Complet list of 1j3x con file
Complete list of 1j3x.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 305
C A 0001 MET C 2.433 C A 0002 GLY CA
C A 0001 MET C 3.684 C A 0002 GLY C
C A 0002 GLY C 2.433 C A 0003 LYS CA
C A 0002 GLY C 3.359 C A 0003 LYS C
C A 0002 GLY C 3.526 C A 0003 LYS CB
C A 0002 GLY C 3.535 C A 0003 LYS CD
C A 0003 LYS C 2.432 C A 0004 GLY CA
C A 0003 LYS C 3.089 C A 0004 GLY C
C A 0004 GLY C 2.432 C A 0005 ASP CA
C A 0004 GLY C 3.536 C A 0005 ASP C
C A 0004 GLY C 3.370 C A 0005 ASP CB
C A 0004 GLY C 3.498 C A 0005 ASP CG
C A 0005 ASP CA 2.914 C A 0006 PRO CD
C A 0005 ASP C 2.434 C A 0006 PRO CA
C A 0005 ASP C 3.093 C A 0006 PRO C
C A 0005 ASP C 3.621 C A 0006 PRO CB
C A 0005 ASP C 3.631 C A 0006 PRO CG
C A 0005 ASP C 2.508 C A 0006 PRO CD
C A 0005 ASP CB 3.432 C A 0006 PRO CD
C A 0005 ASP CB 3.748 C A 0008 LYS C
C A 0005 ASP CB 3.524 C A 0008 LYS CB
C A 0005 ASP CG 3.686 C A 0008 LYS CB
C A 0006 PRO C 2.430 C A 0007 ASN CA
C A 0006 PRO C 3.515 C A 0007 ASN C
C A 0006 PRO C 3.375 C A 0007 ASN CB
C A 0007 ASN C 2.434 C A 0008 LYS CA
C A 0007 ASN C 3.000 C A 0008 LYS C
C A 0007 ASN C 3.654 C A 0008 LYS CB
C A 0008 LYS CA 2.915 C A 0009 PRO CD
C A 0008 LYS C 2.432 C A 0009 PRO CA
C A 0008 LYS C 3.097 C A 0009 PRO C
C A 0008 LYS C 3.619 C A 0009 PRO CB
C A 0008 LYS C 3.640 C A 0009 PRO CG
C A 0008 LYS C 2.508 C A 0009 PRO CD
C A 0008 LYS CB 3.381 C A 0009 PRO CD
C A 0009 PRO C 2.433 C A 0010 ARG CA
C A 0009 PRO C 3.315 C A 0010 ARG C
C A 0009 PRO C 3.555 C A 0010 ARG CB
C A 0009 PRO CG 3.762 H A 0071 TYR CE1
C A 0009 PRO CG 3.690 C A 0075 MET CG
C A 0010 ARG C 2.432 C A 0011 GLY CA
C A 0010 ARG C 3.062 C A 0011 GLY C
C A 0011 GLY C 2.434 C A 0012 LYS CA
C A 0011 GLY C 3.370 C A 0012 LYS C
C A 0011 GLY C 3.519 C A 0012 LYS CB
C A 0011 GLY C 3.666 C A 0012 LYS CG
C A 0012 LYS C 2.434 C A 0013 MET CA
C A 0012 LYS C 3.462 C A 0013 MET C
C A 0012 LYS C 3.445 C A 0013 MET CB
C A 0012 LYS CG 3.255 H A 0071 TYR CB
C A 0012 LYS CG 3.513 H A 0071 TYR CG
C A 0012 LYS CD 3.520 H A 0071 TYR CB
C A 0012 LYS CD 3.767 H A 0071 TYR CG
C A 0012 LYS CD 3.618 H A 0071 TYR CD2
C A 0012 LYS CE 3.260 H A 0071 TYR CD2
C A 0012 LYS CE 3.786 H A 0071 TYR CE2
C A 0013 MET C 2.433 H A 0014 SER CA
C A 0013 MET C 3.692 H A 0014 SER C
C A 0013 MET C 3.055 H A 0014 SER CB
C A 0013 MET CG 3.786 H A 0018 PHE CE1
H A 0014 SER C 2.433 H A 0015 SER CA
H A 0014 SER C 3.134 H A 0015 SER C
H A 0014 SER C 3.630 H A 0015 SER CB
H A 0014 SER CA 3.615 H A 0064 ALA CB
H A 0014 SER C 3.263 H A 0064 ALA CB
H A 0015 SER C 2.433 H A 0016 TYR CA
H A 0015 SER C 3.041 H A 0016 TYR C
H A 0015 SER C 3.651 H A 0016 TYR CB
H A 0015 SER CB 3.569 H A 0060 PHE C
H A 0015 SER CB 3.797 H A 0060 PHE CB
H A 0016 TYR C 2.433 H A 0017 ALA CA
H A 0016 TYR C 3.137 H A 0017 ALA C
H A 0016 TYR C 3.630 H A 0017 ALA CB
H A 0016 TYR CD2 3.427 H A 0049 TRP CD1
H A 0016 TYR CE2 3.303 H A 0049 TRP CD1
H A 0017 ALA C 2.435 H A 0018 PHE CA
H A 0017 ALA C 3.049 H A 0018 PHE C
