Complet list of 1vyx con file
Complete list of 1vyx.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 321
C A 0001 MET C 2.424 C A 0002 GLU CA
C A 0001 MET C 3.201 C A 0002 GLU C
C A 0001 MET C 3.596 C A 0002 GLU CB
C A 0002 GLU C 2.424 C A 0003 ASP CA
C A 0002 GLU C 3.017 C A 0003 ASP C
C A 0002 GLU C 3.633 C A 0003 ASP CB
C A 0002 GLU C 3.760 C A 0004 GLU CG
C A 0003 ASP C 2.429 C A 0004 GLU CA
C A 0003 ASP C 2.911 C A 0004 GLU C
C A 0003 ASP C 3.631 C A 0004 GLU CB
C A 0004 GLU C 2.431 C A 0005 ASP CA
C A 0004 GLU C 3.069 C A 0005 ASP C
C A 0004 GLU C 2.797 C A 0005 ASP CB
C A 0005 ASP C 2.421 C A 0006 VAL CA
C A 0005 ASP C 3.376 C A 0006 VAL C
C A 0005 ASP C 3.500 C A 0006 VAL CB
C A 0005 ASP C 3.556 C A 0006 VAL CG2
C A 0006 VAL CA 2.857 C A 0007 PRO CD
C A 0006 VAL C 2.430 C A 0007 PRO CA
C A 0006 VAL C 3.096 C A 0007 PRO C
C A 0006 VAL C 3.610 C A 0007 PRO CB
C A 0006 VAL C 3.620 C A 0007 PRO CG
C A 0006 VAL C 2.484 C A 0007 PRO CD
C A 0006 VAL CB 3.772 E A 0015 GLU CG
C A 0006 VAL CG1 3.727 E A 0015 GLU CB
C A 0006 VAL CG1 3.354 E A 0015 GLU CG
C A 0006 VAL CG1 3.069 C A 0017 GLY CA
C A 0007 PRO C 2.420 E A 0008 VAL CA
C A 0007 PRO C 3.503 E A 0008 VAL C
C A 0007 PRO C 3.386 E A 0008 VAL CB
C A 0007 PRO C 3.239 E A 0008 VAL CG2
C A 0007 PRO C 3.424 C A 0016 LEU CD2
C A 0007 PRO CD 3.685 C A 0017 GLY CA
C A 0007 PRO CB 3.203 H A 0032 ASN CB
C A 0007 PRO CB 3.078 H A 0032 ASN CG
C A 0007 PRO CG 3.466 H A 0032 ASN CB
C A 0007 PRO CG 3.217 H A 0032 ASN CG
E A 0008 VAL C 2.422 E A 0009 CYS CA
E A 0008 VAL C 2.997 E A 0009 CYS C
E A 0008 VAL C 3.641 E A 0009 CYS CB
E A 0008 VAL CG1 3.363 C A 0013 ASN C
E A 0008 VAL CG1 3.332 E A 0014 GLU CA
E A 0008 VAL CG1 2.986 E A 0014 GLU C
E A 0008 VAL CA 3.710 E A 0015 GLU CA
E A 0008 VAL CG2 3.559 E A 0015 GLU CG
E A 0008 VAL CG2 3.021 E A 0015 GLU CD
E A 0008 VAL CA 3.100 C A 0016 LEU CD2
E A 0008 VAL C 2.987 C A 0016 LEU CD2
E A 0009 CYS C 2.431 C A 0010 TRP CA
E A 0009 CYS C 3.060 C A 0010 TRP C
E A 0009 CYS C 3.630 C A 0010 TRP CB
E A 0009 CYS CA 3.593 C A 0016 LEU CD2
E A 0009 CYS CB 3.353 H A 0034 HIS CE1
C A 0010 TRP C 2.421 C A 0011 ILE CA
C A 0010 TRP C 3.199 C A 0011 ILE C
C A 0010 TRP C 3.602 C A 0011 ILE CB
C A 0010 TRP C 3.743 C A 0011 ILE CG1
C A 0010 TRP CD2 3.176 C A 0011 ILE CG1
C A 0010 TRP CE2 2.998 C A 0011 ILE CG1
C A 0010 TRP CE2 3.559 C A 0011 ILE CD1
C A 0010 TRP CE3 3.458 C A 0011 ILE CG1
