Complet list of 1j3d con file
Complete list of 1j3d.con file
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 352
C A 0001 MET C 2.433 C A 0002 LYS CA
C A 0001 MET C 3.366 C A 0002 LYS C
C A 0001 MET C 3.522 C A 0002 LYS CB
C A 0002 LYS C 2.432 C A 0003 LYS CA
C A 0002 LYS C 3.460 C A 0003 LYS C
C A 0002 LYS C 3.443 C A 0003 LYS CB
C A 0003 LYS C 2.433 C A 0004 ASP CA
C A 0003 LYS C 3.454 C A 0004 ASP C
C A 0003 LYS C 3.453 C A 0004 ASP CB
C A 0004 ASP CA 2.917 C A 0005 PRO CD
C A 0004 ASP C 2.431 C A 0005 PRO CA
C A 0004 ASP C 3.090 C A 0005 PRO C
C A 0004 ASP C 3.621 C A 0005 PRO CB
C A 0004 ASP C 3.640 C A 0005 PRO CG
C A 0004 ASP C 2.510 C A 0005 PRO CD
C A 0004 ASP CB 3.237 C A 0005 PRO CD
C A 0005 PRO C 2.433 C A 0006 ASN CA
C A 0005 PRO C 3.175 C A 0006 ASN C
C A 0005 PRO C 3.617 C A 0006 ASN CB
C A 0006 ASN C 2.439 C A 0007 ALA CA
C A 0006 ASN C 2.987 C A 0007 ALA C
C A 0006 ASN C 3.655 C A 0007 ALA CB
C A 0006 ASN C 3.578 H A 0075 TYR CE2
C A 0007 ALA CA 2.902 C A 0008 PRO CD
C A 0007 ALA C 2.424 C A 0008 PRO CA
C A 0007 ALA C 3.167 C A 0008 PRO C
C A 0007 ALA C 3.588 C A 0008 PRO CB
C A 0007 ALA C 3.634 C A 0008 PRO CG
C A 0007 ALA C 2.497 C A 0008 PRO CD
C A 0007 ALA CB 3.375 C A 0008 PRO CD
C A 0007 ALA CA 3.622 H A 0075 TYR CE2
C A 0008 PRO C 2.439 C A 0009 LYS CA
C A 0008 PRO C 3.039 C A 0009 LYS C
C A 0008 PRO C 3.655 C A 0009 LYS CB
C A 0008 PRO C 3.567 H A 0068 TYR CE1
C A 0008 PRO CB 3.517 H A 0068 TYR CE1
C A 0008 PRO CG 3.380 H A 0068 TYR CE1
C A 0008 PRO CG 3.753 H A 0072 ILE CD1
C A 0008 PRO CD 3.792 H A 0072 ILE CD1
C A 0009 LYS C 2.443 C A 0010 ARG CA
C A 0009 LYS C 2.986 C A 0010 ARG C
C A 0009 LYS C 3.661 C A 0010 ARG CB
C A 0009 LYS C 3.610 H A 0068 TYR CE1
C A 0010 ARG CA 2.918 C A 0011 PRO CD
C A 0010 ARG C 2.435 C A 0011 PRO CA
C A 0010 ARG C 3.119 C A 0011 PRO C
C A 0010 ARG C 3.621 C A 0011 PRO CB
C A 0010 ARG C 3.644 C A 0011 PRO CG
C A 0010 ARG C 2.509 C A 0011 PRO CD
C A 0010 ARG CB 3.366 C A 0011 PRO CD
C A 0010 ARG CZ 3.625 H A 0016 PHE CE2
C A 0010 ARG CZ 3.225 H A 0016 PHE CZ
C A 0011 PRO CA 2.929 C A 0012 PRO CD
C A 0011 PRO C 2.435 C A 0012 PRO CA
C A 0011 PRO C 3.102 C A 0012 PRO C
C A 0011 PRO C 3.630 C A 0012 PRO CB
C A 0011 PRO C 3.640 C A 0012 PRO CG
C A 0011 PRO C 2.510 C A 0012 PRO CD
C A 0011 PRO CB 3.702 H A 0065 LYS CA
C A 0011 PRO CB 3.631 H A 0065 LYS CG
C A 0011 PRO CD 3.566 H A 0068 TYR CD2
C A 0011 PRO CD 3.562 H A 0068 TYR CE2
C A 0012 PRO C 2.438 H A 0013 SER CA
C A 0012 PRO C 3.404 H A 0013 SER C
C A 0012 PRO C 3.485 H A 0013 SER CB
C A 0012 PRO C 3.464 H A 0061 ALA CB
H A 0013 SER C 2.440 H A 0014 ALA CA
H A 0013 SER C 2.963 H A 0014 ALA C
H A 0013 SER C 3.656 H A 0014 ALA CB
H A 0013 SER C 3.770 H A 0016 PHE CB
H A 0013 SER CB 3.755 H A 0016 PHE CB
H A 0013 SER C 3.575 H A 0017 LEU CD1
H A 0013 SER C 3.684 H A 0061 ALA CB
