Complet list of 1vnd con file
Complete list of 1vnd.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 283
C A 0001 ALA C 2.520 C A 0002 SER CA
C A 0001 ALA C 3.439 C A 0002 SER C
C A 0001 ALA C 3.692 C A 0002 SER CB
C A 0002 SER C 2.500 C A 0003 ASP CA
C A 0002 SER C 3.534 C A 0003 ASP C
C A 0002 SER C 3.536 C A 0003 ASP CB
C A 0002 SER C 3.549 C A 0003 ASP CG
C A 0003 ASP C 2.484 C A 0004 GLY CA
C A 0003 ASP C 3.628 C A 0004 GLY C
C A 0004 GLY C 2.478 C A 0005 LEU CA
C A 0004 GLY C 3.671 C A 0005 LEU C
C A 0004 GLY C 3.277 C A 0005 LEU CB
C A 0004 GLY C 3.783 C A 0005 LEU CD2
C A 0005 LEU CA 3.110 C A 0006 PRO CD
C A 0005 LEU C 2.493 C A 0006 PRO CA
C A 0005 LEU C 3.319 C A 0006 PRO C
C A 0005 LEU C 3.620 C A 0006 PRO CB
C A 0005 LEU C 3.724 C A 0006 PRO CG
C A 0005 LEU C 2.511 C A 0006 PRO CD
C A 0006 PRO C 2.493 C A 0007 ASN CA
C A 0006 PRO C 3.593 C A 0007 ASN C
C A 0006 PRO C 3.429 C A 0007 ASN CB
C A 0006 PRO C 3.430 C A 0007 ASN CG
C A 0007 ASN C 2.482 C A 0008 LYS CA
C A 0007 ASN C 3.558 C A 0008 LYS C
C A 0007 ASN C 3.437 C A 0008 LYS CB
C A 0008 LYS C 2.481 C A 0009 LYS CA
C A 0008 LYS C 3.614 C A 0009 LYS C
C A 0008 LYS C 3.315 C A 0009 LYS CB
C A 0009 LYS C 2.491 C A 0010 ARG CA
C A 0009 LYS C 3.630 C A 0010 ARG C
C A 0009 LYS C 3.389 C A 0010 ARG CB
C A 0009 LYS C 3.612 C A 0010 ARG CG
C A 0010 ARG CA 3.079 C A 0011 LYS CA
C A 0010 ARG CA 3.546 C A 0011 LYS C
C A 0010 ARG C 2.564 C A 0011 LYS CA
C A 0010 ARG C 3.391 C A 0011 LYS C
C A 0010 ARG C 3.799 C A 0011 LYS CB
C A 0010 ARG CG 3.670 C A 0073 TYR CE1
C A 0010 ARG CG 3.643 C A 0073 TYR CE2
C A 0010 ARG CG 3.490 C A 0073 TYR CZ
C A 0011 LYS CA 3.226 C A 0012 ARG CA
C A 0011 LYS C 2.588 C A 0012 ARG CA
C A 0011 LYS C 3.444 C A 0012 ARG C
C A 0011 LYS C 3.782 C A 0012 ARG CB
C A 0011 LYS CB 3.568 C A 0012 ARG CA
C A 0012 ARG C 2.522 C A 0013 ARG CA
C A 0012 ARG C 3.352 C A 0013 ARG C
C A 0012 ARG C 3.667 C A 0013 ARG CB
C A 0013 ARG CA 3.742 C A 0014 VAL CA
C A 0013 ARG C 2.499 C A 0014 VAL CA
C A 0013 ARG C 3.494 C A 0014 VAL C
C A 0013 ARG C 3.534 C A 0014 VAL CB
C A 0013 ARG C 3.442 C A 0014 VAL CG1
C A 0014 VAL C 2.468 C A 0015 LEU CA
C A 0014 VAL C 3.552 C A 0015 LEU C
C A 0014 VAL C 3.463 C A 0015 LEU CB
C A 0014 VAL C 3.532 C A 0015 LEU CG
C A 0015 LEU C 2.527 C A 0016 PHE CA
C A 0015 LEU C 3.444 C A 0016 PHE C
C A 0015 LEU C 3.649 C A 0016 PHE CB
C A 0016 PHE C 2.539 C A 0017 THR CA
C A 0016 PHE C 3.405 C A 0017 THR C
C A 0016 PHE C 3.715 C A 0017 THR CB
C A 0016 PHE CB 3.750 H A 0020 GLN CB
C A 0017 THR C 2.534 C A 0018 LYS CA
C A 0017 THR C 3.354 C A 0018 LYS C
C A 0017 THR C 3.798 C A 0018 LYS CB
C A 0018 LYS C 2.514 C A 0019 ALA CA
C A 0018 LYS C 3.296 C A 0019 ALA C
C A 0018 LYS C 3.767 C A 0019 ALA CB
