Complet list of 1bqx con file
Complete list of 1bqx.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 344
C A 0001 ALA C 2.476 C A 0002 TYR CA
C A 0001 ALA C 3.371 C A 0002 TYR C
C A 0001 ALA C 3.616 C A 0002 TYR CB
C A 0001 ALA C 3.776 C A 0002 TYR CD1
C A 0001 ALA CB 3.445 C A 0036 PRO CA
C A 0001 ALA CB 3.501 C A 0036 PRO C
C A 0001 ALA CB 3.535 C A 0036 PRO CB
C A 0001 ALA CA 3.394 C A 0041 ASP CG
C A 0001 ALA C 3.465 C A 0056 HIS CD2
C A 0002 TYR C 2.459 C A 0003 VAL CA
C A 0002 TYR C 3.642 C A 0003 VAL C
C A 0002 TYR C 3.325 C A 0003 VAL CB
C A 0002 TYR C 3.149 C A 0003 VAL CG2
C A 0002 TYR CD2 3.779 C A 0055 TYR C
C A 0003 VAL C 2.492 C A 0004 ILE CA
C A 0003 VAL C 3.114 C A 0004 ILE C
C A 0003 VAL C 3.731 C A 0004 ILE CB
C A 0003 VAL CG2 3.714 C A 0036 PRO CB
C A 0003 VAL C 3.559 C A 0054 ILE CG2
C A 0003 VAL CG1 3.575 H A 0071 ASN CB
C A 0003 VAL CG1 3.242 H A 0071 ASN CG
C A 0004 ILE C 2.435 C A 0005 THR CA
C A 0004 ILE C 3.673 C A 0005 THR C
C A 0004 ILE C 3.259 C A 0005 THR CB
C A 0004 ILE C 3.238 C A 0005 THR CG2
C A 0005 THR C 2.474 C A 0006 GLU CA
C A 0005 THR C 3.622 C A 0006 GLU C
C A 0005 THR C 3.301 C A 0006 GLU CB
C A 0005 THR CG2 3.429 C A 0060 VAL CG1
C A 0005 THR CG2 3.481 C A 0060 VAL CG2
C A 0006 GLU CA 3.037 C A 0007 PRO CD
C A 0006 GLU C 2.471 C A 0007 PRO CA
C A 0006 GLU C 3.187 C A 0007 PRO C
C A 0006 GLU C 3.694 C A 0007 PRO CB
C A 0006 GLU C 3.685 C A 0007 PRO CG
C A 0006 GLU C 2.493 C A 0007 PRO CD
C A 0006 GLU CB 3.403 C A 0007 PRO CD
C A 0006 GLU CA 3.695 C A 0009 ILE CD1
C A 0006 GLU CB 3.531 H A 0064 TRP CE2
C A 0006 GLU CB 3.555 H A 0064 TRP CZ2
C A 0006 GLU CD 3.713 H A 0064 TRP CE2
C A 0007 PRO C 2.508 C A 0008 CYS CA
C A 0007 PRO C 3.527 C A 0008 CYS C
C A 0007 PRO C 3.490 C A 0008 CYS CB
C A 0007 PRO CG 3.752 H A 0064 TRP CH2
C A 0007 PRO CD 3.462 H A 0064 TRP CH2
C A 0008 CYS C 2.466 C A 0009 ILE CA
C A 0008 CYS C 2.990 C A 0009 ILE C
C A 0008 CYS C 3.729 C A 0009 ILE CB
C A 0009 ILE C 2.438 C A 0010 GLY CA
C A 0009 ILE C 3.719 C A 0010 GLY C
C A 0009 ILE CG1 3.701 C A 0031 GLN CD
C A 0010 GLY C 2.519 C A 0011 THR CA
C A 0010 GLY C 3.020 C A 0011 THR C
C A 0010 GLY C 3.502 C A 0011 THR CB
C A 0011 THR C 2.504 C A 0012 LYS CA
C A 0011 THR C 3.247 C A 0012 LYS C
C A 0011 THR C 3.087 C A 0012 LYS CB
C A 0011 THR CA 3.558 C A 0030 ASP CG
C A 0012 LYS CA 3.796 C A 0013 CYS CA
C A 0012 LYS C 2.450 C A 0013 CYS CA
C A 0012 LYS C 2.996 C A 0013 CYS C
C A 0012 LYS C 3.683 C A 0013 CYS CB
C A 0012 LYS CD 3.790 E A 0027 GLU CD
C A 0013 CYS C 2.459 C A 0014 ALA CA
C A 0013 CYS C 3.635 C A 0014 ALA C
C A 0013 CYS C 3.269 C A 0014 ALA CB
C A 0014 ALA C 2.469 C A 0015 SER CA
C A 0014 ALA C 3.682 C A 0015 SER C
C A 0014 ALA C 3.225 C A 0015 SER CB
C A 0015 SER C 2.471 C A 0016 CYS CA
C A 0015 SER C 3.147 C A 0016 CYS C
C A 0015 SER C 3.706 C A 0016 CYS CB
C A 0015 SER C 3.431 H A 0048 VAL CG1
C A 0016 CYS C 2.470 C A 0017 VAL CA
C A 0016 CYS C 3.541 C A 0017 VAL C
C A 0016 CYS C 3.422 C A 0017 VAL CB
C A 0016 CYS C 3.344 C A 0017 VAL CG2
C A 0017 VAL C 2.478 C A 0018 GLU CA
C A 0017 VAL C 3.250 C A 0018 GLU C
C A 0017 VAL C 3.701 C A 0018 GLU CB
C A 0017 VAL CG2 3.715 E A 0032 TYR CE1
C A 0017 VAL CG2 3.644 E A 0032 TYR CE2
C A 0017 VAL CG2 3.389 E A 0032 TYR CZ