C A 0010 TRP CZ2 3.148 C A 0011 ILE CG1
C A 0010 TRP CZ2 3.296 C A 0011 ILE CD1
C A 0010 TRP CZ3 3.580 C A 0011 ILE CG1
C A 0010 TRP CH2 3.437 C A 0011 ILE CG1
C A 0010 TRP CH2 3.762 C A 0011 ILE CD1
C A 0010 TRP CB 3.513 H A 0029 GLU CB
C A 0010 TRP CB 3.166 H A 0029 GLU CG
C A 0010 TRP CB 3.195 H A 0029 GLU CD
C A 0010 TRP CG 3.508 H A 0030 LEU CD2
C A 0010 TRP CD1 3.338 H A 0030 LEU CA
C A 0010 TRP CD1 3.410 H A 0030 LEU CD2
C A 0010 TRP CD2 3.207 H A 0030 LEU CD2
C A 0010 TRP CE2 2.930 H A 0030 LEU CD2
C A 0010 TRP CZ2 3.436 H A 0030 LEU CD2
C A 0010 TRP CD1 3.591 C A 0033 VAL CB
C A 0010 TRP CH2 3.764 H A 0041 TRP CZ2
C A 0010 TRP CH2 3.459 H A 0041 TRP CZ3
C A 0010 TRP CH2 3.418 H A 0041 TRP CH2
C A 0011 ILE C 2.421 C A 0012 CYS CA
C A 0011 ILE C 3.321 C A 0012 CYS C
C A 0011 ILE C 3.535 C A 0012 CYS CB
C A 0011 ILE CG1 3.650 C A 0033 VAL CG2
C A 0011 ILE CD1 3.218 C A 0033 VAL CG2
C A 0011 ILE CD1 3.077 H A 0038 LEU CA
C A 0011 ILE CD1 3.076 H A 0038 LEU CB
C A 0011 ILE CD1 3.731 H A 0038 LEU CG
C A 0011 ILE CD1 3.401 H A 0038 LEU CD1
C A 0012 CYS C 2.424 C A 0013 ASN CA
C A 0012 CYS C 2.969 C A 0013 ASN C
C A 0012 CYS C 2.882 C A 0013 ASN CB
C A 0013 ASN C 2.424 E A 0014 GLU CA
C A 0013 ASN C 3.602 E A 0014 GLU C
C A 0013 ASN C 3.245 E A 0014 GLU CB
E A 0014 GLU C 2.423 E A 0015 GLU CA
E A 0014 GLU C 2.982 E A 0015 GLU C
E A 0014 GLU C 3.638 E A 0015 GLU CB
E A 0014 GLU C 3.637 H A 0034 HIS CE1
E A 0014 GLU CB 3.536 H A 0034 HIS CE1
E A 0014 GLU CG 3.481 H A 0034 HIS CE1
E A 0015 GLU C 2.423 C A 0016 LEU CA
E A 0015 GLU C 3.428 C A 0016 LEU C
E A 0015 GLU C 3.457 C A 0016 LEU CB
E A 0015 GLU C 3.531 C A 0016 LEU CD2
C A 0016 LEU C 2.443 C A 0017 GLY CA
C A 0016 LEU C 3.180 C A 0017 GLY C
C A 0016 LEU CD1 3.590 H A 0032 ASN CA
C A 0016 LEU CD1 3.269 H A 0032 ASN C
C A 0016 LEU CD1 3.286 H A 0032 ASN CB
C A 0016 LEU CD1 3.788 C A 0033 VAL CA
C A 0016 LEU CB 3.400 H A 0034 HIS CD2
C A 0017 GLY C 2.429 C A 0018 ASN CA
C A 0017 GLY C 3.718 C A 0018 ASN C
C A 0017 GLY C 2.823 C A 0018 ASN CB
C A 0017 GLY C 3.053 C A 0018 ASN CG
C A 0018 ASN C 2.411 C A 0019 GLU CA
C A 0018 ASN C 2.934 C A 0019 GLU C
C A 0018 ASN C 3.636 C A 0019 GLU CB
C A 0019 GLU C 2.422 C A 0020 ARG CA
C A 0019 GLU C 2.996 C A 0020 ARG C
C A 0019 GLU C 3.643 C A 0020 ARG CB
C A 0020 ARG C 2.426 C A 0021 PHE CA
C A 0020 ARG C 3.639 C A 0021 PHE C
C A 0020 ARG C 3.157 C A 0021 PHE CB
C A 0021 PHE C 2.418 C A 0022 ARG CA