C A 0019 ALA C 2.535 H A 0020 GLN CA
C A 0019 ALA C 3.247 H A 0020 GLN C
C A 0019 ALA C 3.766 H A 0020 GLN CB
H A 0020 GLN C 2.539 H A 0021 THR CA
H A 0020 GLN C 3.254 H A 0021 THR C
H A 0020 GLN C 3.770 H A 0021 THR CB
H A 0020 GLN CD 3.749 H A 0046 ILE CG2
H A 0021 THR C 2.548 H A 0022 TYR CA
H A 0021 THR C 3.211 H A 0022 TYR C
H A 0022 TYR C 2.512 H A 0023 GLU CA
H A 0022 TYR C 3.261 H A 0023 GLU C
H A 0023 GLU C 2.514 H A 0024 LEU CA
H A 0023 GLU C 3.256 H A 0024 LEU C
H A 0023 GLU C 3.778 H A 0024 LEU CB
H A 0023 GLU CD 3.740 H A 0026 ARG CD
H A 0024 LEU C 2.508 H A 0025 GLU CA
H A 0024 LEU C 3.248 H A 0025 GLU C
H A 0024 LEU C 3.759 H A 0025 GLU CB
H A 0024 LEU CB 3.729 H A 0056 TRP CZ2
H A 0024 LEU CB 3.735 H A 0056 TRP CH2
H A 0024 LEU CD2 3.792 H A 0057 PHE CE1
H A 0025 GLU C 2.507 H A 0026 ARG CA
H A 0025 GLU C 3.287 H A 0026 ARG C
H A 0025 GLU C 3.768 H A 0026 ARG CB
H A 0026 ARG C 2.507 H A 0027 ARG CA
H A 0026 ARG C 3.268 H A 0027 ARG C
H A 0027 ARG C 2.519 H A 0028 PHE CA
H A 0027 ARG C 3.270 H A 0028 PHE C
H A 0028 PHE C 2.522 H A 0029 ARG CA
H A 0028 PHE C 3.323 H A 0029 ARG C
H A 0028 PHE CE1 3.602 C A 0060 HIS CB
H A 0028 PHE CZ 3.781 C A 0060 HIS C
H A 0029 ARG C 2.515 H A 0030 GLN CA
H A 0029 ARG C 3.381 H A 0030 GLN C
H A 0029 ARG C 3.641 H A 0030 GLN CB
H A 0030 GLN C 2.504 C A 0031 GLN CA
H A 0030 GLN C 3.546 C A 0031 GLN C
H A 0030 GLN C 3.618 C A 0031 GLN CB
H A 0030 GLN C 3.766 C A 0031 GLN CG
C A 0031 GLN C 2.517 C A 0032 ARG CA
C A 0031 GLN C 3.452 C A 0032 ARG C
C A 0031 GLN C 3.658 C A 0032 ARG CB
C A 0031 GLN C 3.714 C A 0032 ARG CG
C A 0032 ARG CA 3.791 C A 0033 TYR CA
C A 0032 ARG C 2.507 C A 0033 TYR CA
C A 0032 ARG C 3.614 C A 0033 TYR C
C A 0032 ARG C 3.386 C A 0033 TYR CB
C A 0033 TYR C 2.492 C A 0034 LEU CA
C A 0033 TYR C 3.595 C A 0034 LEU C
C A 0033 TYR C 3.424 C A 0034 LEU CB
C A 0033 TYR C 3.430 C A 0034 LEU CD1
C A 0034 LEU C 2.545 C A 0035 SER CA
C A 0034 LEU C 3.320 C A 0035 SER C
C A 0034 LEU C 3.786 C A 0035 SER CB
C A 0034 LEU CB 3.569 H A 0038 GLU CD
C A 0034 LEU CD2 3.764 H A 0039 ARG CG
C A 0034 LEU CD1 3.621 H A 0057 PHE CD2
C A 0034 LEU CD1 3.662 H A 0057 PHE CE2
C A 0035 SER C 2.561 H A 0036 ALA CA
C A 0035 SER C 3.283 H A 0036 ALA C
C A 0035 SER C 3.701 H A 0037 PRO CD
H A 0036 ALA CA 3.080 H A 0037 PRO CD
H A 0036 ALA C 2.504 H A 0037 PRO CA
H A 0036 ALA C 3.208 H A 0037 PRO C
H A 0036 ALA C 3.698 H A 0037 PRO CB
H A 0036 ALA C 3.623 H A 0037 PRO CG
H A 0036 ALA C 2.479 H A 0037 PRO CD
H A 0036 ALA CB 3.599 H A 0037 PRO CD
H A 0037 PRO C 2.518 H A 0038 GLU CA
H A 0037 PRO C 3.518 H A 0038 GLU C
H A 0037 PRO C 3.639 H A 0038 GLU CB
H A 0038 GLU C 2.536 H A 0039 ARG CA
H A 0038 GLU C 3.314 H A 0039 ARG C
H A 0039 ARG C 2.530 H A 0040 GLU CA