C A 0018 GLU C 2.477 C A 0019 VAL CA
C A 0018 GLU C 3.512 C A 0019 VAL C
C A 0018 GLU C 3.500 C A 0019 VAL CB
C A 0019 VAL C 2.425 C A 0020 CYS CA
C A 0019 VAL C 3.043 C A 0020 CYS C
C A 0019 VAL C 3.696 C A 0020 CYS CB
C A 0020 CYS CA 2.885 C A 0021 PRO CD
C A 0020 CYS C 2.485 C A 0021 PRO CA
C A 0020 CYS C 3.030 C A 0021 PRO C
C A 0020 CYS C 3.672 C A 0021 PRO CB
C A 0020 CYS C 3.682 C A 0021 PRO CG
C A 0020 CYS C 2.469 C A 0021 PRO CD
C A 0021 PRO C 2.467 C A 0022 VAL CA
C A 0021 PRO C 3.581 C A 0022 VAL C
C A 0021 PRO C 3.454 C A 0022 VAL CB
C A 0021 PRO C 3.457 C A 0022 VAL CG2
C A 0022 VAL C 2.493 C A 0023 ASP CA
C A 0022 VAL C 2.967 C A 0023 ASP C
C A 0022 VAL C 3.289 C A 0023 ASP CB
C A 0022 VAL CG2 3.706 C A 0040 ILE CG1
C A 0023 ASP C 2.461 C A 0024 CYS CA
C A 0023 ASP C 3.506 C A 0024 CYS C
C A 0023 ASP C 3.482 C A 0024 CYS CB
C A 0024 CYS C 2.500 E A 0025 ILE CA
C A 0024 CYS C 3.445 E A 0025 ILE C
C A 0024 CYS C 3.583 E A 0025 ILE CB
C A 0024 CYS C 3.561 E A 0026 HIS CD2
C A 0024 CYS CB 3.682 C A 0038 VAL CB
C A 0024 CYS CB 3.660 C A 0038 VAL CG1
E A 0025 ILE C 2.480 E A 0026 HIS CA
E A 0025 ILE C 3.563 E A 0026 HIS C
E A 0025 ILE C 3.420 E A 0026 HIS CB
E A 0025 ILE C 3.421 E A 0026 HIS CG
E A 0025 ILE C 3.728 E A 0026 HIS CD2
E A 0025 ILE C 3.758 E A 0032 TYR CD2
E A 0025 ILE CG2 3.497 E A 0034 ILE CG1
E A 0026 HIS C 2.427 E A 0027 GLU CA
E A 0026 HIS C 3.238 E A 0027 GLU C
E A 0026 HIS C 3.671 E A 0027 GLU CB
E A 0026 HIS CB 3.581 H A 0075 PHE CE1
E A 0026 HIS CB 3.660 H A 0075 PHE CZ
E A 0026 HIS CG 3.451 H A 0075 PHE CE1
E A 0026 HIS CG 3.716 H A 0075 PHE CZ
E A 0026 HIS CD2 3.352 H A 0075 PHE CE1
E A 0026 HIS CD2 3.354 H A 0075 PHE CZ
E A 0027 GLU C 2.482 C A 0028 GLY CA
E A 0027 GLU C 3.355 C A 0028 GLY C
E A 0027 GLU CG 3.529 E A 0032 TYR CE1
E A 0027 GLU CG 3.729 E A 0032 TYR CE2
E A 0027 GLU CG 3.369 E A 0032 TYR CZ
E A 0027 GLU CD 3.753 E A 0032 TYR CZ
C A 0028 GLY C 2.536 C A 0029 GLU CA
C A 0028 GLY C 3.184 C A 0029 GLU C
C A 0028 GLY C 3.163 C A 0029 GLU CB
C A 0028 GLY CA 3.786 E A 0033 TYR CD2
C A 0029 GLU C 2.473 C A 0030 ASP CA
C A 0029 GLU C 3.217 C A 0030 ASP C
C A 0029 GLU C 3.716 C A 0030 ASP CB
C A 0030 ASP C 2.441 C A 0031 GLN CA
C A 0030 ASP C 3.618 C A 0031 GLN C
C A 0030 ASP C 3.224 C A 0031 GLN CB
C A 0030 ASP C 3.694 C A 0031 GLN CG
C A 0031 GLN CA 3.787 E A 0032 TYR CA
C A 0031 GLN C 2.424 E A 0032 TYR CA
C A 0031 GLN C 3.124 E A 0032 TYR C
C A 0031 GLN C 3.677 E A 0032 TYR CB
C A 0031 GLN CG 3.776 E A 0033 TYR CE2
C A 0031 GLN CD 3.160 E A 0033 TYR CE2
C A 0031 GLN CD 3.512 E A 0033 TYR CZ
E A 0032 TYR C 2.514 E A 0033 TYR CA
E A 0032 TYR C 3.558 E A 0033 TYR C
E A 0032 TYR C 3.441 E A 0033 TYR CB
E A 0032 TYR C 3.757 E A 0033 TYR CD2
E A 0033 TYR C 2.442 E A 0034 ILE CA
E A 0033 TYR C 3.200 E A 0034 ILE C
E A 0033 TYR C 3.658 E A 0034 ILE CB
E A 0033 TYR CD1 3.446 H A 0071 ASN CG
E A 0033 TYR CG 3.685 H A 0074 PHE CE2
E A 0033 TYR CD1 3.371 H A 0074 PHE CD2
E A 0033 TYR CD1 3.372 H A 0074 PHE CE2
E A 0033 TYR CE1 3.679 H A 0074 PHE CD2
E A 0033 TYR CE1 3.319 H A 0074 PHE CE2
E A 0033 TYR CE2 3.675 H A 0074 PHE CE2
E A 0033 TYR CZ 3.522 H A 0074 PHE CE2
E A 0034 ILE C 2.409 C A 0035 ASP CA
E A 0034 ILE C 3.034 C A 0035 ASP C
E A 0034 ILE C 3.747 C A 0035 ASP CB