H A 0014 ALA C 2.431 H A 0015 PHE CA
H A 0014 ALA C 2.983 H A 0015 PHE C
H A 0014 ALA C 3.659 H A 0015 PHE CB
H A 0014 ALA C 3.633 H A 0046 TRP CZ2
H A 0014 ALA CB 3.400 H A 0046 TRP CZ2
H A 0015 PHE C 2.432 H A 0016 PHE CA
H A 0015 PHE C 3.074 H A 0016 PHE C
H A 0015 PHE C 3.648 H A 0016 PHE CB
H A 0015 PHE CE1 3.398 H A 0043 GLY CA
H A 0015 PHE CD1 3.712 H A 0046 TRP CG
H A 0015 PHE CD1 3.444 H A 0046 TRP CD1
H A 0016 PHE C 2.429 H A 0017 LEU CA
H A 0016 PHE C 2.958 H A 0017 LEU C
H A 0016 PHE C 3.654 H A 0017 LEU CB
H A 0017 LEU C 2.477 H A 0018 PHE CA
H A 0017 LEU C 2.886 H A 0018 PHE C
H A 0017 LEU C 3.639 H A 0018 PHE CB
H A 0017 LEU CB 3.500 H A 0057 TYR CD1
H A 0017 LEU CD2 3.675 H A 0057 TYR CA
H A 0017 LEU CD2 3.543 H A 0057 TYR CD1
H A 0017 LEU CD2 3.697 H A 0060 LYS CD
H A 0017 LEU CD1 3.707 H A 0061 ALA CB
H A 0018 PHE C 2.429 H A 0019 CYS CA
H A 0018 PHE C 3.033 H A 0019 CYS C
H A 0018 PHE C 3.655 H A 0019 CYS CB
H A 0018 PHE CA 3.668 H A 0021 GLU CG
H A 0018 PHE C 3.462 H A 0021 GLU CG
H A 0018 PHE CD1 3.488 H A 0022 HIS CD2
H A 0018 PHE CE1 3.415 H A 0022 HIS CD2
H A 0018 PHE CE2 3.673 H A 0042 LEU CA
H A 0018 PHE CE2 3.551 H A 0042 LEU C
H A 0018 PHE CE2 3.644 H A 0042 LEU CB
H A 0018 PHE CE2 3.716 H A 0042 LEU CG
H A 0018 PHE CZ 3.636 H A 0045 MET CB
H A 0018 PHE CB 3.151 H A 0046 TRP CE3
H A 0018 PHE CB 3.415 H A 0046 TRP CZ3
H A 0018 PHE CG 3.214 H A 0046 TRP CE3
H A 0018 PHE CD1 3.461 H A 0046 TRP CE3
H A 0018 PHE CD2 3.508 H A 0046 TRP CB
H A 0018 PHE CE2 3.793 H A 0046 TRP CA
H A 0018 PHE CE2 3.542 H A 0046 TRP CB
H A 0018 PHE CE1 3.767 C A 0049 GLN CD
H A 0019 CYS C 2.436 H A 0020 SER CA
H A 0019 CYS C 2.979 H A 0020 SER C
H A 0019 CYS C 3.660 H A 0020 SER CB
H A 0019 CYS CA 3.390 H A 0042 LEU CD2
H A 0019 CYS CB 3.710 H A 0042 LEU CD2
H A 0020 SER C 2.431 H A 0021 GLU CA
H A 0020 SER C 3.275 H A 0021 GLU C
H A 0020 SER C 3.592 H A 0021 GLU CB
H A 0021 GLU C 2.437 H A 0022 HIS CA
H A 0021 GLU C 3.357 H A 0022 HIS C
H A 0021 GLU C 3.548 H A 0022 HIS CB
H A 0021 GLU C 3.762 H A 0022 HIS CG
H A 0021 GLU CG 3.347 H A 0022 HIS CD2
H A 0021 GLU CD 3.462 H A 0022 HIS CD2
H A 0021 GLU CD 3.685 H A 0057 TYR CZ
H A 0022 HIS C 2.433 H A 0023 ARG CA
H A 0022 HIS C 3.213 H A 0023 ARG C
H A 0022 HIS C 3.617 H A 0023 ARG CB
H A 0022 HIS C 3.673 H A 0024 PRO CD
H A 0023 ARG CA 2.984 H A 0024 PRO CD
H A 0023 ARG C 2.430 H A 0024 PRO CA
H A 0023 ARG C 3.131 H A 0024 PRO C
H A 0023 ARG C 3.619 H A 0024 PRO CB
H A 0023 ARG C 3.660 H A 0024 PRO CG
H A 0023 ARG C 2.527 H A 0024 PRO CD
H A 0023 ARG CB 3.295 H A 0024 PRO CD
H A 0024 PRO C 2.437 H A 0025 LYS CA
H A 0024 PRO C 3.243 H A 0025 LYS C
H A 0024 PRO C 3.596 H A 0025 LYS CB
H A 0025 LYS C 2.434 H A 0026 ILE CA
H A 0025 LYS C 3.109 H A 0026 ILE C
H A 0025 LYS C 3.644 H A 0026 ILE CB
H A 0026 ILE C 2.437 H A 0027 LYS CA
H A 0026 ILE C 3.173 H A 0027 LYS C