H A 0039 ARG C 3.273 H A 0040 GLU C
H A 0039 ARG C 3.798 H A 0040 GLU CB
H A 0039 ARG CZ 3.719 H A 0054 LYS CG
H A 0040 GLU C 2.532 H A 0041 HIS CA
H A 0040 GLU C 3.288 H A 0041 HIS C
H A 0040 GLU C 3.758 H A 0041 HIS CB
H A 0040 GLU CD 3.760 H A 0050 PRO CB
H A 0040 GLU CD 3.723 H A 0050 PRO CG
H A 0041 HIS C 2.549 H A 0042 LEU CA
H A 0041 HIS C 3.277 H A 0042 LEU C
H A 0041 HIS C 3.791 H A 0042 LEU CB
H A 0042 LEU C 2.537 H A 0043 ALA CA
H A 0042 LEU C 3.318 H A 0043 ALA C
H A 0042 LEU C 3.778 H A 0043 ALA CB
H A 0043 ALA C 2.512 H A 0044 SER CA
H A 0043 ALA C 3.320 H A 0044 SER C
H A 0043 ALA C 3.757 H A 0044 SER CB
H A 0044 SER C 2.528 H A 0045 LEU CA
H A 0044 SER C 3.251 H A 0045 LEU C
H A 0045 LEU C 2.488 H A 0046 ILE CA
H A 0045 LEU C 3.435 H A 0046 ILE C
H A 0045 LEU C 3.613 H A 0046 ILE CB
H A 0046 ILE C 2.555 C A 0047 ARG CA
H A 0046 ILE C 3.372 C A 0047 ARG C
H A 0046 ILE C 3.060 C A 0047 ARG CB
C A 0047 ARG C 2.485 C A 0048 LEU CA
C A 0047 ARG C 3.609 C A 0048 LEU C
C A 0047 ARG C 3.427 C A 0048 LEU CB
C A 0047 ARG C 3.608 C A 0048 LEU CG
C A 0048 LEU C 2.537 C A 0049 THR CA
C A 0048 LEU C 3.365 C A 0049 THR C
C A 0048 LEU C 3.727 C A 0049 THR CB
C A 0048 LEU CD2 3.774 H A 0052 GLN CD
C A 0049 THR CA 2.946 H A 0050 PRO CD
C A 0049 THR C 2.526 H A 0050 PRO CA
C A 0049 THR C 3.212 H A 0050 PRO C
C A 0049 THR C 3.694 H A 0050 PRO CB
C A 0049 THR C 3.665 H A 0050 PRO CG
C A 0049 THR C 2.467 H A 0050 PRO CD
C A 0049 THR CB 3.770 H A 0050 PRO CD
C A 0049 THR CG2 3.474 H A 0050 PRO CD
H A 0050 PRO C 2.500 H A 0051 THR CA
H A 0050 PRO C 3.320 H A 0051 THR C
H A 0050 PRO C 3.700 H A 0051 THR CB
H A 0050 PRO CA 3.653 H A 0053 VAL CG1
H A 0050 PRO C 3.667 H A 0053 VAL CG1
H A 0051 THR C 2.499 H A 0052 GLN CA
H A 0051 THR C 3.275 H A 0052 GLN C
H A 0051 THR C 3.779 H A 0052 GLN CB
H A 0052 GLN C 2.530 H A 0053 VAL CA
H A 0052 GLN C 3.224 H A 0053 VAL C
H A 0053 VAL C 2.542 H A 0054 LYS CA
H A 0053 VAL C 3.195 H A 0054 LYS C
H A 0054 LYS C 2.504 H A 0055 ILE CA
H A 0054 LYS C 3.338 H A 0055 ILE C
H A 0054 LYS C 3.749 H A 0055 ILE CB
H A 0055 ILE C 2.533 H A 0056 TRP CA
H A 0055 ILE C 3.205 H A 0056 TRP C
H A 0056 TRP C 2.524 H A 0057 PHE CA
H A 0056 TRP C 3.295 H A 0057 PHE C
H A 0056 TRP CE3 3.714 H A 0057 PHE CD1
H A 0056 TRP CE3 3.594 H A 0057 PHE CE1
H A 0056 TRP CE2 3.307 C A 0060 HIS CE1
H A 0056 TRP CZ2 3.198 C A 0060 HIS CE1
H A 0056 TRP CZ3 3.533 C A 0060 HIS CG
H A 0056 TRP CH2 3.638 C A 0060 HIS CG
H A 0056 TRP CH2 3.480 C A 0060 HIS CD2
H A 0056 TRP CH2 3.526 C A 0060 HIS CE1
H A 0057 PHE C 2.529 H A 0058 GLN CA
H A 0057 PHE C 3.272 H A 0058 GLN C
H A 0057 PHE C 3.793 H A 0058 GLN CB
H A 0058 GLN C 2.520 H A 0059 ASN CA
H A 0058 GLN C 3.353 H A 0059 ASN C
