Complet list of 1ilq con file
Complete list of 1ilq.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 289
C A 0002 ALA C 2.432 C A 0003 LYS CA
C A 0002 ALA C 3.559 C A 0003 LYS C
C A 0002 ALA C 3.398 C A 0003 LYS CB
C A 0002 ALA C 3.240 C A 0003 LYS CG
C A 0002 ALA C 3.490 C A 0003 LYS CD
C A 0003 LYS C 2.420 C A 0004 GLU CA
C A 0003 LYS C 3.621 C A 0004 GLU C
C A 0003 LYS C 3.266 C A 0004 GLU CB
C A 0003 LYS C 3.032 C A 0004 GLU CG
C A 0004 GLU C 2.429 C A 0005 LEU CA
C A 0004 GLU C 3.560 C A 0005 LEU C
C A 0004 GLU C 3.375 C A 0005 LEU CB
C A 0004 GLU C 3.379 C A 0005 LEU CG
C A 0005 LEU C 2.419 C A 0006 ARG CA
C A 0005 LEU C 3.304 C A 0006 ARG C
C A 0005 LEU C 3.610 C A 0006 ARG CB
C A 0005 LEU C 3.670 C A 0006 ARG CG
C A 0005 LEU C 3.498 C A 0006 ARG CD
C A 0005 LEU CB 3.710 C A 0033 HIS CA
C A 0006 ARG C 2.420 C A 0007 CYS CA
C A 0006 ARG C 2.982 C A 0007 CYS C
C A 0006 ARG C 3.688 C A 0007 CYS CB
C A 0007 CYS C 2.447 C A 0008 GLN CA
C A 0007 CYS C 3.003 C A 0008 GLN C
C A 0007 CYS C 3.729 C A 0008 GLN CB
C A 0007 CYS CA 3.471 C A 0033 HIS CD2
C A 0007 CYS C 3.488 C A 0033 HIS CD2
C A 0007 CYS CB 3.734 E A 0038 GLU CD
C A 0008 GLN C 2.445 C A 0009 CYS CA
C A 0008 GLN C 3.137 C A 0009 CYS C
C A 0008 GLN C 3.688 C A 0009 CYS CB
C A 0008 GLN CG 3.789 E A 0028 ILE CD1
C A 0008 GLN CG 3.681 C A 0033 HIS CD2
C A 0009 CYS C 2.475 C A 0010 ILE CA
C A 0009 CYS C 3.012 C A 0010 ILE C
C A 0009 CYS C 3.764 C A 0010 ILE CB
C A 0009 CYS CB 3.789 E A 0038 GLU CD
C A 0009 CYS CB 3.689 E A 0050 CYS CB
C A 0010 ILE C 2.483 C A 0011 LYS CA
C A 0010 ILE C 3.596 C A 0011 LYS C
C A 0010 ILE C 3.424 C A 0011 LYS CB
C A 0010 ILE C 3.401 C A 0011 LYS CG
C A 0011 LYS C 2.460 C A 0012 THR CA
C A 0011 LYS C 3.533 C A 0012 THR C
C A 0011 LYS C 3.447 C A 0012 THR CB
C A 0011 LYS C 3.498 C A 0012 THR CG2
C A 0012 THR C 2.468 C A 0013 TYR CA
C A 0012 THR C 3.214 C A 0013 TYR C
C A 0012 THR C 3.661 C A 0013 TYR CB
C A 0012 THR CB 3.780 C A 0052 ASP CB
C A 0013 TYR C 2.466 C A 0014 SER CA
C A 0013 TYR C 3.218 C A 0014 SER C
C A 0013 TYR C 3.661 C A 0014 SER CB
C A 0013 TYR CE2 3.696 C A 0015 LYS CB
C A 0013 TYR CZ 3.729 C A 0015 LYS CB
C A 0013 TYR CB 3.607 E A 0049 LEU CD1
C A 0013 TYR CG 3.755 E A 0049 LEU CD1
C A 0014 SER C 2.479 C A 0015 LYS CA
C A 0014 SER C 3.616 C A 0015 LYS C
C A 0014 SER C 3.376 C A 0015 LYS CB
C A 0014 SER C 3.378 C A 0015 LYS CG
C A 0015 LYS CA 2.968 C A 0016 PRO CD
C A 0015 LYS C 2.472 C A 0016 PRO CA
C A 0015 LYS C 3.057 C A 0016 PRO C
C A 0015 LYS C 3.688 C A 0016 PRO CB
C A 0015 LYS C 3.677 C A 0016 PRO CG
C A 0015 LYS C 2.496 C A 0016 PRO CD
C A 0015 LYS C 3.535 H A 0057 TRP CZ2
C A 0016 PRO C 2.487 C A 0017 PHE CA
C A 0016 PRO C 3.707 C A 0017 PHE C
C A 0016 PRO C 3.182 C A 0017 PHE CB
C A 0016 PRO CG 3.795 H A 0057 TRP CD1
C A 0017 PHE C 2.461 C A 0018 HIS CA
C A 0017 PHE C 3.227 C A 0018 HIS C
C A 0017 PHE C 3.683 C A 0018 HIS CB
C A 0017 PHE CE2 3.588 E A 0022 ILE CD1
C A 0017 PHE CZ 3.485 E A 0049 LEU CD2
C A 0018 HIS CA 2.936 H A 0019 PRO CD
C A 0018 HIS C 2.476 H A 0019 PRO CA
C A 0018 HIS C 3.197 H A 0019 PRO C
C A 0018 HIS C 3.665 H A 0019 PRO CB
C A 0018 HIS C 3.694 H A 0019 PRO CG
C A 0018 HIS C 2.499 H A 0019 PRO CD
C A 0018 HIS CB 3.515 H A 0019 PRO CD
C A 0018 HIS CB 3.749 H A 0020 LYS CG
H A 0019 PRO C 2.482 H A 0020 LYS CA
H A 0019 PRO C 3.042 H A 0020 LYS C
H A 0019 PRO C 3.745 H A 0020 LYS CB
H A 0020 LYS C 2.471 H A 0021 PHE CA
H A 0020 LYS C 3.243 H A 0021 PHE C
H A 0020 LYS C 3.685 H A 0021 PHE CB
H A 0020 LYS CG 3.589 H A 0021 PHE CD2
H A 0020 LYS CG 3.614 H A 0021 PHE CE2
H A 0020 LYS CD 3.791 H A 0021 PHE CE2
H A 0020 LYS CD 3.779 H A 0021 PHE CZ
H A 0021 PHE C 2.471 E A 0022 ILE CA
H A 0021 PHE C 3.376 E A 0022 ILE C
H A 0021 PHE C 3.650 E A 0022 ILE CB
H A 0021 PHE C 3.526 E A 0022 ILE CD1
E A 0022 ILE C 2.427 E A 0023 LYS CA
E A 0022 ILE C 3.474 E A 0023 LYS C
E A 0022 ILE C 3.467 E A 0023 LYS CB
E A 0022 ILE C 3.676 E A 0023 LYS CG
E A 0022 ILE CG1 3.481 E A 0041 VAL CG2
E A 0022 ILE CG2 3.204 E A 0041 VAL CG2
E A 0023 LYS C 2.428 E A 0024 GLU CA
E A 0023 LYS C 3.595 E A 0024 GLU C
E A 0023 LYS C 3.339 E A 0024 GLU CB
E A 0024 GLU C 2.433 E A 0025 LEU CA
E A 0024 GLU C 3.406 E A 0025 LEU C
E A 0024 GLU C 3.542 E A 0025 LEU CB
E A 0024 GLU CB 3.648 E A 0042 LYS CB
E A 0025 LEU C 2.420 E A 0026 ARG CA
E A 0025 LEU C 3.621 E A 0026 ARG C
E A 0025 LEU C 3.259 E A 0026 ARG CB
E A 0025 LEU C 3.557 E A 0026 ARG CG
E A 0025 LEU CB 3.547 H A 0065 PHE CE2
E A 0026 ARG C 2.434 E A 0027 VAL CA
E A 0026 ARG C 3.508 E A 0027 VAL C
E A 0026 ARG C 3.451 E A 0027 VAL CB
E A 0026 ARG C 3.376 E A 0027 VAL CG2
E A 0027 VAL C 2.434 E A 0028 ILE CA
E A 0027 VAL C 3.472 E A 0028 ILE C
E A 0027 VAL C 3.487 E A 0028 ILE CB
E A 0027 VAL C 3.572 E A 0028 ILE CG1
E A 0028 ILE C 2.420 C A 0029 GLU CA
E A 0028 ILE C 3.135 C A 0029 GLU C
E A 0028 ILE C 3.664 C A 0029 GLU CB
E A 0028 ILE CD1 3.792 E A 0040 ILE CD1
C A 0029 GLU C 2.430 C A 0030 SER CA
C A 0029 GLU C 2.843 C A 0030 SER C
C A 0029 GLU C 3.670 C A 0030 SER CB
C A 0030 SER C 2.432 C A 0031 GLY CA
C A 0030 SER C 3.508 C A 0031 GLY C
C A 0030 SER CB 3.740 C A 0035 ALA CA
C A 0030 SER CB 3.414 C A 0035 ALA C
C A 0030 SER CA 3.720 C A 0036 ASN C
C A 0030 SER CB 3.745 C A 0036 ASN C
C A 0031 GLY CA 2.798 C A 0032 PRO CD
C A 0031 GLY C 2.434 C A 0032 PRO CA
C A 0031 GLY C 3.029 C A 0032 PRO C
C A 0031 GLY C 3.651 C A 0032 PRO CB
C A 0031 GLY C 3.657 C A 0032 PRO CG
C A 0031 GLY C 2.453 C A 0032 PRO CD
C A 0032 PRO C 2.430 C A 0033 HIS CA
C A 0032 PRO C 3.478 C A 0033 HIS C
C A 0032 PRO C 3.456 C A 0033 HIS CB
C A 0033 HIS C 2.423 C A 0034 CYS CA
C A 0033 HIS C 3.587 C A 0034 CYS C
C A 0033 HIS C 3.325 C A 0034 CYS CB
C A 0033 HIS CE1 3.619 C A 0034 CYS CB
C A 0034 CYS C 2.419 C A 0035 ALA CA
C A 0034 CYS C 3.304 C A 0035 ALA C
C A 0034 CYS C 3.591 C A 0035 ALA CB
C A 0035 ALA C 2.423 C A 0036 ASN CA
C A 0035 ALA C 3.606 C A 0036 ASN C
C A 0035 ALA C 3.297 C A 0036 ASN CB
C A 0035 ALA C 3.101 C A 0036 ASN CG
C A 0036 ASN C 2.421 C A 0037 THR CA
C A 0036 ASN C 3.540 C A 0037 THR C
C A 0036 ASN C 3.375 C A 0037 THR CB
C A 0037 THR C 2.427 E A 0038 GLU CA
C A 0037 THR C 3.592 E A 0038 GLU C
C A 0037 THR C 3.327 E A 0038 GLU CB
C A 0037 THR C 3.070 E A 0038 GLU CG
E A 0038 GLU C 2.483 E A 0039 ILE CA
E A 0038 GLU C 3.256 E A 0039 ILE C
E A 0038 GLU C 3.691 E A 0039 ILE CB
E A 0039 ILE C 2.497 E A 0040 ILE CA
E A 0039 ILE C 3.543 E A 0040 ILE C
E A 0039 ILE C 3.459 E A 0040 ILE CB