H A 0017 ALA C 3.650 H A 0018 PHE CB
H A 0018 PHE C 2.436 H A 0019 PHE CA
H A 0018 PHE C 2.994 H A 0019 PHE C
H A 0018 PHE C 3.654 H A 0019 PHE CB
H A 0018 PHE CB 3.796 H A 0060 PHE CD1
H A 0019 PHE C 2.434 H A 0020 VAL CA
H A 0019 PHE C 3.054 H A 0020 VAL C
H A 0019 PHE C 3.650 H A 0020 VAL CB
H A 0019 PHE CD2 3.607 H A 0045 CYS CB
H A 0019 PHE CE2 3.612 H A 0045 CYS CA
H A 0019 PHE CE2 3.614 H A 0045 CYS C
H A 0019 PHE CE2 3.408 H A 0045 CYS CB
H A 0019 PHE CG 3.692 H A 0049 TRP CE3
H A 0019 PHE CD1 3.155 H A 0049 TRP CE3
H A 0019 PHE CD1 3.605 H A 0049 TRP CZ3
H A 0019 PHE CE1 3.404 H A 0049 TRP CE3
H A 0019 PHE CE2 3.663 H A 0049 TRP CB
H A 0019 PHE CA 3.695 H A 0060 PHE CE1
H A 0020 VAL C 2.434 H A 0021 GLN CA
H A 0020 VAL C 3.088 H A 0021 GLN C
H A 0020 VAL C 3.643 H A 0021 GLN CB
H A 0021 GLN C 2.433 H A 0022 THR CA
H A 0021 GLN C 3.202 H A 0022 THR C
H A 0021 GLN C 3.606 H A 0022 THR CB
H A 0022 THR C 2.433 H A 0023 SER CA
H A 0022 THR C 3.111 H A 0023 SER C
H A 0022 THR C 3.637 H A 0023 SER CB
H A 0023 SER C 2.433 H A 0024 ARG CA
H A 0023 SER C 3.106 H A 0024 ARG C
H A 0023 SER C 3.640 H A 0024 ARG CB
H A 0023 SER C 3.537 H A 0041 PHE CE2
H A 0023 SER C 3.590 H A 0041 PHE CZ
H A 0023 SER CB 3.367 H A 0041 PHE CE2
H A 0023 SER CB 3.525 H A 0041 PHE CZ
H A 0024 ARG C 2.435 H A 0025 GLU CA
H A 0024 ARG C 3.039 H A 0025 GLU C
H A 0024 ARG C 3.652 H A 0025 GLU CB
H A 0025 GLU C 2.434 H A 0026 GLU CA
H A 0025 GLU C 3.300 H A 0026 GLU C
H A 0025 GLU C 3.567 H A 0026 GLU CB
H A 0026 GLU C 2.435 H A 0027 HIS CA
H A 0026 GLU C 3.375 H A 0027 HIS C
H A 0026 GLU C 3.518 H A 0027 HIS CB
H A 0027 HIS C 2.438 H A 0028 LYS CA
H A 0027 HIS C 2.989 H A 0028 LYS C
H A 0027 HIS C 3.654 H A 0028 LYS CB
H A 0027 HIS CA 3.683 H A 0031 HIS CD2
H A 0027 HIS C 3.605 H A 0031 HIS CD2
H A 0027 HIS CG 3.224 H A 0031 HIS CD2
H A 0027 HIS CD2 3.097 H A 0031 HIS CB
H A 0027 HIS CD2 3.253 H A 0031 HIS CG
H A 0027 HIS CD2 3.176 H A 0031 HIS CD2
H A 0027 HIS CE1 3.589 H A 0031 HIS CG
H A 0027 HIS CE1 3.082 H A 0031 HIS CD2
H A 0028 LYS C 2.438 H A 0029 LYS CA
H A 0028 LYS C 2.989 H A 0029 LYS C
H A 0028 LYS C 3.657 H A 0029 LYS CB
H A 0029 LYS C 2.434 H A 0030 LYS CA
H A 0029 LYS C 3.609 H A 0030 LYS C
H A 0029 LYS C 3.276 H A 0030 LYS CB
H A 0030 LYS C 2.437 H A 0031 HIS CA
H A 0030 LYS C 3.648 H A 0031 HIS C
H A 0030 LYS C 3.209 H A 0031 HIS CB
H A 0030 LYS C 3.026 H A 0031 HIS CG
H A 0030 LYS C 3.557 H A 0031 HIS CD2
H A 0030 LYS CG 3.154 H A 0031 HIS CD2
H A 0030 LYS CG 3.659 H A 0031 HIS CE1
H A 0030 LYS C 3.629 C A 0032 PRO CD
H A 0031 HIS CA 2.913 C A 0032 PRO CD
H A 0031 HIS C 2.432 C A 0032 PRO CA
H A 0031 HIS C 3.096 C A 0032 PRO C
H A 0031 HIS C 3.619 C A 0032 PRO CB
H A 0031 HIS C 3.640 C A 0032 PRO CG
H A 0031 HIS C 2.508 C A 0032 PRO CD
C A 0032 PRO C 2.433 C A 0033 ASP CA
C A 0032 PRO C 3.395 C A 0033 ASP C
C A 0032 PRO C 3.500 C A 0033 ASP CB
C A 0032 PRO C 3.697 C A 0033 ASP CG
C A 0033 ASP C 2.433 C A 0034 SER CA