H A 0058 GLN C 3.772 H A 0059 ASN CB
H A 0059 ASN C 2.523 C A 0060 HIS CA
H A 0059 ASN C 3.333 C A 0060 HIS C
H A 0059 ASN C 3.775 C A 0060 HIS CB
H A 0059 ASN CG 3.601 C A 0072 GLY C
C A 0060 HIS C 2.541 C A 0061 ARG CA
C A 0060 HIS C 3.383 C A 0061 ARG C
C A 0060 HIS C 3.784 C A 0061 ARG CB
C A 0060 HIS CE1 3.463 C A 0077 PRO CA
C A 0060 HIS CE1 3.482 C A 0077 PRO C
C A 0060 HIS CE1 3.582 C A 0077 PRO CB
C A 0061 ARG C 2.473 C A 0062 TYR CA
C A 0061 ARG C 3.670 C A 0062 TYR C
C A 0061 ARG C 3.313 C A 0062 TYR CB
C A 0062 TYR C 2.571 C A 0063 LYS CA
C A 0062 TYR C 3.207 C A 0063 LYS C
C A 0062 TYR C 3.317 C A 0063 LYS CB
C A 0062 TYR C 3.584 C A 0063 LYS CG
C A 0063 LYS CA 3.736 C A 0064 THR CA
C A 0063 LYS C 2.513 C A 0064 THR CA
C A 0063 LYS C 3.397 C A 0064 THR C
C A 0063 LYS C 3.733 C A 0064 THR CB
C A 0064 THR C 2.522 C A 0065 LYS CA
C A 0064 THR C 3.362 C A 0065 LYS C
C A 0064 THR C 3.756 C A 0065 LYS CB
C A 0065 LYS C 2.531 C A 0066 ARG CA
C A 0065 LYS C 3.655 C A 0066 ARG C
C A 0065 LYS C 3.238 C A 0066 ARG CB
C A 0065 LYS C 3.760 C A 0066 ARG CG
C A 0066 ARG C 2.508 C A 0067 ALA CA
C A 0066 ARG C 3.358 C A 0067 ALA C
C A 0066 ARG C 3.746 C A 0067 ALA CB
C A 0067 ALA C 2.502 C A 0068 GLN CA
C A 0067 ALA C 3.287 C A 0068 GLN C
C A 0067 ALA C 3.738 C A 0068 GLN CB
C A 0068 GLN CA 3.776 C A 0069 ASN CA
C A 0068 GLN C 2.498 C A 0069 ASN CA
C A 0068 GLN C 3.521 C A 0069 ASN C
C A 0068 GLN C 3.438 C A 0069 ASN CB
C A 0069 ASN C 2.553 C A 0070 GLU CA
C A 0069 ASN C 3.294 C A 0070 GLU C
C A 0070 GLU C 2.491 C A 0071 LYS CA
C A 0070 GLU C 3.458 C A 0071 LYS C
C A 0070 GLU C 3.609 C A 0071 LYS CB
C A 0070 GLU C 3.755 C A 0071 LYS CG
C A 0071 LYS C 2.508 C A 0072 GLY CA
C A 0071 LYS C 3.301 C A 0072 GLY C
C A 0072 GLY C 2.489 C A 0073 TYR CA
C A 0072 GLY C 3.559 C A 0073 TYR C
C A 0072 GLY C 3.376 C A 0073 TYR CB
C A 0073 TYR CA 3.783 C A 0074 GLU CA
C A 0073 TYR C 2.534 C A 0074 GLU CA
C A 0073 TYR C 3.467 C A 0074 GLU C
C A 0073 TYR C 3.669 C A 0074 GLU CB
C A 0074 GLU C 2.509 C A 0075 GLY CA
C A 0074 GLU C 3.380 C A 0075 GLY C
C A 0075 GLY C 2.492 C A 0076 HIS CA
C A 0075 GLY C 3.610 C A 0076 HIS C
C A 0075 GLY C 3.353 C A 0076 HIS CB
C A 0076 HIS CA 2.956 C A 0077 PRO CD
C A 0076 HIS C 2.469 C A 0077 PRO CA
C A 0076 HIS C 3.197 C A 0077 PRO C
C A 0076 HIS C 3.625 C A 0077 PRO CB
C A 0076 HIS C 3.689 C A 0077 PRO CG
C A 0076 HIS C 2.478 C A 0077 PRO CD
CHARGE_ATTR 2.00 12.00 90
C A 0003 ASP OD1 11.62 C A 0011 LYS NZ
C A 0003 ASP OD1 10.53 C A 0012 ARG NH1
C A 0003 ASP OD1 11.01 C A 0012 ARG NH2
C A 0003 ASP OD1 4.829 C A 0013 ARG NH1
C A 0003 ASP OD1 7.056 C A 0013 ARG NH2
C A 0003 ASP OD2 6.166 C A 0013 ARG NH1
C A 0003 ASP OD2 8.477 C A 0013 ARG NH2
H A 0023 GLU OE2 11.76 C A 0018 LYS NZ