E A 0039 ILE C 3.318 E A 0040 ILE CG1
E A 0040 ILE C 2.437 E A 0041 VAL CA
E A 0040 ILE C 3.665 E A 0041 VAL C
E A 0040 ILE C 3.151 E A 0041 VAL CB
E A 0041 VAL C 2.457 E A 0042 LYS CA
E A 0041 VAL C 3.155 E A 0042 LYS C
E A 0041 VAL C 3.685 E A 0042 LYS CB
E A 0042 LYS C 2.458 E A 0043 LEU CA
E A 0042 LYS C 3.277 E A 0043 LEU C
E A 0042 LYS C 3.603 E A 0043 LEU CB
E A 0043 LEU C 2.472 C A 0044 SER CA
E A 0043 LEU C 3.109 C A 0044 SER C
E A 0043 LEU C 3.736 C A 0044 SER CB
E A 0043 LEU CG 3.587 C A 0045 ASP CB
E A 0043 LEU CD2 3.798 C A 0047 ARG CZ
C A 0044 SER C 2.470 C A 0045 ASP CA
C A 0044 SER C 3.018 C A 0045 ASP C
C A 0044 SER C 3.737 C A 0045 ASP CB
C A 0045 ASP C 2.474 C A 0046 GLY CA
C A 0045 ASP C 3.687 C A 0046 GLY C
C A 0046 GLY C 2.475 C A 0047 ARG CA
C A 0046 GLY C 3.272 C A 0047 ARG C
C A 0046 GLY C 3.676 C A 0047 ARG CB
C A 0047 ARG C 2.485 E A 0048 GLU CA
C A 0047 ARG C 3.509 E A 0048 GLU C
C A 0047 ARG C 3.515 E A 0048 GLU CB
C A 0047 ARG C 3.785 E A 0048 GLU CG
E A 0048 GLU C 2.456 E A 0049 LEU CA
E A 0048 GLU C 3.648 E A 0049 LEU C
E A 0048 GLU C 3.170 E A 0049 LEU CB
E A 0049 LEU C 2.482 E A 0050 CYS CA
E A 0049 LEU C 3.457 E A 0050 CYS C
E A 0049 LEU C 3.552 E A 0050 CYS CB
E A 0050 CYS C 2.483 E A 0051 LEU CA
E A 0050 CYS C 3.441 E A 0051 LEU C
E A 0050 CYS C 3.594 E A 0051 LEU CB
E A 0050 CYS C 3.581 E A 0051 LEU CG
E A 0050 CYS C 3.508 E A 0051 LEU CD2
E A 0051 LEU C 2.422 C A 0052 ASP CA
E A 0051 LEU C 3.390 C A 0052 ASP C
E A 0051 LEU C 3.548 C A 0052 ASP CB
C A 0052 ASP CA 2.936 C A 0053 PRO CD
C A 0052 ASP C 2.439 C A 0053 PRO CA
C A 0052 ASP C 2.981 C A 0053 PRO C
C A 0052 ASP C 3.671 C A 0053 PRO CB
C A 0052 ASP C 3.696 C A 0053 PRO CG
C A 0052 ASP C 2.500 C A 0053 PRO CD
C A 0052 ASP CG 3.729 C A 0054 LYS CB
C A 0053 PRO CA 3.796 C A 0054 LYS CA
C A 0053 PRO C 2.411 C A 0054 LYS CA
C A 0053 PRO C 3.117 C A 0054 LYS C
C A 0053 PRO C 3.659 C A 0054 LYS CB
C A 0054 LYS C 2.427 C A 0055 GLU CA
C A 0054 LYS C 3.340 C A 0055 GLU C
C A 0054 LYS C 3.583 C A 0055 GLU CB
C A 0054 LYS C 3.675 C A 0055 GLU CG
C A 0055 GLU C 2.415 H A 0056 ASN CA
C A 0055 GLU C 3.039 H A 0056 ASN C
C A 0055 GLU C 3.679 H A 0056 ASN CB
C A 0055 GLU CB 3.576 H A 0057 TRP CD1
C A 0055 GLU CB 3.705 H A 0057 TRP CE2
H A 0056 ASN C 2.410 H A 0057 TRP CA
H A 0056 ASN C 2.985 H A 0057 TRP C
H A 0056 ASN C 3.704 H A 0057 TRP CB
H A 0057 TRP C 2.405 H A 0058 VAL CA
H A 0057 TRP C 3.071 H A 0058 VAL C
H A 0057 TRP C 3.668 H A 0058 VAL CB
H A 0057 TRP CD2 3.734 H A 0058 VAL CG2
H A 0057 TRP CE2 3.646 H A 0058 VAL CG2
H A 0057 TRP CE3 3.572 H A 0058 VAL CA
H A 0057 TRP CE3 3.551 H A 0058 VAL CG2
H A 0057 TRP CZ2 3.373 H A 0058 VAL CG2
H A 0057 TRP CZ3 3.266 H A 0058 VAL CG2
H A 0057 TRP CH2 3.172 H A 0058 VAL CG2
H A 0058 VAL CA 3.783 H A 0059 GLN CA
H A 0058 VAL C 2.402 H A 0059 GLN CA
H A 0058 VAL C 3.012 H A 0059 GLN C
H A 0058 VAL C 3.667 H A 0059 GLN CB
H A 0059 GLN C 2.419 H A 0060 ARG CA
H A 0059 GLN C 3.233 H A 0060 ARG C
H A 0059 GLN C 3.632 H A 0060 ARG CB
H A 0060 ARG C 2.408 H A 0061 VAL CA
H A 0060 ARG C 2.918 H A 0061 VAL C
H A 0060 ARG C 3.684 H A 0061 VAL CB
H A 0061 VAL C 2.410 H A 0062 VAL CA
H A 0061 VAL C 3.073 H A 0062 VAL C
H A 0061 VAL C 3.670 H A 0062 VAL CB
H A 0062 VAL C 2.419 H A 0063 GLU CA
H A 0062 VAL C 2.960 H A 0063 GLU C
H A 0062 VAL C 3.694 H A 0063 GLU CB
H A 0063 GLU CA 3.797 H A 0064 LYS CA
H A 0063 GLU C 2.409 H A 0064 LYS CA
H A 0063 GLU C 2.973 H A 0064 LYS C
H A 0063 GLU C 3.684 H A 0064 LYS CB
H A 0064 LYS C 2.412 H A 0065 PHE CA
H A 0064 LYS C 2.917 H A 0065 PHE C
H A 0064 LYS C 3.683 H A 0065 PHE CB
H A 0065 PHE C 2.419 H A 0066 LEU CA
H A 0065 PHE C 3.023 H A 0066 LEU C
H A 0065 PHE C 3.685 H A 0066 LEU CB
H A 0066 LEU C 2.417 H A 0067 LYS CA
H A 0066 LEU C 3.032 H A 0067 LYS C
H A 0066 LEU C 3.682 H A 0067 LYS CB
H A 0067 LYS C 2.418 H A 0068 ARG CA
H A 0067 LYS C 3.169 H A 0068 ARG C
H A 0067 LYS C 3.651 H A 0068 ARG CB
H A 0068 ARG C 2.418 H A 0069 ALA CA
H A 0068 ARG C 3.047 H A 0069 ALA C
H A 0068 ARG C 3.683 H A 0069 ALA CB
H A 0069 ALA C 2.416 H A 0070 GLU CA
H A 0069 ALA C 3.166 H A 0070 GLU C
H A 0069 ALA C 3.650 H A 0070 GLU CB
H A 0070 GLU C 2.417 C A 0071 ASN CA
H A 0070 GLU C 3.055 C A 0071 ASN C
H A 0070 GLU C 3.679 C A 0071 ASN CB
C A 0071 ASN C 2.417 C A 0072 SER CA
C A 0071 ASN C 2.960 C A 0072 SER C
C A 0071 ASN C 3.687 C A 0072 SER CB
CHARGE_ATTR 2.00 12.00 53
C A 0004 GLU OE1 7.111 C A 0003 LYS NZ
C A 0004 GLU OE2 7.178 C A 0003 LYS NZ
C A 0004 GLU OE1 4.286 C A 0006 ARG NH1
C A 0004 GLU OE1 5.857 C A 0006 ARG NH2
C A 0004 GLU OE2 6.272 C A 0006 ARG NH1
C A 0004 GLU OE2 7.984 C A 0006 ARG NH2
E A 0024 GLU OE1 11.48 E A 0023 LYS NZ
E A 0024 GLU OE1 5.468 E A 0026 ARG NH1
E A 0024 GLU OE1 7.249 E A 0026 ARG NH2
E A 0024 GLU OE2 6.000 E A 0026 ARG NH1
E A 0024 GLU OE2 7.206 E A 0026 ARG NH2
E A 0024 GLU OE1 3.219 E A 0042 LYS NZ
E A 0024 GLU OE2 4.948 E A 0042 LYS NZ
C A 0029 GLU OE1 10.95 C A 0033 HIS ND1
C A 0029 GLU OE1 11.12 C A 0033 HIS NE2
C A 0029 GLU OE2 11.07 C A 0033 HIS ND1
C A 0029 GLU OE2 11.43 C A 0033 HIS NE2
E A 0038 GLU OE1 11.39 E A 0026 ARG NH1
E A 0038 GLU OE1 10.08 E A 0026 ARG NH2
E A 0038 GLU OE1 6.407 C A 0033 HIS ND1
E A 0038 GLU OE1 4.586 C A 0033 HIS NE2
E A 0038 GLU OE2 7.541 C A 0033 HIS ND1
E A 0038 GLU OE2 6.077 C A 0033 HIS NE2
C A 0045 ASP OD1 3.379 C A 0047 ARG NH1
C A 0045 ASP OD1 5.043 C A 0047 ARG NH2
C A 0045 ASP OD2 4.483 C A 0047 ARG NH1
C A 0045 ASP OD2 5.384 C A 0047 ARG NH2
E A 0048 GLU OE1 2.939 E A 0026 ARG NH1
E A 0048 GLU OE1 4.276 E A 0026 ARG NH2
E A 0048 GLU OE2 3.191 E A 0026 ARG NH1
E A 0048 GLU OE2 4.766 E A 0026 ARG NH2
E A 0048 GLU OE1 11.57 C A 0033 HIS NE2
E A 0048 GLU OE1 4.109 E A 0042 LYS NZ
E A 0048 GLU OE2 4.009 E A 0042 LYS NZ
E A 0048 GLU OE1 11.75 C A 0047 ARG NH2
E A 0048 GLU OE2 11.76 C A 0047 ARG NH2
C A 0052 ASP OD2 11.61 C A 0011 LYS NZ
C A 0052 ASP OD1 6.791 C A 0054 LYS NZ
C A 0052 ASP OD2 7.033 C A 0054 LYS NZ
C A 0055 GLU OE1 11.86 C A 0015 LYS NZ
C A 0055 GLU OE2 10.13 C A 0015 LYS NZ
C A 0055 GLU OE1 9.336 C A 0054 LYS NZ
C A 0055 GLU OE2 9.960 C A 0054 LYS NZ
H A 0063 GLU OE1 8.285 H A 0060 ARG NH1
H A 0063 GLU OE1 6.934 H A 0060 ARG NH2
H A 0063 GLU OE2 10.39 H A 0060 ARG NH1
H A 0063 GLU OE2 9.090 H A 0060 ARG NH2
H A 0063 GLU OE1 9.091 H A 0064 LYS NZ
H A 0063 GLU OE2 10.83 H A 0064 LYS NZ
H A 0063 GLU OE1 7.345 H A 0067 LYS NZ
H A 0063 GLU OE2 7.867 H A 0067 LYS NZ
H A 0070 GLU OE1 9.794 H A 0067 LYS NZ
