ASP C 3.051 C A 0059 PHE C
C A 0058 ASP C 3.691 C A 0059 PHE CB
C A 0059 PHE C 2.467 C A 0060 VAL CA
C A 0059 PHE C 2.920 C A 0060 VAL C
C A 0059 PHE C 3.710 C A 0060 VAL CB
C A 0060 VAL CA 2.910 C A 0061 PRO CD
C A 0060 VAL C 2.442 C A 0061 PRO CA
C A 0060 VAL C 2.980 C A 0061 PRO C
C A 0060 VAL C 3.683 C A 0061 PRO CB
C A 0060 VAL C 3.700 C A 0061 PRO CG
C A 0060 VAL C 2.484 C A 0061 PRO CD
C A 0060 VAL CG1 3.339 H A 0064 TRP C
C A 0060 VAL CG1 3.716 H A 0068 ILE CD1
C A 0061 PRO C 2.462 H A 0062 GLU CA
C A 0061 PRO C 2.936 H A 0062 GLU C
C A 0061 PRO C 3.719 H A 0062 GLU CB
C A 0061 PRO CG 3.629 H A 0064 TRP CE3
H A 0062 GLU C 2.478 H A 0063 GLU CA
H A 0062 GLU C 2.943 H A 0063 GLU C
H A 0062 GLU C 3.702 H A 0063 GLU CB
H A 0063 GLU C 2.458 H A 0064 TRP CA
H A 0063 GLU C 3.349 H A 0064 TRP C
H A 0063 GLU C 3.606 H A 0064 TRP CB
H A 0063 GLU C 3.728 H A 0064 TRP CD1
H A 0063 GLU CG 3.755 H A 0064 TRP CD1
H A 0064 TRP C 2.427 H A 0065 LYS CA
H A 0064 TRP C 2.961 H A 0065 LYS C
H A 0064 TRP C 3.751 H A 0065 LYS CB
H A 0064 TRP CD1 3.729 H A 0067 TYR CD2
H A 0064 TRP CD1 3.651 H A 0067 TYR CE2
H A 0065 LYS C 2.453 H A 0066 SER CA
H A 0065 LYS C 2.939 H A 0066 SER C
H A 0065 LYS C 3.711 H A 0066 SER CB
H A 0066 SER C 2.441 H A 0067 TYR CA
H A 0066 SER C 3.040 H A 0067 TYR C
H A 0066 SER C 3.748 H A 0067 TYR CB
H A 0067 TYR CA 3.797 H A 0068 ILE CA
H A 0067 TYR C 2.411 H A 0068 ILE CA
H A 0067 TYR C 2.931 H A 0068 ILE C
H A 0067 TYR C 3.679 H A 0068 ILE CB
H A 0067 TYR C 3.797 H A 0068 ILE CD1
H A 0067 TYR C 3.795 H A 0070 LYS CB
H A 0068 ILE CA 3.791 H A 0069 GLN CA
H A 0068 ILE C 2.438 H A 0069 GLN CA
H A 0068 ILE C 3.004 H A 0069 GLN C
H A 0068 ILE C 3.694 H A 0069 GLN CB
H A 0069 GLN C 2.453 H A 0070 LYS CA
H A 0069 GLN C 3.086 H A 0070 LYS C
H A 0069 GLN C 3.723 H A 0070 LYS CB
H A 0070 LYS C 2.441 H A 0071 ASN CA
H A 0070 LYS C 2.939 H A 0071 ASN C
H A 0070 LYS C 3.720 H A 0071 ASN CB
H A 0071 ASN CA 3.791 H A 0072 ARG CA
H A 0071 ASN C 2.420 H A 0072 ARG CA
H A 0071 ASN C 2.886 H A 0072 ARG C
H A 0071 ASN C 3.688 H A 0072 ARG CB
H A 0072 ARG C 2.471 H A 0073 ASP CA