H A 0023 GLU OE1 4.976 H A 0026 ARG NH1
H A 0023 GLU OE1 6.778 H A 0026 ARG NH2
H A 0023 GLU OE2 4.791 H A 0026 ARG NH1
H A 0023 GLU OE2 5.936 H A 0026 ARG NH2
H A 0023 GLU OE1 6.903 H A 0027 ARG NH1
H A 0023 GLU OE1 8.649 H A 0027 ARG NH2
H A 0023 GLU OE2 9.062 H A 0027 ARG NH1
H A 0023 GLU OE2 10.69 H A 0027 ARG NH2
H A 0023 GLU OE1 9.547 H A 0041 HIS ND1
H A 0023 GLU OE1 11.60 H A 0041 HIS NE2
H A 0023 GLU OE2 11.18 H A 0041 HIS ND1
H A 0025 GLU OE1 3.187 H A 0029 ARG NH1
H A 0025 GLU OE1 3.887 H A 0029 ARG NH2
H A 0025 GLU OE2 4.205 H A 0029 ARG NH1
H A 0025 GLU OE2 3.607 H A 0029 ARG NH2
H A 0025 GLU OE1 6.201 C A 0060 HIS ND1
H A 0025 GLU OE1 4.483 C A 0060 HIS NE2
H A 0025 GLU OE2 7.791 C A 0060 HIS ND1
H A 0025 GLU OE2 5.798 C A 0060 HIS NE2
H A 0025 GLU OE1 5.768 C A 0065 LYS NZ
H A 0025 GLU OE2 5.720 C A 0065 LYS NZ
H A 0025 GLU OE1 9.553 C A 0076 HIS ND1
H A 0025 GLU OE1 11.34 C A 0076 HIS NE2
H A 0025 GLU OE2 9.345 C A 0076 HIS ND1
H A 0025 GLU OE2 11.18 C A 0076 HIS NE2
H A 0038 GLU OE1 11.53 H A 0026 ARG NH1
H A 0038 GLU OE1 3.052 H A 0027 ARG NH1
H A 0038 GLU OE1 3.092 H A 0027 ARG NH2
H A 0038 GLU OE2 4.744 H A 0027 ARG NH1
H A 0038 GLU OE2 3.647 H A 0027 ARG NH2
H A 0038 GLU OE2 11.73 C A 0032 ARG NH1
H A 0038 GLU OE1 9.377 H A 0039 ARG NH1
H A 0038 GLU OE1 9.575 H A 0039 ARG NH2
H A 0038 GLU OE2 10.09 H A 0039 ARG NH1
H A 0038 GLU OE2 9.799 H A 0039 ARG NH2
H A 0038 GLU OE1 8.157 H A 0041 HIS ND1
H A 0038 GLU OE1 9.850 H A 0041 HIS NE2
H A 0038 GLU OE2 9.942 H A 0041 HIS ND1
H A 0038 GLU OE2 11.41 H A 0041 HIS NE2
H A 0040 GLU OE1 10.84 H A 0027 ARG NH1
H A 0040 GLU OE1 3.107 H A 0039 ARG NH1
H A 0040 GLU OE1 4.351 H A 0039 ARG NH2
H A 0040 GLU OE2 4.589 H A 0039 ARG NH1
H A 0040 GLU OE2 5.027 H A 0039 ARG NH2
H A 0040 GLU OE1 10.33 H A 0041 HIS ND1
H A 0040 GLU OE1 11.29 H A 0041 HIS NE2
H A 0040 GLU OE2 11.29 H A 0041 HIS ND1
H A 0040 GLU OE2 11.87 H A 0041 HIS NE2
H A 0040 GLU OE1 10.86 C A 0047 ARG NH1
H A 0040 GLU OE2 11.27 C A 0047 ARG NH1
H A 0040 GLU OE1 10.68 H A 0054 LYS NZ
H A 0040 GLU OE2 11.39 H A 0054 LYS NZ
C A 0070 GLU OE1 11.92 C A 0061 ARG NH1
C A 0070 GLU OE1 10.66 C A 0061 ARG NH2
C A 0070 GLU OE2 9.707 C A 0061 ARG NH1
C A 0070 GLU OE2 8.492 C A 0061 ARG NH2
C A 0070 GLU OE1 4.101 C A 0063 LYS NZ
C A 0070 GLU OE2 4.906 C A 0063 LYS NZ
C A 0070 GLU OE1 8.728 C A 0066 ARG NH1
C A 0070 GLU OE1 7.242 C A 0066 ARG NH2
C A 0070 GLU OE2 9.026 C A 0066 ARG NH1
C A 0070 GLU OE2 7.507 C A 0066 ARG NH2
C A 0070 GLU OE1 7.128 C A 0071 LYS NZ
C A 0070 GLU OE2 6.161 C A 0071 LYS NZ
C A 0070 GLU OE1 11.26 C A 0076 HIS NE2
C A 0070 GLU OE2 11.22 C A 0076 HIS NE2
C A 0074 GLU OE1 9.624 C A 0010 ARG NH1
C A 0074 GLU OE1 7.405 C A 0010 ARG NH2
