Complet list of 1iqo con file
Complete list of 1iqo.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 371
C A 0001 LEU C 2.434 C A 0002 PHE CA
C A 0001 LEU C 3.710 C A 0002 PHE C
C A 0001 LEU C 3.064 C A 0002 PHE CB
C A 0002 PHE C 2.435 C A 0003 ILE CA
C A 0002 PHE C 2.989 C A 0003 ILE C
C A 0002 PHE C 3.739 C A 0003 ILE CB
C A 0003 ILE C 2.433 C A 0004 ALA CA
C A 0003 ILE C 3.479 C A 0004 ALA C
C A 0003 ILE C 3.480 C A 0004 ALA CB
C A 0003 ILE CG1 3.704 C A 0005 THR CG2
C A 0004 ALA C 2.435 C A 0005 THR CA
C A 0004 ALA C 3.583 C A 0005 THR C
C A 0004 ALA C 3.365 C A 0005 THR CB
C A 0004 ALA C 3.414 C A 0005 THR CG2
C A 0005 THR C 2.434 E A 0006 LEU CA
C A 0005 THR C 3.567 E A 0006 LEU C
C A 0005 THR C 3.387 E A 0006 LEU CB
E A 0006 LEU C 2.434 E A 0007 LYS CA
E A 0006 LEU C 3.370 E A 0007 LYS C
E A 0006 LEU C 3.584 E A 0007 LYS CB
E A 0007 LYS CA 3.791 E A 0008 GLY CA
E A 0007 LYS C 2.417 E A 0008 GLY CA
E A 0007 LYS C 3.628 E A 0008 GLY C
E A 0007 LYS CE 3.539 H A 0069 LEU CD2
E A 0008 GLY CA 3.797 E A 0009 ILE CA
E A 0008 GLY C 2.432 E A 0009 ILE CA
E A 0008 GLY C 3.410 E A 0009 ILE C
E A 0008 GLY C 3.575 E A 0009 ILE CB
E A 0008 GLY C 3.624 E A 0009 ILE CG1
E A 0009 ILE C 2.439 E A 0010 PHE CA
E A 0009 ILE C 3.252 E A 0010 PHE C
E A 0009 ILE C 3.651 E A 0010 PHE CB
E A 0009 ILE C 3.743 E A 0010 PHE CD1
E A 0010 PHE C 2.435 C A 0011 THR CA
E A 0010 PHE C 3.643 C A 0011 THR C
E A 0010 PHE C 3.278 C A 0011 THR CB
E A 0010 PHE C 3.431 C A 0011 THR CG2
E A 0010 PHE C 3.580 C A 0015 LEU CB
E A 0010 PHE CB 3.674 C A 0015 LEU CB
E A 0010 PHE CD2 3.477 C A 0015 LEU C
E A 0010 PHE CD2 3.638 C A 0015 LEU CD1
E A 0010 PHE CD1 3.743 C A 0017 GLU CG
E A 0010 PHE CE1 3.286 C A 0017 GLU CB
E A 0010 PHE CE1 3.205 C A 0017 GLU CG
E A 0010 PHE CE1 3.370 C A 0017 GLU CD
E A 0010 PHE CZ 3.493 C A 0017 GLU CB
E A 0010 PHE CD2 3.761 H A 0023 VAL CG2
E A 0010 PHE CB 3.795 E A 0042 ILE CD1
E A 0010 PHE CG 3.338 E A 0042 ILE CD1
E A 0010 PHE CD2 3.206 E A 0042 ILE CD1
E A 0010 PHE CE2 3.636 E A 0042 ILE CD1
C A 0011 THR CA 3.779 C A 0012 LEU CA
C A 0011 THR C 2.437 C A 0012 LEU CA
C A 0011 THR C 2.890 C A 0012 LEU C
C A 0011 THR C 3.152 C A 0012 LEU CB
C A 0011 THR C 3.184 C A 0012 LEU CG
C A 0011 THR C 3.052 C A 0012 LEU CD1
C A 0011 THR CB 3.548 C A 0012 LEU CD1
C A 0011 THR C 3.529 C A 0015 LEU CB
C A 0011 THR CG2 3.448 C A 0039 GLU CA
C A 0011 THR CG2 3.308 C A 0039 GLU CB
C A 0012 LEU CA 3.791 C A 0013 LYS CA
C A 0012 LEU C 2.430 C A 0013 LYS CA
C A 0012 LEU C 3.097 C A 0013 LYS C
C A 0012 LEU C 3.693 C A 0013 LYS CB
C A 0013 LYS C 2.439 C A 0014 ASP CA
C A 0013 LYS C 3.250 C A 0014 ASP C
C A 0013 LYS C 3.652 C A 0014 ASP CB
C A 0013 LYS CE 3.693 C A 0034 LEU CA
C A 0013 LYS CE 3.503 C A 0034 LEU CB
C A 0013 LYS CE 3.619 C A 0034 LEU CD2
C A 0014 ASP C 2.445 C A 0015 LEU CA
C A 0014 ASP C 3.055 C A 0015 LEU C
C A 0014 ASP C 3.719 C A 0015 LEU CB
C A 0014 ASP CA 3.647 C A 0016 PRO CD
C A 0014 ASP C 2.969 C A 0016 PRO CD
C A 0015 LEU CA 2.982 C A 0016 PRO CD
C A 0015 LEU C 2.479 C A 0016 PRO CA
C A 0015 LEU C 3.097 C A 0016 PRO C
C A 0015 LEU C 3.673 C A 0016 PRO CB
C A 0015 LEU C 3.614 C A 0016 PRO CG
C A 0015 LEU C 2.524 C A 0016 PRO CD
C A 0015 LEU CB 3.637 C A 0016 PRO CD
C A 0015 LEU CG 3.250 C A 0016 PRO CD
C A 0015 LEU CD2 3.494 C A 0016 PRO CD
C A 0015 LEU CD1 3.068 H A 0023 VAL CG2
C A 0016 PRO C 2.463 C A 0017 GLU CA