H A 0072 ARG C 2.909 H A 0073 ASP C
H A 0072 ARG C 3.723 H A 0073 ASP CB
H A 0073 ASP CA 3.787 H A 0074 PHE CA
H A 0073 ASP C 2.480 H A 0074 PHE CA
H A 0073 ASP C 2.994 H A 0074 PHE C
H A 0073 ASP C 3.725 H A 0074 PHE CB
H A 0074 PHE C 2.451 H A 0075 PHE CA
H A 0074 PHE C 3.493 H A 0075 PHE C
H A 0074 PHE C 3.496 H A 0075 PHE CB
H A 0074 PHE C 3.559 H A 0075 PHE CG
H A 0074 PHE C 3.549 H A 0075 PHE CD1
H A 0074 PHE CB 3.714 H A 0075 PHE CZ
H A 0075 PHE C 2.452 C A 0076 LYS CA
H A 0075 PHE C 3.470 C A 0076 LYS C
H A 0075 PHE C 3.515 C A 0076 LYS CB
H A 0075 PHE C 3.762 C A 0076 LYS CE
C A 0076 LYS CA 3.739 C A 0077 LYS CA
C A 0076 LYS C 2.426 C A 0077 LYS CA
C A 0076 LYS C 3.663 C A 0077 LYS C
C A 0076 LYS C 3.094 C A 0077 LYS CB
CHARGE_ATTR 2.00 12.00 90
C A 0006 GLU OE1 10.35 H A 0070 LYS NZ
C A 0013 ASP OD1 6.384 C A 0012 LYS NZ
C A 0013 ASP OD2 7.515 C A 0012 LYS NZ
C A 0018 GLU OE1 6.978 C A 0012 LYS NZ
C A 0018 GLU OE2 7.031 C A 0012 LYS NZ
C A 0023 ASP OD1 8.936 E A 0026 HIS ND1
C A 0023 ASP OD1 8.878 E A 0026 HIS NE2
C A 0023 ASP OD2 8.462 E A 0026 HIS ND1
C A 0023 ASP OD2 8.950 E A 0026 HIS NE2
E A 0027 GLU OE1 4.994 E A 0026 HIS ND1
E A 0027 GLU OE1 6.968 E A 0026 HIS NE2
E A 0027 GLU OE2 6.893 E A 0026 HIS ND1
E A 0027 GLU OE2 8.985 E A 0026 HIS NE2
E A 0027 GLU OE1 11.70 H A 0070 LYS NZ
C A 0029 GLU OE1 2.780 H A 0070 LYS NZ
C A 0029 GLU OE2 2.637 H A 0070 LYS NZ
C A 0029 GLU OE1 11.48 C A 0077 LYS NZ
C A 0029 GLU OE2 10.37 C A 0077 LYS NZ
C A 0030 ASP OD1 11.57 C A 0012 LYS NZ
C A 0030 ASP OD1 9.931 H A 0070 LYS NZ
C A 0030 ASP OD2 10.92 H A 0070 LYS NZ
C A 0035 ASP OD1 8.700 E A 0026 HIS ND1
C A 0035 ASP OD1 6.548 E A 0026 HIS NE2
C A 0035 ASP OD2 7.966 E A 0026 HIS ND1
C A 0035 ASP OD2 5.956 E A 0026 HIS NE2
C A 0035 ASP OD1 8.296 H A 0072 ARG NH1
C A 0035 ASP OD1 6.821 H A 0072 ARG NH2
C A 0035 ASP OD2 8.788 H A 0072 ARG NH1
C A 0035 ASP OD2 7.785 H A 0072 ARG NH2
C A 0035 ASP OD1 3.505 C A 0076 LYS NZ
C A 0035 ASP OD2 2.575 C A 0076 LYS NZ
C A 0035 ASP OD2 10.93 C A 0077 LYS NZ
C A 0037 ASP OD1 11.33 E A 0026 HIS NE2