C A 0033 ASP C 3.648 C A 0034 SER C
C A 0033 ASP C 3.176 C A 0034 SER CB
C A 0034 SER C 2.432 C A 0035 SER CA
C A 0034 SER C 3.239 C A 0035 SER C
C A 0034 SER C 3.590 C A 0035 SER CB
C A 0035 SER C 2.432 C A 0036 VAL CA
C A 0035 SER C 3.388 C A 0036 VAL C
C A 0035 SER C 3.506 C A 0036 VAL CB
C A 0036 VAL C 2.438 H A 0037 ASN CA
C A 0036 VAL C 2.977 H A 0037 ASN C
C A 0036 VAL C 3.657 H A 0037 ASN CB
C A 0036 VAL CG2 3.383 H A 0041 PHE CB
C A 0036 VAL CG2 3.476 H A 0041 PHE CG
C A 0036 VAL CG2 3.433 H A 0041 PHE CD1
H A 0037 ASN C 2.426 H A 0038 PHE CA
H A 0037 ASN C 3.085 H A 0038 PHE C
H A 0037 ASN C 3.649 H A 0038 PHE CB
H A 0038 PHE C 2.428 H A 0039 ALA CA
H A 0038 PHE C 3.078 H A 0039 ALA C
H A 0038 PHE C 3.644 H A 0039 ALA CB
H A 0038 PHE C 3.750 H A 0042 SER CB
H A 0039 ALA C 2.421 H A 0040 GLU CA
H A 0039 ALA C 2.997 H A 0040 GLU C
H A 0039 ALA C 3.644 H A 0040 GLU CB
H A 0040 GLU C 2.433 H A 0041 PHE CA
H A 0040 GLU C 3.452 H A 0041 PHE C
H A 0040 GLU C 3.456 H A 0041 PHE CB
H A 0041 PHE C 2.441 H A 0042 SER CA
H A 0041 PHE C 2.968 H A 0042 SER C
H A 0041 PHE C 3.651 H A 0042 SER CB
H A 0042 SER C 2.435 H A 0043 LYS CA
H A 0042 SER C 3.082 H A 0043 LYS C
H A 0042 SER C 3.644 H A 0043 LYS CB
H A 0043 LYS C 2.434 H A 0044 LYS CA
H A 0043 LYS C 3.182 H A 0044 LYS C
H A 0043 LYS C 3.616 H A 0044 LYS CB
H A 0044 LYS C 2.435 H A 0045 CYS CA
H A 0044 LYS C 2.997 H A 0045 CYS C
H A 0044 LYS C 3.658 H A 0045 CYS CB
H A 0045 CYS C 2.435 H A 0046 SER CA
H A 0045 CYS C 3.046 H A 0046 SER C
H A 0045 CYS C 3.650 H A 0046 SER CB
H A 0046 SER C 2.433 H A 0047 GLU CA
H A 0046 SER C 3.042 H A 0047 GLU C
H A 0046 SER C 3.651 H A 0047 GLU CB
H A 0047 GLU C 2.436 H A 0048 ARG CA
H A 0047 GLU C 3.219 H A 0048 ARG C
H A 0047 GLU C 3.608 H A 0048 ARG CB
H A 0048 ARG C 2.436 H A 0049 TRP CA
H A 0048 ARG C 2.996 H A 0049 TRP C
H A 0048 ARG C 3.656 H A 0049 TRP CB
H A 0048 ARG C 3.589 H A 0052 MET CG
H A 0048 ARG CD 3.780 H A 0052 MET CG
H A 0049 TRP C 2.434 H A 0050 LYS CA
H A 0049 TRP C 3.086 H A 0050 LYS C
H A 0049 TRP C 3.642 H A 0050 LYS CB
H A 0049 TRP CZ3 3.415 H A 0057 LYS CG
H A 0049 TRP CH2 3.551 H A 0057 LYS CG
H A 0049 TRP CZ3 3.674 H A 0060 PHE CD2
H A 0049 TRP CH2 3.569 H A 0060 PHE CB
H A 0050 LYS C 2.435 H A 0051 THR CA
H A 0050 LYS C 3.293 H A 0051 THR C
H A 0050 LYS C 3.572 H A 0051 THR CB
H A 0051 THR C 2.442 H A 0052 MET CA
H A 0051 THR C 2.972 H A 0052 MET C
H A 0051 THR C 3.658 H A 0052 MET CB
H A 0052 MET C 2.434 H A 0053 SER CA
H A 0052 MET C 3.365 H A 0053 SER C
H A 0052 MET C 3.522 H A 0053 SER CB
H A 0052 MET CE 3.479 H A 0056 GLU CB
H A 0052 MET C 3.523 H A 0057 LYS CD
H A 0052 MET CB 3.695 H A 0057 LYS CG
H A 0052 MET CB 3.637 H A 0057 LYS CD
H A 0053 SER C 2.438 H A 0054 ALA CA
H A 0053 SER C 3.086 H A 0054 ALA C
H A 0053 SER C 3.648 H A 0054 ALA CB
H A 0053 SER C 3.738 H A 0057 LYS CD
H A 0054 ALA C 2.435 H A 0055 LYS CA
H A 0054 ALA C 3.048 H A 0055 LYS C
H A 0054 ALA C 3.653 H A 0055 LYS CB