C A 0016 PRO C 2.814 C A 0017 GLU C
C A 0016 PRO C 3.649 C A 0017 GLU CB
C A 0016 PRO CA 3.511 C A 0020 ARG C
C A 0016 PRO CB 3.359 C A 0020 ARG C
C A 0016 PRO CB 3.597 C A 0021 PRO CA
C A 0016 PRO CG 3.796 C A 0021 PRO CA
C A 0017 GLU C 2.442 C A 0018 GLU CA
C A 0017 GLU C 3.177 C A 0018 GLU C
C A 0017 GLU C 2.883 C A 0018 GLU CB
C A 0018 GLU CA 3.790 C A 0019 PHE CA
C A 0018 GLU C 2.430 C A 0019 PHE CA
C A 0018 GLU C 3.718 C A 0019 PHE C
C A 0018 GLU C 3.038 C A 0019 PHE CB
C A 0018 GLU C 3.299 C A 0019 PHE CG
C A 0018 GLU C 3.708 C A 0019 PHE CD2
C A 0019 PHE C 2.432 C A 0020 ARG CA
C A 0019 PHE C 3.453 C A 0020 ARG C
C A 0019 PHE C 3.519 C A 0020 ARG CB
C A 0019 PHE C 3.615 C A 0020 ARG CG
C A 0019 PHE C 3.276 C A 0021 PRO CD
C A 0020 ARG CA 2.918 C A 0021 PRO CD
C A 0020 ARG C 2.464 C A 0021 PRO CA
C A 0020 ARG C 3.243 C A 0021 PRO C
C A 0020 ARG C 3.606 C A 0021 PRO CB
C A 0020 ARG C 3.665 C A 0021 PRO CG
C A 0020 ARG C 2.511 C A 0021 PRO CD
C A 0021 PRO C 2.437 C A 0022 PHE CA
C A 0021 PRO C 3.121 C A 0022 PHE C
C A 0021 PRO C 3.699 C A 0022 PHE CB
C A 0021 PRO C 3.765 H A 0024 ASP CB
C A 0022 PHE C 2.439 H A 0023 VAL CA
C A 0022 PHE C 3.039 H A 0023 VAL C
C A 0022 PHE C 3.740 H A 0023 VAL CB
H A 0023 VAL C 2.439 H A 0024 ASP CA
H A 0023 VAL C 2.899 H A 0024 ASP C
H A 0023 VAL C 3.711 H A 0024 ASP CB
H A 0023 VAL CA 3.505 H A 0025 TYR CD1
H A 0023 VAL CA 3.685 H A 0025 TYR CE1
H A 0023 VAL C 3.449 H A 0025 TYR CD1
H A 0023 VAL CG1 3.685 E A 0042 ILE CD1
H A 0023 VAL CG2 3.508 E A 0042 ILE CD1
H A 0023 VAL CG1 3.032 E A 0053 VAL CG1
H A 0024 ASP C 2.435 H A 0025 TYR CA
H A 0024 ASP C 3.006 H A 0025 TYR C
H A 0024 ASP C 3.721 H A 0025 TYR CB
H A 0025 TYR C 2.432 H A 0026 LYS CA
H A 0025 TYR C 3.044 H A 0026 LYS C
H A 0025 TYR C 3.711 H A 0026 LYS CB
H A 0026 LYS CA 3.798 H A 0027 ALA CA
H A 0026 LYS C 2.431 H A 0027 ALA CA
H A 0026 LYS C 3.083 H A 0027 ALA C
H A 0026 LYS C 3.693 H A 0027 ALA CB
H A 0027 ALA CA 3.793 H A 0028 GLY CA
H A 0027 ALA C 2.419 H A 0028 GLY CA
H A 0027 ALA C 3.485 H A 0028 GLY C
H A 0027 ALA CB 3.592 C A 0034 LEU CD2
H A 0028 GLY C 2.437 C A 0029 LEU CA
H A 0028 GLY C 2.992 C A 0029 LEU C
H A 0028 GLY C 3.727 C A 0029 LEU CB
C A 0029 LEU C 2.437 C A 0030 GLU CA
C A 0029 LEU C 3.717 C A 0030 GLU C
C A 0029 LEU C 2.983 C A 0030 GLU CB
C A 0029 LEU CD1 3.739 C A 0030 GLU CA
C A 0029 LEU CD2 3.464 C A 0030 GLU CB
C A 0029 LEU CD1 3.646 C A 0032 LYS CB
C A 0030 GLU C 2.434 C A 0031 LYS CA
C A 0030 GLU C 3.007 C A 0031 LYS C
C A 0030 GLU C 2.998 C A 0031 LYS CB
C A 0031 LYS C 2.436 C A 0032 LYS CA
C A 0031 LYS C 3.071 C A 0032 LYS C
C A 0031 LYS C 3.708 C A 0032 LYS CB
C A 0032 LYS C 2.435 C A 0033 LYS CA
C A 0032 LYS C 2.993 C A 0033 LYS C
C A 0032 LYS C 3.716 C A 0033 LYS CB
C A 0033 LYS C 2.434 C A 0034 LEU CA
C A 0033 LYS C 3.639 C A 0034 LEU C
C A 0033 LYS C 3.278 C A 0034 LEU CB
C A 0033 LYS C 3.229 C A 0034 LEU CG
C A 0033 LYS C 3.779 C A 0034 LEU CD2
C A 0034 LEU C 2.433 C A 0035 SER CA
C A 0034 LEU C 3.344 C A 0035 SER C
C A 0034 LEU C 3.598 C A 0035 SER CB
C A 0035 SER C 2.436 C A 0036 ASP CA
C A 0035 SER C 2.975 C A 0036 ASP C
C A 0035 SER C 3.034 C A 0036 ASP CB
C A 0036 ASP C 2.435 C A 0037 ASP CA
C A 0036 ASP C 3.556 C A 0037 ASP C
C A 0036 ASP C 3.407 C A 0037 ASP CB
C A 0036 ASP C 3.746 C A 0037 ASP CG
C A 0037 ASP C 2.434 C A 0038 ASP CA
C A 0037 ASP C 3.133 C A 0038 ASP C