C A 0037 ASP OD2 10.35 E A 0026 HIS NE2
C A 0037 ASP OD1 11.39 E A 0056 HIS ND1
C A 0037 ASP OD1 10.01 E A 0056 HIS NE2
C A 0037 ASP OD1 9.693 H A 0065 LYS NZ
C A 0037 ASP OD2 11.29 H A 0065 LYS NZ
C A 0037 ASP OD1 4.419 H A 0072 ARG NH1
C A 0037 ASP OD1 2.630 H A 0072 ARG NH2
C A 0037 ASP OD2 5.685 H A 0072 ARG NH1
C A 0037 ASP OD2 4.522 H A 0072 ARG NH2
C A 0037 ASP OD1 4.675 C A 0076 LYS NZ
C A 0037 ASP OD2 2.645 C A 0076 LYS NZ
C A 0037 ASP OD2 11.58 C A 0077 LYS NZ
C A 0041 ASP OD1 5.297 E A 0056 HIS ND1
C A 0041 ASP OD1 3.328 E A 0056 HIS NE2
C A 0041 ASP OD2 6.217 E A 0056 HIS ND1
C A 0041 ASP OD2 4.020 E A 0056 HIS NE2
C A 0041 ASP OD1 10.81 H A 0065 LYS NZ
C A 0041 ASP OD2 10.81 H A 0065 LYS NZ
C A 0041 ASP OD1 10.52 H A 0072 ARG NH1
C A 0041 ASP OD1 9.088 H A 0072 ARG NH2
C A 0041 ASP OD2 9.918 H A 0072 ARG NH1
C A 0041 ASP OD2 8.222 H A 0072 ARG NH2
H A 0046 GLU OE1 10.08 E A 0056 HIS ND1
H A 0046 GLU OE1 9.901 E A 0056 HIS NE2
H A 0046 GLU OE2 8.471 E A 0056 HIS ND1
H A 0046 GLU OE2 8.704 E A 0056 HIS NE2
C A 0057 GLU OE1 7.016 E A 0056 HIS ND1
C A 0057 GLU OE1 7.069 E A 0056 HIS NE2
C A 0057 GLU OE2 7.059 E A 0056 HIS ND1
C A 0057 GLU OE2 6.428 E A 0056 HIS NE2
C A 0057 GLU OE1 2.622 H A 0065 LYS NZ
C A 0057 GLU OE2 4.779 H A 0065 LYS NZ
C A 0057 GLU OE1 3.340 H A 0072 ARG NH1
C A 0057 GLU OE1 4.477 H A 0072 ARG NH2
C A 0057 GLU OE2 2.663 H A 0072 ARG NH1
C A 0057 GLU OE2 2.607 H A 0072 ARG NH2
C A 0057 GLU OE1 10.95 C A 0076 LYS NZ
C A 0057 GLU OE2 9.326 C A 0076 LYS NZ
C A 0058 ASP OD1 6.194 E A 0056 HIS ND1
C A 0058 ASP OD1 7.275 E A 0056 HIS NE2
C A 0058 ASP OD2 6.261 E A 0056 HIS ND1
C A 0058 ASP OD2 7.526 E A 0056 HIS NE2
C A 0058 ASP OD1 2.638 H A 0065 LYS NZ
C A 0058 ASP OD2 4.860 H A 0065 LYS NZ
C A 0058 ASP OD1 7.571 H A 0072 ARG NH1
C A 0058 ASP OD1 8.490 H A 0072 ARG NH2
C A 0058 ASP OD2 9.543 H A 0072 ARG NH1
C A 0058 ASP OD2 10.18 H A 0072 ARG NH2
H A 0062 GLU OE1 9.180 H A 0065 LYS NZ
H A 0062 GLU OE2 8.199 H A 0065 LYS NZ
H A 0073 ASP OD1 8.926 H A 0070 LYS NZ
H A 0073 ASP OD2 7.216 H A 0070 LYS NZ
H A 0073 ASP OD1 11.20 H A 0072 ARG NH1