H A 0055 LYS C 2.432 H A 0056 GLU CA
H A 0055 LYS C 3.327 H A 0056 GLU C
H A 0055 LYS C 3.536 H A 0056 GLU CB
H A 0056 GLU C 2.435 H A 0057 LYS CA
H A 0056 GLU C 3.013 H A 0057 LYS C
H A 0056 GLU C 3.652 H A 0057 LYS CB
H A 0057 LYS C 2.437 H A 0058 SER CA
H A 0057 LYS C 2.994 H A 0058 SER C
H A 0057 LYS C 3.656 H A 0058 SER CB
H A 0058 SER C 2.433 H A 0059 LYS CA
H A 0058 SER C 3.044 H A 0059 LYS C
H A 0058 SER C 3.652 H A 0059 LYS CB
H A 0059 LYS C 2.433 H A 0060 PHE CA
H A 0059 LYS C 3.273 H A 0060 PHE C
H A 0059 LYS C 3.577 H A 0060 PHE CB
H A 0059 LYS CE 3.341 H A 0060 PHE CE2
H A 0059 LYS CE 3.368 H A 0060 PHE CZ
H A 0060 PHE C 2.434 H A 0061 GLU CA
H A 0060 PHE C 3.100 H A 0061 GLU C
H A 0060 PHE C 3.642 H A 0061 GLU CB
H A 0061 GLU C 2.434 H A 0062 ASP CA
H A 0061 GLU C 3.147 H A 0062 ASP C
H A 0061 GLU C 3.629 H A 0062 ASP CB
H A 0062 ASP C 2.433 H A 0063 MET CA
H A 0062 ASP C 3.180 H A 0063 MET C
H A 0062 ASP C 3.617 H A 0063 MET CB
H A 0063 MET C 2.433 H A 0064 ALA CA
H A 0063 MET C 3.127 H A 0064 ALA C
H A 0063 MET C 3.634 H A 0064 ALA CB
H A 0064 ALA C 2.433 H A 0065 LYS CA
H A 0064 ALA C 3.058 H A 0065 LYS C
H A 0064 ALA C 3.648 H A 0065 LYS CB
H A 0065 LYS C 2.435 H A 0066 SER CA
H A 0065 LYS C 2.995 H A 0066 SER C
H A 0065 LYS C 3.654 H A 0066 SER CB
H A 0066 SER C 2.433 H A 0067 ASP CA
H A 0066 SER C 3.251 H A 0067 ASP C
H A 0066 SER C 3.587 H A 0067 ASP CB
H A 0067 ASP C 2.435 H A 0068 LYS CA
H A 0067 ASP C 3.017 H A 0068 LYS C
H A 0067 ASP C 3.654 H A 0068 LYS CB
H A 0068 LYS C 2.434 H A 0069 ALA CA
H A 0068 LYS C 3.156 H A 0069 ALA C
H A 0068 LYS C 3.626 H A 0069 ALA CB
H A 0069 ALA C 2.435 H A 0070 ARG CA
H A 0069 ALA C 3.007 H A 0070 ARG C
H A 0069 ALA C 3.654 H A 0070 ARG CB
H A 0070 ARG C 2.434 H A 0071 TYR CA
H A 0070 ARG C 3.074 H A 0071 TYR C
H A 0070 ARG C 3.647 H A 0071 TYR CB
H A 0071 TYR C 2.434 C A 0072 ASP CA
H A 0071 TYR C 3.050 C A 0072 ASP C
H A 0071 TYR C 3.650 C A 0072 ASP CB
C A 0072 ASP C 2.432 C A 0073 ARG CA
C A 0072 ASP C 3.336 C A 0073 ARG C
C A 0072 ASP C 3.539 C A 0073 ARG CB
C A 0072 ASP C 3.789 C A 0073 ARG CG
C A 0073 ARG C 2.433 C A 0074 GLU CA
C A 0073 ARG C 3.534 C A 0074 GLU C
C A 0073 ARG C 3.363 C A 0074 GLU CB
C A 0074 GLU C 2.433 C A 0075 MET CA
C A 0074 GLU C 3.340 C A 0075 MET C
C A 0074 GLU C 3.538 C A 0075 MET CB
C A 0075 MET C 2.434 C A 0076 LYS CA
C A 0075 MET C 3.266 C A 0076 LYS C
C A 0075 MET C 3.581 C A 0076 LYS CB
C A 0076 LYS C 2.450 C A 0077 ASN CA
C A 0076 LYS C 2.963 C A 0077 ASN C
C A 0076 LYS C 2.968 C A 0077 ASN CB
CHARGE_ATTR 2.00 12.00 110
C A 0005 ASP OD1 9.933 C A 0003 LYS NZ
C A 0005 ASP OD2 8.756 C A 0003 LYS NZ
C A 0005 ASP OD1 4.586 C A 0008 LYS NZ
C A 0005 ASP OD2 6.194 C A 0008 LYS NZ
C A 0005 ASP OD1 11.17 C A 0010 ARG NH1
C A 0005 ASP OD1 10.64 C A 0010 ARG NH2
C A 0005 ASP OD2 9.472 C A 0010 ARG NH1
C A 0005 ASP OD2 9.236 C A 0010 ARG NH2
C A 0005 ASP OD2 10.53 C A 0012 LYS NZ
H A 0025 GLU OE1 7.846 H A 0024 ARG NH1