H A 0026 ILE C 3.627 H A 0027 LYS CB
H A 0026 ILE CB 3.754 H A 0038 THR CB
H A 0026 ILE CG2 3.110 H A 0038 THR CB
H A 0026 ILE CG1 3.577 H A 0042 LEU CD1
H A 0027 LYS C 2.438 C A 0028 SER CA
H A 0027 LYS C 3.122 C A 0028 SER C
H A 0027 LYS C 3.642 C A 0028 SER CB
C A 0028 SER C 2.436 C A 0029 GLU CA
C A 0028 SER C 3.226 C A 0029 GLU C
C A 0028 SER C 3.606 C A 0029 GLU CB
C A 0029 GLU CA 3.736 C A 0030 HIS CD2
C A 0029 GLU C 2.441 C A 0030 HIS CA
C A 0029 GLU C 3.661 C A 0030 HIS C
C A 0029 GLU C 3.185 C A 0030 HIS CB
C A 0029 GLU C 2.987 C A 0030 HIS CG
C A 0029 GLU C 2.946 C A 0030 HIS CD2
C A 0029 GLU CB 3.420 C A 0030 HIS CD2
C A 0030 HIS CA 2.899 C A 0031 PRO CD
C A 0030 HIS C 2.428 C A 0031 PRO CA
C A 0030 HIS C 3.040 C A 0031 PRO C
C A 0030 HIS C 3.620 C A 0031 PRO CB
C A 0030 HIS C 3.611 C A 0031 PRO CG
C A 0030 HIS C 2.499 C A 0031 PRO CD
C A 0030 HIS CB 3.390 C A 0033 LEU CB
C A 0030 HIS CB 3.617 C A 0033 LEU CG
C A 0031 PRO C 2.432 C A 0032 GLY CA
C A 0031 PRO C 3.303 C A 0032 GLY C
C A 0032 GLY C 2.452 C A 0033 LEU CA
C A 0032 GLY C 2.952 C A 0033 LEU C
C A 0032 GLY C 3.655 C A 0033 LEU CB
C A 0033 LEU C 2.440 C A 0034 SER CA
C A 0033 LEU C 2.975 C A 0034 SER C
C A 0033 LEU C 3.653 C A 0034 SER CB
C A 0033 LEU CD1 3.442 H A 0037 ASP CB
C A 0033 LEU CD2 3.782 H A 0037 ASP CB
C A 0033 LEU CD1 3.605 H A 0038 THR CB
C A 0034 SER C 2.436 C A 0035 ILE CA
C A 0034 SER C 3.281 C A 0035 ILE C
C A 0034 SER C 3.585 C A 0035 ILE CB
C A 0034 SER C 3.759 C A 0035 ILE CG1
C A 0035 ILE C 2.434 H A 0036 GLY CA
C A 0035 ILE C 3.328 H A 0036 GLY C
C A 0035 ILE CA 3.606 H A 0038 THR CG2
H A 0036 GLY C 2.435 H A 0037 ASP CA
H A 0036 GLY C 3.019 H A 0037 ASP C
H A 0036 GLY C 3.652 H A 0037 ASP CB
H A 0037 ASP C 2.432 H A 0038 THR CA
H A 0037 ASP C 3.051 H A 0038 THR C
H A 0037 ASP C 3.660 H A 0038 THR CB
H A 0038 THR C 2.435 H A 0039 ALA CA
H A 0038 THR C 3.082 H A 0039 ALA C
H A 0038 THR C 3.644 H A 0039 ALA CB
H A 0039 ALA C 2.433 H A 0040 LYS CA
H A 0039 ALA C 3.102 H A 0040 LYS C
H A 0039 ALA C 3.634 H A 0040 LYS CB
H A 0040 LYS C 2.434 H A 0041 LYS CA
H A 0040 LYS C 3.044 H A 0041 LYS C
H A 0040 LYS C 3.649 H A 0041 LYS CB
H A 0041 LYS C 2.449 H A 0042 LEU CA
H A 0041 LYS C 2.953 H A 0042 LEU C
H A 0041 LYS C 3.647 H A 0042 LEU CB
H A 0042 LEU C 2.441 H A 0043 GLY CA
H A 0042 LEU C 2.948 H A 0043 GLY C
H A 0043 GLY C 2.429 H A 0044 GLU CA
H A 0043 GLY C 3.071 H A 0044 GLU C
H A 0043 GLY C 3.640 H A 0044 GLU CB
H A 0044 GLU C 2.433 H A 0045 MET CA
H A 0044 GLU C 3.154 H A 0045 MET C
H A 0044 GLU C 3.621 H A 0045 MET CB
H A 0045 MET C 2.449 H A 0046 TRP CA
H A 0045 MET C 2.956 H A 0046 TRP C
H A 0045 MET C 3.668 H A 0046 TRP CB
H A 0046 TRP C 2.436 H A 0047 SER CA
H A 0046 TRP C 3.059 H A 0047 SER C
H A 0046 TRP C 3.652 H A 0047 SER CB
H A 0046 TRP CZ2 3.794 H A 0054 LYS CG