C A 0037 ASP C 3.691 C A 0038 ASP CB
C A 0038 ASP C 2.435 C A 0039 GLU CA
C A 0038 ASP C 3.327 C A 0039 GLU C
C A 0038 ASP C 3.612 C A 0039 GLU CB
C A 0038 ASP C 3.467 E A 0040 ILE CD1
C A 0039 GLU C 2.436 E A 0040 ILE CA
C A 0039 GLU C 3.631 E A 0040 ILE C
C A 0039 GLU C 3.322 E A 0040 ILE CB
C A 0039 GLU C 3.130 E A 0040 ILE CG1
C A 0039 GLU C 3.259 E A 0040 ILE CD1
E A 0040 ILE C 2.432 E A 0041 ALA CA
E A 0040 ILE C 3.270 E A 0041 ALA C
E A 0040 ILE C 3.629 E A 0041 ALA CB
E A 0041 ALA C 2.434 E A 0042 ILE CA
E A 0041 ALA C 3.487 E A 0042 ILE C
E A 0041 ALA C 3.509 E A 0042 ILE CB
E A 0041 ALA C 3.485 E A 0042 ILE CG1
E A 0041 ALA CB 3.457 C A 0056 LEU CD1
E A 0041 ALA CB 3.745 H A 0069 LEU CD1
E A 0042 ILE C 2.431 E A 0043 ILE CA
E A 0042 ILE C 3.544 E A 0043 ILE C
E A 0042 ILE C 3.444 E A 0043 ILE CB
E A 0042 ILE C 3.364 E A 0043 ILE CG1
E A 0043 ILE C 2.433 E A 0044 SER CA
E A 0043 ILE C 3.394 E A 0044 SER C
E A 0043 ILE C 3.560 E A 0044 SER CB
E A 0043 ILE CD1 3.207 H A 0073 GLY CA
E A 0044 SER C 2.434 C A 0045 ILE CA
E A 0044 SER C 3.496 C A 0045 ILE C
E A 0044 SER C 3.501 C A 0045 ILE CB
E A 0044 SER C 3.605 C A 0045 ILE CG2
E A 0044 SER CA 3.600 C A 0051 ASN CB
E A 0044 SER CB 3.582 C A 0051 ASN CB
C A 0045 ILE C 2.433 C A 0046 LYS CA
C A 0045 ILE C 3.084 C A 0046 LYS C
C A 0045 ILE C 3.705 C A 0046 LYS CB
C A 0046 LYS CA 3.793 C A 0047 GLY CA
C A 0046 LYS C 2.419 C A 0047 GLY CA
C A 0046 LYS C 3.389 C A 0047 GLY C
C A 0047 GLY CA 3.794 C A 0048 THR CA
C A 0047 GLY C 2.432 C A 0048 THR CA
C A 0047 GLY C 3.007 C A 0048 THR C
C A 0047 GLY C 2.998 C A 0048 THR CB
C A 0048 THR C 2.440 C A 0049 GLN CA
C A 0048 THR C 3.058 C A 0049 GLN C
C A 0048 THR C 2.963 C A 0049 GLN CB
C A 0049 GLN C 2.432 C A 0050 SER CA
C A 0049 GLN C 3.697 C A 0050 SER C
C A 0049 GLN C 3.106 C A 0050 SER CB
C A 0050 SER C 2.432 C A 0051 ASN CA
C A 0050 SER C 3.687 C A 0051 ASN C
C A 0050 SER C 3.153 C A 0051 ASN CB
C A 0051 ASN C 2.433 E A 0052 HIS CA
C A 0051 ASN C 3.626 E A 0052 HIS C
C A 0051 ASN C 3.296 E A 0052 HIS CB
E A 0052 HIS C 2.435 E A 0053 VAL CA
E A 0052 HIS C 3.454 E A 0053 VAL C
E A 0052 HIS C 3.545 E A 0053 VAL CB
E A 0053 VAL C 2.434 E A 0054 LEU CA
E A 0053 VAL C 3.680 E A 0054 LEU C
E A 0053 VAL C 3.176 E A 0054 LEU CB
E A 0054 LEU C 2.433 E A 0055 PHE CA
E A 0054 LEU C 3.089 E A 0055 PHE C
E A 0054 LEU C 3.703 E A 0055 PHE CB
E A 0054 LEU CD1 3.632 E A 0055 PHE C
E A 0054 LEU CD1 3.623 C A 0056 LEU CD1
E A 0054 LEU CD2 2.994 H A 0084 LEU CD2
E A 0055 PHE C 2.433 C A 0056 LEU CA
E A 0055 PHE C 3.475 C A 0056 LEU C
E A 0055 PHE C 3.491 C A 0056 LEU CB
E A 0055 PHE C 3.539 C A 0056 LEU CD1
E A 0055 PHE CB 3.477 H A 0088 LEU CD1
C A 0056 LEU C 2.433 C A 0057 SER CA
C A 0056 LEU C 3.335 C A 0057 SER C
C A 0056 LEU C 3.602 C A 0057 SER CB
C A 0057 SER C 2.435 C A 0058 SER CA
C A 0057 SER C 3.705 C A 0058 SER C
C A 0057 SER C 3.088 C A 0058 SER CB
C A 0058 SER C 2.435 C A 0059 TYR CA
C A 0058 SER C 3.426 C A 0059 TYR C
C A 0058 SER C 3.543 C A 0059 TYR CB
C A 0059 TYR C 2.432 C A 0060 ASN CA
C A 0059 TYR C 3.106 C A 0060 ASN C
C A 0059 TYR C 3.698 C A 0060 ASN CB
C A 0059 TYR C 3.796 H A 0065 ILE CG1
C A 0059 TYR C 3.679 H A 0065 ILE CD1
C A 0059 TYR CG 3.769 H A 0065 ILE CG1
C A 0059 TYR CD1 3.762 H A 0065 ILE CB
C A 0059 TYR CD1 3.387 H A 0065 ILE CG1
C A 0059 TYR CE1 3.719 H A 0065 ILE C
C A 0059 TYR CE1 3.529 H A 0065 ILE CG1