H A 0073 ASP OD1 9.325 C A 0076 LYS NZ
H A 0073 ASP OD2 10.05 C A 0076 LYS NZ
H A 0073 ASP OD1 2.820 C A 0077 LYS NZ
H A 0073 ASP OD2 2.627 C A 0077 LYS NZ
CHARGE_REPU 2.00 12.00 100
C A 0006 GLU OE1 10.66 C A 0029 GLU OE1
C A 0006 GLU OE1 11.58 C A 0029 GLU OE2
C A 0006 GLU OE1 8.650 C A 0030 ASP OD1
C A 0006 GLU OE1 10.06 C A 0030 ASP OD2
C A 0006 GLU OE2 10.45 C A 0030 ASP OD1
C A 0006 GLU OE2 11.67 C A 0030 ASP OD2
C A 0006 GLU OE1 8.849 H A 0063 GLU OE1
C A 0006 GLU OE1 7.007 H A 0063 GLU OE2
C A 0006 GLU OE2 7.292 H A 0063 GLU OE1
C A 0006 GLU OE2 5.426 H A 0063 GLU OE2
C A 0013 ASP OD1 7.115 C A 0018 GLU OE1
C A 0013 ASP OD1 7.064 C A 0018 GLU OE2
C A 0013 ASP OD2 8.175 C A 0018 GLU OE1
C A 0013 ASP OD2 7.543 C A 0018 GLU OE2
C A 0013 ASP OD1 10.37 E A 0027 GLU OE1
C A 0013 ASP OD1 9.911 E A 0027 GLU OE2
C A 0013 ASP OD2 11.73 E A 0027 GLU OE1
C A 0013 ASP OD2 10.90 E A 0027 GLU OE2
C A 0013 ASP OD1 10.71 C A 0030 ASP OD1
C A 0013 ASP OD1 11.42 C A 0030 ASP OD2
C A 0013 ASP OD2 11.99 C A 0030 ASP OD1
C A 0018 GLU OE1 11.54 C A 0023 ASP OD1
C A 0018 GLU OE1 10.09 C A 0023 ASP OD2
C A 0018 GLU OE2 11.44 C A 0023 ASP OD2
C A 0023 ASP OD2 11.57 E A 0027 GLU OE1
E A 0026 HIS ND1 10.40 C A 0076 LYS NZ
E A 0026 HIS NE2 8.415 C A 0076 LYS NZ
E A 0027 GLU OE1 10.23 C A 0029 GLU OE1
E A 0027 GLU OE1 11.65 C A 0029 GLU OE2
E A 0027 GLU OE2 11.12 C A 0029 GLU OE1
E A 0027 GLU OE1 11.65 C A 0035 ASP OD2
C A 0029 GLU OE1 7.965 C A 0030 ASP OD1
C A 0029 GLU OE1 8.712 C A 0030 ASP OD2
C A 0029 GLU OE2 9.692 C A 0030 ASP OD1
C A 0029 GLU OE2 10.16 C A 0030 ASP OD2
C A 0029 GLU OE1 11.25 H A 0073 ASP OD1
C A 0029 GLU OE1 9.339 H A 0073 ASP OD2
C A 0029 GLU OE2 10.29 H A 0073 ASP OD1
C A 0029 GLU OE2 8.300 H A 0073 ASP OD2
C A 0035 ASP OD1 4.890 C A 0037 ASP OD1
C A 0035 ASP OD1 4.235 C A 0037 ASP OD2
C A 0035 ASP OD2 5.874 C A 0037 ASP OD1
C A 0035 ASP OD2 4.488 C A 0037 ASP OD2
C A 0035 ASP OD1 11.07 C A 0041 ASP OD1
C A 0035 ASP OD1 10.46 C A 0041 ASP OD2
C A 0035 ASP OD1 10.79 C A 0057 GLU OE1
C A 0035 ASP OD1 8.869 C A 0057 GLU OE2