H A 0046 TRP CZ3 3.539 H A 0054 LYS CA
H A 0046 TRP CZ3 3.455 H A 0054 LYS CG
H A 0046 TRP CH2 3.520 H A 0054 LYS CA
H A 0046 TRP CH2 3.378 H A 0054 LYS CG
H A 0046 TRP CH2 3.691 H A 0057 TYR CB
H A 0047 SER C 2.437 C A 0048 GLU CA
H A 0047 SER C 3.380 C A 0048 GLU C
H A 0047 SER C 3.511 C A 0048 GLU CB
H A 0047 SER C 3.771 C A 0048 GLU CG
C A 0048 GLU C 2.422 C A 0049 GLN CA
C A 0048 GLU C 3.011 C A 0049 GLN C
C A 0048 GLU C 3.661 C A 0049 GLN CB
C A 0049 GLN C 2.419 C A 0050 SER CA
C A 0049 GLN C 3.232 C A 0050 SER C
C A 0049 GLN C 3.558 C A 0050 SER CB
C A 0049 GLN CG 3.695 C A 0053 ASP C
C A 0049 GLN CG 3.138 C A 0053 ASP CB
C A 0050 SER C 2.425 C A 0051 ALA CA
C A 0050 SER C 3.123 C A 0051 ALA C
C A 0050 SER C 3.631 C A 0051 ALA CB
C A 0051 ALA C 2.439 C A 0052 LYS CA
C A 0051 ALA C 2.997 C A 0052 LYS C
C A 0051 ALA C 3.661 C A 0052 LYS CB
C A 0051 ALA CA 3.798 H A 0055 GLN CB
C A 0051 ALA CA 3.475 H A 0055 GLN CG
C A 0051 ALA CB 3.387 H A 0055 GLN CG
C A 0052 LYS C 2.434 C A 0053 ASP CA
C A 0052 LYS C 3.531 C A 0053 ASP C
C A 0052 LYS C 3.373 C A 0053 ASP CB
C A 0052 LYS C 3.665 C A 0053 ASP CG
C A 0053 ASP C 2.436 H A 0054 LYS CA
C A 0053 ASP C 3.718 H A 0054 LYS C
C A 0053 ASP C 2.953 H A 0054 LYS CB
C A 0053 ASP CA 3.739 H A 0057 TYR CD2
C A 0053 ASP CA 3.525 H A 0057 TYR CE2
C A 0053 ASP C 3.385 H A 0057 TYR CD2
C A 0053 ASP C 3.726 H A 0057 TYR CE2
H A 0054 LYS C 2.435 H A 0055 GLN CA
H A 0054 LYS C 3.118 H A 0055 GLN C
H A 0054 LYS C 3.643 H A 0055 GLN CB
H A 0054 LYS C 3.723 H A 0056 PRO CD
H A 0055 GLN CA 2.938 H A 0056 PRO CD
H A 0055 GLN C 2.429 H A 0056 PRO CA
H A 0055 GLN C 3.125 H A 0056 PRO C
H A 0055 GLN C 3.617 H A 0056 PRO CB
H A 0055 GLN C 3.648 H A 0056 PRO CG
H A 0055 GLN C 2.513 H A 0056 PRO CD
H A 0055 GLN CB 3.064 H A 0056 PRO CD
H A 0055 GLN C 3.633 H A 0059 GLN CD
H A 0056 PRO C 2.435 H A 0057 TYR CA
H A 0056 PRO C 3.276 H A 0057 TYR C
H A 0056 PRO C 3.587 H A 0057 TYR CB
H A 0057 TYR C 2.430 H A 0058 GLU CA
H A 0057 TYR C 3.173 H A 0058 GLU C
H A 0057 TYR C 3.626 H A 0058 GLU CB
H A 0058 GLU C 2.437 H A 0059 GLN CA
H A 0058 GLU C 3.192 H A 0059 GLN C
H A 0058 GLU C 3.620 H A 0059 GLN CB
H A 0058 GLU CD 3.448 H A 0059 GLN CG
H A 0059 GLN C 2.438 H A 0060 LYS CA
H A 0059 GLN C 3.365 H A 0060 LYS C
H A 0059 GLN C 3.522 H A 0060 LYS CB
H A 0060 LYS C 2.431 H A 0061 ALA CA
H A 0060 LYS C 3.327 H A 0061 ALA C
H A 0060 LYS C 3.541 H A 0061 ALA CB
H A 0061 ALA C 2.429 H A 0062 ALA CA
H A 0061 ALA C 3.018 H A 0062 ALA C
H A 0061 ALA C 3.650 H A 0062 ALA CB
H A 0062 ALA C 2.432 H A 0063 LYS CA
H A 0062 ALA C 3.169 H A 0063 LYS C
H A 0062 ALA C 3.623 H A 0063 LYS CB
H A 0063 LYS C 2.440 H A 0064 LEU CA
H A 0063 LYS C 3.375 H A 0064 LEU C
H A 0063 LYS C 3.529 H A 0064 LEU CB
H A 0063 LYS C 3.460 H A 0064 LEU CD2
H A 0064 LEU C 2.436 H A 0065 LYS CA
H A 0064 LEU C 3.126 H A 0065 LYS C