H A 0070 GLU OE2 8.189 H A 0067 LYS NZ
CHARGE_REPU 2.00 12.00 48
C A 0003 LYS NZ 10.27 C A 0006 ARG NH1
C A 0003 LYS NZ 10.75 C A 0006 ARG NH2
C A 0011 LYS NZ 9.407 C A 0015 LYS NZ
C A 0015 LYS NZ 10.66 C A 0047 ARG NH2
C A 0018 HIS ND1 4.749 H A 0020 LYS NZ
C A 0018 HIS NE2 6.791 H A 0020 LYS NZ
C A 0018 HIS NE2 11.86 H A 0060 ARG NH1
C A 0018 HIS ND1 9.069 H A 0064 LYS NZ
C A 0018 HIS NE2 9.186 H A 0064 LYS NZ
C A 0018 HIS ND1 10.83 H A 0068 ARG NH1
C A 0018 HIS ND1 11.87 H A 0068 ARG NH2
H A 0020 LYS NZ 11.63 E A 0023 LYS NZ
H A 0020 LYS NZ 11.69 H A 0064 LYS NZ
H A 0020 LYS NZ 9.978 H A 0068 ARG NH1
H A 0020 LYS NZ 10.19 H A 0068 ARG NH2
E A 0023 LYS NZ 7.989 H A 0068 ARG NH1
E A 0023 LYS NZ 6.180 H A 0068 ARG NH2
E A 0024 GLU OE1 6.882 E A 0048 GLU OE1
E A 0024 GLU OE1 7.031 E A 0048 GLU OE2
E A 0024 GLU OE2 7.891 E A 0048 GLU OE1
E A 0024 GLU OE2 8.316 E A 0048 GLU OE2
E A 0026 ARG NH1 11.66 C A 0033 HIS NE2
E A 0026 ARG NH2 11.25 C A 0033 HIS ND1
E A 0026 ARG NH2 9.712 C A 0033 HIS NE2
E A 0026 ARG NH1 3.629 E A 0042 LYS NZ
E A 0026 ARG NH2 5.881 E A 0042 LYS NZ
C A 0029 GLU OE1 11.84 E A 0038 GLU OE1
E A 0038 GLU OE1 10.31 E A 0048 GLU OE1
E A 0038 GLU OE1 11.88 E A 0048 GLU OE2
E A 0038 GLU OE1 9.762 C A 0052 ASP OD1
E A 0038 GLU OE1 10.21 C A 0052 ASP OD2
E A 0038 GLU OE2 8.316 C A 0052 ASP OD1
E A 0038 GLU OE2 8.634 C A 0052 ASP OD2
C A 0052 ASP OD1 7.550 C A 0055 GLU OE1
C A 0052 ASP OD1 6.904 C A 0055 GLU OE2
C A 0052 ASP OD2 7.087 C A 0055 GLU OE1
C A 0052 ASP OD2 6.063 C A 0055 GLU OE2
H A 0060 ARG NH1 7.886 H A 0064 LYS NZ
H A 0060 ARG NH2 7.357 H A 0064 LYS NZ
H A 0060 ARG NH2 10.13 H A 0067 LYS NZ
H A 0063 GLU OE1 11.52 H A 0070 GLU OE1
H A 0063 GLU OE1 11.21 H A 0070 GLU OE2
H A 0063 GLU OE2 10.05 H A 0070 GLU OE1
H A 0063 GLU OE2 10.01 H A 0070 GLU OE2
H A 0064 LYS NZ 9.043 H A 0067 LYS NZ
H A 0064 LYS NZ 8.199 H A 0068 ARG NH1
H A 0064 LYS NZ 10.43 H A 0068 ARG NH2
H A 0067 LYS NZ 11.85 H A 0068 ARG NH1
HB_MM 2.00 3.20 114
C A 0003 LYS N 2.224 C A 0002 ALA O
C A 0004 GLU N 2.215 C A 0003 LYS O
C A 0005 LEU N 2.222 C A 0004 GLU O
C A 0006 ARG N 2.217 C A 0005 LEU O
C A 0007 CYS N 2.219 C A 0006 ARG O
C A 0008 GLN N 2.216 C A 0007 CYS O
C A 0009 CYS N 2.253 C A 0008 GLN O
C A 0010 ILE N 2.263 C A 0009 CYS O
C A 0011 LYS N 2.263 C A 0010 ILE O
C A 0012 THR N 2.259 C A 0011 LYS O
C A 0013 TYR N 2.258 C A 0012 THR O
C A 0013 TYR N 2.835 E A 0050 CYS O
C A 0014 SER N 3.127 C A 0012 THR O
C A 0014 SER N 2.257 C A 0013 TYR O
C A 0015 LYS N 2.891 C A 0013 TYR O
C A 0015 LYS N 2.255 C A 0014 SER O
C A 0016 PRO N 2.252 C A 0015 LYS O
C A 0017 PHE N 2.262 C A 0016 PRO O
C A 0018 HIS N 2.249 C A 0017 PHE O
H A 0019 PRO N 2.254 C A 0018 HIS O
H A 0020 LYS N 2.255 H A 0019 PRO O
H A 0021 PHE N 3.072 H A 0019 PRO O
H A 0021 PHE N 2.256 H A 0020 LYS O
E A 0022 ILE N 2.953 H A 0019 PRO O
E A 0022 ILE N 2.257 H A 0021 PHE O
E A 0023 LYS N 2.227 E A 0022 ILE O
E A 0024 GLU N 2.225 E A 0023 LYS O
E A 0025 LEU N 2.224 E A 0024 GLU O
E A 0026 ARG N 2.216 E A 0025 LEU O
E A 0026 ARG N 2.886 E A 0040 ILE O
E A 0027 VAL N 2.225 E A 0026 ARG O
E A 0028 ILE N 2.224 E A 0027 VAL O
E A 0028 ILE N 3.055 E A 0038 GLU O
C A 0029 GLU N 2.217 E A 0028 ILE O
C A 0030 SER N 2.221 C A 0029 GLU O
C A 0030 SER N 2.424 C A 0036 ASN O
C A 0031 GLY N 2.987 C A 0029 GLU O
C A 0031 GLY N 2.224 C A 0030 SER O
C A 0031 GLY N 2.478 C A 0034 CYS O
C A 0032 PRO N 2.226 C A 0031 GLY O
C A 0033 HIS N 2.772 C A 0031 GLY O
C A 0033 HIS N 2.222 C A 0032 PRO O
C A 0034 CYS N 2.959 C A 0031 GLY O
C A 0034 CYS N 2.221 C A 0033 HIS O
C A 0035 ALA N 2.218 C A 0034 CYS O
C A 0036 ASN N 2.218 C A 0035 ALA O
C A 0037 THR N 2.204 C A 0036 ASN O
E A 0038 GLU N 3.154 E A 0028 ILE O
E A 0038 GLU N 2.220 C A 0037 THR O
E A 0039 ILE N 2.262 E A 0038 GLU O
E A 0040 ILE N 2.723 E A 0026 ARG O
E A 0040 ILE N 2.260 E A 0039 ILE O
E A 0041 VAL N 2.248 E A 0040 ILE O
E A 0041 VAL N 2.829 E A 0049 LEU O
E A 0042 LYS N 3.004 E A 0024 GLU O
E A 0042 LYS N 2.259 E A 0041 VAL O
E A 0043 LEU N 2.259 E A 0042 LYS O
E A 0043 LEU N 3.021 C A 0047 ARG O
C A 0044 SER N 2.260 E A 0043 LEU O
C A 0045 ASP N 3.141 E A 0043 LEU O
C A 0045 ASP N 2.254 C A 0044 SER O
C A 0046 GLY N 2.952 E A 0043 LEU O
C A 0046 GLY N 2.260 C A 0045 ASP O
C A 0047 ARG N 2.258 C A 0046 GLY O
E A 0048 GLU N 2.259 C A 0047 ARG O
E A 0049 LEU N 2.895 E A 0041 VAL O
E A 0049 LEU N 2.260 E A 0048 GLU O
E A 0050 CYS N 2.253 E A 0049 LEU O
E A 0051 LEU N 2.938 E A 0039 ILE O
E A 0051 LEU N 2.259 E A 0050 CYS O
C A 0052 ASP N 2.220 E A 0051 LEU O
C A 0053 PRO N 2.233 C A 0052 ASP O
C A 0054 LYS N 2.618 C A 0052 ASP O
C A 0054 LYS N 2.218 C A 0053 PRO O
C A 0055 GLU N 2.872 C A 0052 ASP O
C A 0055 GLU N 2.223 C A 0054 LYS O
H A 0056 ASN N 2.214 C A 0055 GLU O
H A 0057 TRP N 2.214 H A 0056 ASN O
H A 0058 VAL N 3.159 C A 0055 GLU O
H A 0058 VAL N 3.013 H A 0056 ASN O
H A 0058 VAL N 2.207 H A 0057 TRP O
H A 0059 GLN N 3.041 H A 0056 ASN O
H A 0059 GLN N 2.213 H A 0058 VAL O
H A 0060 ARG N 3.193 H A 0056 ASN O
H A 0060 ARG N 3.137 H A 0058 VAL O
H A 0060 ARG N 2.213 H A 0059 GLN O
H A 0061 VAL N 3.033 H A 0057 TRP O
H A 0061 VAL N 2.216 H A 0060 ARG O
H A 0062 VAL N 3.082 H A 0058 VAL O
H A 0062 VAL N 3.021 H A 0060 ARG O
H A 0062 VAL N 2.215 H A 0061 VAL O
H A 0063 GLU N 3.153 H A 0059 GLN O
H A 0063 GLU N 2.896 H A 0060 ARG O
H A 0063 GLU N 2.220 H A 0062 VAL O
H A 0064 LYS N 2.855 H A 0060 ARG O
H A 0064 LYS N 2.217 H A 0063 GLU O
H A 0065 PHE N 3.111 H A 0062 VAL O
H A 0065 PHE N 2.217 H A 0064 LYS O
H A 0066 LEU N 3.183 H A 0063 GLU O
H A 0066 LEU N 3.195 H A 0064 LYS O
H A 0066 LEU N 2.216 H A 0065 PHE O
H A 0067 LYS N 2.998 H A 0063 GLU O
H A 0067 LYS N 3.076 H A 0064 LYS O
H A 0067 LYS N 2.216 H A 0066 LEU O
H A 0068 ARG N 2.671 H A 0064 LYS O
H A 0068 ARG N 2.218 H A 0067 LYS O
H A 0069 ALA N 2.769 H A 0065 PHE O
H A 0069 ALA N 2.215 H A 0068 ARG O
H A 0070 GLU N 2.916 H A 0066 LEU O
H A 0070 GLU N 2.217 H A 0069 ALA O
C A 0071 ASN N 3.160 H A 0067 LYS O
C A 0071 ASN N 2.216 H A 0070 GLU O
C A 0072 SER N 3.008 H A 0068 ARG O
C A 0072 SER N 2.215 C A 0071 ASN O
HB_MS 2.00 3.20 4
C A 0008 GLN N 3.159 E A 0038 GLU OE1
C A 0009 CYS N 2.933 E A 0038 GLU OE1
H A 0021 PHE O 2.852 C A 0044 SER OG
C A 0054 LYS N 3.190 C A 0052 ASP OD1
HB_SS 2.00 3.20 1
C A 0052 ASP OD2 3.070 C A 0012 THR OG1
AROMATIC 0.00 8.00 5
H A 0020 LYS 5.598 H A 0021 PHE
C A 0015 LYS 5.987 C A 0013 TYR
C A 0047 ARG 7.716 C A 0013 TYR
C A 0013 TYR 5.714 C A 0017 PHE