H A 0025 GLU OE1 7.371 H A 0024 ARG NH2
H A 0025 GLU OE2 7.310 H A 0024 ARG NH1
H A 0025 GLU OE2 6.346 H A 0024 ARG NH2
H A 0025 GLU OE1 11.68 H A 0027 HIS ND1
H A 0025 GLU OE1 10.63 H A 0028 LYS NZ
H A 0025 GLU OE2 9.520 H A 0028 LYS NZ
H A 0025 GLU OE1 10.32 H A 0029 LYS NZ
H A 0025 GLU OE2 11.18 H A 0029 LYS NZ
H A 0025 GLU OE1 8.582 H A 0059 LYS NZ
H A 0025 GLU OE2 10.51 H A 0059 LYS NZ
H A 0026 GLU OE1 8.680 H A 0027 HIS ND1
H A 0026 GLU OE1 10.76 H A 0027 HIS NE2
H A 0026 GLU OE2 9.745 H A 0027 HIS ND1
H A 0026 GLU OE2 11.65 H A 0027 HIS NE2
H A 0026 GLU OE1 6.342 H A 0029 LYS NZ
H A 0026 GLU OE2 4.346 H A 0029 LYS NZ
H A 0026 GLU OE1 6.011 H A 0030 LYS NZ
H A 0026 GLU OE2 5.813 H A 0030 LYS NZ
H A 0026 GLU OE1 11.30 H A 0031 HIS ND1
H A 0026 GLU OE1 9.290 H A 0031 HIS NE2
H A 0026 GLU OE2 11.77 H A 0031 HIS ND1
H A 0026 GLU OE2 9.937 H A 0031 HIS NE2
H A 0026 GLU OE1 10.55 H A 0044 LYS NZ
H A 0026 GLU OE1 8.691 H A 0048 ARG NH1
H A 0026 GLU OE1 8.951 H A 0048 ARG NH2
H A 0026 GLU OE2 10.43 H A 0048 ARG NH1
H A 0026 GLU OE2 10.77 H A 0048 ARG NH2
H A 0026 GLU OE1 9.146 H A 0059 LYS NZ
H A 0026 GLU OE2 9.699 H A 0059 LYS NZ
C A 0033 ASP OD1 10.98 H A 0027 HIS NE2
C A 0033 ASP OD2 11.74 H A 0027 HIS NE2
C A 0033 ASP OD1 11.89 H A 0028 LYS NZ
C A 0033 ASP OD1 9.313 H A 0031 HIS ND1
C A 0033 ASP OD1 11.37 H A 0031 HIS NE2
C A 0033 ASP OD2 10.53 H A 0031 HIS ND1
H A 0040 GLU OE1 10.72 H A 0027 HIS ND1
H A 0040 GLU OE1 9.477 H A 0027 HIS NE2
H A 0040 GLU OE2 11.09 H A 0027 HIS NE2
H A 0040 GLU OE1 11.82 H A 0031 HIS ND1
H A 0040 GLU OE1 10.81 H A 0043 LYS NZ
H A 0040 GLU OE2 8.907 H A 0043 LYS NZ
H A 0047 GLU OE1 9.361 H A 0043 LYS NZ
H A 0047 GLU OE2 8.665 H A 0043 LYS NZ
H A 0047 GLU OE1 6.490 H A 0044 LYS NZ
H A 0047 GLU OE2 8.568 H A 0044 LYS NZ
H A 0047 GLU OE1 11.69 H A 0048 ARG NH1
H A 0047 GLU OE1 10.04 H A 0048 ARG NH2
H A 0047 GLU OE2 11.50 H A 0048 ARG NH2
H A 0047 GLU OE1 10.70 H A 0050 LYS NZ
H A 0047 GLU OE2 9.364 H A 0050 LYS NZ
H A 0056 GLU OE1 4.343 H A 0048 ARG NH1
H A 0056 GLU OE1 6.601 H A 0048 ARG NH2
H A 0056 GLU OE2 4.902 H A 0048 ARG NH1
H A 0056 GLU OE2 6.968 H A 0048 ARG NH2
H A 0056 GLU OE1 11.11 H A 0055 LYS NZ
H A 0056 GLU OE2 9.861 H A 0055 LYS NZ
H A 0056 GLU OE1 10.58 H A 0057 LYS NZ
H A 0056 GLU OE2 9.716 H A 0057 LYS NZ
H A 0056 GLU OE1 9.287 H A 0059 LYS NZ
H A 0056 GLU OE2 11.16 H A 0059 LYS NZ
H A 0061 GLU OE1 6.448 H A 0057 LYS NZ
H A 0061 GLU OE2 5.134 H A 0057 LYS NZ
H A 0061 GLU OE2 11.28 H A 0059 LYS NZ
H A 0061 GLU OE1 7.807 H A 0065 LYS NZ
H A 0061 GLU OE2 9.338 H A 0065 LYS NZ
H A 0062 ASP OD1 9.734 H A 0059 LYS NZ
H A 0062 ASP OD2 10.38 H A 0059 LYS NZ
H A 0062 ASP OD1 6.386 H A 0065 LYS NZ
H A 0062 ASP OD2 5.761 H A 0065 LYS NZ
H A 0067 ASP OD1 11.00 C A 0010 ARG NH1
H A 0067 ASP OD2 11.86 C A 0010 ARG NH1
H A 0067 ASP OD1 8.444 C A 0012 LYS NZ
H A 0067 ASP OD2 10.57 C A 0012 LYS NZ
H A 0067 ASP OD1 9.720 H A 0068 LYS NZ
H A 0067 ASP OD2 11.42 H A 0068 LYS NZ