H A 0064 LEU C 3.636 H A 0065 LYS CB
H A 0065 LYS C 2.434 H A 0066 GLU CA
H A 0065 LYS C 3.028 H A 0066 GLU C
H A 0065 LYS C 3.653 H A 0066 GLU CB
H A 0066 GLU C 2.435 H A 0067 LYS CA
H A 0066 GLU C 3.084 H A 0067 LYS C
H A 0066 GLU C 3.647 H A 0067 LYS CB
H A 0067 LYS C 2.444 H A 0068 TYR CA
H A 0067 LYS C 3.099 H A 0068 TYR C
H A 0067 LYS C 3.645 H A 0068 TYR CB
H A 0068 TYR C 2.438 H A 0069 GLU CA
H A 0068 TYR C 3.026 H A 0069 GLU C
H A 0068 TYR C 3.653 H A 0069 GLU CB
H A 0068 TYR CG 3.633 H A 0072 ILE CG1
H A 0068 TYR CD1 3.616 H A 0072 ILE CG1
H A 0068 TYR CD2 3.433 H A 0072 ILE CG1
H A 0068 TYR CE1 3.394 H A 0072 ILE CG1
H A 0068 TYR CE1 3.436 H A 0072 ILE CD1
H A 0068 TYR CE2 3.201 H A 0072 ILE CG1
H A 0068 TYR CE2 3.595 H A 0072 ILE CD1
H A 0068 TYR CZ 3.179 H A 0072 ILE CG1
H A 0068 TYR CZ 3.091 H A 0072 ILE CD1
H A 0069 GLU C 2.432 H A 0070 LYS CA
H A 0069 GLU C 3.237 H A 0070 LYS C
H A 0069 GLU C 3.584 H A 0070 LYS CB
H A 0070 LYS C 2.433 H A 0071 ASP CA
H A 0070 LYS C 2.986 H A 0071 ASP C
H A 0070 LYS C 3.649 H A 0071 ASP CB
H A 0071 ASP C 2.444 H A 0072 ILE CA
H A 0071 ASP C 2.957 H A 0072 ILE C
H A 0071 ASP C 3.656 H A 0072 ILE CB
H A 0072 ILE C 2.432 H A 0073 ALA CA
H A 0072 ILE C 2.989 H A 0073 ALA C
H A 0072 ILE C 3.653 H A 0073 ALA CB
H A 0073 ALA C 2.442 H A 0074 ALA CA
H A 0073 ALA C 2.964 H A 0074 ALA C
H A 0073 ALA C 3.657 H A 0074 ALA CB
H A 0073 ALA C 3.779 H A 0076 ARG CB
H A 0074 ALA C 2.429 H A 0075 TYR CA
H A 0074 ALA C 3.189 H A 0075 TYR C
H A 0074 ALA C 3.614 H A 0075 TYR CB
H A 0075 TYR C 2.437 H A 0076 ARG CA
H A 0075 TYR C 3.006 H A 0076 ARG C
H A 0075 TYR C 3.660 H A 0076 ARG CB
H A 0076 ARG C 2.435 H A 0077 ALA CA
H A 0076 ARG C 3.694 H A 0077 ALA C
H A 0076 ARG C 3.056 H A 0077 ALA CB
H A 0077 ALA C 2.435 H A 0078 LYS CA
H A 0077 ALA C 3.023 H A 0078 LYS C
H A 0077 ALA C 3.659 H A 0078 LYS CB
CHARGE_ATTR 2.00 12.00 72
C A 0004 ASP OD1 10.38 C A 0002 LYS NZ
C A 0004 ASP OD2 8.601 C A 0002 LYS NZ
C A 0004 ASP OD1 10.76 C A 0003 LYS NZ
C A 0004 ASP OD2 10.28 C A 0003 LYS NZ
C A 0004 ASP OD1 11.61 C A 0009 LYS NZ
C A 0004 ASP OD2 11.82 H A 0076 ARG NH1
H A 0021 GLU OE1 4.483 H A 0022 HIS ND1
H A 0021 GLU OE1 3.357 H A 0022 HIS NE2
H A 0021 GLU OE2 5.411 H A 0022 HIS ND1
H A 0021 GLU OE2 3.704 H A 0022 HIS NE2
H A 0021 GLU OE1 7.861 H A 0025 LYS NZ
H A 0021 GLU OE2 9.816 H A 0025 LYS NZ
H A 0021 GLU OE1 9.796 H A 0060 LYS NZ
H A 0021 GLU OE2 9.108 H A 0060 LYS NZ
C A 0029 GLU OE1 10.94 H A 0025 LYS NZ
C A 0029 GLU OE2 10.84 H A 0025 LYS NZ
C A 0029 GLU OE1 7.460 C A 0030 HIS ND1
C A 0029 GLU OE1 6.483 C A 0030 HIS NE2
C A 0029 GLU OE2 7.296 C A 0030 HIS ND1
C A 0029 GLU OE2 5.862 C A 0030 HIS NE2
C A 0029 GLU OE1 10.75 H A 0041 LYS NZ
C A 0029 GLU OE2 9.710 H A 0041 LYS NZ
H A 0037 ASP OD1 10.77 H A 0027 LYS NZ
H A 0037 ASP OD1 8.831 C A 0030 HIS ND1