C A 0021 PHE C 3.074 C A 0022 ARG C
C A 0021 PHE C 3.628 C A 0022 ARG CB
C A 0021 PHE CD1 3.735 C A 0022 ARG C
C A 0021 PHE CE1 3.236 C A 0023 ALA CB
C A 0021 PHE CE2 3.381 C A 0023 ALA CB
C A 0021 PHE CZ 2.981 C A 0023 ALA CB
C A 0021 PHE CB 3.686 H A 0035 ARG CB
C A 0021 PHE CG 3.796 H A 0035 ARG CA
C A 0021 PHE CG 3.387 H A 0035 ARG CB
C A 0021 PHE CD2 3.030 H A 0035 ARG CA
C A 0021 PHE CD2 3.217 H A 0035 ARG CB
C A 0021 PHE CE2 3.328 H A 0035 ARG CA
C A 0021 PHE CE2 3.793 H A 0035 ARG CB
C A 0021 PHE CE2 3.583 H A 0038 LEU CB
C A 0021 PHE CE2 3.328 H A 0038 LEU CG
C A 0021 PHE CE2 3.021 H A 0038 LEU CD2
C A 0021 PHE CZ 3.784 H A 0038 LEU CG
C A 0021 PHE CZ 3.573 H A 0038 LEU CD2
C A 0021 PHE CE1 3.518 C A 0059 THR CG2
C A 0021 PHE CZ 3.381 C A 0059 THR CG2
C A 0022 ARG C 2.417 C A 0023 ALA CA
C A 0022 ARG C 3.481 C A 0023 ALA C
C A 0022 ARG C 3.397 C A 0023 ALA CB
C A 0023 ALA C 2.421 C A 0024 CYS CA
C A 0023 ALA C 3.697 C A 0024 CYS C
C A 0023 ALA C 2.800 C A 0024 CYS CB
C A 0023 ALA CB 3.438 H A 0038 LEU CD2
C A 0023 ALA CA 3.372 C A 0057 TYR CA
C A 0023 ALA CA 3.589 C A 0057 TYR C
C A 0023 ALA CB 3.757 C A 0057 TYR CA
C A 0024 CYS C 2.423 C A 0025 GLY CA
C A 0024 CYS C 3.536 C A 0025 GLY C
C A 0024 CYS CB 3.609 H A 0030 LEU CD1
C A 0024 CYS CB 3.647 C A 0050 CYS CB
C A 0024 CYS CA 3.640 C A 0055 VAL CB
C A 0024 CYS CA 3.386 C A 0055 VAL CG1
C A 0025 GLY C 2.423 C A 0026 CYS CA
C A 0025 GLY C 3.113 C A 0026 CYS C
C A 0025 GLY C 3.622 C A 0026 CYS CB
C A 0026 CYS C 2.420 C A 0027 THR CA
C A 0026 CYS C 3.526 C A 0027 THR C
C A 0026 CYS C 3.354 C A 0027 THR CB
C A 0026 CYS CB 3.604 H A 0030 LEU CB
C A 0026 CYS C 3.330 H A 0031 GLU CG
C A 0027 THR C 2.418 H A 0028 GLY CA
C A 0027 THR C 3.586 H A 0028 GLY C
H A 0028 GLY C 2.431 H A 0029 GLU CA
H A 0028 GLY C 2.966 H A 0029 GLU C
H A 0028 GLY C 3.628 H A 0029 GLU CB
H A 0029 GLU C 2.420 H A 0030 LEU CA
H A 0029 GLU C 2.907 H A 0030 LEU C
H A 0029 GLU C 3.630 H A 0030 LEU CB
H A 0030 LEU C 2.411 H A 0031 GLU CA
H A 0030 LEU C 2.889 H A 0031 GLU C
H A 0030 LEU C 3.625 H A 0031 GLU CB
H A 0031 GLU C 2.419 H A 0032 ASN CA
H A 0031 GLU C 3.481 H A 0032 ASN C
H A 0031 GLU C 3.401 H A 0032 ASN CB
H A 0031 GLU C 3.334 H A 0032 ASN CG
H A 0032 ASN C 2.412 C A 0033 VAL CA
H A 0032 ASN C 3.653 C A 0033 VAL C
H A 0032 ASN C 3.121 C A 0033 VAL CB
H A 0032 ASN C 3.657 C A 0033 VAL CG1
C A 0033 VAL C 2.420 H A 0034 HIS CA