E A 0034 ILE CG2 3.771 C A 0035 ASP C
E A 0034 ILE CD1 3.549 C A 0054 ILE CG2
C A 0035 ASP CA 3.022 C A 0036 PRO CD
C A 0035 ASP C 2.424 C A 0036 PRO CA
C A 0035 ASP C 2.990 C A 0036 PRO C
C A 0035 ASP C 3.657 C A 0036 PRO CB
C A 0035 ASP C 3.675 C A 0036 PRO CG
C A 0035 ASP C 2.514 C A 0036 PRO CD
C A 0035 ASP CG 3.757 C A 0038 VAL CG2
C A 0035 ASP CA 3.719 H A 0075 PHE CE2
C A 0035 ASP CB 3.520 H A 0075 PHE CD2
C A 0035 ASP CG 3.399 H A 0075 PHE CD2
C A 0036 PRO C 2.430 C A 0037 ASP CA
C A 0036 PRO C 3.156 C A 0037 ASP C
C A 0036 PRO C 3.651 C A 0037 ASP CB
C A 0036 PRO CG 3.518 H A 0072 ARG CZ
C A 0037 ASP C 2.462 C A 0038 VAL CA
C A 0037 ASP C 3.353 C A 0038 VAL C
C A 0037 ASP C 3.630 C A 0038 VAL CB
C A 0037 ASP C 3.762 C A 0038 VAL CG2
C A 0038 VAL C 2.462 C A 0039 CYS CA
C A 0038 VAL C 3.007 C A 0039 CYS C
C A 0038 VAL C 3.716 C A 0039 CYS CB
C A 0039 CYS C 2.467 C A 0040 ILE CA
C A 0039 CYS C 3.320 C A 0040 ILE C
C A 0039 CYS C 3.650 C A 0040 ILE CB
C A 0040 ILE C 2.490 C A 0041 ASP CA
C A 0040 ILE C 2.990 C A 0041 ASP C
C A 0040 ILE C 3.261 C A 0041 ASP CB
C A 0041 ASP C 2.464 C A 0042 CYS CA
C A 0041 ASP C 3.351 C A 0042 CYS C
C A 0041 ASP C 3.572 C A 0042 CYS CB
C A 0042 CYS C 2.460 C A 0043 GLY CA
C A 0042 CYS C 3.683 C A 0043 GLY C
C A 0043 GLY C 2.452 H A 0044 ALA CA
C A 0043 GLY C 3.172 H A 0044 ALA C
C A 0043 GLY C 3.689 H A 0044 ALA CB
H A 0044 ALA C 2.466 H A 0045 CYS CA
H A 0044 ALA C 3.008 H A 0045 CYS C
H A 0044 ALA C 3.708 H A 0045 CYS CB
H A 0045 CYS C 2.462 H A 0046 GLU CA
H A 0045 CYS C 2.996 H A 0046 GLU C
H A 0045 CYS C 3.756 H A 0046 GLU CB
H A 0045 CYS C 3.695 C A 0054 ILE CD1
H A 0046 GLU C 2.446 H A 0047 ALA CA
H A 0046 GLU C 2.996 H A 0047 ALA C
H A 0046 GLU C 3.724 H A 0047 ALA CB
H A 0046 GLU CD 3.623 C A 0052 SER CA
H A 0047 ALA C 2.456 H A 0048 VAL CA
H A 0047 ALA C 3.203 H A 0048 VAL C
H A 0047 ALA C 3.675 H A 0048 VAL CB
H A 0048 VAL C 2.448 C A 0049 CYS CA
H A 0048 VAL C 2.979 C A 0049 CYS C
H A 0048 VAL C 3.721 C A 0049 CYS CB
C A 0049 CYS CA 2.985 C A 0050 PRO CD
C A 0049 CYS C 2.473 C A 0050 PRO CA
C A 0049 CYS C 3.212 C A 0050 PRO C
C A 0049 CYS C 3.652 C A 0050 PRO CB
C A 0049 CYS C 3.690 C A 0050 PRO CG
C A 0049 CYS C 2.500 C A 0050 PRO CD
C A 0050 PRO C 2.486 C A 0051 VAL CA
C A 0050 PRO C 3.580 C A 0051 VAL C
C A 0050 PRO C 3.446 C A 0051 VAL CB
C A 0050 PRO C 3.328 C A 0051 VAL CG1
C A 0051 VAL C 2.493 C A 0052 SER CA
C A 0051 VAL C 3.085 C A 0052 SER C
C A 0051 VAL C 3.094 C A 0052 SER CB
C A 0051 VAL CG2 3.703 C A 0052 SER C
C A 0051 VAL CG2 3.416 C A 0053 ALA CB
C A 0052 SER C 2.466 C A 0053 ALA CA
C A 0052 SER C 3.731 C A 0053 ALA C
C A 0052 SER C 3.220 C A 0053 ALA CB
C A 0053 ALA C 2.440 C A 0054 ILE CA
C A 0053 ALA C 3.117 C A 0054 ILE C
C A 0053 ALA C 3.687 C A 0054 ILE CB
C A 0053 ALA CA 3.667 C A 0055 TYR CE2
C A 0053 ALA C 3.786 C A 0055 TYR CD2
C A 0053 ALA C 3.610 C A 0055 TYR CE2
C A 0054 ILE C 2.449 C A 0055 TYR CA
C A 0054 ILE C 3.510 C A 0055 TYR C
C A 0054 ILE C 3.448 C A 0055 TYR CB
C A 0054 ILE C 3.613 C A 0055 TYR CG
C A 0055 TYR CA 3.766 C A 0056 HIS CA
C A 0055 TYR C 2.412 C A 0056 HIS CA
C A 0055 TYR C 2.927 C A 0056 HIS C
C A 0055 TYR C 3.708 C A 0056 HIS CB
C A 0056 HIS CA 3.789 C A 0057 GLU CA
C A 0056 HIS C 2.421 C A 0057 GLU CA