C A 0035 ASP OD2 11.59 C A 0057 GLU OE1
C A 0035 ASP OD2 9.903 C A 0057 GLU OE2
C A 0035 ASP OD2 10.29 H A 0073 ASP OD1
C A 0035 ASP OD2 10.50 H A 0073 ASP OD2
C A 0037 ASP OD1 10.10 C A 0041 ASP OD1
C A 0037 ASP OD1 9.016 C A 0041 ASP OD2
C A 0037 ASP OD2 11.01 C A 0041 ASP OD2
C A 0037 ASP OD1 7.097 C A 0057 GLU OE1
C A 0037 ASP OD1 5.195 C A 0057 GLU OE2
C A 0037 ASP OD2 8.778 C A 0057 GLU OE1
C A 0037 ASP OD2 7.089 C A 0057 GLU OE2
C A 0037 ASP OD1 11.09 C A 0058 ASP OD1
C A 0037 ASP OD1 11.73 H A 0073 ASP OD1
C A 0037 ASP OD2 10.19 H A 0073 ASP OD1
C A 0037 ASP OD2 11.25 H A 0073 ASP OD2
C A 0041 ASP OD1 8.561 H A 0046 GLU OE1
C A 0041 ASP OD1 8.108 H A 0046 GLU OE2
C A 0041 ASP OD2 10.52 H A 0046 GLU OE1
C A 0041 ASP OD2 10.14 H A 0046 GLU OE2
C A 0041 ASP OD1 9.424 C A 0057 GLU OE1
C A 0041 ASP OD1 8.130 C A 0057 GLU OE2
C A 0041 ASP OD2 9.147 C A 0057 GLU OE1
C A 0041 ASP OD2 7.611 C A 0057 GLU OE2
C A 0041 ASP OD1 10.46 C A 0058 ASP OD1
C A 0041 ASP OD1 10.78 C A 0058 ASP OD2
C A 0041 ASP OD2 10.41 C A 0058 ASP OD1
C A 0041 ASP OD2 10.72 C A 0058 ASP OD2
E A 0056 HIS ND1 7.126 H A 0065 LYS NZ
E A 0056 HIS NE2 7.931 H A 0065 LYS NZ
E A 0056 HIS ND1 9.611 H A 0072 ARG NH1
E A 0056 HIS ND1 9.280 H A 0072 ARG NH2
E A 0056 HIS NE2 9.058 H A 0072 ARG NH1
E A 0056 HIS NE2 8.220 H A 0072 ARG NH2
C A 0057 GLU OE1 4.335 C A 0058 ASP OD1
C A 0057 GLU OE1 6.366 C A 0058 ASP OD2
C A 0057 GLU OE2 6.043 C A 0058 ASP OD1
C A 0057 GLU OE2 7.777 C A 0058 ASP OD2
C A 0057 GLU OE1 11.60 H A 0062 GLU OE1
C A 0057 GLU OE1 10.40 H A 0062 GLU OE2
C A 0058 ASP OD1 9.467 H A 0062 GLU OE1
C A 0058 ASP OD1 8.713 H A 0062 GLU OE2
C A 0058 ASP OD2 10.10 H A 0062 GLU OE1
C A 0058 ASP OD2 9.589 H A 0062 GLU OE2
H A 0062 GLU OE1 8.950 H A 0063 GLU OE1
H A 0062 GLU OE1 10.65 H A 0063 GLU OE2
H A 0062 GLU OE2 10.38 H A 0063 GLU OE1
H A 0062 GLU OE2 11.80 H A 0063 GLU OE2
H A 0065 LYS NZ 5.666 H A 0072 ARG NH1
H A 0065 LYS NZ 7.085 H A 0072 ARG NH2
H A 0070 LYS NZ 9.623 C A 0077 LYS NZ
H A 0072 ARG NH1 7.818 C A 0076 LYS NZ
H A 0072 ARG NH2 6.891 C A 0076 LYS NZ
C A 0076 LYS NZ 10.16 C A 0077 LYS NZ