C A 0033 VAL C 3.010 H A 0034 HIS C
C A 0033 VAL C 3.647 H A 0034 HIS CB
C A 0033 VAL CG1 3.171 H A 0038 LEU CD2
C A 0033 VAL CG2 3.334 H A 0038 LEU CB
C A 0033 VAL CG2 3.383 H A 0038 LEU CD2
H A 0034 HIS C 2.407 H A 0035 ARG CA
H A 0034 HIS C 3.012 H A 0035 ARG C
H A 0034 HIS C 3.619 H A 0035 ARG CB
H A 0035 ARG C 2.428 H A 0036 SER CA
H A 0035 ARG C 3.054 H A 0036 SER C
H A 0035 ARG C 3.636 H A 0036 SER CB
H A 0036 SER C 2.421 H A 0037 CYS CA
H A 0036 SER C 3.176 H A 0037 CYS C
H A 0036 SER C 3.633 H A 0037 CYS CB
H A 0037 CYS C 2.412 H A 0038 LEU CA
H A 0037 CYS C 3.075 H A 0038 LEU C
H A 0037 CYS C 3.636 H A 0038 LEU CB
H A 0037 CYS CA 3.263 H A 0040 THR CG2
H A 0037 CYS C 3.310 H A 0040 THR CG2
H A 0037 CYS C 3.707 H A 0041 TRP CB
H A 0038 LEU C 2.423 H A 0039 SER CA
H A 0038 LEU C 2.890 H A 0039 SER C
H A 0038 LEU C 3.625 H A 0039 SER CB
H A 0038 LEU CD1 3.113 H A 0041 TRP CE3
H A 0038 LEU CD1 3.506 H A 0041 TRP CZ3
H A 0038 LEU C 3.412 H A 0042 LEU CD2
H A 0038 LEU CD1 3.558 H A 0042 LEU CD2
H A 0039 SER C 2.420 H A 0040 THR CA
H A 0039 SER C 3.110 H A 0040 THR C
H A 0039 SER C 3.624 H A 0040 THR CB
H A 0039 SER CA 3.604 H A 0042 LEU CG
H A 0039 SER CA 3.205 H A 0042 LEU CD2
H A 0039 SER C 3.428 H A 0042 LEU CG
H A 0039 SER C 3.746 H A 0042 LEU CD1
H A 0039 SER C 3.693 H A 0042 LEU CD2
H A 0039 SER CA 3.783 C A 0059 THR CG2
H A 0039 SER CB 3.706 C A 0059 THR CB
H A 0039 SER CB 3.472 C A 0059 THR CG2
H A 0040 THR C 2.422 H A 0041 TRP CA
H A 0040 THR C 2.961 H A 0041 TRP C
H A 0040 THR C 3.642 H A 0041 TRP CB
H A 0040 THR C 3.786 H A 0043 THR CB
H A 0040 THR C 3.505 H A 0044 ILE CD1
H A 0041 TRP C 2.417 H A 0042 LEU CA
H A 0041 TRP C 2.901 H A 0042 LEU C
H A 0041 TRP C 3.651 H A 0042 LEU CB
H A 0041 TRP CE3 3.525 H A 0042 LEU CA
H A 0041 TRP CE3 3.652 H A 0042 LEU CB
H A 0042 LEU C 2.420 H A 0043 THR CA
H A 0042 LEU C 2.994 H A 0043 THR C
H A 0042 LEU C 3.640 H A 0043 THR CB
H A 0042 LEU CA 3.791 C A 0047 ASN CB
H A 0042 LEU CB 3.643 C A 0047 ASN CB
H A 0042 LEU CB 3.788 C A 0057 TYR CE2
H A 0042 LEU CD2 3.782 C A 0057 TYR CB
H A 0042 LEU CD2 3.583 C A 0057 TYR CG
H A 0042 LEU CD2 3.420 C A 0057 TYR CD2
H A 0043 THR C 2.426 H A 0044 ILE CA
H A 0043 THR C 3.106 H A 0044 ILE C
H A 0043 THR C 3.626 H A 0044 ILE CB
H A 0044 ILE C 2.424 H A 0045 SER CA
H A 0044 ILE C 3.140 H A 0045 SER C
H A 0044 ILE C 3.616 H A 0045 SER CB
H A 0045 SER C 2.429 H A 0046 ARG CA