C A 0056 HIS C 2.959 C A 0057 GLU C
C A 0056 HIS C 3.677 C A 0057 GLU CB
C A 0056 HIS CB 3.535 C A 0059 PHE CG
C A 0056 HIS CB 3.577 C A 0059 PHE CD2
C A 0057 GLU CA 3.791 C A 0058 ASP CA
C A 0057 GLU C 2.438 C A 0058 ASP CA
C A 0057 GLU C 3.039 C A 0058 ASP C
C A 0057 GLU C 3.710 C A 0058 ASP CB
C A 0057 GLU CA 3.620 H A 0068 ILE CG1
C A 0057 GLU CB 3.638 H A 0068 ILE CG1
C A 0058 ASP C 2.453 C A 0059 PHE CA
C A 0058 ASP C 3.169 C A 0059 PHE C
C A 0058 ASP C 3.682 C A 0059 PHE CB
C A 0059 PHE C 2.436 C A 0060 VAL CA
C A 0059 PHE C 2.932 C A 0060 VAL C
C A 0059 PHE C 3.712 C A 0060 VAL CB
C A 0060 VAL CA 2.983 C A 0061 PRO CD
C A 0060 VAL C 2.473 C A 0061 PRO CA
C A 0060 VAL C 3.034 C A 0061 PRO C
C A 0060 VAL C 3.688 C A 0061 PRO CB
C A 0060 VAL C 3.683 C A 0061 PRO CG
C A 0060 VAL C 2.504 C A 0061 PRO CD
C A 0060 VAL CG1 3.478 H A 0064 TRP C
C A 0060 VAL CG1 3.421 H A 0064 TRP CB
C A 0060 VAL CB 3.630 H A 0068 ILE CD1
C A 0060 VAL CG1 3.508 H A 0068 ILE CD1
C A 0061 PRO C 2.510 H A 0062 GLU CA
C A 0061 PRO C 3.053 H A 0062 GLU C
C A 0061 PRO C 3.640 H A 0062 GLU CB
H A 0062 GLU C 2.454 H A 0063 GLU CA
H A 0062 GLU C 2.938 H A 0063 GLU C
H A 0062 GLU C 3.716 H A 0063 GLU CB
H A 0062 GLU CA 3.743 H A 0065 LYS CB
H A 0062 GLU CA 3.392 H A 0065 LYS CG
H A 0063 GLU C 2.482 H A 0064 TRP CA
H A 0063 GLU C 3.426 H A 0064 TRP C
H A 0063 GLU C 3.583 H A 0064 TRP CB
H A 0063 GLU C 3.689 H A 0064 TRP CD1
H A 0064 TRP C 2.460 H A 0065 LYS CA
H A 0064 TRP C 2.955 H A 0065 LYS C
H A 0064 TRP C 3.704 H A 0065 LYS CB
H A 0065 LYS C 2.470 H A 0066 SER CA
H A 0065 LYS C 2.956 H A 0066 SER C
H A 0065 LYS C 3.691 H A 0066 SER CB
H A 0066 SER C 2.435 H A 0067 TYR CA
H A 0066 SER C 3.069 H A 0067 TYR C
H A 0066 SER C 3.739 H A 0067 TYR CB
H A 0067 TYR C 2.432 H A 0068 ILE CA
H A 0067 TYR C 2.947 H A 0068 ILE C
H A 0067 TYR C 3.702 H A 0068 ILE CB
H A 0068 ILE CA 3.795 H A 0069 GLN CA
H A 0068 ILE C 2.431 H A 0069 GLN CA
H A 0068 ILE C 2.941 H A 0069 GLN C
H A 0068 ILE C 3.715 H A 0069 GLN CB
H A 0069 GLN C 2.445 H A 0070 LYS CA
H A 0069 GLN C 3.059 H A 0070 LYS C
H A 0069 GLN C 3.726 H A 0070 LYS CB
H A 0070 LYS C 2.475 H A 0071 ASN CA
H A 0070 LYS C 3.051 H A 0071 ASN C
H A 0070 LYS C 3.746 H A 0071 ASN CB
H A 0070 LYS CE 3.717 H A 0074 PHE CD2
H A 0070 LYS CE 3.615 H A 0074 PHE CE2
H A 0071 ASN C 2.469 H A 0072 ARG CA
H A 0071 ASN C 2.954 H A 0072 ARG C
H A 0071 ASN C 3.694 H A 0072 ARG CB
H A 0072 ARG CA 3.790 H A 0073 ASP CA
H A 0072 ARG C 2.499 H A 0073 ASP CA
H A 0072 ARG C 3.120 H A 0073 ASP C
H A 0072 ARG C 3.670 H A 0073 ASP CB
H A 0073 ASP C 2.482 H A 0074 PHE CA
H A 0073 ASP C 2.929 H A 0074 PHE C
H A 0073 ASP C 3.733 H A 0074 PHE CB
H A 0074 PHE C 2.453 H A 0075 PHE CA
H A 0074 PHE C 3.396 H A 0075 PHE C
H A 0074 PHE C 3.554 H A 0075 PHE CB
H A 0074 PHE C 3.614 H A 0075 PHE CG
H A 0074 PHE CB 3.664 H A 0075 PHE CD2
H A 0074 PHE CB 3.488 H A 0075 PHE CE2
H A 0074 PHE CB 3.572 H A 0075 PHE CZ
H A 0075 PHE C 2.445 C A 0076 LYS CA
H A 0075 PHE C 3.121 C A 0076 LYS C
H A 0075 PHE C 3.705 C A 0076 LYS CB
C A 0076 LYS C 2.442 C A 0077 LYS CA
C A 0076 LYS C 3.644 C A 0077 LYS C
C A 0076 LYS C 3.146 C A 0077 LYS CB
CHARGE_ATTR 2.00 12.00 90
C A 0023 ASP OD1 6.381 E A 0026 HIS ND1
C A 0023 ASP OD1 6.685 E A 0026 HIS NE2