HB_MM 2.00 3.20 129
E A 0002 TYR N 2.268 C A 0001 ALA O
E A 0003 VAL N 2.254 E A 0002 TYR O
E A 0003 VAL N 2.800 E A 0055 TYR O
C A 0004 ILE N 2.244 E A 0003 VAL O
C A 0005 THR N 2.250 C A 0004 ILE O
C A 0006 GLU N 2.264 C A 0005 THR O
C A 0007 PRO N 2.236 C A 0006 GLU O
C A 0008 CYS N 2.928 C A 0006 GLU O
C A 0008 CYS N 2.242 C A 0007 PRO O
C A 0009 ILE N 2.831 C A 0006 GLU O
C A 0009 ILE N 2.248 C A 0008 CYS O
C A 0010 GLY N 3.036 C A 0008 CYS O
C A 0010 GLY N 2.257 C A 0009 ILE O
C A 0011 THR N 2.796 C A 0008 CYS O
C A 0011 THR N 2.927 C A 0009 ILE O
C A 0011 THR N 2.243 C A 0010 GLY O
C A 0012 LYS N 2.257 C A 0011 THR O
C A 0013 ASP N 2.258 C A 0012 LYS O
C A 0014 ALA N 2.260 C A 0013 ASP O
C A 0015 SER N 2.249 C A 0014 ALA O
C A 0016 CYS N 2.260 C A 0015 SER O
C A 0017 VAL N 2.240 C A 0016 CYS O
C A 0018 GLU N 2.243 C A 0017 VAL O
C A 0019 VAL N 3.195 C A 0016 CYS O
C A 0019 VAL N 2.247 C A 0018 GLU O
C A 0020 CYS N 2.244 C A 0019 VAL O
C A 0021 PRO N 2.248 C A 0020 CYS O
C A 0022 VAL N 3.042 C A 0020 CYS O
C A 0022 VAL N 2.253 C A 0021 PRO O
C A 0023 ASP N 3.041 C A 0020 CYS O
C A 0023 ASP N 2.260 C A 0022 VAL O
C A 0024 CYS N 2.861 C A 0022 VAL O
C A 0024 CYS N 2.237 C A 0023 ASP O
E A 0025 ILE N 2.259 C A 0024 CYS O
E A 0026 HIS N 2.247 E A 0025 ILE O
E A 0026 HIS N 2.834 E A 0033 TYR O
E A 0027 GLU N 2.227 E A 0026 HIS O
C A 0028 GLY N 2.253 E A 0027 GLU O
C A 0028 GLY N 2.812 C A 0031 GLN O
C A 0029 GLU N 2.250 C A 0028 GLY O
C A 0030 ASP N 2.260 C A 0029 GLU O
C A 0031 GLN N 2.253 C A 0030 ASP O
E A 0032 TYR N 2.249 C A 0031 GLN O
E A 0033 TYR N 2.765 E A 0026 HIS O
E A 0033 TYR N 2.260 E A 0032 TYR O
E A 0034 ILE N 2.253 E A 0033 TYR O
C A 0035 ASP N 2.933 C A 0024 CYS O
C A 0035 ASP N 2.246 E A 0034 ILE O
C A 0036 PRO N 2.255 C A 0035 ASP O
C A 0037 ASP N 2.222 C A 0036 PRO O
C A 0038 VAL N 2.253 C A 0037 ASP O
C A 0039 CYS N 3.102 C A 0035 ASP O
C A 0039 CYS N 2.255 C A 0038 VAL O
C A 0040 ILE N 3.178 C A 0038 VAL O
C A 0040 ILE N 2.245 C A 0039 CYS O
C A 0041 ASP N 2.248 C A 0040 ILE O
C A 0042 CYS N 2.247 C A 0041 ASP O