H A 0045 SER C 3.064 H A 0046 ARG C
H A 0045 SER C 2.801 H A 0046 ARG CB
H A 0046 ARG C 2.421 C A 0047 ASN CA
H A 0046 ARG C 3.564 C A 0047 ASN C
H A 0046 ARG C 3.291 C A 0047 ASN CB
H A 0046 ARG C 3.427 C A 0047 ASN CG
C A 0047 ASN C 2.418 C A 0048 THR CA
C A 0047 ASN C 3.486 C A 0048 THR C
C A 0047 ASN C 3.398 C A 0048 THR CB
C A 0047 ASN C 3.314 C A 0048 THR CG2
C A 0047 ASN C 3.584 C A 0057 TYR CE2
C A 0047 ASN CB 3.769 C A 0057 TYR CE2
C A 0048 THR C 2.418 C A 0049 ALA CA
C A 0048 THR C 3.616 C A 0049 ALA C
C A 0048 THR C 3.216 C A 0049 ALA CB
C A 0048 THR CA 3.502 C A 0057 TYR CD2
C A 0048 THR CA 3.614 C A 0057 TYR CE2
C A 0048 THR C 2.873 C A 0057 TYR CD2
C A 0048 THR C 3.035 C A 0057 TYR CE2
C A 0049 ALA C 2.427 C A 0050 CYS CA
C A 0049 ALA C 2.950 C A 0050 CYS C
C A 0049 ALA C 3.641 C A 0050 CYS CB
C A 0049 ALA CA 3.725 C A 0055 VAL C
C A 0049 ALA CB 3.376 C A 0055 VAL C
C A 0049 ALA CA 3.454 C A 0056 VAL CA
C A 0049 ALA CB 3.285 C A 0056 VAL CA
C A 0049 ALA CA 3.663 C A 0057 TYR CD2
C A 0049 ALA CA 3.355 C A 0057 TYR CE2
C A 0049 ALA CA 3.503 C A 0057 TYR CZ
C A 0049 ALA C 3.408 C A 0057 TYR CE1
C A 0049 ALA C 3.353 C A 0057 TYR CE2
C A 0049 ALA C 2.936 C A 0057 TYR CZ
C A 0050 CYS C 2.424 C A 0051 GLN CA
C A 0050 CYS C 3.189 C A 0051 GLN C
C A 0050 CYS C 3.604 C A 0051 GLN CB
C A 0050 CYS CA 3.470 C A 0057 TYR CE1
C A 0050 CYS CA 3.573 C A 0057 TYR CZ
C A 0051 GLN C 2.420 C A 0052 ILE CA
C A 0051 GLN C 3.292 C A 0052 ILE C
C A 0051 GLN C 3.551 C A 0052 ILE CB
C A 0051 GLN C 3.675 C A 0052 ILE CG1
C A 0052 ILE C 2.425 C A 0053 CYS CA
C A 0052 ILE C 3.470 C A 0053 CYS C
C A 0052 ILE C 3.421 C A 0053 CYS CB
C A 0053 CYS C 2.423 C A 0054 GLY CA
C A 0053 CYS C 3.252 C A 0054 GLY C
C A 0054 GLY C 2.423 C A 0055 VAL CA
C A 0054 GLY C 3.379 C A 0055 VAL C
C A 0054 GLY C 3.499 C A 0055 VAL CB
C A 0054 GLY C 3.540 C A 0055 VAL CG2
C A 0055 VAL C 2.422 C A 0056 VAL CA
C A 0055 VAL C 3.091 C A 0056 VAL C
C A 0055 VAL C 3.630 C A 0056 VAL CB
C A 0056 VAL C 2.426 C A 0057 TYR CA
C A 0056 VAL C 3.096 C A 0057 TYR C
C A 0056 VAL C 3.627 C A 0057 TYR CB
C A 0056 VAL CG1 3.691 C A 0058 ASN CG
C A 0057 TYR C 2.424 C A 0058 ASN CA
C A 0057 TYR C 2.898 C A 0058 ASN C
C A 0057 TYR C 2.955 C A 0058 ASN CB
C A 0057 TYR C 3.529 C A 0058 ASN CG
C A 0058 ASN C 2.425 C A 0059 THR CA
C A 0058 ASN C 3.325 C A 0059 THR C
C A 0058 ASN C 3.538 C A 0059 THR CB
C A 0058 ASN C 3.620 C A 0059 THR CG2