C A 0059 TYR CE1 3.753 H A 0069 LEU CB
C A 0059 TYR CE1 3.669 H A 0069 LEU CD2
C A 0060 ASN C 2.434 C A 0061 SER CA
C A 0060 ASN C 3.710 C A 0061 SER C
C A 0060 ASN C 3.071 C A 0061 SER CB
C A 0061 SER C 2.433 H A 0062 VAL CA
C A 0061 SER C 3.707 H A 0062 VAL C
C A 0061 SER C 3.122 H A 0062 VAL CB
C A 0061 SER CB 3.659 H A 0065 ILE CD1
H A 0062 VAL C 2.450 H A 0063 ASP CA
H A 0062 VAL C 2.912 H A 0063 ASP C
H A 0062 VAL C 3.709 H A 0063 ASP CB
H A 0062 VAL CG1 3.555 H A 0064 GLU CB
H A 0062 VAL C 3.754 H A 0065 ILE CD1
H A 0063 ASP C 2.447 H A 0064 GLU CA
H A 0063 ASP C 2.891 H A 0064 GLU C
H A 0063 ASP C 3.707 H A 0064 GLU CB
H A 0063 ASP CA 3.509 H A 0066 ARG CB
H A 0064 GLU C 2.433 H A 0065 ILE CA
H A 0064 GLU C 3.431 H A 0065 ILE C
H A 0064 GLU C 3.570 H A 0065 ILE CB
H A 0064 GLU C 3.698 H A 0065 ILE CG2
H A 0065 ILE C 2.438 H A 0066 ARG CA
H A 0065 ILE C 2.980 H A 0066 ARG C
H A 0065 ILE C 3.719 H A 0066 ARG CB
H A 0066 ARG C 2.434 H A 0067 LYS CA
H A 0066 ARG C 3.135 H A 0067 LYS C
H A 0066 ARG C 3.692 H A 0067 LYS CB
H A 0067 LYS C 2.434 H A 0068 GLU CA
H A 0067 LYS C 3.039 H A 0068 GLU C
H A 0067 LYS C 3.713 H A 0068 GLU CB
H A 0068 GLU C 2.434 H A 0069 LEU CA
H A 0068 GLU C 3.152 H A 0069 LEU C
H A 0068 GLU C 3.692 H A 0069 LEU CB
H A 0069 LEU C 2.435 H A 0070 GLU CA
H A 0069 LEU C 2.960 H A 0070 GLU C
H A 0069 LEU C 3.718 H A 0070 GLU CB
H A 0070 GLU C 2.433 H A 0071 GLU CA
H A 0070 GLU C 3.074 H A 0071 GLU C
H A 0070 GLU C 3.705 H A 0071 GLU CB
H A 0071 GLU C 2.435 H A 0072 ALA CA
H A 0071 GLU C 2.963 H A 0072 ALA C
H A 0071 GLU C 3.704 H A 0072 ALA CB
H A 0071 GLU C 3.579 H A 0075 LYS CB
H A 0071 GLU CB 3.776 H A 0075 LYS CB
H A 0072 ALA CA 3.790 H A 0073 GLY CA
H A 0072 ALA C 2.417 H A 0073 GLY CA
H A 0072 ALA C 3.189 H A 0073 GLY C
H A 0073 GLY CA 3.795 H A 0074 ALA CA
H A 0073 GLY C 2.432 H A 0074 ALA CA
H A 0073 GLY C 3.700 H A 0074 ALA C
H A 0073 GLY C 3.107 H A 0074 ALA CB
H A 0074 ALA C 2.434 H A 0075 LYS CA
H A 0074 ALA C 3.338 H A 0075 LYS C
H A 0074 ALA C 3.601 H A 0075 LYS CB
H A 0075 LYS C 2.435 C A 0076 ILE CA
H A 0075 LYS C 3.240 C A 0076 ILE C
H A 0075 LYS C 3.685 C A 0076 ILE CB
H A 0075 LYS CG 3.465 C A 0078 HIS CB
H A 0075 LYS CD 3.767 C A 0078 HIS CB
H A 0075 LYS CD 3.584 C A 0078 HIS CD2
C A 0076 ILE C 2.432 C A 0077 ASN CA
C A 0076 ILE C 3.225 C A 0077 ASN C
C A 0076 ILE C 3.662 C A 0077 ASN CB
C A 0077 ASN C 2.436 C A 0078 HIS CA
C A 0077 ASN C 2.978 C A 0078 HIS C
C A 0077 ASN C 3.036 C A 0078 HIS CB
C A 0078 HIS C 2.436 C A 0079 THR CA
C A 0078 HIS C 2.985 C A 0079 THR C
C A 0078 HIS C 3.031 C A 0079 THR CB
C A 0079 THR C 2.433 C A 0080 THR CA
C A 0079 THR C 3.347 C A 0080 THR C
C A 0079 THR C 3.596 C A 0080 THR CB
C A 0080 THR C 2.446 H A 0081 LEU CA
C A 0080 THR C 3.172 H A 0081 LEU C
C A 0080 THR C 2.901 H A 0081 LEU CB
H A 0081 LEU C 2.431 H A 0082 LYS CA
H A 0081 LEU C 3.150 H A 0082 LYS C
H A 0081 LEU C 3.687 H A 0082 LYS CB
H A 0081 LEU CA 3.752 H A 0084 LEU CD1
H A 0081 LEU CD1 3.792 H A 0084 LEU CD1
H A 0082 LYS C 2.431 H A 0083 ILE CA
H A 0082 LYS C 2.941 H A 0083 ILE C
H A 0082 LYS C 3.737 H A 0083 ILE CB
H A 0083 ILE CA 3.797 H A 0084 LEU CA
H A 0083 ILE C 2.431 H A 0084 LEU CA
H A 0083 ILE C 3.052 H A 0084 LEU C
H A 0083 ILE C 3.707 H A 0084 LEU CB
H A 0084 LEU CA 3.799 H A 0085 GLU CA
H A 0084 LEU C 2.433 H A 0085 GLU CA
H A 0084 LEU C 3.035 H A 0085 GLU C