H A 0037 ASP OD1 10.21 C A 0030 HIS NE2
H A 0037 ASP OD2 8.015 C A 0030 HIS ND1
H A 0037 ASP OD2 9.272 C A 0030 HIS NE2
H A 0037 ASP OD1 5.779 H A 0040 LYS NZ
H A 0037 ASP OD2 4.835 H A 0040 LYS NZ
H A 0037 ASP OD1 8.330 H A 0041 LYS NZ
H A 0037 ASP OD2 6.788 H A 0041 LYS NZ
H A 0044 GLU OE1 11.86 H A 0040 LYS NZ
H A 0044 GLU OE1 9.475 H A 0041 LYS NZ
H A 0044 GLU OE2 11.49 H A 0041 LYS NZ
C A 0048 GLU OE1 10.62 H A 0054 LYS NZ
C A 0048 GLU OE2 9.599 H A 0054 LYS NZ
C A 0053 ASP OD1 7.778 H A 0022 HIS ND1
C A 0053 ASP OD1 5.857 H A 0022 HIS NE2
C A 0053 ASP OD2 5.990 H A 0022 HIS ND1
C A 0053 ASP OD2 3.938 H A 0022 HIS NE2
C A 0053 ASP OD1 10.92 H A 0025 LYS NZ
C A 0053 ASP OD2 9.819 H A 0025 LYS NZ
C A 0053 ASP OD1 6.728 C A 0052 LYS NZ
C A 0053 ASP OD2 8.826 C A 0052 LYS NZ
C A 0053 ASP OD1 11.36 H A 0054 LYS NZ
C A 0053 ASP OD2 11.57 H A 0054 LYS NZ
C A 0053 ASP OD2 11.45 H A 0060 LYS NZ
H A 0058 GLU OE1 8.727 H A 0054 LYS NZ
H A 0058 GLU OE2 6.958 H A 0054 LYS NZ
H A 0058 GLU OE1 8.591 H A 0063 LYS NZ
H A 0058 GLU OE2 10.13 H A 0063 LYS NZ
H A 0058 GLU OE1 11.78 H A 0065 LYS NZ
H A 0066 GLU OE1 9.062 H A 0063 LYS NZ
H A 0066 GLU OE2 8.231 H A 0063 LYS NZ
H A 0066 GLU OE1 9.837 H A 0065 LYS NZ
H A 0066 GLU OE2 8.606 H A 0065 LYS NZ
H A 0066 GLU OE1 8.624 H A 0067 LYS NZ
H A 0066 GLU OE2 8.718 H A 0067 LYS NZ
H A 0066 GLU OE1 6.036 H A 0070 LYS NZ
H A 0066 GLU OE2 7.375 H A 0070 LYS NZ
H A 0069 GLU OE1 8.684 H A 0065 LYS NZ
H A 0069 GLU OE2 7.651 H A 0065 LYS NZ
H A 0069 GLU OE2 11.17 H A 0067 LYS NZ
H A 0069 GLU OE1 5.982 H A 0070 LYS NZ
H A 0069 GLU OE2 5.115 H A 0070 LYS NZ
H A 0069 GLU OE1 10.56 H A 0076 ARG NH1
H A 0069 GLU OE1 11.95 H A 0076 ARG NH2
H A 0071 ASP OD2 11.85 C A 0009 LYS NZ
H A 0071 ASP OD1 6.673 H A 0067 LYS NZ
H A 0071 ASP OD2 8.335 H A 0067 LYS NZ
H A 0071 ASP OD1 7.765 H A 0070 LYS NZ
H A 0071 ASP OD2 9.769 H A 0070 LYS NZ
CHARGE_REPU 2.00 12.00 45
C A 0002 LYS NZ 7.830 H A 0076 ARG NH1
C A 0002 LYS NZ 7.920 H A 0076 ARG NH2
C A 0003 LYS NZ 7.101 C A 0009 LYS NZ
C A 0003 LYS NZ 7.238 C A 0010 ARG NH1
C A 0003 LYS NZ 6.756 C A 0010 ARG NH2
C A 0009 LYS NZ 10.61 C A 0010 ARG NH1
C A 0009 LYS NZ 9.555 C A 0010 ARG NH2
C A 0010 ARG NH1 9.403 H A 0023 ARG NH1
C A 0010 ARG NH1 10.87 H A 0023 ARG NH2
C A 0010 ARG NH2 7.921 H A 0023 ARG NH1
C A 0010 ARG NH2 9.313 H A 0023 ARG NH2
C A 0010 ARG NH1 9.559 H A 0065 LYS NZ
C A 0010 ARG NH2 11.77 H A 0065 LYS NZ
H A 0021 GLU OE1 5.813 C A 0053 ASP OD1
H A 0021 GLU OE1 3.914 C A 0053 ASP OD2
H A 0021 GLU OE2 5.605 C A 0053 ASP OD1
H A 0021 GLU OE2 3.588 C A 0053 ASP OD2
H A 0022 HIS ND1 5.934 H A 0025 LYS NZ
H A 0022 HIS NE2 7.524 H A 0025 LYS NZ
H A 0023 ARG NH1 6.932 H A 0027 LYS NZ
H A 0023 ARG NH2 6.676 H A 0027 LYS NZ
H A 0027 LYS NZ 10.76 C A 0030 HIS ND1
H A 0027 LYS NZ 11.53 C A 0030 HIS NE2
C A 0030 HIS ND1 4.895 H A 0041 LYS NZ