C A 0074 GLU OE2 8.521 C A 0010 ARG NH1
C A 0074 GLU OE2 6.180 C A 0010 ARG NH2
C A 0074 GLU OE2 11.79 C A 0011 LYS NZ
C A 0074 GLU OE2 10.21 C A 0012 ARG NH1
C A 0074 GLU OE2 11.26 C A 0012 ARG NH2
C A 0074 GLU OE1 10.75 C A 0013 ARG NH1
C A 0074 GLU OE1 11.28 C A 0013 ARG NH2
C A 0074 GLU OE2 9.094 C A 0013 ARG NH1
C A 0074 GLU OE2 9.575 C A 0013 ARG NH2
C A 0074 GLU OE1 11.69 H A 0054 LYS NZ
C A 0074 GLU OE1 7.797 C A 0060 HIS ND1
C A 0074 GLU OE1 9.285 C A 0060 HIS NE2
C A 0074 GLU OE2 9.986 C A 0060 HIS ND1
C A 0074 GLU OE2 11.38 C A 0060 HIS NE2
CHARGE_REPU 2.00 12.00 94
C A 0003 ASP OD1 9.739 C A 0074 GLU OE1
C A 0003 ASP OD1 8.640 C A 0074 GLU OE2
C A 0003 ASP OD2 11.78 C A 0074 GLU OE1
C A 0003 ASP OD2 10.75 C A 0074 GLU OE2
C A 0008 LYS NZ 11.87 C A 0010 ARG NH1
C A 0008 LYS NZ 6.674 C A 0011 LYS NZ
C A 0008 LYS NZ 9.605 C A 0012 ARG NH1
C A 0008 LYS NZ 11.20 C A 0012 ARG NH2
C A 0008 LYS NZ 10.45 C A 0013 ARG NH2
C A 0009 LYS NZ 11.63 C A 0010 ARG NH1
C A 0009 LYS NZ 11.88 C A 0010 ARG NH2
C A 0009 LYS NZ 9.644 C A 0011 LYS NZ
C A 0009 LYS NZ 11.82 C A 0060 HIS NE2
C A 0009 LYS NZ 11.33 C A 0065 LYS NZ
C A 0009 LYS NZ 5.498 C A 0076 HIS ND1
C A 0009 LYS NZ 4.888 C A 0076 HIS NE2
C A 0010 ARG NH1 9.196 C A 0011 LYS NZ
C A 0010 ARG NH2 9.350 C A 0011 LYS NZ
C A 0010 ARG NH1 7.627 C A 0012 ARG NH1
C A 0010 ARG NH1 9.280 C A 0012 ARG NH2
C A 0010 ARG NH2 7.418 C A 0012 ARG NH1
C A 0010 ARG NH2 8.967 C A 0012 ARG NH2
C A 0010 ARG NH1 11.34 C A 0013 ARG NH1
C A 0010 ARG NH1 9.906 C A 0013 ARG NH2
C A 0010 ARG NH2 10.06 C A 0013 ARG NH1
C A 0010 ARG NH2 9.039 C A 0013 ARG NH2
C A 0011 LYS NZ 7.648 C A 0012 ARG NH1
C A 0011 LYS NZ 9.863 C A 0012 ARG NH2
C A 0011 LYS NZ 8.128 C A 0013 ARG NH1
C A 0011 LYS NZ 6.350 C A 0013 ARG NH2
C A 0012 ARG NH1 6.123 C A 0013 ARG NH1
C A 0012 ARG NH1 4.319 C A 0013 ARG NH2
C A 0012 ARG NH2 6.820 C A 0013 ARG NH1
C A 0012 ARG NH2 5.551 C A 0013 ARG NH2
H A 0023 GLU OE1 9.638 H A 0038 GLU OE1
H A 0023 GLU OE1 11.57 H A 0038 GLU OE2
H A 0023 GLU OE2 11.84 H A 0038 GLU OE1
H A 0026 ARG NH1 8.763 H A 0027 ARG NH1
H A 0026 ARG NH1 9.357 H A 0027 ARG NH2
H A 0026 ARG NH2 10.95 H A 0027 ARG NH1
H A 0026 ARG NH2 11.44 H A 0027 ARG NH2
H A 0026 ARG NH1 11.65 H A 0029 ARG NH1
H A 0026 ARG NH2 11.45 H A 0029 ARG NH1
H A 0027 ARG NH2 11.48 C A 0032 ARG NH1
H A 0027 ARG NH1 10.52 H A 0039 ARG NH1
H A 0027 ARG NH1 11.26 H A 0039 ARG NH2
H A 0027 ARG NH2 11.75 H A 0039 ARG NH1
H A 0027 ARG NH1 8.517 H A 0041 HIS ND1
H A 0027 ARG NH1 10.56 H A 0041 HIS NE2
H A 0027 ARG NH2 9.863 H A 0041 HIS ND1
H A 0027 ARG NH2 11.70 H A 0041 HIS NE2
H A 0029 ARG NH1 8.446 C A 0060 HIS ND1
H A 0029 ARG NH1 6.995 C A 0060 HIS NE2
H A 0029 ARG NH2 9.607 C A 0060 HIS ND1