H A 0067 ASP OD1 9.564 H A 0070 ARG NH1
H A 0067 ASP OD1 10.20 H A 0070 ARG NH2
H A 0067 ASP OD2 9.574 H A 0070 ARG NH1
H A 0067 ASP OD2 9.756 H A 0070 ARG NH2
C A 0072 ASP OD1 8.467 C A 0012 LYS NZ
C A 0072 ASP OD2 10.21 C A 0012 LYS NZ
C A 0072 ASP OD1 7.002 H A 0068 LYS NZ
C A 0072 ASP OD2 7.944 H A 0068 LYS NZ
C A 0072 ASP OD1 10.30 H A 0070 ARG NH1
C A 0072 ASP OD2 9.094 H A 0070 ARG NH1
C A 0072 ASP OD2 11.35 H A 0070 ARG NH2
C A 0072 ASP OD1 9.799 C A 0073 ARG NH1
C A 0072 ASP OD1 8.510 C A 0073 ARG NH2
C A 0072 ASP OD2 7.740 C A 0073 ARG NH1
C A 0072 ASP OD2 6.421 C A 0073 ARG NH2
C A 0072 ASP OD1 3.171 C A 0076 LYS NZ
C A 0072 ASP OD2 4.943 C A 0076 LYS NZ
C A 0074 GLU OE1 11.61 C A 0008 LYS NZ
C A 0074 GLU OE1 9.588 C A 0012 LYS NZ
C A 0074 GLU OE2 10.94 C A 0012 LYS NZ
C A 0074 GLU OE1 9.432 H A 0070 ARG NH1
C A 0074 GLU OE1 10.35 H A 0070 ARG NH2
C A 0074 GLU OE2 8.447 H A 0070 ARG NH1
C A 0074 GLU OE2 8.956 H A 0070 ARG NH2
C A 0074 GLU OE1 10.56 C A 0076 LYS NZ
CHARGE_REPU 2.00 12.00 75
C A 0003 LYS NZ 9.749 C A 0010 ARG NH1
C A 0003 LYS NZ 10.85 C A 0010 ARG NH2
C A 0003 LYS NZ 6.658 C A 0012 LYS NZ
C A 0003 LYS NZ 11.99 H A 0068 LYS NZ
C A 0005 ASP OD1 10.50 C A 0074 GLU OE1
C A 0005 ASP OD2 8.939 C A 0074 GLU OE1
C A 0005 ASP OD2 10.50 C A 0074 GLU OE2
C A 0010 ARG NH1 11.60 C A 0012 LYS NZ
C A 0012 LYS NZ 5.887 H A 0068 LYS NZ
C A 0012 LYS NZ 8.735 C A 0076 LYS NZ
H A 0024 ARG NH1 10.17 H A 0027 HIS ND1
H A 0024 ARG NH1 10.72 H A 0027 HIS NE2
H A 0024 ARG NH2 10.52 H A 0027 HIS ND1
H A 0024 ARG NH2 10.96 H A 0027 HIS NE2
H A 0024 ARG NH1 10.88 H A 0028 LYS NZ
H A 0024 ARG NH2 8.880 H A 0028 LYS NZ
H A 0025 GLU OE1 8.828 H A 0026 GLU OE1
H A 0025 GLU OE1 8.853 H A 0026 GLU OE2
H A 0025 GLU OE2 10.60 H A 0026 GLU OE1
H A 0025 GLU OE2 10.43 H A 0026 GLU OE2
H A 0026 GLU OE1 9.952 H A 0056 GLU OE1
H A 0026 GLU OE1 11.90 H A 0056 GLU OE2
H A 0026 GLU OE2 11.32 H A 0056 GLU OE1
H A 0027 HIS ND1 11.78 H A 0028 LYS NZ
H A 0027 HIS NE2 11.75 H A 0028 LYS NZ
H A 0027 HIS ND1 11.26 H A 0029 LYS NZ
H A 0027 HIS ND1 7.895 H A 0030 LYS NZ
H A 0027 HIS NE2 9.155 H A 0030 LYS NZ
H A 0027 HIS ND1 4.855 H A 0031 HIS ND1
H A 0027 HIS ND1 3.748 H A 0031 HIS NE2
H A 0027 HIS NE2 3.861 H A 0031 HIS ND1
H A 0027 HIS NE2 3.873 H A 0031 HIS NE2
H A 0027 HIS ND1 8.493 H A 0044 LYS NZ
H A 0027 HIS NE2 9.695 H A 0044 LYS NZ
H A 0027 HIS ND1 11.92 H A 0048 ARG NH2
H A 0028 LYS NZ 10.59 H A 0029 LYS NZ
H A 0029 LYS NZ 6.260 H A 0030 LYS NZ
H A 0029 LYS NZ 11.89 H A 0031 HIS ND1
H A 0029 LYS NZ 10.64 H A 0031 HIS NE2
H A 0030 LYS NZ 7.564 H A 0031 HIS ND1
H A 0030 LYS NZ 5.906 H A 0031 HIS NE2
H A 0030 LYS NZ 10.49 H A 0044 LYS NZ
H A 0030 LYS NZ 11.54 H A 0048 ARG NH1
H A 0030 LYS NZ 10.76 H A 0048 ARG NH2
H A 0031 HIS ND1 10.52 H A 0044 LYS NZ
H A 0031 HIS NE2 8.837 H A 0044 LYS NZ
H A 0040 GLU OE2 11.71 H A 0047 GLU OE1
H A 0043 LYS NZ 10.01 H A 0050 LYS NZ
H A 0044 LYS NZ 7.943 H A 0048 ARG NH1