C A 0059 THR C 2.423 C A 0060 ARG CA
C A 0059 THR C 3.005 C A 0060 ARG C
C A 0059 THR C 3.640 C A 0060 ARG CB
CHARGE_ATTR 2.00 12.00 27
C A 0003 ASP OD2 11.34 C A 0022 ARG NH2
E A 0014 GLU OE1 6.041 H A 0034 HIS ND1
E A 0014 GLU OE1 5.855 H A 0034 HIS NE2
E A 0014 GLU OE2 4.617 H A 0034 HIS ND1
E A 0014 GLU OE2 4.182 H A 0034 HIS NE2
E A 0015 GLU OE1 8.457 H A 0034 HIS ND1
E A 0015 GLU OE1 7.757 H A 0034 HIS NE2
E A 0015 GLU OE2 10.26 H A 0034 HIS ND1
E A 0015 GLU OE2 9.382 H A 0034 HIS NE2
C A 0019 GLU OE1 6.949 C A 0020 ARG NH1
C A 0019 GLU OE1 8.600 C A 0020 ARG NH2
C A 0019 GLU OE2 4.797 C A 0020 ARG NH1
C A 0019 GLU OE2 6.495 C A 0020 ARG NH2
C A 0019 GLU OE1 5.918 H A 0034 HIS ND1
C A 0019 GLU OE1 4.477 H A 0034 HIS NE2
C A 0019 GLU OE2 7.686 H A 0034 HIS ND1
C A 0019 GLU OE2 6.525 H A 0034 HIS NE2
C A 0019 GLU OE1 8.574 H A 0035 ARG NH1
C A 0019 GLU OE1 9.577 H A 0035 ARG NH2
C A 0019 GLU OE2 6.963 H A 0035 ARG NH1
C A 0019 GLU OE2 7.832 H A 0035 ARG NH2
H A 0029 GLU OE1 10.66 H A 0034 HIS ND1
H A 0029 GLU OE1 11.88 H A 0034 HIS NE2
H A 0031 GLU OE1 8.720 C A 0022 ARG NH1
H A 0031 GLU OE1 8.505 C A 0022 ARG NH2
H A 0031 GLU OE2 7.630 C A 0022 ARG NH1
H A 0031 GLU OE2 7.960 C A 0022 ARG NH2
CHARGE_REPU 2.00 12.00 61
C A 0002 GLU OE1 6.336 C A 0003 ASP OD1
C A 0002 GLU OE1 6.684 C A 0003 ASP OD2
C A 0002 GLU OE2 8.043 C A 0003 ASP OD1
C A 0002 GLU OE2 8.671 C A 0003 ASP OD2
C A 0002 GLU OE1 7.692 C A 0004 GLU OE1
C A 0002 GLU OE1 5.811 C A 0004 GLU OE2
C A 0002 GLU OE2 7.972 C A 0004 GLU OE1
C A 0002 GLU OE2 6.101 C A 0004 GLU OE2
C A 0002 GLU OE1 9.768 C A 0005 ASP OD1
C A 0002 GLU OE1 8.170 C A 0005 ASP OD2
C A 0002 GLU OE2 10.65 C A 0005 ASP OD1
C A 0002 GLU OE2 8.802 C A 0005 ASP OD2
C A 0002 GLU OE1 9.895 H A 0031 GLU OE1
C A 0002 GLU OE1 11.56 H A 0031 GLU OE2
C A 0002 GLU OE2 11.75 H A 0031 GLU OE1
C A 0003 ASP OD1 8.485 C A 0004 GLU OE1
C A 0003 ASP OD1 6.981 C A 0004 GLU OE2
C A 0003 ASP OD2 9.822 C A 0004 GLU OE1
C A 0003 ASP OD2 8.403 C A 0004 GLU OE2
C A 0003 ASP OD1 11.79 C A 0005 ASP OD1
C A 0003 ASP OD1 11.22 C A 0005 ASP OD2
C A 0003 ASP OD2 11.69 C A 0005 ASP OD1
C A 0003 ASP OD2 11.23 C A 0005 ASP OD2
C A 0003 ASP OD1 9.685 H A 0031 GLU OE1
C A 0003 ASP OD1 11.44 H A 0031 GLU OE2
C A 0003 ASP OD2 7.661 H A 0031 GLU OE1
C A 0003 ASP OD2 9.429 H A 0031 GLU OE2
C A 0004 GLU OE1 7.729 C A 0005 ASP OD1
C A 0004 GLU OE1 7.067 C A 0005 ASP OD2