H A 0084 LEU C 3.712 H A 0085 GLU CB
H A 0085 GLU CA 3.793 H A 0086 GLY CA
H A 0085 GLU C 2.419 H A 0086 GLY CA
H A 0085 GLU C 3.145 H A 0086 GLY C
H A 0086 GLY CA 3.797 H A 0087 HIS CA
H A 0086 GLY C 2.435 H A 0087 HIS CA
H A 0086 GLY C 3.292 H A 0087 HIS C
H A 0086 GLY C 3.630 H A 0087 HIS CB
H A 0087 HIS C 2.435 H A 0088 LEU CA
H A 0087 HIS C 3.134 H A 0088 LEU C
H A 0087 HIS C 3.694 H A 0088 LEU CB
CHARGE_ATTR 2.00 12.00 94
C A 0014 ASP OD1 11.07 C A 0013 LYS NZ
C A 0014 ASP OD2 11.83 C A 0013 LYS NZ
C A 0017 GLU OE2 10.39 E A 0007 LYS NZ
C A 0017 GLU OE1 9.961 C A 0020 ARG NH1
C A 0017 GLU OE1 9.599 C A 0020 ARG NH2
C A 0017 GLU OE2 11.53 C A 0020 ARG NH1
C A 0017 GLU OE2 10.99 C A 0020 ARG NH2
C A 0018 GLU OE1 7.208 C A 0020 ARG NH1
C A 0018 GLU OE1 8.918 C A 0020 ARG NH2
C A 0018 GLU OE2 8.191 C A 0020 ARG NH1
C A 0018 GLU OE2 9.571 C A 0020 ARG NH2
H A 0024 ASP OD1 8.068 C A 0013 LYS NZ
H A 0024 ASP OD2 8.893 C A 0013 LYS NZ
H A 0024 ASP OD1 11.03 H A 0026 LYS NZ
H A 0024 ASP OD1 9.685 C A 0031 LYS NZ
H A 0024 ASP OD2 11.26 C A 0031 LYS NZ
H A 0024 ASP OD1 10.43 C A 0032 LYS NZ
C A 0030 GLU OE1 8.093 C A 0031 LYS NZ
C A 0030 GLU OE2 8.303 C A 0031 LYS NZ
C A 0030 GLU OE1 10.29 C A 0032 LYS NZ
C A 0030 GLU OE2 11.36 C A 0032 LYS NZ
C A 0036 ASP OD1 3.965 C A 0013 LYS NZ
C A 0036 ASP OD2 6.124 C A 0013 LYS NZ
C A 0037 ASP OD1 8.796 C A 0013 LYS NZ
C A 0037 ASP OD2 10.13 C A 0013 LYS NZ
C A 0037 ASP OD1 10.61 C A 0033 LYS NZ
C A 0037 ASP OD2 9.513 C A 0033 LYS NZ
C A 0038 ASP OD1 7.351 C A 0013 LYS NZ
C A 0038 ASP OD2 7.284 C A 0013 LYS NZ
C A 0038 ASP OD1 9.818 H A 0026 LYS NZ
C A 0038 ASP OD2 8.850 H A 0026 LYS NZ
C A 0038 ASP OD2 11.92 C A 0031 LYS NZ
C A 0038 ASP OD1 6.052 C A 0032 LYS NZ
C A 0038 ASP OD2 6.225 C A 0032 LYS NZ
C A 0038 ASP OD1 6.241 C A 0033 LYS NZ
C A 0038 ASP OD2 8.227 C A 0033 LYS NZ
C A 0039 GLU OE1 11.98 E A 0007 LYS NZ
C A 0039 GLU OE1 10.60 C A 0033 LYS NZ
C A 0039 GLU OE2 9.517 C A 0033 LYS NZ
C A 0039 GLU OE1 8.304 H A 0087 HIS ND1
C A 0039 GLU OE1 7.889 H A 0087 HIS NE2
C A 0039 GLU OE2 9.321 H A 0087 HIS ND1
C A 0039 GLU OE2 9.282 H A 0087 HIS NE2
H A 0063 ASP OD1 11.30 E A 0007 LYS NZ
H A 0063 ASP OD2 11.11 E A 0007 LYS NZ
H A 0063 ASP OD1 6.325 H A 0066 ARG NH1
H A 0063 ASP OD1 6.929 H A 0066 ARG NH2
H A 0063 ASP OD2 7.732 H A 0066 ARG NH1
H A 0063 ASP OD2 8.507 H A 0066 ARG NH2
H A 0063 ASP OD1 7.928 H A 0067 LYS NZ
H A 0063 ASP OD2 6.247 H A 0067 LYS NZ
H A 0064 GLU OE2 11.60 H A 0067 LYS NZ
H A 0064 GLU OE1 7.706 H A 0087 HIS ND1
H A 0064 GLU OE1 7.020 H A 0087 HIS NE2
H A 0064 GLU OE2 8.058 H A 0087 HIS ND1
H A 0064 GLU OE2 7.111 H A 0087 HIS NE2
H A 0068 GLU OE1 11.05 E A 0007 LYS NZ
H A 0068 GLU OE2 11.33 E A 0007 LYS NZ
H A 0068 GLU OE1 11.50 H A 0075 LYS NZ
H A 0068 GLU OE2 10.06 H A 0075 LYS NZ
H A 0068 GLU OE1 11.12 C A 0078 HIS NE2
H A 0068 GLU OE2 11.49 C A 0078 HIS ND1
H A 0068 GLU OE2 9.484 C A 0078 HIS NE2
H A 0068 GLU OE1 5.471 H A 0087 HIS ND1
H A 0068 GLU OE1 4.041 H A 0087 HIS NE2
H A 0068 GLU OE2 5.257 H A 0087 HIS ND1
H A 0068 GLU OE2 4.164 H A 0087 HIS NE2
H A 0070 GLU OE1 3.225 E A 0007 LYS NZ
H A 0070 GLU OE2 5.123 E A 0007 LYS NZ
H A 0070 GLU OE1 11.90 E A 0052 HIS ND1
H A 0070 GLU OE1 10.13 E A 0052 HIS NE2
H A 0070 GLU OE1 8.046 H A 0066 ARG NH1
H A 0070 GLU OE1 10.01 H A 0066 ARG NH2
H A 0070 GLU OE2 7.356 H A 0066 ARG NH1
H A 0070 GLU OE2 9.542 H A 0066 ARG NH2