H A 0020 LYS 6.024 C A 0018 HIS
SS_BOND 1.50 2.80 2
C A 0007 CYS SG 2.020 C A 0034 CYS SG
C A 0009 CYS SG 2.042 E A 0050 CYS SG
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 7
E A 0024 GLU CD 3.647 E B 0028 ILE CG1
E A 0026 ARG CG 3.446 E B 0026 ARG CG
E A 0028 ILE CG1 3.646 E B 0024 GLU CD
C A 0029 GLU CB 3.717 H B 0065 PHE CE1
C A 0037 THR CB 3.748 H B 0069 ALA C
H A 0065 PHE CE1 3.720 C B 0029 GLU CB
H A 0069 ALA C 3.749 C B 0037 THR CB
CHARGE_ATTR 2.00 12.00 46
E A 0023 LYS NZ 5.569 C B 0029 GLU OE1
E A 0023 LYS NZ 5.562 C B 0029 GLU OE2
E A 0024 GLU OE1 7.327 E B 0026 ARG NH1
E A 0024 GLU OE1 5.320 E B 0026 ARG NH2
E A 0024 GLU OE2 6.026 E B 0026 ARG NH1
E A 0024 GLU OE2 4.158 E B 0026 ARG NH2
E A 0024 GLU OE1 9.393 C B 0033 HIS ND1
E A 0024 GLU OE1 8.643 C B 0033 HIS NE2
E A 0024 GLU OE2 9.459 C B 0033 HIS ND1
E A 0024 GLU OE2 8.281 C B 0033 HIS NE2
E A 0024 GLU OE1 11.72 E B 0042 LYS NZ
E A 0024 GLU OE2 10.72 E B 0042 LYS NZ
E A 0026 ARG NH1 7.327 E B 0024 GLU OE1
E A 0026 ARG NH1 6.026 E B 0024 GLU OE2
E A 0026 ARG NH2 5.320 E B 0024 GLU OE1
E A 0026 ARG NH2 4.158 E B 0024 GLU OE2
E A 0026 ARG NH1 11.29 E B 0048 GLU OE1
E A 0026 ARG NH1 11.82 E B 0048 GLU OE2
E A 0026 ARG NH2 10.45 E B 0048 GLU OE1
E A 0026 ARG NH2 11.35 E B 0048 GLU OE2
C A 0029 GLU OE1 9.462 C B 0018 HIS ND1
C A 0029 GLU OE1 10.60 C B 0018 HIS NE2
C A 0029 GLU OE2 10.08 C B 0018 HIS ND1
C A 0029 GLU OE2 10.95 C B 0018 HIS NE2
C A 0029 GLU OE1 5.569 E B 0023 LYS NZ
C A 0029 GLU OE2 5.560 E B 0023 LYS NZ
C A 0029 GLU OE1 6.860 H B 0068 ARG NH1
C A 0029 GLU OE1 6.302 H B 0068 ARG NH2
C A 0029 GLU OE2 6.019 H B 0068 ARG NH1
C A 0029 GLU OE2 5.142 H B 0068 ARG NH2
C A 0033 HIS ND1 9.393 E B 0024 GLU OE1
C A 0033 HIS ND1 9.461 E B 0024 GLU OE2
C A 0033 HIS NE2 8.643 E B 0024 GLU OE1
C A 0033 HIS NE2 8.282 E B 0024 GLU OE2
E A 0042 LYS NZ 10.49 E B 0024 GLU OE1
E A 0042 LYS NZ 9.098 E B 0024 GLU OE2
E A 0048 GLU OE1 9.473 E B 0026 ARG NH1
E A 0048 GLU OE1 8.822 E B 0026 ARG NH2
E A 0048 GLU OE2 9.461 E B 0026 ARG NH1
E A 0048 GLU OE2 8.689 E B 0026 ARG NH2
E A 0048 GLU OE1 11.13 E B 0042 LYS NZ
E A 0048 GLU OE2 11.04 E B 0042 LYS NZ
H A 0068 ARG NH1 6.859 C B 0029 GLU OE1
H A 0068 ARG NH1 6.021 C B 0029 GLU OE2
H A 0068 ARG NH2 6.302 C B 0029 GLU OE1
H A 0068 ARG NH2 5.146 C B 0029 GLU OE2
CHARGE_REPU 2.00 12.00 57
E A 0023 LYS NZ 9.233 C B 0033 HIS ND1
E A 0023 LYS NZ 10.41 C B 0033 HIS NE2
E A 0024 GLU OE1 10.55 E B 0024 GLU OE1
E A 0024 GLU OE1 9.392 E B 0024 GLU OE2
E A 0024 GLU OE2 9.393 E B 0024 GLU OE1
E A 0024 GLU OE2 8.398 E B 0024 GLU OE2
E A 0024 GLU OE1 11.17 C B 0029 GLU OE1
E A 0024 GLU OE2 11.08 C B 0029 GLU OE1
E A 0024 GLU OE1 10.57 E B 0038 GLU OE1
E A 0024 GLU OE2 9.257 E B 0038 GLU OE1
E A 0024 GLU OE2 11.34 E B 0038 GLU OE2
E A 0024 GLU OE1 11.91 E B 0048 GLU OE1
E A 0024 GLU OE1 11.42 E B 0048 GLU OE2
E A 0024 GLU OE2 10.64 E B 0048 GLU OE1
E A 0024 GLU OE2 10.11 E B 0048 GLU OE2
E A 0026 ARG NH1 6.577 E B 0026 ARG NH1
E A 0026 ARG NH1 5.997 E B 0026 ARG NH2
E A 0026 ARG NH2 5.997 E B 0026 ARG NH1
E A 0026 ARG NH2 6.252 E B 0026 ARG NH2
E A 0026 ARG NH1 8.655 E B 0042 LYS NZ
E A 0026 ARG NH2 6.900 E B 0042 LYS NZ
C A 0029 GLU OE1 11.17 E B 0024 GLU OE1
C A 0029 GLU OE1 11.07 E B 0024 GLU OE2
C A 0029 GLU OE1 11.61 H B 0070 GLU OE1
C A 0029 GLU OE2 11.63 H B 0070 GLU OE1
C A 0029 GLU OE2 11.78 H B 0070 GLU OE2
C A 0033 HIS ND1 9.230 E B 0023 LYS NZ
C A 0033 HIS NE2 10.40 E B 0023 LYS NZ
C A 0033 HIS ND1 11.25 E B 0042 LYS NZ
C A 0033 HIS NE2 10.90 E B 0042 LYS NZ
E A 0038 GLU OE1 10.57 E B 0024 GLU OE1
E A 0038 GLU OE1 9.256 E B 0024 GLU OE2
E A 0038 GLU OE2 11.34 E B 0024 GLU OE2
E A 0042 LYS NZ 8.373 E B 0026 ARG NH1
E A 0042 LYS NZ 6.815 E B 0026 ARG NH2
E A 0042 LYS NZ 11.58 C B 0033 HIS NE2
E A 0042 LYS NZ 11.70 E B 0042 LYS NZ
E A 0048 GLU OE1 9.351 E B 0024 GLU OE1
E A 0048 GLU OE1 7.683 E B 0024 GLU OE2
E A 0048 GLU OE2 10.08 E B 0024 GLU OE1
E A 0048 GLU OE2 8.777 E B 0024 GLU OE2
C A 0052 ASP OD1 10.90 H B 0070 GLU OE1
H A 0063 GLU OE1 11.42 H B 0063 GLU OE2
H A 0063 GLU OE2 11.42 H B 0063 GLU OE1
H A 0063 GLU OE2 9.288 H B 0063 GLU OE2
H A 0063 GLU OE1 10.08 H B 0070 GLU OE1
H A 0063 GLU OE1 11.03 H B 0070 GLU OE2
H A 0063 GLU OE2 8.801 H B 0070 GLU OE1
H A 0063 GLU OE2 9.748 H B 0070 GLU OE2
H A 0070 GLU OE1 11.60 C B 0029 GLU OE1
H A 0070 GLU OE1 11.63 C B 0029 GLU OE2
H A 0070 GLU OE2 11.78 C B 0029 GLU OE2
H A 0070 GLU OE1 10.90 C B 0052 ASP OD1
H A 0070 GLU OE1 10.08 H B 0063 GLU OE1
H A 0070 GLU OE1 8.804 H B 0063 GLU OE2
H A 0070 GLU OE2 11.04 H B 0063 GLU OE1
H A 0070 GLU OE2 9.751 H B 0063 GLU OE2
HB_MM 2.00 3.20 6
E A 0023 LYS O 3.182 C B 0029 GLU N
E A 0025 LEU N 2.851 E B 0027 VAL O
E A 0025 LEU O 3.141 E B 0027 VAL N
E A 0027 VAL N 3.140 E B 0025 LEU O
E A 0027 VAL O 2.850 E B 0025 LEU N
C A 0029 GLU N 3.179 E B 0023 LYS O
HB_MS 2.00 3.20 2
C A 0037 THR OG1 2.456 H B 0069 ALA O
H A 0069 ALA O 2.456 C B 0037 THR OG1
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "C"
HYDROPHOBIC 2.00 3.80 20
C A 0010 ILE CD1 3.796 C C 0016 SER C
C A 0013 TYR CE1 3.600 C C 0010 PRO CB
C A 0013 TYR CE1 3.508 C C 0010 PRO CG
C A 0013 TYR CZ 3.751 C C 0010 PRO CA
C A 0013 TYR CZ 3.698 C C 0010 PRO CG
H A 0021 PHE CG 3.688 C C 0009 PRO CG
H A 0021 PHE CD2 3.731 C C 0009 PRO CG
H A 0021 PHE CE2 3.681 C C 0009 PRO CD
H A 0021 PHE CZ 3.757 C C 0009 PRO CD
E A 0040 ILE CG2 3.695 C C 0017 PRO CG
E A 0043 LEU CD1 3.454 C C 0009 PRO CB
E A 0043 LEU CD1 3.507 C C 0009 PRO CG
C A 0044 SER C 3.554 C C 0003 ASP CG
C A 0045 ASP CA 3.663 C C 0003 ASP CB
C A 0045 ASP CA 3.704 C C 0003 ASP CG
C A 0047 ARG CD 3.459 C C 0013 GLU CD
E A 0049 LEU CD1 3.496 C C 0010 PRO CG
E A 0049 LEU CD2 3.762 C C 0010 PRO CG
E A 0049 LEU CD2 3.750 C C 0010 PRO CD
E A 0049 LEU CD1 3.610 C C 0015 TYR CD2
CHARGE_ATTR 2.00 12.00 36
C A 0006 ARG NH2 10.73 C C 0014 ASP OD1
C A 0006 ARG NH2 10.21 C C 0014 ASP OD2
C A 0011 LYS NZ 8.259 C C 0012 ASP OD1
C A 0011 LYS NZ 8.909 C C 0012 ASP OD2
C A 0011 LYS NZ 6.755 C C 0014 ASP OD1
C A 0011 LYS NZ 4.784 C C 0014 ASP OD2
C A 0015 LYS NZ 5.522 C C 0012 ASP OD1
C A 0015 LYS NZ 3.719 C C 0012 ASP OD2
C A 0018 HIS ND1 11.50 C C 0003 ASP OD1
C A 0018 HIS ND1 10.63 C C 0003 ASP OD2
C A 0018 HIS ND1 7.678 C C 0005 ASP OD1
C A 0018 HIS ND1 6.226 C C 0005 ASP OD2
C A 0018 HIS NE2 9.275 C C 0005 ASP OD1
C A 0018 HIS NE2 7.994 C C 0005 ASP OD2
C A 0018 HIS ND1 11.91 C C 0006 ASP OD2
H A 0020 LYS NZ 8.898 C C 0003 ASP OD1
H A 0020 LYS NZ 8.871 C C 0003 ASP OD2