C A 0004 GLU OE2 8.485 C A 0005 ASP OD1
C A 0004 GLU OE2 7.461 C A 0005 ASP OD2
C A 0005 ASP OD1 8.045 E A 0015 GLU OE1
C A 0005 ASP OD1 6.063 E A 0015 GLU OE2
C A 0005 ASP OD2 9.504 E A 0015 GLU OE1
C A 0005 ASP OD2 7.561 E A 0015 GLU OE2
E A 0014 GLU OE1 7.459 E A 0015 GLU OE1
E A 0014 GLU OE1 9.480 E A 0015 GLU OE2
E A 0014 GLU OE2 8.094 E A 0015 GLU OE1
E A 0014 GLU OE2 10.05 E A 0015 GLU OE2
E A 0014 GLU OE1 9.490 C A 0019 GLU OE1
E A 0014 GLU OE1 11.42 C A 0019 GLU OE2
E A 0014 GLU OE2 7.454 C A 0019 GLU OE1
E A 0014 GLU OE2 9.324 C A 0019 GLU OE2
E A 0015 GLU OE1 11.32 C A 0019 GLU OE1
E A 0015 GLU OE1 10.35 H A 0029 GLU OE1
E A 0015 GLU OE2 11.12 H A 0029 GLU OE1
C A 0020 ARG NH1 11.25 H A 0034 HIS NE2
C A 0020 ARG NH1 5.310 H A 0035 ARG NH1
C A 0020 ARG NH1 5.334 H A 0035 ARG NH2
C A 0020 ARG NH2 4.242 H A 0035 ARG NH1
C A 0020 ARG NH2 3.562 H A 0035 ARG NH2
C A 0020 ARG NH1 9.774 C A 0060 ARG NH1
C A 0020 ARG NH1 10.91 C A 0060 ARG NH2
C A 0020 ARG NH2 7.652 C A 0060 ARG NH1
C A 0020 ARG NH2 8.691 C A 0060 ARG NH2
H A 0034 HIS ND1 11.52 H A 0035 ARG NH1
H A 0034 HIS NE2 11.57 H A 0035 ARG NH1
H A 0035 ARG NH1 8.430 C A 0060 ARG NH1
H A 0035 ARG NH1 9.327 C A 0060 ARG NH2
H A 0035 ARG NH2 7.055 C A 0060 ARG NH1
H A 0035 ARG NH2 7.604 C A 0060 ARG NH2
HB_MM 2.00 3.20 92
C A 0002 GLU N 2.197 C A 0001 MET O
C A 0003 ASP N 2.195 C A 0002 GLU O
C A 0004 GLU N 2.869 C A 0002 GLU O
C A 0004 GLU N 2.197 C A 0003 ASP O
C A 0005 ASP N 2.198 C A 0004 GLU O
C A 0006 VAL N 2.195 C A 0005 ASP O
C A 0007 PRO N 2.226 C A 0006 VAL O
E A 0008 VAL N 2.195 C A 0007 PRO O
E A 0009 CYS N 2.199 E A 0008 VAL O
E A 0009 CYS N 2.728 E A 0014 GLU O
C A 0010 TRP N 3.064 E A 0008 VAL O
C A 0010 TRP N 2.195 E A 0009 CYS O
C A 0011 ILE N 3.003 E A 0009 CYS O
C A 0011 ILE N 2.192 C A 0010 TRP O
C A 0012 CYS N 2.194 C A 0011 ILE O
C A 0013 ASN N 2.686 E A 0009 CYS O
C A 0013 ASN N 2.196 C A 0012 CYS O
E A 0014 GLU N 2.196 C A 0013 ASN O
E A 0015 GLU N 2.192 E A 0014 GLU O
C A 0016 LEU N 2.941 C A 0007 PRO O
C A 0016 LEU N 2.200 E A 0015 GLU O
C A 0017 GLY N 2.201 C A 0016 LEU O
C A 0018 ASN N 2.873 C A 0016 LEU O
C A 0018 ASN N 2.194 C A 0017 GLY O
C A 0019 GLU N 2.188 C A 0018 ASN O
C A 0020 ARG N 2.759 C A 0018 ASN O
C A 0020 ARG N 2.197 C A 0019 GLU O
C A 0021 PHE N 2.693 C A 0019 GLU O
C A 0021 PHE N 2.199 C A 0020 ARG O
C A 0022 ARG N 2.194 C A 0021 PHE O
C A 0023 ALA N 2.884 C A 0021 PHE O