C A 0043 GLY N 2.247 C A 0042 CYS O
C A 0044 ALA N 2.254 C A 0043 GLY O
H A 0045 CYS N 2.679 C A 0043 GLY O
H A 0045 CYS N 2.258 C A 0044 ALA O
H A 0046 GLU N 2.258 H A 0045 CYS O
H A 0047 ALA N 2.779 C A 0044 ALA O
H A 0047 ALA N 3.049 H A 0045 CYS O
H A 0047 ALA N 2.246 H A 0046 GLU O
H A 0048 VAL N 3.051 H A 0045 CYS O
H A 0048 VAL N 2.253 H A 0047 ALA O
C A 0049 CYS N 2.823 H A 0045 CYS O
C A 0049 CYS N 2.248 H A 0048 VAL O
H A 0050 PRO N 2.246 C A 0049 CYS O
H A 0051 VAL N 3.043 C A 0049 CYS O
H A 0051 VAL N 2.252 H A 0050 PRO O
H A 0052 SER N 2.826 C A 0049 CYS O
H A 0052 SER N 3.057 H A 0050 PRO O
H A 0052 SER N 2.246 H A 0051 VAL O
C A 0053 ALA N 2.241 H A 0052 SER O
C A 0054 ILE N 3.168 H A 0052 SER O
C A 0054 ILE N 2.256 C A 0053 ALA O
E A 0055 TYR N 2.770 E A 0003 VAL O
E A 0055 TYR N 2.247 C A 0054 ILE O
E A 0056 HIS N 2.240 E A 0055 TYR O
C A 0057 GLU N 2.885 C A 0001 ALA O
C A 0057 GLU N 2.249 E A 0056 HIS O
C A 0058 ASP N 2.814 E A 0056 HIS O
C A 0058 ASP N 2.256 C A 0057 GLU O
C A 0059 PHE N 2.810 E A 0056 HIS O
C A 0059 PHE N 2.240 C A 0058 ASP O
C A 0060 VAL N 2.802 E A 0056 HIS O
C A 0060 VAL N 2.257 C A 0059 PHE O
C A 0061 PRO N 2.258 C A 0060 VAL O
H A 0062 GLU N 2.254 C A 0061 PRO O
H A 0063 GLU N 3.115 C A 0061 PRO O
H A 0063 GLU N 2.257 H A 0062 GLU O
H A 0064 TRP N 2.712 C A 0061 PRO O
H A 0064 TRP N 3.115 H A 0062 GLU O
H A 0064 TRP N 2.245 H A 0063 GLU O
H A 0065 LYS N 2.819 C A 0061 PRO O
H A 0065 LYS N 2.897 H A 0062 GLU O
H A 0065 LYS N 2.230 H A 0064 TRP O
H A 0066 SER N 3.095 H A 0064 TRP O
H A 0066 SER N 2.245 H A 0065 LYS O
H A 0067 TYR N 2.766 H A 0064 TRP O
H A 0067 TYR N 2.243 H A 0066 SER O
H A 0068 ILE N 3.041 H A 0065 LYS O
H A 0068 ILE N 2.232 H A 0067 TYR O
H A 0069 GLN N 2.922 H A 0065 LYS O
H A 0069 GLN N 2.253 H A 0068 ILE O
H A 0070 LYS N 2.817 H A 0066 SER O
H A 0070 LYS N 3.010 H A 0067 TYR O
H A 0070 LYS N 2.234 H A 0069 GLN O
H A 0071 ASN N 2.736 H A 0067 TYR O
H A 0071 ASN N 3.180 H A 0068 ILE O
H A 0071 ASN N 2.239 H A 0070 LYS O
H A 0072 ARG N 2.852 H A 0068 ILE O
H A 0072 ARG N 2.244 H A 0071 ASN O