H A 0070 GLU OE1 10.85 H A 0067 LYS NZ
H A 0070 GLU OE2 9.798 H A 0067 LYS NZ
H A 0070 GLU OE1 11.76 C A 0078 HIS ND1
H A 0070 GLU OE1 10.93 C A 0078 HIS NE2
H A 0071 GLU OE1 11.01 E A 0007 LYS NZ
H A 0071 GLU OE2 10.60 E A 0007 LYS NZ
H A 0071 GLU OE1 7.234 H A 0067 LYS NZ
H A 0071 GLU OE2 6.189 H A 0067 LYS NZ
H A 0071 GLU OE1 4.342 H A 0075 LYS NZ
H A 0071 GLU OE2 5.816 H A 0075 LYS NZ
H A 0071 GLU OE1 9.960 C A 0078 HIS ND1
H A 0071 GLU OE1 9.234 C A 0078 HIS NE2
H A 0071 GLU OE2 10.86 C A 0078 HIS ND1
H A 0071 GLU OE2 10.32 C A 0078 HIS NE2
H A 0085 GLU OE1 11.71 C A 0078 HIS NE2
H A 0085 GLU OE1 9.249 H A 0082 LYS NZ
H A 0085 GLU OE2 7.436 H A 0082 LYS NZ
H A 0085 GLU OE1 10.76 H A 0087 HIS ND1
H A 0085 GLU OE1 11.97 H A 0087 HIS NE2
CHARGE_REPU 2.00 12.00 100
E A 0007 LYS NZ 10.68 E A 0052 HIS ND1
E A 0007 LYS NZ 8.673 E A 0052 HIS NE2
E A 0007 LYS NZ 7.969 H A 0066 ARG NH1
E A 0007 LYS NZ 9.387 H A 0066 ARG NH2
E A 0007 LYS NZ 11.16 C A 0078 HIS ND1
E A 0007 LYS NZ 9.984 C A 0078 HIS NE2
E A 0007 LYS NZ 11.06 H A 0087 HIS NE2
C A 0013 LYS NZ 11.44 C A 0031 LYS NZ
C A 0013 LYS NZ 11.63 C A 0033 LYS NZ
C A 0014 ASP OD1 10.60 C A 0017 GLU OE1
C A 0014 ASP OD1 10.57 C A 0017 GLU OE2
C A 0014 ASP OD2 9.947 C A 0017 GLU OE1
C A 0014 ASP OD2 9.696 C A 0017 GLU OE2
C A 0014 ASP OD1 10.29 C A 0018 GLU OE1
C A 0014 ASP OD1 11.17 C A 0018 GLU OE2
C A 0014 ASP OD2 11.01 C A 0018 GLU OE1
C A 0014 ASP OD2 11.49 C A 0018 GLU OE2
C A 0014 ASP OD1 10.93 H A 0024 ASP OD1
C A 0014 ASP OD1 9.533 H A 0024 ASP OD2
C A 0014 ASP OD2 11.13 H A 0024 ASP OD2
C A 0014 ASP OD1 9.301 C A 0036 ASP OD1
C A 0014 ASP OD1 9.447 C A 0036 ASP OD2
C A 0014 ASP OD2 9.555 C A 0036 ASP OD1
C A 0014 ASP OD2 9.291 C A 0036 ASP OD2
C A 0017 GLU OE1 8.893 C A 0018 GLU OE1
C A 0017 GLU OE1 8.295 C A 0018 GLU OE2
C A 0017 GLU OE2 10.77 C A 0018 GLU OE1
C A 0017 GLU OE2 10.32 C A 0018 GLU OE2
H A 0024 ASP OD1 10.63 C A 0036 ASP OD1
H A 0024 ASP OD2 10.88 C A 0036 ASP OD1
H A 0024 ASP OD1 8.479 C A 0038 ASP OD1
H A 0024 ASP OD1 6.519 C A 0038 ASP OD2
H A 0024 ASP OD2 10.16 C A 0038 ASP OD1
H A 0024 ASP OD2 8.153 C A 0038 ASP OD2
H A 0026 LYS NZ 5.918 C A 0032 LYS NZ
H A 0026 LYS NZ 11.37 E A 0052 HIS ND1
H A 0026 LYS NZ 11.35 E A 0052 HIS NE2
C A 0031 LYS NZ 11.99 C A 0032 LYS NZ
C A 0032 LYS NZ 6.772 C A 0033 LYS NZ
C A 0036 ASP OD1 6.878 C A 0037 ASP OD1
C A 0036 ASP OD1 8.759 C A 0037 ASP OD2
C A 0036 ASP OD2 6.298 C A 0037 ASP OD1
C A 0036 ASP OD2 8.328 C A 0037 ASP OD2
C A 0036 ASP OD1 9.225 C A 0038 ASP OD1
C A 0036 ASP OD1 9.316 C A 0038 ASP OD2
C A 0036 ASP OD2 10.66 C A 0038 ASP OD1
C A 0036 ASP OD2 10.91 C A 0038 ASP OD2
C A 0037 ASP OD1 8.564 C A 0038 ASP OD1
C A 0037 ASP OD1 9.824 C A 0038 ASP OD2
C A 0037 ASP OD2 8.823 C A 0038 ASP OD1
C A 0037 ASP OD2 10.44 C A 0038 ASP OD2
C A 0037 ASP OD1 8.540 C A 0039 GLU OE1
C A 0037 ASP OD1 6.734 C A 0039 GLU OE2
C A 0037 ASP OD2 8.130 C A 0039 GLU OE1
C A 0037 ASP OD2 6.040 C A 0039 GLU OE2
C A 0038 ASP OD1 9.127 C A 0039 GLU OE1
C A 0038 ASP OD1 8.538 C A 0039 GLU OE2
C A 0038 ASP OD2 10.02 C A 0039 GLU OE1
C A 0038 ASP OD2 9.797 C A 0039 GLU OE2
C A 0039 GLU OE1 11.08 H A 0068 GLU OE1
C A 0039 GLU OE1 11.85 H A 0068 GLU OE2
E A 0052 HIS ND1 11.71 H A 0075 LYS NZ
E A 0052 HIS NE2 11.09 H A 0075 LYS NZ
E A 0052 HIS ND1 4.791 C A 0078 HIS ND1
E A 0052 HIS ND1 5.473 C A 0078 HIS NE2