H A 0044 LYS NZ 5.884 H A 0048 ARG NH2
H A 0048 ARG NH1 11.56 H A 0059 LYS NZ
H A 0050 LYS NZ 9.873 H A 0057 LYS NZ
H A 0056 GLU OE1 11.11 H A 0061 GLU OE2
H A 0056 GLU OE2 10.98 H A 0061 GLU OE2
H A 0061 GLU OE1 9.924 H A 0062 ASP OD1
H A 0061 GLU OE1 9.042 H A 0062 ASP OD2
H A 0061 GLU OE2 10.24 H A 0062 ASP OD1
H A 0061 GLU OE2 9.330 H A 0062 ASP OD2
H A 0062 ASP OD1 11.58 H A 0067 ASP OD2
H A 0065 LYS NZ 8.998 H A 0068 LYS NZ
H A 0067 ASP OD1 11.81 C A 0072 ASP OD1
H A 0067 ASP OD1 8.253 C A 0074 GLU OE1
H A 0067 ASP OD1 7.715 C A 0074 GLU OE2
H A 0067 ASP OD2 9.506 C A 0074 GLU OE1
H A 0067 ASP OD2 8.520 C A 0074 GLU OE2
H A 0068 LYS NZ 8.647 C A 0076 LYS NZ
H A 0070 ARG NH1 6.255 C A 0073 ARG NH1
H A 0070 ARG NH1 7.469 C A 0073 ARG NH2
H A 0070 ARG NH2 7.724 C A 0073 ARG NH1
H A 0070 ARG NH2 9.196 C A 0073 ARG NH2
C A 0072 ASP OD1 9.836 C A 0074 GLU OE1
C A 0072 ASP OD1 11.09 C A 0074 GLU OE2
C A 0072 ASP OD2 10.53 C A 0074 GLU OE1
C A 0072 ASP OD2 11.47 C A 0074 GLU OE2
C A 0073 ARG NH2 10.85 C A 0076 LYS NZ
HB_MM 2.00 3.20 112
C A 0002 GLY N 2.206 C A 0001 MET O
C A 0003 LYS N 2.204 C A 0002 GLY O
C A 0004 GLY N 2.205 C A 0003 LYS O
C A 0005 ASP N 2.205 C A 0004 GLY O
C A 0006 PRO N 2.229 C A 0005 ASP O
C A 0007 ASN N 2.205 C A 0006 PRO O
C A 0008 LYS N 2.205 C A 0007 ASN O
C A 0009 PRO N 2.231 C A 0008 LYS O
C A 0010 ARG N 2.205 C A 0009 PRO O
C A 0011 GLY N 2.206 C A 0010 ARG O
C A 0012 LYS N 2.205 C A 0011 GLY O
C A 0013 MET N 2.205 C A 0012 LYS O
H A 0014 SER N 2.205 C A 0013 MET O
H A 0015 SER N 2.205 H A 0014 SER O
H A 0016 TYR N 2.205 H A 0015 SER O
H A 0017 ALA N 2.205 H A 0016 TYR O
H A 0018 PHE N 2.205 H A 0017 ALA O
H A 0019 PHE N 3.145 H A 0015 SER O
H A 0019 PHE N 2.206 H A 0018 PHE O
H A 0020 VAL N 2.205 H A 0019 PHE O
H A 0021 GLN N 3.128 H A 0017 ALA O
H A 0021 GLN N 2.206 H A 0020 VAL O
H A 0022 THR N 2.745 H A 0018 PHE O
H A 0022 THR N 2.206 H A 0021 GLN O
H A 0023 SER N 2.786 H A 0019 PHE O
H A 0023 SER N 2.204 H A 0022 THR O
H A 0024 ARG N 2.957 H A 0020 VAL O
H A 0024 ARG N 2.206 H A 0023 SER O
H A 0025 GLU N 2.204 H A 0024 ARG O
H A 0026 GLU N 2.205 H A 0025 GLU O
H A 0027 HIS N 3.123 H A 0024 ARG O
H A 0027 HIS N 2.205 H A 0026 GLU O
H A 0028 LYS N 2.205 H A 0027 HIS O
H A 0029 LYS N 2.992 H A 0027 HIS O
H A 0029 LYS N 2.206 H A 0028 LYS O
H A 0030 LYS N 2.971 H A 0027 HIS O
H A 0030 LYS N 3.037 H A 0028 LYS O
H A 0030 LYS N 2.205 H A 0029 LYS O
H A 0031 HIS N 2.871 H A 0027 HIS O
H A 0031 HIS N 2.205 H A 0030 LYS O
C A 0032 PRO N 2.228 H A 0031 HIS O
C A 0033 ASP N 2.206 C A 0032 PRO O
C A 0034 SER N 2.205 C A 0033 ASP O
C A 0035 SER N 2.205 C A 0034 SER O
C A 0036 VAL N 2.205 C A 0035 SER O
H A 0037 ASN N 2.206 C A 0036 VAL O
H A 0038 PHE N 2.204 H A 0037 ASN O
H A 0039 ALA N 2.191 H A 0038 PHE O
H A 0040 GLU N 2.201 H A 0039 ALA O
H A 0041 PHE N 2.958 H A 0039 ALA O
H A 0041 PHE N 2.209 H A 0040 GLU O
H A 0042 SER N 2.509 H A 0038 PHE O
H A 0042 SER N 2.201 H A 0041 PHE O