H A 0029 ARG NH2 7.771 C A 0060 HIS NE2
H A 0029 ARG NH1 6.302 C A 0065 LYS NZ
H A 0029 ARG NH2 5.406 C A 0065 LYS NZ
H A 0029 ARG NH1 11.45 C A 0076 HIS ND1
H A 0029 ARG NH2 10.77 C A 0076 HIS ND1
H A 0038 GLU OE1 9.593 H A 0040 GLU OE1
H A 0038 GLU OE1 11.21 H A 0040 GLU OE2
H A 0038 GLU OE2 10.66 H A 0040 GLU OE1
H A 0039 ARG NH1 7.726 H A 0054 LYS NZ
H A 0039 ARG NH2 7.136 H A 0054 LYS NZ
H A 0041 HIS ND1 10.37 C A 0047 ARG NH1
H A 0041 HIS ND1 10.45 C A 0047 ARG NH2
H A 0041 HIS NE2 10.67 C A 0047 ARG NH1
H A 0041 HIS NE2 10.59 C A 0047 ARG NH2
H A 0054 LYS NZ 7.664 C A 0061 ARG NH1
H A 0054 LYS NZ 9.746 C A 0061 ARG NH2
C A 0060 HIS ND1 10.08 C A 0061 ARG NH1
C A 0060 HIS ND1 11.46 C A 0061 ARG NH2
C A 0060 HIS NE2 11.85 C A 0061 ARG NH1
C A 0060 HIS ND1 8.078 C A 0065 LYS NZ
C A 0060 HIS NE2 6.172 C A 0065 LYS NZ
C A 0060 HIS ND1 8.528 C A 0076 HIS ND1
C A 0060 HIS ND1 10.18 C A 0076 HIS NE2
C A 0060 HIS NE2 7.214 C A 0076 HIS ND1
C A 0060 HIS NE2 9.036 C A 0076 HIS NE2
C A 0061 ARG NH2 11.70 C A 0063 LYS NZ
C A 0061 ARG NH1 9.397 C A 0071 LYS NZ
C A 0061 ARG NH2 8.389 C A 0071 LYS NZ
C A 0063 LYS NZ 5.275 C A 0066 ARG NH1
C A 0063 LYS NZ 3.410 C A 0066 ARG NH2
C A 0063 LYS NZ 10.46 C A 0071 LYS NZ
C A 0063 LYS NZ 10.81 C A 0076 HIS NE2
C A 0065 LYS NZ 10.31 C A 0066 ARG NH1
C A 0065 LYS NZ 11.82 C A 0066 ARG NH2
C A 0065 LYS NZ 5.899 C A 0076 HIS ND1
C A 0065 LYS NZ 6.880 C A 0076 HIS NE2
C A 0066 ARG NH1 10.20 C A 0076 HIS ND1
C A 0066 ARG NH1 8.573 C A 0076 HIS NE2
C A 0066 ARG NH2 11.58 C A 0076 HIS ND1
C A 0066 ARG NH2 10.04 C A 0076 HIS NE2
HB_MM 2.00 3.20 85
C A 0002 SER N 2.277 C A 0001 ALA O
C A 0003 ASP N 2.274 C A 0002 SER O
C A 0004 GLY N 2.273 C A 0003 ASP O
C A 0005 LEU N 2.269 C A 0004 GLY O
C A 0006 PRO N 2.233 C A 0005 LEU O
C A 0007 ASN N 2.273 C A 0006 PRO O
C A 0008 LYS N 2.271 C A 0007 ASN O
C A 0009 LYS N 2.275 C A 0008 LYS O
C A 0010 ARG N 2.271 C A 0009 LYS O
C A 0011 LYS N 2.261 C A 0010 ARG O
C A 0012 ARG N 2.246 C A 0011 LYS O
C A 0013 ARG N 2.278 C A 0012 ARG O
C A 0014 VAL N 2.269 C A 0013 ARG O
C A 0015 LEU N 2.267 C A 0014 VAL O
C A 0016 PHE N 2.276 C A 0015 LEU O
C A 0017 THR N 2.286 C A 0016 PHE O
C A 0018 LYS N 2.270 C A 0017 THR O
C A 0019 ALA N 2.263 C A 0018 LYS O
H A 0020 GLN N 3.187 C A 0017 THR O
H A 0020 GLN N 2.284 C A 0019 ALA O
H A 0021 THR N 3.003 C A 0017 THR O
H A 0021 THR N 2.275 H A 0020 GLN O
H A 0022 TYR N 2.275 H A 0021 THR O
H A 0023 GLU N 2.277 H A 0022 TYR O
H A 0024 LEU N 2.266 H A 0023 GLU O
H A 0025 GLU N 2.265 H A 0024 LEU O
H A 0026 ARG N 2.274 H A 0025 GLU O
H A 0027 ARG N 2.281 H A 0026 ARG O
H A 0028 PHE N 2.253 H A 0027 ARG O
H A 0029 ARG N 2.267 H A 0028 PHE O
H A 0030 GLN N 2.265 H A 0029 ARG O
C A 0031 GLN N 2.929 H A 0027 ARG O