H A 0020 LYS NZ 4.078 C C 0005 ASP OD1
H A 0020 LYS NZ 3.142 C C 0005 ASP OD2
H A 0020 LYS NZ 11.49 C C 0006 ASP OD1
H A 0020 LYS NZ 10.14 C C 0006 ASP OD2
E A 0023 LYS NZ 9.393 C C 0003 ASP OD1
E A 0023 LYS NZ 10.71 C C 0003 ASP OD2
C A 0047 ARG NH1 9.575 C C 0003 ASP OD1
C A 0047 ARG NH1 7.978 C C 0003 ASP OD2
C A 0047 ARG NH2 10.02 C C 0003 ASP OD1
C A 0047 ARG NH2 8.113 C C 0003 ASP OD2
C A 0047 ARG NH1 10.28 C C 0012 ASP OD1
C A 0047 ARG NH1 9.891 C C 0012 ASP OD2
C A 0047 ARG NH2 9.101 C C 0012 ASP OD1
C A 0047 ARG NH2 8.383 C C 0012 ASP OD2
C A 0047 ARG NH1 4.743 C C 0013 GLU OE1
C A 0047 ARG NH1 3.294 C C 0013 GLU OE2
C A 0047 ARG NH2 5.541 C C 0013 GLU OE1
C A 0047 ARG NH2 4.163 C C 0013 GLU OE2
C A 0047 ARG NH2 11.51 C C 0014 ASP OD1
CHARGE_REPU 2.00 12.00 14
C A 0045 ASP OD1 6.848 C C 0003 ASP OD1
C A 0045 ASP OD1 5.742 C C 0003 ASP OD2
C A 0045 ASP OD2 5.768 C C 0003 ASP OD1
C A 0045 ASP OD2 4.315 C C 0003 ASP OD2
C A 0045 ASP OD1 11.48 C C 0005 ASP OD2
C A 0045 ASP OD2 10.42 C C 0005 ASP OD1
C A 0045 ASP OD2 9.404 C C 0005 ASP OD2
C A 0045 ASP OD2 11.49 C C 0006 ASP OD1
C A 0045 ASP OD2 11.14 C C 0006 ASP OD2
C A 0045 ASP OD1 7.566 C C 0013 GLU OE1
C A 0045 ASP OD1 6.286 C C 0013 GLU OE2
C A 0045 ASP OD2 9.117 C C 0013 GLU OE1
C A 0045 ASP OD2 7.496 C C 0013 GLU OE2
E A 0048 GLU OE2 11.70 C C 0013 GLU OE1
HB_MS 2.00 3.20 1
C A 0045 ASP N 3.174 C C 0003 ASP OD2
HB_SS 2.00 3.20 2
C A 0044 SER OG 3.085 C C 0003 ASP OD1
C A 0044 SER OG 2.972 C C 0003 ASP OD2
AROMATIC 0.00 8.00 1
C A 0047 ARG 7.315 C C 0015 TYR
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 298
C B 0002 ALA C 2.432 C B 0003 LYS CA
C B 0002 ALA C 3.558 C B 0003 LYS C
C B 0002 ALA C 3.397 C B 0003 LYS CB
C B 0002 ALA C 3.240 C B 0003 LYS CG
C B 0002 ALA C 3.488 C B 0003 LYS CD
C B 0003 LYS C 2.420 C B 0004 GLU CA
C B 0003 LYS C 3.620 C B 0004 GLU C
C B 0003 LYS C 3.266 C B 0004 GLU CB
C B 0003 LYS C 3.032 C B 0004 GLU CG
C B 0004 GLU C 2.431 C B 0005 LEU CA
C B 0004 GLU C 3.562 C B 0005 LEU C
C B 0004 GLU C 3.375 C B 0005 LEU CB
C B 0004 GLU C 3.379 C B 0005 LEU CG
C B 0005 LEU C 2.419 C B 0006 ARG CA
C B 0005 LEU C 3.301 C B 0006 ARG C
C B 0005 LEU C 3.610 C B 0006 ARG CB
C B 0005 LEU C 3.669 C B 0006 ARG CG
C B 0005 LEU C 3.497 C B 0006 ARG CD
C B 0005 LEU CB 3.712 C B 0033 HIS CA
C B 0006 ARG C 2.420 C B 0007 CYS CA
C B 0006 ARG C 2.983 C B 0007 CYS C
C B 0006 ARG C 3.689 C B 0007 CYS CB
C B 0007 CYS C 2.410 C B 0008 GLN CA
C B 0007 CYS C 2.975 C B 0008 GLN C
C B 0007 CYS C 3.689 C B 0008 GLN CB
C B 0007 CYS CA 3.471 C B 0033 HIS CD2
C B 0007 CYS C 3.488 C B 0033 HIS CD2
C B 0007 CYS CB 3.733 E B 0038 GLU CD
C B 0008 GLN C 2.434 C B 0009 CYS CA
C B 0008 GLN C 3.503 C B 0009 CYS C
C B 0008 GLN C 3.454 C B 0009 CYS CB
C B 0008 GLN CG 3.457 C B 0033 HIS CD2
C B 0009 CYS C 2.417 C B 0010 ILE CA
C B 0009 CYS C 3.247 C B 0010 ILE C
C B 0009 CYS C 3.619 C B 0010 ILE CB
C B 0009 CYS C 3.739 C B 0010 ILE CG1
C B 0009 CYS CB 3.638 E B 0038 GLU CD
C B 0009 CYS CB 3.645 E B 0050 CYS CB
C B 0010 ILE C 2.433 C B 0011 LYS CA
C B 0010 ILE C 3.482 C B 0011 LYS C
C B 0010 ILE C 3.473 C B 0011 LYS CB
C B 0011 LYS C 2.428 C B 0012 THR CA
C B 0011 LYS C 3.594 C B 0012 THR C
C B 0011 LYS C 3.339 C B 0012 THR CB
C B 0011 LYS C 3.328 C B 0012 THR CG2
C B 0012 THR C 2.425 C B 0013 TYR CA
C B 0012 THR C 3.339 C B 0013 TYR C
C B 0012 THR C 3.576 C B 0013 TYR CB
C B 0012 THR CG2 3.752 C B 0052 ASP CB
C B 0013 TYR C 2.425 C B 0014 SER CA
C B 0013 TYR C 3.323 C B 0014 SER C
C B 0013 TYR C 3.591 C B 0014 SER CB
C B 0013 TYR CE2 3.612 C B 0015 LYS CB
C B 0013 TYR CD1 3.461 E B 0049 LEU CD2
C B 0013 TYR CE1 3.389 E B 0049 LEU CD2
C B 0014 SER C 2.422 C B 0015 LYS CA
C B 0014 SER C 3.635 C B 0015 LYS C
C B 0014 SER C 3.278 C B 0015 LYS CB
C B 0015 LYS CA 2.921 C B 0016 PRO CD
C B 0015 LYS C 2.445 C B 0016 PRO CA
C B 0015 LYS C 3.011 C B 0016 PRO C
C B 0015 LYS C 3.672 C B 0016 PRO CB
C B 0015 LYS C 3.693 C B 0016 PRO CG
C B 0015 LYS C 2.497 C B 0016 PRO CD
C B 0016 PRO C 2.428 C B 0017 PHE CA
C B 0016 PRO C 3.607 C B 0017 PHE C
C B 0016 PRO C 3.318 C B 0017 PHE CB
C B 0016 PRO CA 3.559 H B 0057 TRP CE3
C B 0016 PRO CA 3.639 H B 0057 TRP CZ3
C B 0016 PRO CB 3.771 H B 0057 TRP CG
C B 0016 PRO CB 3.602 H B 0057 TRP CD2
C B 0016 PRO CB 3.649 H B 0057 TRP CE3
C B 0017 PHE C 2.437 C B 0018 HIS CA
C B 0017 PHE C 3.479 C B 0018 HIS C
C B 0017 PHE C 3.483 C B 0018 HIS CB
C B 0017 PHE CD1 3.707 C B 0018 HIS C
C B 0017 PHE CD1 3.683 E B 0022 ILE CD1
C B 0017 PHE CE1 3.511 E B 0022 ILE CG1
C B 0017 PHE CE1 3.082 E B 0022 ILE CD1
C B 0017 PHE CZ 3.777 E B 0022 ILE CD1
C B 0017 PHE CE2 3.796 E B 0051 LEU CD2
C B 0017 PHE CZ 3.773 E B 0051 LEU CD1
C B 0018 HIS CA 2.937 H B 0019 PRO CD
C B 0018 HIS C 2.449 H B 0019 PRO CA
C B 0018 HIS C 2.985 H B 0019 PRO C
C B 0018 HIS C 3.676 H B 0019 PRO CB
C B 0018 HIS C 3.700 H B 0019 PRO CG
C B 0018 HIS C 2.505 H B 0019 PRO CD
C B 0018 HIS CB 3.743 H B 0019 PRO CD
C B 0018 HIS CG 3.339 H B 0019 PRO CD
C B 0018 HIS CE1 3.612 H B 0019 PRO CD
H B 0019 PRO C 2.423 H B 0020 LYS CA
H B 0019 PRO C 2.906 H B 0020 LYS C
H B 0019 PRO C 3.682 H B 0020 LYS CB
H B 0019 PRO CG 3.563 H B 0064 LYS CB
H B 0020 LYS C 2.422 H B 0021 PHE CA
H B 0020 LYS C 3.252 H B 0021 PHE C
H B 0020 LYS C 3.617 H B 0021 PHE CB
H B 0021 PHE C 2.418 E B 0022 ILE CA
H B 0021 PHE C 3.257 E B 0022 ILE C
H B 0021 PHE C 3.639 E B 0022 ILE CB
H B 0021 PHE C 3.639 E B 0022 ILE CD1
E B 0022 ILE C 2.427 E B 0023 LYS CA
E B 0022 ILE C 3.476 E B 0023 LYS C
E B 0022 ILE C 3.466 E B 0023 LYS CB
E B 0022 ILE C 3.677 E B 0023 LYS CG
E B 0022 ILE CG1 3.636 E B 0041 VAL CG2
E B 0022 ILE CG2 3.467 E B 0041 VAL CG2
E B 0022 ILE CD1 3.668 E B 0043 LEU CD1
E B 0023 LYS C 2.430 E B 0024 GLU CA
E B 0023 LYS C 3.597 E B 0024 GLU C
E B 0023 LYS C 3.338 E B 0024 GLU CB
E B 0023 LYS CG 3.652 C B 0044 SER CB
E B 0024 GLU C 2.431 E B 0025 LEU CA
E B 0024 GLU C 3.405 E B 0025 LEU C
E B 0024 GLU C 3.542 E B 0025 LEU CB
E B 0024 GLU CB 3.768 E B 0042 LYS CB
E B 0025 LEU C 2.419 E B 0026 ARG CA
E B 0025 LEU C 3.621 E B 0026 ARG C
E B 0025 LEU C 3.258 E B 0026 ARG CB
E B 0025 LEU C 3.557 E B 0026 ARG CG
E B 0025 LEU CB 3.546 H B 0065 PHE CE2
E B 0026 ARG C 2.434 E B 0027 VAL CA
E B 0026 ARG C 3.509 E B 0027 VAL C
E B 0026 ARG C 3.451 E B 0027 VAL CB
E B 0026 ARG C 3.377 E B 0027 VAL CG2
E B 0027 VAL C 2.433 E B 0028 ILE CA
E B 0027 VAL C 3.471 E B 0028 ILE C
E B 0027 VAL C 3.486 E B 0028 ILE CB
E B 0027 VAL C 3.573 E B 0028 ILE CG1