C A 0030 HIS NE2 4.419 H A 0041 LYS NZ
H A 0040 LYS NZ 8.986 H A 0041 LYS NZ
H A 0044 GLU OE1 5.766 C A 0048 GLU OE1
H A 0044 GLU OE1 6.533 C A 0048 GLU OE2
H A 0044 GLU OE2 4.431 C A 0048 GLU OE1
H A 0044 GLU OE2 4.646 C A 0048 GLU OE2
H A 0058 GLU OE1 10.38 H A 0066 GLU OE1
H A 0058 GLU OE1 8.499 H A 0066 GLU OE2
H A 0058 GLU OE2 10.24 H A 0066 GLU OE2
H A 0063 LYS NZ 7.252 H A 0067 LYS NZ
H A 0065 LYS NZ 11.80 H A 0070 LYS NZ
H A 0066 GLU OE1 8.293 H A 0069 GLU OE1
H A 0066 GLU OE1 6.259 H A 0069 GLU OE2
H A 0066 GLU OE2 9.050 H A 0069 GLU OE1
H A 0066 GLU OE2 6.901 H A 0069 GLU OE2
H A 0066 GLU OE1 11.77 H A 0071 ASP OD1
H A 0066 GLU OE2 11.87 H A 0071 ASP OD1
H A 0067 LYS NZ 7.495 H A 0070 LYS NZ
H A 0069 GLU OE1 10.89 H A 0071 ASP OD1
H A 0069 GLU OE2 10.44 H A 0071 ASP OD1
H A 0069 GLU OE2 11.90 H A 0071 ASP OD2
HB_MM 2.00 3.20 120
C A 0002 LYS N 2.206 C A 0001 MET O
C A 0003 LYS N 2.205 C A 0002 LYS O
C A 0004 ASP N 2.205 C A 0003 LYS O
C A 0005 PRO N 2.230 C A 0004 ASP O
C A 0006 ASN N 2.204 C A 0005 PRO O
C A 0007 ALA N 2.205 C A 0006 ASN O
C A 0008 PRO N 2.232 C A 0007 ALA O
C A 0009 LYS N 2.205 C A 0008 PRO O
C A 0010 ARG N 2.208 C A 0009 LYS O
C A 0011 PRO N 2.230 C A 0010 ARG O
C A 0012 PRO N 2.231 C A 0011 PRO O
H A 0013 SER N 2.206 C A 0012 PRO O
H A 0014 ALA N 2.200 H A 0013 SER O
H A 0015 PHE N 2.207 H A 0014 ALA O
H A 0016 PHE N 2.855 H A 0013 SER O
H A 0016 PHE N 3.072 H A 0014 ALA O
H A 0016 PHE N 2.208 H A 0015 PHE O
H A 0017 LEU N 3.051 H A 0013 SER O
H A 0017 LEU N 3.023 H A 0014 ALA O
H A 0017 LEU N 2.208 H A 0016 PHE O
H A 0018 PHE N 2.220 H A 0017 LEU O
H A 0019 CYS N 3.105 H A 0015 PHE O
H A 0019 CYS N 2.912 H A 0017 LEU O
H A 0019 CYS N 2.202 H A 0018 PHE O
H A 0020 SER N 2.720 H A 0016 PHE O
H A 0020 SER N 2.600 H A 0017 LEU O
H A 0020 SER N 2.205 H A 0019 CYS O
H A 0021 GLU N 2.992 H A 0017 LEU O
H A 0021 GLU N 3.051 H A 0019 CYS O
H A 0021 GLU N 2.207 H A 0020 SER O
H A 0022 HIS N 3.024 H A 0018 PHE O
H A 0022 HIS N 3.085 H A 0019 CYS O
H A 0022 HIS N 2.206 H A 0021 GLU O
H A 0023 ARG N 2.868 H A 0019 CYS O
H A 0023 ARG N 2.203 H A 0022 HIS O
H A 0024 PRO N 2.229 H A 0023 ARG O
H A 0025 LYS N 3.196 H A 0023 ARG O
H A 0025 LYS N 2.205 H A 0024 PRO O
H A 0026 ILE N 2.204 H A 0025 LYS O
H A 0027 LYS N 2.202 H A 0026 ILE O
C A 0028 SER N 2.206 H A 0027 LYS O
C A 0029 GLU N 2.206 C A 0028 SER O
C A 0030 HIS N 2.204 C A 0029 GLU O
C A 0031 PRO N 2.223 C A 0030 HIS O
C A 0032 GLY N 2.205 C A 0031 PRO O
C A 0033 LEU N 3.110 C A 0030 HIS O
C A 0033 LEU N 2.206 C A 0032 GLY O
C A 0034 SER N 2.716 C A 0032 GLY O
C A 0034 SER N 2.206 C A 0033 LEU O
C A 0035 ILE N 2.205 C A 0034 SER O
H A 0036 GLY N 2.204 C A 0035 ILE O
H A 0037 ASP N 2.206 H A 0036 GLY O
H A 0038 THR N 2.207 H A 0037 ASP O
H A 0039 ALA N 3.193 H A 0036 GLY O
H A 0039 ALA N 2.205 H A 0038 THR O