C A 0023 ASP OD2 6.009 E A 0026 HIS ND1
C A 0023 ASP OD2 6.331 E A 0026 HIS NE2
E A 0027 GLU OE1 2.585 C A 0012 LYS NZ
E A 0027 GLU OE2 4.023 C A 0012 LYS NZ
E A 0027 GLU OE1 9.524 E A 0026 HIS ND1
E A 0027 GLU OE1 11.45 E A 0026 HIS NE2
E A 0027 GLU OE2 9.391 E A 0026 HIS ND1
E A 0027 GLU OE2 11.19 E A 0026 HIS NE2
C A 0029 GLU OE1 2.550 C A 0012 LYS NZ
C A 0029 GLU OE2 4.106 C A 0012 LYS NZ
C A 0030 ASP OD1 8.383 C A 0012 LYS NZ
C A 0030 ASP OD2 8.090 C A 0012 LYS NZ
C A 0035 ASP OD1 8.806 E A 0026 HIS ND1
C A 0035 ASP OD1 6.849 E A 0026 HIS NE2
C A 0035 ASP OD2 7.495 E A 0026 HIS ND1
C A 0035 ASP OD2 5.657 E A 0026 HIS NE2
C A 0035 ASP OD1 11.88 C A 0056 HIS NE2
C A 0035 ASP OD1 10.19 H A 0070 LYS NZ
C A 0035 ASP OD2 10.00 H A 0070 LYS NZ
C A 0035 ASP OD1 7.398 H A 0072 ARG NH1
C A 0035 ASP OD1 5.975 H A 0072 ARG NH2
C A 0035 ASP OD2 9.311 H A 0072 ARG NH1
C A 0035 ASP OD2 7.977 H A 0072 ARG NH2
C A 0035 ASP OD1 2.690 C A 0076 LYS NZ
C A 0035 ASP OD2 2.713 C A 0076 LYS NZ
C A 0035 ASP OD1 10.52 C A 0077 LYS NZ
C A 0035 ASP OD2 9.800 C A 0077 LYS NZ
C A 0037 ASP OD1 11.49 E A 0026 HIS NE2
C A 0037 ASP OD2 11.90 E A 0026 HIS ND1
C A 0037 ASP OD2 10.05 E A 0026 HIS NE2
C A 0037 ASP OD1 11.02 C A 0056 HIS ND1
C A 0037 ASP OD1 9.855 C A 0056 HIS NE2
C A 0037 ASP OD2 11.44 C A 0056 HIS NE2
C A 0037 ASP OD2 10.31 H A 0070 LYS NZ
C A 0037 ASP OD1 4.413 H A 0072 ARG NH1
C A 0037 ASP OD1 2.609 H A 0072 ARG NH2
C A 0037 ASP OD2 5.158 H A 0072 ARG NH1
C A 0037 ASP OD2 3.959 H A 0072 ARG NH2
C A 0037 ASP OD1 4.730 C A 0076 LYS NZ
C A 0037 ASP OD2 2.646 C A 0076 LYS NZ
C A 0037 ASP OD1 11.66 C A 0077 LYS NZ
C A 0037 ASP OD2 9.702 C A 0077 LYS NZ
C A 0041 ASP OD1 4.930 C A 0056 HIS ND1
C A 0041 ASP OD1 2.824 C A 0056 HIS NE2
C A 0041 ASP OD2 6.030 C A 0056 HIS ND1
C A 0041 ASP OD2 3.858 C A 0056 HIS NE2
C A 0041 ASP OD1 9.734 H A 0072 ARG NH1
C A 0041 ASP OD1 8.508 H A 0072 ARG NH2
C A 0041 ASP OD2 9.466 H A 0072 ARG NH1
C A 0041 ASP OD2 7.948 H A 0072 ARG NH2
C A 0057 GLU OE1 6.341 C A 0056 HIS ND1
C A 0057 GLU OE1 5.929 C A 0056 HIS NE2
C A 0057 GLU OE2 4.841 C A 0056 HIS ND1
C A 0057 GLU OE2 3.900 C A 0056 HIS NE2
C A 0057 GLU OE1 8.962 H A 0065 LYS NZ
C A 0057 GLU OE2 9.675 H A 0065 LYS NZ
C A 0057 GLU OE1 2.625 H A 0072 ARG NH1
C A 0057 GLU OE1 2.669 H A 0072 ARG NH2
C A 0057 GLU OE2 4.791 H A 0072 ARG NH1
C A 0057 GLU OE2 4.042 H A 0072 ARG NH2
C A 0057 GLU OE1 8.933 C A 0076 LYS NZ
C A 0057 GLU OE2 10.06 C A 0076 LYS NZ
C A 0058 ASP OD1 5.756 C A 0056 HIS ND1
C A 0058 ASP OD1 7.656 C A 0056 HIS NE2
C A 0058 ASP OD2 5.048 C A 0056 HIS ND1
C A 0058 ASP OD2 7.145 C A 0056 HIS NE2
C A 0058 ASP OD1 4.830 H A 0065 LYS NZ
C A 0058 ASP OD2 5.889 H A 0065 LYS NZ
C A 0058 ASP OD1 9.708 H A 0072 ARG NH1
C A 0058 ASP OD1 10.75 H A 0072 ARG NH2
C A 0058 ASP OD2 11.09 H A 0072 ARG NH1
C A 0058 ASP OD2 11.87 H A 0072 ARG NH2
H A 0062 GLU OE1 11.57 C A 0056 HIS ND1
H A 0062 GLU OE2 10.66 C A 0056 HIS ND1
H A 0062 GLU OE1 3.724 H A 0065 LYS NZ
H A 0062 GLU OE2 2.631 H A 0065 LYS NZ
H A 0062 GLU OE2 11.25 H A 0072 ARG NH1
H A 0063 GLU OE1 7.651 H A 0065 LYS NZ
H A 0063 GLU OE2 9.689 H A 0065 LYS NZ
H A 0073 ASP OD1 4.798 H A 0070 LYS NZ
H A 0073 ASP OD2 2.623 H A 0070 LYS NZ
H A 0073 ASP OD1 11.04 H A 0072 ARG NH1