E B 0028 ILE C 2.421 C B 0029 GLU CA
E B 0028 ILE C 3.134 C B 0029 GLU C
E B 0028 ILE C 3.665 C B 0029 GLU CB
E B 0028 ILE CD1 3.483 E B 0040 ILE CD1
C B 0029 GLU C 2.430 C B 0030 SER CA
C B 0029 GLU C 2.843 C B 0030 SER C
C B 0029 GLU C 3.670 C B 0030 SER CB
C B 0030 SER C 2.433 C B 0031 GLY CA
C B 0030 SER C 3.509 C B 0031 GLY C
C B 0030 SER CB 3.740 C B 0035 ALA CA
C B 0030 SER CB 3.413 C B 0035 ALA C
C B 0030 SER CA 3.721 C B 0036 ASN C
C B 0030 SER CB 3.745 C B 0036 ASN C
C B 0031 GLY CA 2.798 C B 0032 PRO CD
C B 0031 GLY C 2.433 C B 0032 PRO CA
C B 0031 GLY C 3.028 C B 0032 PRO C
C B 0031 GLY C 3.649 C B 0032 PRO CB
C B 0031 GLY C 3.656 C B 0032 PRO CG
C B 0031 GLY C 2.452 C B 0032 PRO CD
C B 0032 PRO C 2.430 C B 0033 HIS CA
C B 0032 PRO C 3.478 C B 0033 HIS C
C B 0032 PRO C 3.456 C B 0033 HIS CB
C B 0033 HIS C 2.424 C B 0034 CYS CA
C B 0033 HIS C 3.588 C B 0034 CYS C
C B 0033 HIS C 3.325 C B 0034 CYS CB
C B 0033 HIS CE1 3.619 C B 0034 CYS CB
C B 0034 CYS C 2.419 C B 0035 ALA CA
C B 0034 CYS C 3.305 C B 0035 ALA C
C B 0034 CYS C 3.592 C B 0035 ALA CB
C B 0035 ALA C 2.424 C B 0036 ASN CA
C B 0035 ALA C 3.608 C B 0036 ASN C
C B 0035 ALA C 3.299 C B 0036 ASN CB
C B 0035 ALA C 3.101 C B 0036 ASN CG
C B 0036 ASN C 2.419 C B 0037 THR CA
C B 0036 ASN C 3.540 C B 0037 THR C
C B 0036 ASN C 3.373 C B 0037 THR CB
C B 0037 THR C 2.425 E B 0038 GLU CA
C B 0037 THR C 3.590 E B 0038 GLU C
C B 0037 THR C 3.325 E B 0038 GLU CB
C B 0037 THR C 3.072 E B 0038 GLU CG
E B 0038 GLU C 2.422 E B 0039 ILE CA
E B 0038 GLU C 3.320 E B 0039 ILE C
E B 0038 GLU C 3.589 E B 0039 ILE CB
E B 0039 ILE C 2.417 E B 0040 ILE CA
E B 0039 ILE C 3.227 E B 0040 ILE C
E B 0039 ILE C 3.627 E B 0040 ILE CB
E B 0040 ILE C 2.412 E B 0041 VAL CA
E B 0040 ILE C 3.644 E B 0041 VAL C
E B 0040 ILE C 3.200 E B 0041 VAL CB
E B 0041 VAL C 2.437 E B 0042 LYS CA
E B 0041 VAL C 3.561 E B 0042 LYS C
E B 0041 VAL C 3.403 E B 0042 LYS CB
E B 0042 LYS C 2.428 E B 0043 LEU CA
E B 0042 LYS C 3.271 E B 0043 LEU C
E B 0042 LYS C 3.625 E B 0043 LEU CB
E B 0042 LYS C 3.312 E B 0043 LEU CD1
E B 0043 LEU C 2.434 C B 0044 SER CA
E B 0043 LEU C 2.925 C B 0044 SER C
E B 0043 LEU C 3.684 C B 0044 SER CB
E B 0043 LEU CB 3.326 C B 0045 ASP CG
E B 0043 LEU CD1 3.700 E B 0049 LEU CD1
E B 0043 LEU CD2 3.684 E B 0049 LEU CD1
C B 0044 SER C 2.414 C B 0045 ASP CA
C B 0044 SER C 2.961 C B 0045 ASP C
C B 0044 SER C 3.683 C B 0045 ASP CB
C B 0045 ASP C 2.411 C B 0046 GLY CA
C B 0045 ASP C 3.216 C B 0046 GLY C
C B 0045 ASP CG 3.569 E B 0047 ARG CG
C B 0045 ASP CG 3.304 E B 0047 ARG CD
C B 0046 GLY C 2.433 E B 0047 ARG CA
C B 0046 GLY C 3.442 E B 0047 ARG C
C B 0046 GLY C 3.515 E B 0047 ARG CB
C B 0046 GLY C 3.541 E B 0047 ARG CG
E B 0047 ARG C 2.424 E B 0048 GLU CA
E B 0047 ARG C 3.588 E B 0048 GLU C
E B 0047 ARG C 3.327 E B 0048 GLU CB
E B 0048 GLU C 2.429 E B 0049 LEU CA
E B 0048 GLU C 3.540 E B 0049 LEU C
E B 0048 GLU C 3.403 E B 0049 LEU CB
E B 0048 GLU C 3.380 E B 0049 LEU CG
E B 0049 LEU C 2.429 E B 0050 CYS CA
E B 0049 LEU C 3.563 E B 0050 CYS C
E B 0049 LEU C 3.368 E B 0050 CYS CB
E B 0050 CYS C 2.426 E B 0051 LEU CA
E B 0050 CYS C 3.383 E B 0051 LEU C
E B 0050 CYS C 3.552 E B 0051 LEU CB
E B 0050 CYS C 3.560 E B 0051 LEU CG
E B 0050 CYS C 3.486 E B 0051 LEU CD2
E B 0051 LEU C 2.423 C B 0052 ASP CA
E B 0051 LEU C 3.390 C B 0052 ASP C
E B 0051 LEU C 3.547 C B 0052 ASP CB
C B 0052 ASP CA 2.935 C B 0053 PRO CD
C B 0052 ASP C 2.439 C B 0053 PRO CA
C B 0052 ASP C 2.981 C B 0053 PRO C
C B 0052 ASP C 3.670 C B 0053 PRO CB
C B 0052 ASP C 3.696 C B 0053 PRO CG
C B 0052 ASP C 2.500 C B 0053 PRO CD
C B 0052 ASP CG 3.728 C B 0054 LYS CB
C B 0053 PRO CA 3.797 C B 0054 LYS CA
C B 0053 PRO C 2.411 C B 0054 LYS CA
C B 0053 PRO C 3.116 C B 0054 LYS C
C B 0053 PRO C 3.658 C B 0054 LYS CB
C B 0054 LYS C 2.428 C B 0055 GLU CA
C B 0054 LYS C 3.340 C B 0055 GLU C
C B 0054 LYS C 3.583 C B 0055 GLU CB
C B 0054 LYS C 3.675 C B 0055 GLU CG
C B 0055 GLU C 2.416 H B 0056 ASN CA
C B 0055 GLU C 3.039 H B 0056 ASN C
C B 0055 GLU C 3.680 H B 0056 ASN CB
C B 0055 GLU CB 3.577 H B 0057 TRP CD1
C B 0055 GLU CB 3.705 H B 0057 TRP CE2
H B 0056 ASN C 2.410 H B 0057 TRP CA
H B 0056 ASN C 2.986 H B 0057 TRP C
H B 0056 ASN C 3.706 H B 0057 TRP CB
H B 0057 TRP C 2.404 H B 0058 VAL CA
H B 0057 TRP C 3.071 H B 0058 VAL C
H B 0057 TRP C 3.668 H B 0058 VAL CB
H B 0057 TRP CD2 3.735 H B 0058 VAL CG2
H B 0057 TRP CE2 3.646 H B 0058 VAL CG2
H B 0057 TRP CE3 3.573 H B 0058 VAL CA
H B 0057 TRP CE3 3.552 H B 0058 VAL CG2
H B 0057 TRP CZ2 3.372 H B 0058 VAL CG2
H B 0057 TRP CZ3 3.267 H B 0058 VAL CG2
H B 0057 TRP CH2 3.173 H B 0058 VAL CG2
H B 0058 VAL CA 3.783 H B 0059 GLN CA
H B 0058 VAL C 2.403 H B 0059 GLN CA
H B 0058 VAL C 3.012 H B 0059 GLN C
H B 0058 VAL C 3.667 H B 0059 GLN CB
H B 0059 GLN C 2.420 H B 0060 ARG CA
H B 0059 GLN C 3.233 H B 0060 ARG C
H B 0059 GLN C 3.631 H B 0060 ARG CB
H B 0060 ARG C 2.409 H B 0061 VAL CA
H B 0060 ARG C 2.919 H B 0061 VAL C
H B 0060 ARG C 3.685 H B 0061 VAL CB
H B 0061 VAL C 2.409 H B 0062 VAL CA
H B 0061 VAL C 3.070 H B 0062 VAL C
H B 0061 VAL C 3.670 H B 0062 VAL CB
H B 0062 VAL C 2.419 H B 0063 GLU CA
H B 0062 VAL C 2.960 H B 0063 GLU C
H B 0062 VAL C 3.693 H B 0063 GLU CB
H B 0063 GLU CA 3.799 H B 0064 LYS CA
H B 0063 GLU C 2.411 H B 0064 LYS CA
H B 0063 GLU C 2.973 H B 0064 LYS C
H B 0063 GLU C 3.685 H B 0064 LYS CB
H B 0064 LYS C 2.412 H B 0065 PHE CA
H B 0064 LYS C 2.916 H B 0065 PHE C
H B 0064 LYS C 3.682 H B 0065 PHE CB
H B 0065 PHE C 2.418 H B 0066 LEU CA
H B 0065 PHE C 3.023 H B 0066 LEU C
H B 0065 PHE C 3.684 H B 0066 LEU CB
H B 0066 LEU C 2.418 H B 0067 LYS CA
H B 0066 LEU C 3.032 H B 0067 LYS C
H B 0066 LEU C 3.683 H B 0067 LYS CB
H B 0067 LYS C 2.418 H B 0068 ARG CA
H B 0067 LYS C 3.170 H B 0068 ARG C
H B 0067 LYS C 3.652 H B 0068 ARG CB
H B 0068 ARG C 2.416 H B 0069 ALA CA
H B 0068 ARG C 3.044 H B 0069 ALA C
H B 0068 ARG C 3.681 H B 0069 ALA CB
H B 0069 ALA C 2.416 H B 0070 GLU CA
H B 0069 ALA C 3.166 H B 0070 GLU C
H B 0069 ALA C 3.650 H B 0070 GLU CB
H B 0070 GLU C 2.418 C B 0071 ASN CA
H B 0070 GLU C 3.056 C B 0071 ASN C
H B 0070 GLU C 3.679 C B 0071 ASN CB
C B 0071 ASN C 2.418 C B 0072 SER CA
C B 0071 ASN C 2.961 C B 0072 SER C
C B 0071 ASN C 3.688 C B 0072 SER CB
CHARGE_ATTR 2.00 12.00 59
C B 0004 GLU OE1 7.113 C B 0003 LYS NZ
C B 0004 GLU OE2 7.178 C B 0003 LYS NZ
C B 0004 GLU OE1 4.286 C B 0006 ARG NH1
C B 0004 GLU OE1 5.859 C B 0006 ARG NH2
C B 0004 GLU OE2 6.270 C B 0006 ARG NH1