H A 0040 LYS N 2.933 H A 0036 GLY O
H A 0040 LYS N 3.153 H A 0037 ASP O
H A 0040 LYS N 2.208 H A 0039 ALA O
H A 0041 LYS N 3.065 H A 0037 ASP O
H A 0041 LYS N 2.209 H A 0040 LYS O
H A 0042 LEU N 2.882 H A 0038 THR O
H A 0042 LEU N 2.204 H A 0041 LYS O
H A 0043 GLY N 2.205 H A 0042 LEU O
H A 0044 GLU N 2.772 H A 0041 LYS O
H A 0044 GLU N 2.935 H A 0042 LEU O
H A 0044 GLU N 2.208 H A 0043 GLY O
H A 0045 MET N 3.149 H A 0041 LYS O
H A 0045 MET N 2.769 H A 0042 LEU O
H A 0045 MET N 2.207 H A 0044 GLU O
H A 0046 TRP N 2.572 H A 0042 LEU O
H A 0046 TRP N 2.208 H A 0045 MET O
H A 0047 SER N 2.207 H A 0046 TRP O
C A 0048 GLU N 2.806 H A 0045 MET O
C A 0048 GLU N 2.999 H A 0046 TRP O
C A 0048 GLU N 2.205 H A 0047 SER O
C A 0049 GLN N 2.688 H A 0045 MET O
C A 0049 GLN N 3.073 H A 0046 TRP O
C A 0049 GLN N 2.207 C A 0048 GLU O
C A 0050 SER N 2.197 C A 0049 GLN O
C A 0051 ALA N 2.201 C A 0050 SER O
C A 0052 LYS N 2.204 C A 0051 ALA O
C A 0053 ASP N 2.205 C A 0052 LYS O
H A 0054 LYS N 2.206 C A 0053 ASP O
H A 0055 GLN N 2.203 H A 0054 LYS O
H A 0056 PRO N 2.227 H A 0055 GLN O
H A 0057 TYR N 3.183 H A 0055 GLN O
H A 0057 TYR N 2.205 H A 0056 PRO O
H A 0058 GLU N 2.206 H A 0057 TYR O
H A 0059 GLN N 2.206 H A 0058 GLU O
H A 0060 LYS N 2.207 H A 0059 GLN O
H A 0061 ALA N 2.208 H A 0060 LYS O
H A 0062 ALA N 2.933 H A 0058 GLU O
H A 0062 ALA N 2.205 H A 0061 ALA O
H A 0063 LYS N 2.206 H A 0062 ALA O
H A 0064 LEU N 3.098 H A 0061 ALA O
H A 0064 LEU N 2.207 H A 0063 LYS O
H A 0065 LYS N 2.838 H A 0061 ALA O
H A 0065 LYS N 2.208 H A 0064 LEU O
H A 0066 GLU N 2.206 H A 0065 LYS O
H A 0067 LYS N 2.204 H A 0066 GLU O
H A 0068 TYR N 3.130 H A 0065 LYS O
H A 0068 TYR N 2.204 H A 0067 LYS O
H A 0069 GLU N 2.203 H A 0068 TYR O
H A 0070 LYS N 2.204 H A 0069 GLU O
H A 0071 ASP N 2.943 H A 0067 LYS O
H A 0071 ASP N 2.209 H A 0070 LYS O
H A 0072 ILE N 2.758 H A 0068 TYR O
H A 0072 ILE N 2.206 H A 0071 ASP O
H A 0073 ALA N 3.179 H A 0071 ASP O
H A 0073 ALA N 2.202 H A 0072 ILE O
H A 0074 ALA N 2.901 H A 0070 LYS O
H A 0074 ALA N 2.205 H A 0073 ALA O
H A 0075 TYR N 2.796 H A 0071 ASP O
H A 0075 TYR N 3.052 H A 0073 ALA O
H A 0075 TYR N 2.204 H A 0074 ALA O
H A 0076 ARG N 2.584 H A 0072 ILE O
H A 0076 ARG N 2.794 H A 0073 ALA O
H A 0076 ARG N 2.208 H A 0075 TYR O
H A 0077 ALA N 2.204 H A 0076 ARG O
H A 0078 LYS N 2.204 H A 0077 ALA O
HB_MS 2.00 3.20 6
C A 0008 PRO O 2.894 H A 0068 TYR OH
C A 0029 GLU O 3.174 C A 0030 HIS ND1
H A 0045 MET O 2.593 C A 0049 GLN NE2
C A 0051 ALA N 2.858 C A 0050 SER OG
H A 0059 GLN N 3.044 H A 0058 GLU OE1
H A 0066 GLU O 2.948 H A 0070 LYS NZ
HB_SS 2.00 3.20 2
H A 0021 GLU OE1 3.174 H A 0057 TYR OH
H A 0021 GLU OE2 2.505 H A 0057 TYR OH
AROMATIC 0.00 8.00 5
H A 0041 LYS 4.897 C A 0030 HIS
C A 0010 ARG 3.585 H A 0016 PHE
H A 0023 ARG 7.996 H A 0016 PHE
H A 0060 LYS 7.418 H A 0057 TYR
C A 0003 LYS 7.645 H A 0068 TYR