H A 0073 ASP OD1 11.87 H A 0072 ARG NH2
H A 0073 ASP OD2 11.38 H A 0072 ARG NH1
H A 0073 ASP OD1 8.570 C A 0076 LYS NZ
H A 0073 ASP OD2 8.774 C A 0076 LYS NZ
H A 0073 ASP OD1 2.619 C A 0077 LYS NZ
H A 0073 ASP OD2 3.707 C A 0077 LYS NZ
CHARGE_REPU 2.00 12.00 95
C A 0006 GLU OE1 10.66 C A 0030 ASP OD1
C A 0006 GLU OE1 11.95 C A 0030 ASP OD2
C A 0006 GLU OE1 10.30 H A 0063 GLU OE1
C A 0006 GLU OE1 10.03 H A 0063 GLU OE2
C A 0006 GLU OE2 9.233 H A 0063 GLU OE1
C A 0006 GLU OE2 8.578 H A 0063 GLU OE2
C A 0018 GLU OE1 8.592 C A 0023 ASP OD1
C A 0018 GLU OE1 10.61 C A 0023 ASP OD2
C A 0018 GLU OE2 10.16 C A 0023 ASP OD1
C A 0018 GLU OE1 11.81 E A 0027 GLU OE1
C A 0018 GLU OE1 9.615 E A 0027 GLU OE2
C A 0018 GLU OE2 10.98 E A 0027 GLU OE2
C A 0023 ASP OD1 11.63 E A 0027 GLU OE1
C A 0023 ASP OD1 10.31 E A 0027 GLU OE2
C A 0023 ASP OD2 11.33 E A 0027 GLU OE2
C A 0023 ASP OD1 11.81 C A 0035 ASP OD2
C A 0023 ASP OD2 11.27 C A 0035 ASP OD2
E A 0026 HIS ND1 11.94 H A 0070 LYS NZ
E A 0026 HIS NE2 11.77 H A 0070 LYS NZ
E A 0026 HIS ND1 9.882 C A 0076 LYS NZ
E A 0026 HIS NE2 8.208 C A 0076 LYS NZ
E A 0027 GLU OE1 4.018 C A 0029 GLU OE1
E A 0027 GLU OE1 6.108 C A 0029 GLU OE2
E A 0027 GLU OE2 6.060 C A 0029 GLU OE1
E A 0027 GLU OE2 8.008 C A 0029 GLU OE2
E A 0027 GLU OE1 9.383 C A 0030 ASP OD1
E A 0027 GLU OE1 9.638 C A 0030 ASP OD2
E A 0027 GLU OE2 9.944 C A 0030 ASP OD1
E A 0027 GLU OE2 10.45 C A 0030 ASP OD2
C A 0029 GLU OE1 8.883 C A 0030 ASP OD1
C A 0029 GLU OE1 8.319 C A 0030 ASP OD2
C A 0029 GLU OE2 9.247 C A 0030 ASP OD1
C A 0029 GLU OE2 8.170 C A 0030 ASP OD2
C A 0035 ASP OD1 4.679 C A 0037 ASP OD1
C A 0035 ASP OD1 3.309 C A 0037 ASP OD2
C A 0035 ASP OD2 6.327 C A 0037 ASP OD1
C A 0035 ASP OD2 4.672 C A 0037 ASP OD2
C A 0035 ASP OD1 11.17 C A 0041 ASP OD1
C A 0035 ASP OD1 10.77 C A 0041 ASP OD2
C A 0035 ASP OD1 8.083 C A 0057 GLU OE1
C A 0035 ASP OD1 8.730 C A 0057 GLU OE2
C A 0035 ASP OD2 10.20 C A 0057 GLU OE1
C A 0035 ASP OD2 10.88 C A 0057 GLU OE2
C A 0035 ASP OD1 10.68 H A 0073 ASP OD1
C A 0035 ASP OD1 10.49 H A 0073 ASP OD2
C A 0035 ASP OD2 10.46 H A 0073 ASP OD1
C A 0035 ASP OD2 10.24 H A 0073 ASP OD2
C A 0037 ASP OD1 9.875 C A 0041 ASP OD1
C A 0037 ASP OD1 8.934 C A 0041 ASP OD2
C A 0037 ASP OD2 11.37 C A 0041 ASP OD1
C A 0037 ASP OD2 10.66 C A 0041 ASP OD2
C A 0037 ASP OD1 5.236 C A 0057 GLU OE1
C A 0037 ASP OD1 6.179 C A 0057 GLU OE2
C A 0037 ASP OD2 6.535 C A 0057 GLU OE1
C A 0037 ASP OD2 7.733 C A 0057 GLU OE2
C A 0037 ASP OD1 11.32 H A 0073 ASP OD1
C A 0037 ASP OD1 11.84 H A 0073 ASP OD2
C A 0037 ASP OD2 9.513 H A 0073 ASP OD1
C A 0037 ASP OD2 9.920 H A 0073 ASP OD2
C A 0041 ASP OD1 7.239 C A 0057 GLU OE1
C A 0041 ASP OD1 5.057 C A 0057 GLU OE2
C A 0041 ASP OD2 7.129 C A 0057 GLU OE1
C A 0041 ASP OD2 4.990 C A 0057 GLU OE2
C A 0041 ASP OD1 10.48 C A 0058 ASP OD1
C A 0041 ASP OD1 9.891 C A 0058 ASP OD2
C A 0041 ASP OD2 10.99 C A 0058 ASP OD1
C A 0041 ASP OD2 10.68 C A 0058 ASP OD2
C A 0056 HIS ND1 8.233 H A 0065 LYS NZ
C A 0056 HIS NE2 10.09 H A 0065 LYS NZ
C A 0056 HIS ND1 8.836 H A 0072 ARG NH1
C A 0056 HIS ND1 8.766 H A 0072 ARG NH2
C A 0056 HIS NE2 8.554 H A 0072 ARG NH1
C A 0056 HIS NE2 7.922 H A 0072 ARG NH2
C A 0057 GLU OE1 8.255 C A 0058 ASP OD1
C A 0057 GLU OE1 9.266 C A 0058 ASP OD2