H A 0043 LYS N 2.899 H A 0041 PHE O
H A 0043 LYS N 2.207 H A 0042 SER O
H A 0044 LYS N 2.829 H A 0041 PHE O
H A 0044 LYS N 2.206 H A 0043 LYS O
H A 0045 CYS N 2.939 H A 0041 PHE O
H A 0045 CYS N 2.206 H A 0044 LYS O
H A 0046 SER N 3.180 H A 0042 SER O
H A 0046 SER N 3.139 H A 0044 LYS O
H A 0046 SER N 2.206 H A 0045 CYS O
H A 0047 GLU N 3.007 H A 0044 LYS O
H A 0047 GLU N 2.205 H A 0046 SER O
H A 0048 ARG N 2.205 H A 0047 GLU O
H A 0049 TRP N 2.759 H A 0045 CYS O
H A 0049 TRP N 2.205 H A 0048 ARG O
H A 0050 LYS N 2.931 H A 0046 SER O
H A 0050 LYS N 2.205 H A 0049 TRP O
H A 0051 THR N 3.053 H A 0048 ARG O
H A 0051 THR N 2.205 H A 0050 LYS O
H A 0052 MET N 2.600 H A 0048 ARG O
H A 0052 MET N 2.205 H A 0051 THR O
H A 0053 SER N 2.206 H A 0052 MET O
H A 0054 ALA N 2.205 H A 0053 SER O
H A 0055 LYS N 2.206 H A 0054 ALA O
H A 0056 GLU N 2.204 H A 0055 LYS O
H A 0057 LYS N 2.834 H A 0053 SER O
H A 0057 LYS N 2.205 H A 0056 GLU O
H A 0058 SER N 3.026 H A 0054 ALA O
H A 0058 SER N 3.068 H A 0056 GLU O
H A 0058 SER N 2.206 H A 0057 LYS O
H A 0059 LYS N 3.100 H A 0056 GLU O
H A 0059 LYS N 3.116 H A 0057 LYS O
H A 0059 LYS N 2.205 H A 0058 SER O
H A 0060 PHE N 2.967 H A 0057 LYS O
H A 0060 PHE N 2.205 H A 0059 LYS O
H A 0061 GLU N 2.919 H A 0057 LYS O
H A 0061 GLU N 2.204 H A 0060 PHE O
H A 0062 ASP N 3.078 H A 0058 SER O
H A 0062 ASP N 2.205 H A 0061 GLU O
H A 0063 MET N 2.205 H A 0062 ASP O
H A 0064 ALA N 3.148 H A 0060 PHE O
H A 0064 ALA N 2.205 H A 0063 MET O
H A 0065 LYS N 2.205 H A 0064 ALA O
H A 0066 SER N 2.205 H A 0065 LYS O
H A 0067 ASP N 2.206 H A 0066 SER O
H A 0068 LYS N 2.916 H A 0064 ALA O
H A 0068 LYS N 2.206 H A 0067 ASP O
H A 0069 ALA N 3.069 H A 0065 LYS O
H A 0069 ALA N 2.204 H A 0068 LYS O
H A 0070 ARG N 3.177 H A 0067 ASP O
H A 0070 ARG N 2.205 H A 0069 ALA O
H A 0071 TYR N 3.143 H A 0069 ALA O
H A 0071 TYR N 2.204 H A 0070 ARG O
C A 0072 ASP N 3.021 H A 0069 ALA O
C A 0072 ASP N 2.206 H A 0071 TYR O
C A 0073 ARG N 2.205 C A 0072 ASP O
C A 0074 GLU N 2.205 C A 0073 ARG O
C A 0075 MET N 2.204 C A 0074 GLU O
C A 0076 LYS N 2.205 C A 0075 MET O
C A 0077 ASN N 2.206 C A 0076 LYS O
HB_MS 2.00 3.20 15
H A 0015 SER N 2.610 H A 0014 SER OG
H A 0016 TYR N 3.030 H A 0015 SER OG
H A 0018 PHE O 2.560 H A 0022 THR OG1
H A 0019 PHE O 2.638 H A 0023 SER OG
H A 0030 LYS O 2.578 H A 0031 HIS ND1
C A 0033 ASP O 2.841 C A 0034 SER OG
H A 0038 PHE O 2.546 H A 0042 SER OG
H A 0043 LYS N 3.011 H A 0042 SER OG
H A 0043 LYS O 2.565 H A 0046 SER OG
H A 0047 GLU N 2.874 H A 0046 SER OG
H A 0047 GLU O 2.668 H A 0051 THR OG1
H A 0048 ARG O 2.714 H A 0051 THR OG1
H A 0054 ALA O 2.732 H A 0058 SER OG
H A 0055 LYS O 2.813 H A 0058 SER OG
H A 0059 LYS N 3.123 H A 0058 SER OG
HB_SS 2.00 3.20 1
H A 0025 GLU OE1 2.607 H A 0021 GLN NE2
AROMATIC 0.00 8.00 6
H A 0049 TRP 5.546 H A 0060 PHE
C A 0012 LYS 5.492 H A 0071 TYR
H A 0027 HIS 5.467 H A 0041 PHE
H A 0050 LYS 7.784 H A 0016 TYR
H A 0024 ARG 5.833 H A 0038 PHE
H A 0048 ARG 7.910 H A 0019 PHE