C B 0004 GLU OE2 7.983 C B 0006 ARG NH2
E B 0024 GLU OE1 11.48 E B 0023 LYS NZ
E B 0024 GLU OE1 5.468 E B 0026 ARG NH1
E B 0024 GLU OE1 7.250 E B 0026 ARG NH2
E B 0024 GLU OE2 6.000 E B 0026 ARG NH1
E B 0024 GLU OE2 7.207 E B 0026 ARG NH2
E B 0024 GLU OE1 4.134 E B 0042 LYS NZ
E B 0024 GLU OE2 5.977 E B 0042 LYS NZ
C B 0029 GLU OE1 10.95 C B 0033 HIS ND1
C B 0029 GLU OE1 11.12 C B 0033 HIS NE2
C B 0029 GLU OE2 11.06 C B 0033 HIS ND1
C B 0029 GLU OE2 11.43 C B 0033 HIS NE2
E B 0038 GLU OE1 11.40 E B 0026 ARG NH1
E B 0038 GLU OE1 10.08 E B 0026 ARG NH2
E B 0038 GLU OE1 6.408 C B 0033 HIS ND1
E B 0038 GLU OE1 4.588 C B 0033 HIS NE2
E B 0038 GLU OE2 7.541 C B 0033 HIS ND1
E B 0038 GLU OE2 6.078 C B 0033 HIS NE2
C B 0045 ASP OD2 11.71 H B 0020 LYS NZ
C B 0045 ASP OD1 11.50 E B 0023 LYS NZ
C B 0045 ASP OD2 11.15 E B 0023 LYS NZ
C B 0045 ASP OD1 11.71 E B 0026 ARG NH1
C B 0045 ASP OD1 8.911 E B 0042 LYS NZ
C B 0045 ASP OD2 10.94 E B 0042 LYS NZ
C B 0045 ASP OD1 5.870 E B 0047 ARG NH1
C B 0045 ASP OD1 6.374 E B 0047 ARG NH2
C B 0045 ASP OD2 5.549 E B 0047 ARG NH1
C B 0045 ASP OD2 6.798 E B 0047 ARG NH2
E B 0048 GLU OE1 5.170 E B 0026 ARG NH1
E B 0048 GLU OE1 6.628 E B 0026 ARG NH2
E B 0048 GLU OE2 5.611 E B 0026 ARG NH1
E B 0048 GLU OE2 6.404 E B 0026 ARG NH2
E B 0048 GLU OE2 11.86 C B 0033 HIS NE2
E B 0048 GLU OE1 5.614 E B 0042 LYS NZ
E B 0048 GLU OE2 7.526 E B 0042 LYS NZ
E B 0048 GLU OE1 11.38 E B 0047 ARG NH1
E B 0048 GLU OE1 10.01 E B 0047 ARG NH2
E B 0048 GLU OE2 10.76 E B 0047 ARG NH2
C B 0052 ASP OD2 11.88 C B 0011 LYS NZ
C B 0052 ASP OD1 6.790 C B 0054 LYS NZ
C B 0052 ASP OD2 7.032 C B 0054 LYS NZ
C B 0055 GLU OE2 11.53 C B 0015 LYS NZ
C B 0055 GLU OE1 9.335 C B 0054 LYS NZ
C B 0055 GLU OE2 9.958 C B 0054 LYS NZ
H B 0063 GLU OE1 8.285 H B 0060 ARG NH1
H B 0063 GLU OE1 6.934 H B 0060 ARG NH2
H B 0063 GLU OE2 10.39 H B 0060 ARG NH1
H B 0063 GLU OE2 9.090 H B 0060 ARG NH2
H B 0063 GLU OE1 9.091 H B 0064 LYS NZ
H B 0063 GLU OE2 10.83 H B 0064 LYS NZ
H B 0063 GLU OE1 7.305 H B 0067 LYS NZ
H B 0063 GLU OE2 7.830 H B 0067 LYS NZ
H B 0070 GLU OE1 9.790 H B 0067 LYS NZ
H B 0070 GLU OE2 8.192 H B 0067 LYS NZ
CHARGE_REPU 2.00 12.00 56
C B 0003 LYS NZ 10.27 C B 0006 ARG NH1
C B 0003 LYS NZ 10.75 C B 0006 ARG NH2
C B 0015 LYS NZ 11.84 E B 0047 ARG NH1
C B 0018 HIS ND1 6.818 H B 0020 LYS NZ
C B 0018 HIS NE2 7.617 H B 0020 LYS NZ
C B 0018 HIS ND1 10.27 E B 0023 LYS NZ
C B 0018 HIS NE2 11.78 E B 0023 LYS NZ
C B 0018 HIS NE2 11.20 H B 0060 ARG NH1
C B 0018 HIS NE2 11.33 H B 0060 ARG NH2
C B 0018 HIS ND1 6.298 H B 0064 LYS NZ
C B 0018 HIS NE2 4.561 H B 0064 LYS NZ
C B 0018 HIS ND1 6.309 H B 0068 ARG NH1
C B 0018 HIS ND1 7.596 H B 0068 ARG NH2
C B 0018 HIS NE2 6.342 H B 0068 ARG NH1
C B 0018 HIS NE2 8.068 H B 0068 ARG NH2
H B 0020 LYS NZ 9.803 E B 0023 LYS NZ
H B 0020 LYS NZ 11.96 H B 0064 LYS NZ
H B 0020 LYS NZ 8.421 H B 0068 ARG NH1
H B 0020 LYS NZ 8.218 H B 0068 ARG NH2
E B 0023 LYS NZ 7.989 H B 0068 ARG NH1
E B 0023 LYS NZ 6.180 H B 0068 ARG NH2
E B 0024 GLU OE1 10.30 C B 0045 ASP OD1
E B 0024 GLU OE1 11.89 C B 0045 ASP OD2
E B 0024 GLU OE1 8.448 E B 0048 GLU OE1
E B 0024 GLU OE1 9.866 E B 0048 GLU OE2
E B 0024 GLU OE2 9.980 E B 0048 GLU OE1
E B 0024 GLU OE2 11.12 E B 0048 GLU OE2
E B 0026 ARG NH1 11.66 C B 0033 HIS NE2
E B 0026 ARG NH2 11.25 C B 0033 HIS ND1
E B 0026 ARG NH2 9.712 C B 0033 HIS NE2
E B 0026 ARG NH1 5.081 E B 0042 LYS NZ
E B 0026 ARG NH2 7.193 E B 0042 LYS NZ
C B 0029 GLU OE1 11.84 E B 0038 GLU OE1
E B 0038 GLU OE1 10.87 E B 0048 GLU OE2
E B 0038 GLU OE1 9.761 C B 0052 ASP OD1
E B 0038 GLU OE1 10.21 C B 0052 ASP OD2
E B 0038 GLU OE2 8.316 C B 0052 ASP OD1
E B 0038 GLU OE2 8.634 C B 0052 ASP OD2
C B 0045 ASP OD1 9.103 E B 0048 GLU OE1
C B 0045 ASP OD1 10.63 E B 0048 GLU OE2
C B 0045 ASP OD2 11.11 E B 0048 GLU OE1
C B 0052 ASP OD1 7.550 C B 0055 GLU OE1
C B 0052 ASP OD1 6.904 C B 0055 GLU OE2
C B 0052 ASP OD2 7.086 C B 0055 GLU OE1
C B 0052 ASP OD2 6.062 C B 0055 GLU OE2
H B 0060 ARG NH1 7.884 H B 0064 LYS NZ
H B 0060 ARG NH2 7.357 H B 0064 LYS NZ
H B 0060 ARG NH2 10.10 H B 0067 LYS NZ
H B 0063 GLU OE1 11.52 H B 0070 GLU OE1
H B 0063 GLU OE1 11.21 H B 0070 GLU OE2
H B 0063 GLU OE2 10.05 H B 0070 GLU OE1
H B 0063 GLU OE2 10.01 H B 0070 GLU OE2
H B 0064 LYS NZ 9.024 H B 0067 LYS NZ
H B 0064 LYS NZ 8.200 H B 0068 ARG NH1
H B 0064 LYS NZ 10.43 H B 0068 ARG NH2
H B 0067 LYS NZ 11.85 H B 0068 ARG NH1
HB_MM 2.00 3.20 115
C B 0003 LYS N 2.224 C B 0002 ALA O
C B 0004 GLU N 2.216 C B 0003 LYS O
C B 0005 LEU N 2.223 C B 0004 GLU O
C B 0006 ARG N 2.217 C B 0005 LEU O
C B 0007 CYS N 2.219 C B 0006 ARG O
C B 0008 GLN N 2.213 C B 0007 CYS O
C B 0009 CYS N 3.144 C B 0007 CYS O
C B 0009 CYS N 2.226 C B 0008 GLN O
C B 0010 ILE N 2.217 C B 0009 CYS O
C B 0011 LYS N 2.226 C B 0010 ILE O
C B 0012 THR N 2.221 C B 0011 LYS O
C B 0013 TYR N 2.220 C B 0012 THR O
C B 0013 TYR N 2.929 E B 0050 CYS O
C B 0014 SER N 2.219 C B 0013 TYR O
C B 0015 LYS N 2.217 C B 0014 SER O
C B 0016 PRO N 2.233 C B 0015 LYS O
C B 0017 PHE N 2.225 C B 0016 PRO O
C B 0018 HIS N 2.222 C B 0017 PHE O
H B 0019 PRO N 2.238 C B 0018 HIS O
H B 0020 LYS N 2.722 C B 0018 HIS O
H B 0020 LYS N 2.214 H B 0019 PRO O
H B 0021 PHE N 3.083 C B 0018 HIS O
H B 0021 PHE N 2.879 H B 0019 PRO O
H B 0021 PHE N 2.216 H B 0020 LYS O
E B 0022 ILE N 2.626 H B 0019 PRO O
E B 0022 ILE N 2.214 H B 0021 PHE O
E B 0023 LYS N 2.228 E B 0022 ILE O
E B 0024 GLU N 2.225 E B 0023 LYS O
E B 0025 LEU N 2.225 E B 0024 GLU O
E B 0026 ARG N 2.218 E B 0025 LEU O
E B 0026 ARG N 2.798 E B 0040 ILE O
E B 0027 VAL N 2.224 E B 0026 ARG O
E B 0028 ILE N 2.225 E B 0027 VAL O
E B 0028 ILE N 3.054 E B 0038 GLU O
C B 0029 GLU N 2.217 E B 0028 ILE O
C B 0030 SER N 2.222 C B 0029 GLU O
C B 0030 SER N 2.423 C B 0036 ASN O
C B 0031 GLY N 2.987 C B 0029 GLU O
C B 0031 GLY N 2.225 C B 0030 SER O
C B 0031 GLY N 2.478 C B 0034 CYS O
C B 0032 PRO N 2.226 C B 0031 GLY O
C B 0033 HIS N 2.771 C B 0031 GLY O
C B 0033 HIS N 2.223 C B 0032 PRO O
C B 0034 CYS N 2.958 C B 0031 GLY O
C B 0034 CYS N 2.222 C B 0033 HIS O
C B 0035 ALA N 2.218 C B 0034 CYS O
C B 0036 ASN N 2.220 C B 0035 ALA O
C B 0037 THR N 2.205 C B 0036 ASN O
E B 0038 GLU N 3.154 E B 0028 ILE O
E B 0038 GLU N 2.220 C B 0037 THR O
E B 0039 ILE N 2.219 E B 0038 GLU O
E B 0040 ILE N 2.459 E B 0026 ARG O
E B 0040 ILE N 2.217 E B 0039 ILE O
E B 0041 VAL N 2.213 E B 0040 ILE O
E B 0042 LYS N 2.781 E B 0024 GLU O
E B 0042 LYS N 2.227 E B 0041 VAL O
E B 0043 LEU N 2.228 E B 0042 LYS O
E B 0043 LEU N 2.850 E B 0047 ARG O