C A 0057 GLU OE2 8.168 C A 0058 ASP OD1
C A 0057 GLU OE2 8.697 C A 0058 ASP OD2
C A 0057 GLU OE1 11.01 H A 0062 GLU OE2
C A 0057 GLU OE2 11.94 H A 0062 GLU OE2
C A 0058 ASP OD1 7.495 H A 0062 GLU OE1
C A 0058 ASP OD1 6.263 H A 0062 GLU OE2
C A 0058 ASP OD2 8.242 H A 0062 GLU OE1
C A 0058 ASP OD2 7.541 H A 0062 GLU OE2
H A 0062 GLU OE1 4.969 H A 0063 GLU OE1
H A 0062 GLU OE1 6.953 H A 0063 GLU OE2
H A 0062 GLU OE2 6.642 H A 0063 GLU OE1
H A 0062 GLU OE2 8.787 H A 0063 GLU OE2
H A 0065 LYS NZ 9.608 H A 0072 ARG NH1
H A 0065 LYS NZ 11.29 H A 0072 ARG NH2
H A 0070 LYS NZ 11.61 H A 0072 ARG NH1
H A 0070 LYS NZ 9.075 C A 0076 LYS NZ
H A 0070 LYS NZ 5.894 C A 0077 LYS NZ
H A 0072 ARG NH1 7.496 C A 0076 LYS NZ
H A 0072 ARG NH2 6.488 C A 0076 LYS NZ
C A 0076 LYS NZ 8.197 C A 0077 LYS NZ
HB_MM 2.00 3.20 125
C A 0002 TYR N 2.260 C A 0001 ALA O
C A 0003 VAL N 2.255 C A 0002 TYR O
C A 0003 VAL N 2.786 C A 0055 TYR O
C A 0004 ILE N 2.265 C A 0003 VAL O
C A 0005 THR N 2.244 C A 0004 ILE O
C A 0006 GLU N 2.260 C A 0005 THR O
C A 0007 PRO N 2.238 C A 0006 GLU O
C A 0008 CYS N 2.708 C A 0006 GLU O
C A 0008 CYS N 2.244 C A 0007 PRO O
C A 0009 ILE N 3.076 C A 0006 GLU O
C A 0009 ILE N 2.254 C A 0008 CYS O
C A 0010 GLY N 2.252 C A 0009 ILE O
C A 0011 THR N 2.260 C A 0010 GLY O
C A 0012 LYS N 2.259 C A 0011 THR O
C A 0012 LYS N 2.750 C A 0030 ASP O
C A 0013 CYS N 2.256 C A 0012 LYS O
C A 0014 ALA N 2.240 C A 0013 CYS O
C A 0015 SER N 2.248 C A 0014 ALA O
C A 0016 CYS N 2.248 C A 0015 SER O
C A 0017 VAL N 2.740 C A 0015 SER O
C A 0017 VAL N 2.240 C A 0016 CYS O
C A 0018 GLU N 2.240 C A 0017 VAL O
C A 0019 VAL N 2.738 C A 0017 VAL O
C A 0019 VAL N 2.243 C A 0018 GLU O
C A 0020 CYS N 2.245 C A 0019 VAL O
C A 0021 PRO N 2.254 C A 0020 CYS O
C A 0022 VAL N 3.019 C A 0020 CYS O
C A 0022 VAL N 2.257 C A 0021 PRO O
C A 0023 ASP N 2.263 C A 0022 VAL O
C A 0024 CYS N 3.159 C A 0022 VAL O
C A 0024 CYS N 2.243 C A 0023 ASP O
E A 0025 ILE N 2.268 C A 0024 CYS O
E A 0026 HIS N 2.238 E A 0025 ILE O
E A 0026 HIS N 2.803 E A 0033 TYR O
E A 0027 GLU N 2.214 E A 0026 HIS O
C A 0028 GLY N 2.257 E A 0027 GLU O
C A 0028 GLY N 2.799 C A 0031 GLN O
C A 0029 GLU N 2.262 C A 0028 GLY O
C A 0030 ASP N 2.771 C A 0028 GLY O
C A 0030 ASP N 2.249 C A 0029 GLU O
C A 0031 GLN N 2.238 C A 0030 ASP O
E A 0032 TYR N 2.256 C A 0031 GLN O
E A 0033 TYR N 2.614 E A 0026 HIS O
E A 0033 TYR N 2.263 E A 0032 TYR O
E A 0034 ILE N 2.248 E A 0033 TYR O
C A 0035 ASP N 2.852 C A 0024 CYS O
C A 0035 ASP N 2.245 E A 0034 ILE O
C A 0036 PRO N 2.245 C A 0035 ASP O
C A 0037 ASP N 2.229 C A 0036 PRO O
C A 0038 VAL N 2.257 C A 0037 ASP O
C A 0039 CYS N 2.857 C A 0035 ASP O
C A 0039 CYS N 2.244 C A 0038 VAL O
C A 0040 ILE N 2.242 C A 0039 CYS O
C A 0041 ASP N 3.192 C A 0039 CYS O
C A 0041 ASP N 2.254 C A 0040 ILE O
C A 0042 CYS N 2.251 C A 0041 ASP O
C A 0043 GLY N 2.241 C A 0042 CYS O
H A 0044 ALA N 2.243 C A 0043 GLY O
H A 0045 CYS N 2.249 H A 0044 ALA O
H A 0046 GLU N 2.243 H A 0045 CYS O
H A 0047 ALA N 2.972 H A 0044 ALA O
H A 0047 ALA N 2.243 H A 0046 GLU O
H A 0048 VAL N 2.846 H A 0044 ALA O
H A 0048 VAL N 3.086 H A 0045 CYS O
H A 0048 VAL N 3.154 H A 0046 GLU O
H A 0048 VAL N 2.250 H A 0047 ALA O
C A 0049 CYS N 2.752 H A 0045 CYS O
C A 0049 CYS N 3.074 H A 0046 GLU O