E A 0052 HIS NE2 4.840 C A 0078 HIS ND1
E A 0052 HIS NE2 4.725 C A 0078 HIS NE2
H A 0063 ASP OD1 10.74 H A 0064 GLU OE1
H A 0063 ASP OD1 10.18 H A 0064 GLU OE2
H A 0063 ASP OD2 9.665 H A 0064 GLU OE1
H A 0063 ASP OD2 8.732 H A 0064 GLU OE2
H A 0063 ASP OD1 11.13 H A 0068 GLU OE1
H A 0063 ASP OD2 9.733 H A 0068 GLU OE1
H A 0063 ASP OD2 11.31 H A 0068 GLU OE2
H A 0063 ASP OD1 10.52 H A 0070 GLU OE1
H A 0063 ASP OD1 9.440 H A 0070 GLU OE2
H A 0063 ASP OD2 10.25 H A 0070 GLU OE1
H A 0063 ASP OD2 9.353 H A 0070 GLU OE2
H A 0063 ASP OD1 11.84 H A 0071 GLU OE2
H A 0063 ASP OD2 10.54 H A 0071 GLU OE1
H A 0063 ASP OD2 10.11 H A 0071 GLU OE2
H A 0064 GLU OE1 4.750 H A 0068 GLU OE1
H A 0064 GLU OE1 6.621 H A 0068 GLU OE2
H A 0064 GLU OE2 3.742 H A 0068 GLU OE1
H A 0064 GLU OE2 5.443 H A 0068 GLU OE2
H A 0064 GLU OE2 11.18 H A 0071 GLU OE1
H A 0067 LYS NZ 11.50 H A 0075 LYS NZ
H A 0068 GLU OE1 9.786 H A 0071 GLU OE1
H A 0068 GLU OE1 11.18 H A 0071 GLU OE2
H A 0068 GLU OE2 9.126 H A 0071 GLU OE1
H A 0068 GLU OE2 10.80 H A 0071 GLU OE2
H A 0068 GLU OE2 11.79 H A 0085 GLU OE1
H A 0070 GLU OE1 9.793 H A 0071 GLU OE1
H A 0070 GLU OE1 8.793 H A 0071 GLU OE2
H A 0070 GLU OE2 10.18 H A 0071 GLU OE1
H A 0070 GLU OE2 8.829 H A 0071 GLU OE2
H A 0075 LYS NZ 7.213 C A 0078 HIS ND1
H A 0075 LYS NZ 7.080 C A 0078 HIS NE2
C A 0078 HIS NE2 11.76 H A 0087 HIS ND1
C A 0078 HIS NE2 10.78 H A 0087 HIS NE2
HB_MM 2.00 3.20 136
C A 0002 PHE N 2.250 C A 0001 LEU O
C A 0003 ILE N 2.251 C A 0002 PHE O
C A 0004 ALA N 2.250 C A 0003 ILE O
C A 0005 THR N 2.249 C A 0004 ALA O
E A 0006 LEU N 2.250 C A 0005 THR O
E A 0006 LEU N 3.045 E A 0044 SER O
E A 0007 LYS N 2.249 E A 0006 LEU O
E A 0008 GLY N 2.251 E A 0007 LYS O
E A 0008 GLY N 3.087 E A 0042 ILE O
E A 0009 ILE N 2.250 E A 0008 GLY O
E A 0010 PHE N 2.251 E A 0009 ILE O
E A 0010 PHE N 3.176 E A 0040 ILE O
C A 0011 THR N 2.252 E A 0010 PHE O
C A 0012 LEU N 2.260 C A 0011 THR O
C A 0012 LEU N 2.735 C A 0038 ASP O
C A 0013 LYS N 2.242 C A 0012 LEU O
C A 0014 ASP N 2.253 C A 0013 LYS O
C A 0015 LEU N 2.646 C A 0011 THR O
C A 0015 LEU N 3.183 C A 0012 LEU O
C A 0015 LEU N 2.255 C A 0014 ASP O
C A 0016 PRO N 2.251 C A 0015 LEU O
C A 0017 GLU N 2.453 C A 0015 LEU O
C A 0017 GLU N 2.263 C A 0016 PRO O
C A 0018 GLU N 2.659 C A 0016 PRO O
C A 0018 GLU N 2.257 C A 0017 GLU O
C A 0019 PHE N 2.708 C A 0016 PRO O
C A 0019 PHE N 2.831 C A 0017 GLU O
C A 0019 PHE N 2.245 C A 0018 GLU O
C A 0020 ARG N 3.008 C A 0016 PRO O
C A 0020 ARG N 2.246 C A 0019 PHE O
C A 0021 PRO N 2.252 C A 0020 ARG O
C A 0022 PHE N 2.928 C A 0020 ARG O
C A 0022 PHE N 2.250 C A 0021 PRO O
H A 0023 VAL N 2.250 C A 0022 PHE O
H A 0024 ASP N 2.975 C A 0022 PHE O
H A 0024 ASP N 2.250 H A 0023 VAL O
H A 0025 TYR N 2.752 H A 0023 VAL O
H A 0025 TYR N 2.251 H A 0024 ASP O
H A 0026 LYS N 2.590 H A 0023 VAL O
H A 0026 LYS N 2.251 H A 0025 TYR O
H A 0027 ALA N 3.046 H A 0024 ASP O
H A 0027 ALA N 2.250 H A 0026 LYS O
H A 0028 GLY N 3.154 H A 0024 ASP O
H A 0028 GLY N 3.170 H A 0025 TYR O
H A 0028 GLY N 2.253 H A 0027 ALA O
C A 0029 LEU N 2.583 H A 0025 TYR O
C A 0029 LEU N 2.251 H A 0028 GLY O
C A 0030 GLU N 2.929 H A 0028 GLY O
C A 0030 GLU N 2.248 C A 0029 LEU O
C A 0031 LYS N 2.250 C A 0030 GLU O
C A 0032 LYS N 2.250 C A 0031 LYS O
C A 0033 LYS N 2.250 C A 0032 LYS O
C A 0034 LEU N 2.250 C A 0033 LYS O
C A 0035 SER N 2.250 C A 0034 LEU O
C A 0036 ASP N 2.250 C A 0035 SER O