C B 0044 SER N 2.224 E B 0043 LEU O
C B 0045 ASP N 2.875 E B 0043 LEU O
C B 0045 ASP N 2.211 C B 0044 SER O
C B 0046 GLY N 2.675 E B 0043 LEU O
C B 0046 GLY N 2.650 C B 0044 SER O
C B 0046 GLY N 2.213 C B 0045 ASP O
E B 0047 ARG N 2.225 C B 0046 GLY O
E B 0048 GLU N 2.222 E B 0047 ARG O
E B 0049 LEU N 3.175 E B 0041 VAL O
E B 0049 LEU N 2.223 E B 0048 GLU O
E B 0050 CYS N 2.224 E B 0049 LEU O
E B 0051 LEU N 3.131 E B 0039 ILE O
E B 0051 LEU N 2.222 E B 0050 CYS O
C B 0052 ASP N 2.220 E B 0051 LEU O
C B 0053 PRO N 2.233 C B 0052 ASP O
C B 0054 LYS N 2.619 C B 0052 ASP O
C B 0054 LYS N 2.216 C B 0053 PRO O
C B 0055 GLU N 2.872 C B 0052 ASP O
C B 0055 GLU N 2.223 C B 0054 LYS O
H B 0056 ASN N 2.214 C B 0055 GLU O
H B 0057 TRP N 2.213 H B 0056 ASN O
H B 0058 VAL N 3.161 C B 0055 GLU O
H B 0058 VAL N 3.013 H B 0056 ASN O
H B 0058 VAL N 2.207 H B 0057 TRP O
H B 0059 GLN N 3.041 H B 0056 ASN O
H B 0059 GLN N 2.212 H B 0058 VAL O
H B 0060 ARG N 3.194 H B 0056 ASN O
H B 0060 ARG N 3.138 H B 0058 VAL O
H B 0060 ARG N 2.213 H B 0059 GLN O
H B 0061 VAL N 3.033 H B 0057 TRP O
H B 0061 VAL N 2.217 H B 0060 ARG O
H B 0062 VAL N 3.083 H B 0058 VAL O
H B 0062 VAL N 3.022 H B 0060 ARG O
H B 0062 VAL N 2.215 H B 0061 VAL O
H B 0063 GLU N 3.152 H B 0059 GLN O
H B 0063 GLU N 2.896 H B 0060 ARG O
H B 0063 GLU N 2.221 H B 0062 VAL O
H B 0064 LYS N 2.855 H B 0060 ARG O
H B 0064 LYS N 2.217 H B 0063 GLU O
H B 0065 PHE N 3.110 H B 0062 VAL O
H B 0065 PHE N 2.217 H B 0064 LYS O
H B 0066 LEU N 3.182 H B 0063 GLU O
H B 0066 LEU N 3.195 H B 0064 LYS O
H B 0066 LEU N 2.216 H B 0065 PHE O
H B 0067 LYS N 2.997 H B 0063 GLU O
H B 0067 LYS N 3.077 H B 0064 LYS O
H B 0067 LYS N 2.215 H B 0066 LEU O
H B 0068 ARG N 2.671 H B 0064 LYS O
H B 0068 ARG N 2.216 H B 0067 LYS O
H B 0069 ALA N 2.770 H B 0065 PHE O
H B 0069 ALA N 2.216 H B 0068 ARG O
H B 0070 GLU N 2.917 H B 0066 LEU O
H B 0070 GLU N 2.216 H B 0069 ALA O
C B 0071 ASN N 3.162 H B 0067 LYS O
C B 0071 ASN N 2.215 H B 0070 GLU O
C B 0072 SER N 3.006 H B 0068 ARG O
C B 0072 SER N 2.215 C B 0071 ASN O
HB_MS 2.00 3.20 6
C B 0008 GLN N 3.177 E B 0038 GLU OE1
C B 0009 CYS N 2.782 E B 0038 GLU OE1
C B 0045 ASP N 2.676 C B 0044 SER OG
C B 0046 GLY N 3.007 C B 0045 ASP OD1
E B 0047 ARG N 2.877 C B 0045 ASP OD1
C B 0054 LYS N 3.190 C B 0052 ASP OD1
AROMATIC 0.00 8.00 3
C B 0017 PHE 5.899 H B 0057 TRP
H B 0064 LYS 5.478 C B 0018 HIS
H B 0068 ARG 6.823 C B 0018 HIS
SS_BOND 1.50 2.80 2
C B 0007 CYS SG 2.019 C B 0034 CYS SG
C B 0009 CYS SG 2.019 E B 0050 CYS SG
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "C"
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "C"
AND
CHAIN(S) "C"
HYDROPHOBIC 2.00 3.80 61
C C 0001 MET C 2.490 C C 0002 TRP CA
C C 0001 MET C 3.145 C C 0002 TRP C
C C 0001 MET C 3.724 C C 0002 TRP CB
C C 0002 TRP C 2.483 C C 0003 ASP CA
C C 0002 TRP C 3.053 C C 0003 ASP C
C C 0002 TRP C 3.720 C C 0003 ASP CB
C C 0003 ASP C 2.468 C C 0004 PHE CA
C C 0003 ASP C 3.112 C C 0004 PHE C
C C 0003 ASP C 3.723 C C 0004 PHE CB
C C 0004 PHE C 2.477 C C 0005 ASP CA
C C 0004 PHE C 3.612 C C 0005 ASP C
C C 0004 PHE C 3.358 C C 0005 ASP CB
C C 0004 PHE C 3.374 C C 0005 ASP CG
C C 0004 PHE CD2 3.650 C C 0005 ASP C
C C 0004 PHE CE2 3.675 C C 0006 ASP CG
C C 0004 PHE CZ 3.589 C C 0006 ASP CG
C C 0005 ASP C 2.468 C C 0006 ASP CA
C C 0005 ASP C 3.161 C C 0006 ASP C
C C 0005 ASP C 3.703 C C 0006 ASP CB
C C 0008 MET CA 2.943 C C 0009 PRO CD
C C 0008 MET C 2.486 C C 0009 PRO CA
C C 0008 MET C 3.090 C C 0009 PRO C
C C 0008 MET C 3.684 C C 0009 PRO CB
C C 0008 MET C 3.629 C C 0009 PRO CG
C C 0008 MET C 2.485 C C 0009 PRO CD
C C 0009 PRO CA 2.918 C C 0010 PRO CD
C C 0009 PRO C 2.471 C C 0010 PRO CA
C C 0009 PRO C 3.113 C C 0010 PRO C
C C 0009 PRO C 3.678 C C 0010 PRO CB
C C 0009 PRO C 3.670 C C 0010 PRO CG
C C 0009 PRO C 2.487 C C 0010 PRO CD
C C 0009 PRO CB 2.993 C C 0010 PRO CD
C C 0010 PRO C 2.490 C C 0011 ALA CA
C C 0010 PRO C 3.415 C C 0011 ALA C
C C 0010 PRO C 3.580 C C 0011 ALA CB
C C 0011 ALA C 2.527 C C 0012 ASP CA
C C 0011 ALA C 3.653 C C 0012 ASP C
C C 0011 ALA C 3.320 C C 0012 ASP CB
C C 0011 ALA C 3.251 C C 0012 ASP CG
C C 0012 ASP C 2.417 C C 0013 GLU CA
C C 0012 ASP C 3.717 C C 0013 GLU C
C C 0012 ASP C 3.065 C C 0013 GLU CB
C C 0012 ASP C 3.525 C C 0013 GLU CG
C C 0013 GLU C 2.481 C C 0014 ASP CA
C C 0013 GLU C 3.608 C C 0014 ASP C
C C 0013 GLU C 3.303 C C 0014 ASP CB
C C 0014 ASP C 2.484 C C 0015 TYR CA
C C 0014 ASP C 3.563 C C 0015 TYR C
C C 0014 ASP C 3.436 C C 0015 TYR CB
C C 0014 ASP C 3.409 C C 0015 TYR CG
C C 0014 ASP C 3.390 C C 0015 TYR CD1
C C 0015 TYR C 2.480 C C 0016 SER CA
C C 0015 TYR C 3.484 C C 0016 SER C
C C 0015 TYR C 3.539 C C 0016 SER CB
C C 0015 TYR C 3.480 C C 0017 PRO CD
C C 0016 SER CA 2.948 C C 0017 PRO CD
C C 0016 SER C 2.469 C C 0017 PRO CA
C C 0016 SER C 3.129 C C 0017 PRO C
C C 0016 SER C 3.665 C C 0017 PRO CB
C C 0016 SER C 3.671 C C 0017 PRO CG
C C 0016 SER C 2.493 C C 0017 PRO CD
CHARGE_REPU 2.00 12.00 23
C C 0003 ASP OD1 8.098 C C 0005 ASP OD1
C C 0003 ASP OD1 6.928 C C 0005 ASP OD2
C C 0003 ASP OD2 8.121 C C 0005 ASP OD1
C C 0003 ASP OD2 6.645 C C 0005 ASP OD2
C C 0003 ASP OD1 11.98 C C 0006 ASP OD2
C C 0003 ASP OD2 11.38 C C 0006 ASP OD2
C C 0003 ASP OD2 11.25 C C 0013 GLU OE2
C C 0005 ASP OD1 8.248 C C 0006 ASP OD1
C C 0005 ASP OD1 6.538 C C 0006 ASP OD2
C C 0005 ASP OD2 9.169 C C 0006 ASP OD1
C C 0005 ASP OD2 7.821 C C 0006 ASP OD2
C C 0012 ASP OD1 9.625 C C 0013 GLU OE1
C C 0012 ASP OD1 8.560 C C 0013 GLU OE2
C C 0012 ASP OD2 10.19 C C 0013 GLU OE1
C C 0012 ASP OD2 8.879 C C 0013 GLU OE2
C C 0012 ASP OD1 10.30 C C 0014 ASP OD1
C C 0012 ASP OD1 9.918 C C 0014 ASP OD2
C C 0012 ASP OD2 11.34 C C 0014 ASP OD1
C C 0012 ASP OD2 10.80 C C 0014 ASP OD2
C C 0013 GLU OE1 8.659 C C 0014 ASP OD1
C C 0013 GLU OE1 10.14 C C 0014 ASP OD2
C C 0013 GLU OE2 10.02 C C 0014 ASP OD1
C C 0013 GLU OE2 11.18 C C 0014 ASP OD2
HB_MM 2.00 3.20 16
C C 0002 TRP N 2.259 C C 0001 MET O
C C 0003 ASP N 3.061 C C 0001 MET O
C C 0003 ASP N 2.255 C C 0002 TRP O
C C 0004 PHE N 3.174 C C 0002 TRP O
C C 0004 PHE N 2.256 C C 0003 ASP O
C C 0005 ASP N 2.254 C C 0004 PHE O
C C 0006 ASP N 2.255 C C 0005 ASP O
C C 0009 PRO N 2.253 C C 0008 MET O
C C 0010 PRO N 2.247 C C 0009 PRO O
C C 0011 ALA N 2.274 C C 0010 PRO O
C C 0012 ASP N 2.262 C C 0011 ALA O
C C 0013 GLU N 2.242 C C 0012 ASP O
C C 0014 ASP N 2.261 C C 0013 GLU O
C C 0015 TYR N 2.260 C C 0014 ASP O
C C 0016 SER N 2.259 C C 0015 TYR O
C C 0017 PRO N 2.249 C C 0016 SER O