C A 0049 CYS N 2.243 H A 0048 VAL O
C A 0050 PRO N 3.037 H A 0048 VAL O
C A 0050 PRO N 2.239 C A 0049 CYS O
C A 0051 VAL N 2.718 C A 0049 CYS O
C A 0051 VAL N 2.246 C A 0050 PRO O
C A 0052 SER N 3.119 C A 0049 CYS O
C A 0052 SER N 2.268 C A 0051 VAL O
C A 0053 ALA N 2.246 C A 0052 SER O
C A 0054 ILE N 2.244 C A 0053 ALA O
C A 0055 TYR N 3.084 C A 0003 VAL O
C A 0055 TYR N 2.242 C A 0054 ILE O
C A 0056 HIS N 2.250 C A 0055 TYR O
C A 0057 GLU N 2.866 C A 0001 ALA O
C A 0057 GLU N 2.248 C A 0056 HIS O
C A 0058 ASP N 3.119 C A 0056 HIS O
C A 0058 ASP N 2.252 C A 0057 GLU O
C A 0059 PHE N 2.722 C A 0056 HIS O
C A 0059 PHE N 2.256 C A 0058 ASP O
C A 0060 VAL N 2.903 C A 0056 HIS O
C A 0060 VAL N 2.248 C A 0059 PHE O
C A 0061 PRO N 3.177 C A 0059 PHE O
C A 0061 PRO N 2.257 C A 0060 VAL O
H A 0062 GLU N 2.242 C A 0061 PRO O
H A 0063 GLU N 3.165 C A 0061 PRO O
H A 0063 GLU N 2.236 H A 0062 GLU O
H A 0064 TRP N 2.677 C A 0061 PRO O
H A 0064 TRP N 3.126 H A 0062 GLU O
H A 0064 TRP N 2.252 H A 0063 GLU O
H A 0065 LYS N 2.745 C A 0061 PRO O
H A 0065 LYS N 3.112 H A 0062 GLU O
H A 0065 LYS N 2.236 H A 0064 TRP O
H A 0066 SER N 3.060 H A 0064 TRP O
H A 0066 SER N 2.242 H A 0065 LYS O
H A 0067 TYR N 2.764 H A 0064 TRP O
H A 0067 TYR N 3.156 H A 0065 LYS O
H A 0067 TYR N 2.243 H A 0066 SER O
H A 0068 ILE N 2.780 H A 0065 LYS O
H A 0068 ILE N 2.229 H A 0067 TYR O
H A 0069 GLN N 2.963 H A 0065 LYS O
H A 0069 GLN N 2.256 H A 0068 ILE O
H A 0070 LYS N 2.885 H A 0066 SER O
H A 0070 LYS N 3.162 H A 0067 TYR O
H A 0070 LYS N 2.242 H A 0069 GLN O
H A 0071 ASN N 2.745 H A 0067 TYR O
H A 0071 ASN N 2.263 H A 0070 LYS O
H A 0072 ARG N 2.851 H A 0068 ILE O
H A 0072 ARG N 2.245 H A 0071 ASN O
H A 0073 ASP N 2.884 H A 0069 GLN O
H A 0073 ASP N 2.282 H A 0072 ARG O
H A 0074 PHE N 2.807 H A 0070 LYS O
H A 0074 PHE N 2.265 H A 0073 ASP O
H A 0075 PHE N 3.054 H A 0073 ASP O
H A 0075 PHE N 2.258 H A 0074 PHE O
C A 0076 LYS N 3.191 H A 0072 ARG O
C A 0076 LYS N 2.245 H A 0075 PHE O
C A 0077 LYS N 2.988 H A 0075 PHE O
C A 0077 LYS N 2.240 C A 0076 LYS O
HB_MS 2.00 3.20 23
C A 0001 ALA N 2.524 C A 0041 ASP OD1
C A 0001 ALA N 2.801 C A 0041 ASP OD2
C A 0001 ALA N 2.602 C A 0057 GLU OE2
C A 0006 GLU N 2.783 C A 0005 THR OG1
C A 0010 GLY N 2.735 C A 0030 ASP OD1
C A 0011 THR N 3.175 C A 0030 ASP OD1
C A 0011 THR N 2.707 C A 0030 ASP OD2
C A 0014 ALA O 2.743 C A 0015 SER OG
C A 0029 GLU O 2.688 C A 0012 LYS NZ
E A 0032 TYR O 2.746 C A 0031 GLN NE2
E A 0034 ILE N 3.129 H A 0071 ASN OD1
C A 0036 PRO N 2.966 C A 0035 ASP OD1
C A 0037 ASP N 2.672 C A 0035 ASP OD1
C A 0053 ALA N 2.736 H A 0046 GLU OE1
C A 0053 ALA N 3.179 H A 0046 GLU OE2
C A 0054 ILE N 2.660 H A 0046 GLU OE1
C A 0058 ASP O 2.664 H A 0065 LYS NZ
C A 0060 VAL O 2.685 H A 0065 LYS NZ
H A 0063 GLU O 2.797 H A 0066 SER OG
H A 0067 TYR O 2.771 H A 0071 ASN ND2
H A 0072 ARG O 2.820 C A 0076 LYS NZ
H A 0073 ASP O 2.661 C A 0077 LYS NZ
C A 0076 LYS O 2.574 C A 0077 LYS NZ
HB_SS 2.00 3.20 6
C A 0006 GLU OE2 2.665 H A 0064 TRP NE1
C A 0006 GLU OE1 2.629 H A 0067 TYR OH
E A 0027 GLU OE2 2.599 E A 0032 TYR OH
C A 0030 ASP OD2 2.652 C A 0011 THR OG1
E A 0033 TYR OH 2.740 C A 0031 GLN OE1
H A 0046 GLU OE2 2.612 C A 0055 TYR OH
AROMATIC 0.00 8.00 2
C A 0076 LYS 5.550 H A 0075 PHE
C A 0002 TYR 5.279 C A 0056 HIS