C A 0023 ALA N 2.195 C A 0022 ARG O
C A 0024 CYS N 2.196 C A 0023 ALA O
C A 0025 GLY N 2.197 C A 0024 CYS O
C A 0026 CYS N 2.197 C A 0025 GLY O
C A 0027 THR N 2.195 C A 0026 CYS O
H A 0028 GLY N 2.195 C A 0027 THR O
H A 0029 GLU N 2.199 H A 0028 GLY O
H A 0030 LEU N 3.158 H A 0028 GLY O
H A 0030 LEU N 2.195 H A 0029 GLU O
H A 0031 GLU N 3.036 H A 0028 GLY O
H A 0031 GLU N 2.890 H A 0029 GLU O
H A 0031 GLU N 2.190 H A 0030 LEU O
H A 0032 ASN N 2.763 H A 0029 GLU O
H A 0032 ASN N 2.868 H A 0030 LEU O
H A 0032 ASN N 2.195 H A 0031 GLU O
C A 0033 VAL N 2.193 H A 0032 ASN O
H A 0034 HIS N 2.195 C A 0033 VAL O
H A 0035 ARG N 2.190 H A 0034 HIS O
H A 0036 SER N 3.096 H A 0034 HIS O
H A 0036 SER N 2.198 H A 0035 ARG O
H A 0037 CYS N 2.196 H A 0036 SER O
H A 0038 LEU N 3.058 H A 0034 HIS O
H A 0038 LEU N 2.189 H A 0037 CYS O
H A 0039 SER N 3.090 H A 0035 ARG O
H A 0039 SER N 2.198 H A 0038 LEU O
H A 0040 THR N 2.999 H A 0038 LEU O
H A 0040 THR N 2.194 H A 0039 SER O
H A 0041 TRP N 2.680 H A 0037 CYS O
H A 0041 TRP N 2.850 H A 0038 LEU O
H A 0041 TRP N 2.198 H A 0040 THR O
H A 0042 LEU N 2.852 H A 0038 LEU O
H A 0042 LEU N 2.196 H A 0041 TRP O
H A 0043 THR N 3.089 H A 0040 THR O
H A 0043 THR N 2.959 H A 0041 TRP O
H A 0043 THR N 2.198 H A 0042 LEU O
H A 0044 ILE N 2.876 H A 0040 THR O
H A 0044 ILE N 2.777 H A 0041 TRP O
H A 0044 ILE N 2.200 H A 0043 THR O
H A 0045 SER N 2.598 H A 0041 TRP O
H A 0045 SER N 2.199 H A 0044 ILE O
H A 0046 ARG N 2.473 H A 0042 LEU O
H A 0046 ARG N 2.200 H A 0045 SER O
C A 0047 ASN N 2.583 H A 0042 LEU O
C A 0047 ASN N 2.197 H A 0046 ARG O
C A 0048 THR N 2.195 C A 0047 ASN O
C A 0049 ALA N 2.194 C A 0048 THR O
C A 0050 CYS N 2.199 C A 0049 ALA O
C A 0050 CYS N 2.426 C A 0055 VAL O
C A 0051 GLN N 3.156 C A 0049 ALA O
C A 0051 GLN N 2.197 C A 0050 CYS O
C A 0052 ILE N 2.195 C A 0051 GLN O
C A 0053 CYS N 2.196 C A 0052 ILE O
C A 0054 GLY N 2.966 C A 0050 CYS O
C A 0054 GLY N 2.196 C A 0053 CYS O
C A 0055 VAL N 2.196 C A 0054 GLY O
C A 0056 VAL N 2.194 C A 0055 VAL O
C A 0057 TYR N 2.859 C A 0048 THR O
C A 0057 TYR N 2.199 C A 0056 VAL O
C A 0058 ASN N 2.195 C A 0057 TYR O
C A 0059 THR N 2.197 C A 0058 ASN O
C A 0060 ARG N 2.196 C A 0059 THR O
HB_MS 2.00 3.20 4
C A 0006 VAL N 2.979 C A 0005 ASP OD1
H A 0039 SER O 2.443 H A 0043 THR OG1
C A 0049 ALA N 3.017 C A 0048 THR OG1
C A 0049 ALA O 2.633 C A 0057 TYR OH
AROMATIC 0.00 8.00 1
C A 0010 TRP 4.897 H A 0041 TRP