C A 0037 ASP N 2.927 C A 0035 SER O
C A 0037 ASP N 2.250 C A 0036 ASP O
C A 0038 ASP N 2.250 C A 0037 ASP O
C A 0039 GLU N 2.917 C A 0037 ASP O
C A 0039 GLU N 2.251 C A 0038 ASP O
E A 0040 ILE N 2.633 E A 0010 PHE O
E A 0040 ILE N 2.251 C A 0039 GLU O
E A 0041 ALA N 2.250 E A 0040 ILE O
E A 0041 ALA N 2.936 E A 0054 LEU O
E A 0042 ILE N 2.251 E A 0041 ALA O
E A 0043 ILE N 2.250 E A 0042 ILE O
E A 0044 SER N 2.954 E A 0006 LEU O
E A 0044 SER N 2.249 E A 0043 ILE O
C A 0045 ILE N 2.250 E A 0044 SER O
C A 0046 LYS N 2.251 C A 0045 ILE O
C A 0047 GLY N 2.581 C A 0045 ILE O
C A 0047 GLY N 2.250 C A 0046 LYS O
C A 0048 THR N 2.251 C A 0047 GLY O
C A 0049 GLN N 2.252 C A 0048 THR O
C A 0050 SER N 2.250 C A 0049 GLN O
C A 0051 ASN N 2.250 C A 0050 SER O
E A 0052 HIS N 2.249 C A 0051 ASN O
E A 0053 VAL N 2.250 E A 0052 HIS O
E A 0054 LEU N 2.983 E A 0041 ALA O
E A 0054 LEU N 2.250 E A 0053 VAL O
E A 0055 PHE N 2.250 E A 0054 LEU O
C A 0056 LEU N 2.249 E A 0055 PHE O
C A 0057 SER N 2.250 C A 0056 LEU O
C A 0058 SER N 2.250 C A 0057 SER O
C A 0059 TYR N 2.250 C A 0058 SER O
C A 0060 ASN N 2.249 C A 0059 TYR O
C A 0061 SER N 3.060 C A 0059 TYR O
C A 0061 SER N 2.250 C A 0060 ASN O
H A 0062 VAL N 2.250 C A 0061 SER O
H A 0063 ASP N 2.251 H A 0062 VAL O
H A 0064 GLU N 2.614 H A 0062 VAL O
H A 0064 GLU N 2.253 H A 0063 ASP O
H A 0065 ILE N 2.946 H A 0062 VAL O
H A 0065 ILE N 2.688 H A 0063 ASP O
H A 0065 ILE N 2.251 H A 0064 GLU O
H A 0066 ARG N 2.721 H A 0063 ASP O
H A 0066 ARG N 2.251 H A 0065 ILE O
H A 0067 LYS N 3.114 H A 0063 ASP O
H A 0067 LYS N 2.250 H A 0066 ARG O
H A 0068 GLU N 2.251 H A 0067 LYS O
H A 0069 LEU N 2.771 H A 0065 ILE O
H A 0069 LEU N 2.249 H A 0068 GLU O
H A 0070 GLU N 3.177 H A 0066 ARG O
H A 0070 GLU N 2.251 H A 0069 LEU O
H A 0071 GLU N 3.127 H A 0067 LYS O
H A 0071 GLU N 2.250 H A 0070 GLU O
H A 0072 ALA N 3.179 H A 0068 GLU O
H A 0072 ALA N 3.161 H A 0069 LEU O
H A 0072 ALA N 2.252 H A 0071 GLU O
H A 0073 GLY N 2.928 H A 0069 LEU O
H A 0073 GLY N 2.915 H A 0071 GLU O
H A 0073 GLY N 2.251 H A 0072 ALA O
H A 0074 ALA N 2.917 H A 0071 GLU O
H A 0074 ALA N 2.250 H A 0073 GLY O
H A 0075 LYS N 2.715 H A 0071 GLU O
H A 0075 LYS N 2.251 H A 0074 ALA O
C A 0076 ILE N 2.249 H A 0075 LYS O
C A 0077 ASN N 2.248 C A 0076 ILE O
C A 0078 HIS N 2.249 C A 0077 ASN O
C A 0079 THR N 2.250 C A 0078 HIS O
C A 0080 THR N 3.104 C A 0078 HIS O
C A 0080 THR N 2.250 C A 0079 THR O
H A 0081 LEU N 2.254 C A 0080 THR O
H A 0082 LYS N 3.197 C A 0080 THR O
H A 0082 LYS N 2.249 H A 0081 LEU O
H A 0083 ILE N 2.251 H A 0082 LYS O
H A 0084 LEU N 2.981 H A 0082 LYS O
H A 0084 LEU N 2.251 H A 0083 ILE O
H A 0085 GLU N 2.746 H A 0082 LYS O
H A 0085 GLU N 2.253 H A 0084 LEU O
H A 0086 GLY N 3.190 H A 0082 LYS O
H A 0086 GLY N 2.253 H A 0085 GLU O
H A 0087 HIS N 3.172 H A 0084 LEU O
H A 0087 HIS N 2.250 H A 0086 GLY O
H A 0088 LEU N 2.628 H A 0084 LEU O
H A 0088 LEU N 2.250 H A 0087 HIS O
HB_MS 2.00 3.20 7
E A 0009 ILE N 3.126 C A 0017 GLU OE2
C A 0034 LEU O 2.980 C A 0013 LYS NZ
C A 0047 GLY O 2.769 C A 0048 THR OG1
C A 0049 GLN O 2.496 C A 0050 SER OG
H A 0062 VAL N 2.957 C A 0061 SER OG
H A 0072 ALA O 2.612 C A 0078 HIS NE2
C A 0078 HIS O 3.157 C A 0079 THR OG1
AROMATIC 0.00 8.00 5
H A 0026 LYS 5.668 H A 0025 TYR
C A 0032 LYS 4.830 E A 0055 PHE
H A 0075 LYS 6.467 C A 0078 HIS
E A 0007 LYS 7.447 C A 0059 TYR
H A 0066 ARG 6.093 C A 0059 TYR