H A 0073 ASP N 2.770 H A 0069 GLN O
H A 0073 ASP N 2.979 H A 0070 LYS O
H A 0073 ASP N 2.269 H A 0072 ARG O
H A 0074 PHE N 2.898 H A 0070 LYS O
H A 0074 PHE N 3.064 H A 0072 ARG O
H A 0074 PHE N 2.284 H A 0073 ASP O
H A 0075 PHE N 2.846 H A 0072 ARG O
H A 0075 PHE N 3.021 H A 0073 ASP O
H A 0075 PHE N 2.252 H A 0074 PHE O
C A 0076 LYS N 3.055 H A 0072 ARG O
C A 0076 LYS N 3.017 H A 0073 ASP O
C A 0076 LYS N 2.247 H A 0075 PHE O
C A 0077 LYS N 3.111 H A 0073 ASP O
C A 0077 LYS N 2.258 C A 0076 LYS O
HB_MS 2.00 3.20 26
C A 0001 ALA N 2.609 C A 0041 ASP OD1
C A 0001 ALA N 2.652 C A 0041 ASP OD2
C A 0005 THR O 2.936 C A 0031 GLN NE2
C A 0006 GLU N 2.750 C A 0005 THR OG1
C A 0009 ILE O 2.795 C A 0011 THR OG1
C A 0010 GLY N 2.606 C A 0030 ASP OD1
C A 0013 ASP O 2.668 C A 0012 LYS NZ
C A 0014 ALA O 2.616 C A 0012 LYS NZ
C A 0014 ALA N 2.639 C A 0013 ASP OD1
C A 0014 ALA O 2.797 C A 0015 SER OG
C A 0015 SER N 2.901 C A 0018 GLU OE1
C A 0015 SER N 2.734 C A 0018 GLU OE2
C A 0016 CYS N 2.666 C A 0018 GLU OE1
C A 0017 VAL N 3.102 C A 0018 GLU OE1
C A 0031 GLN N 2.823 C A 0030 ASP OD1
E A 0034 ILE N 2.895 H A 0071 ASN OD1
C A 0036 PRO N 3.149 C A 0035 ASP OD1
C A 0037 ASP N 2.713 C A 0035 ASP OD1
C A 0038 VAL N 2.730 C A 0035 ASP OD1
H A 0051 VAL O 2.734 E A 0055 TYR OH
C A 0053 ALA O 2.740 C A 0005 THR OG1
C A 0054 ILE O 2.706 H A 0052 SER OG
C A 0057 GLU O 2.681 H A 0065 LYS NZ
H A 0063 GLU O 2.744 H A 0066 SER OG
H A 0065 LYS O 2.724 H A 0069 GLN NE2
H A 0067 TYR O 2.963 H A 0071 ASN ND2
HB_SS 2.00 3.20 7
C A 0006 GLU OE1 2.618 H A 0067 TYR OH
C A 0012 LYS NZ 2.757 C A 0015 SER OG
C A 0013 ASP OD1 2.615 E A 0032 TYR OH
C A 0029 GLU OE1 2.549 E A 0033 TYR OH
H A 0046 GLU OE2 2.626 E A 0002 TYR OH
H A 0070 LYS NZ 2.761 E A 0033 TYR OH
H A 0072 ARG NH1 2.806 H A 0069 GLN OE1
AROMATIC 0.00 8.00 9
H A 0070 LYS 4.627 E A 0033 TYR
E A 0033 TYR 4.878 H A 0074 PHE
H A 0070 LYS 4.331 H A 0074 PHE
C A 0077 LYS 7.865 H A 0074 PHE
H A 0074 PHE 5.926 H A 0075 PHE
C A 0076 LYS 6.780 H A 0075 PHE
E A 0002 TYR 5.301 E A 0056 HIS
H A 0065 LYS 7.839 E A 0056 HIS
H A 0070 LYS 7.147 H A 0067 TYR