C A 0031 GLN N 2.266 H A 0030 GLN O
C A 0032 ARG N 2.278 C A 0031 GLN O
C A 0033 TYR N 2.282 C A 0032 ARG O
C A 0034 LEU N 2.271 C A 0033 TYR O
C A 0035 SER N 2.287 C A 0034 LEU O
H A 0036 ALA N 2.281 C A 0035 SER O
H A 0037 PRO N 2.225 H A 0036 ALA O
H A 0038 GLU N 2.288 H A 0037 PRO O
H A 0039 ARG N 2.900 C A 0035 SER O
H A 0039 ARG N 2.265 H A 0038 GLU O
H A 0040 GLU N 2.272 H A 0039 ARG O
H A 0041 HIS N 2.279 H A 0040 GLU O
H A 0042 LEU N 2.283 H A 0041 HIS O
H A 0043 ALA N 2.273 H A 0042 LEU O
H A 0044 SER N 2.262 H A 0043 ALA O
H A 0045 LEU N 3.121 H A 0041 HIS O
H A 0045 LEU N 2.273 H A 0044 SER O
H A 0046 ILE N 2.276 H A 0045 LEU O
C A 0047 ARG N 3.121 H A 0043 ALA O
C A 0047 ARG N 2.284 H A 0046 ILE O
C A 0048 LEU N 2.947 H A 0043 ALA O
C A 0048 LEU N 2.265 C A 0047 ARG O
C A 0049 THR N 2.283 C A 0048 LEU O
H A 0050 PRO N 2.268 C A 0049 THR O
H A 0051 THR N 2.277 H A 0050 PRO O
H A 0052 GLN N 2.269 H A 0051 THR O
H A 0053 VAL N 2.285 H A 0052 GLN O
H A 0054 LYS N 2.281 H A 0053 VAL O
H A 0055 ILE N 2.278 H A 0054 LYS O
H A 0056 TRP N 3.154 H A 0052 GLN O
H A 0056 TRP N 2.269 H A 0055 ILE O
H A 0057 PHE N 2.280 H A 0056 TRP O
H A 0058 GLN N 2.273 H A 0057 PHE O
H A 0059 ASN N 2.274 H A 0058 GLN O
C A 0060 HIS N 2.271 H A 0059 ASN O
C A 0061 ARG N 2.267 C A 0060 HIS O
C A 0062 TYR N 2.261 C A 0061 ARG O
C A 0063 LYS N 2.279 C A 0062 TYR O
C A 0064 THR N 2.281 C A 0063 LYS O
C A 0065 LYS N 2.272 C A 0064 THR O
C A 0066 ARG N 3.101 C A 0064 THR O
C A 0066 ARG N 2.276 C A 0065 LYS O
C A 0067 ALA N 2.264 C A 0066 ARG O
C A 0068 GLN N 2.272 C A 0067 ALA O
C A 0069 ASN N 2.275 C A 0068 GLN O
C A 0070 GLU N 2.267 C A 0069 ASN O
C A 0071 LYS N 2.255 C A 0070 GLU O
C A 0072 GLY N 2.278 C A 0071 LYS O
C A 0073 TYR N 2.268 C A 0072 GLY O
C A 0074 GLU N 2.272 C A 0073 TYR O
C A 0075 GLY N 2.273 C A 0074 GLU O
C A 0076 HIS N 2.276 C A 0075 GLY O
C A 0077 PRO N 2.235 C A 0076 HIS O
HB_MS 2.00 3.20 7
C A 0017 THR O 3.068 H A 0021 THR OG1
H A 0040 GLU O 2.977 H A 0044 SER OG
H A 0046 ILE O 2.908 H A 0020 GLN NE2
H A 0050 PRO O 3.133 H A 0039 ARG NH1
H A 0056 TRP O 3.127 C A 0060 HIS ND1
C A 0060 HIS O 3.017 C A 0064 THR OG1
C A 0072 GLY O 3.040 C A 0069 ASN ND2
HB_SS 2.00 3.20 1
C A 0049 THR OG1 2.999 H A 0052 GLN OE1
AROMATIC 0.00 8.00 14
H A 0028 PHE 5.234 C A 0060 HIS
H A 0029 ARG 7.329 C A 0060 HIS
H A 0056 TRP 3.549 C A 0060 HIS
C A 0065 LYS 6.908 C A 0060 HIS
H A 0026 ARG 5.342 H A 0022 TYR
C A 0061 ARG 4.717 C A 0062 TYR
C A 0071 LYS 5.953 C A 0062 TYR
C A 0009 LYS 6.541 C A 0073 TYR
C A 0010 ARG 6.160 C A 0073 TYR
C A 0009 LYS 4.507 C A 0076 HIS
H A 0029 ARG 7.770 H A 0056 TRP
C A 0065 LYS 6.866 C A 0076 HIS
H A 0029 ARG 5.290 H A 0028 PHE
C A 0065 LYS 7.720 H A 0028 PHE