Complet list of 1hma con file
Complete list of 1hma.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 366
C A 0002 SER C 2.423 C A 0003 ASP CA
C A 0002 SER C 3.277 C A 0003 ASP C
C A 0002 SER C 3.609 C A 0003 ASP CB
C A 0003 ASP C 2.423 C A 0004 LYS CA
C A 0003 ASP C 2.965 C A 0004 LYS C
C A 0003 ASP C 3.695 C A 0004 LYS CB
C A 0003 ASP C 3.727 H A 0070 PHE CD1
C A 0004 LYS CA 2.813 C A 0005 PRO CD
C A 0004 LYS C 2.440 C A 0005 PRO CA
C A 0004 LYS C 3.153 C A 0005 PRO C
C A 0004 LYS C 3.606 C A 0005 PRO CB
C A 0004 LYS C 3.642 C A 0005 PRO CG
C A 0004 LYS C 2.455 C A 0005 PRO CD
C A 0004 LYS CG 3.618 C A 0005 PRO CD
C A 0004 LYS CE 3.756 C A 0007 ARG CD
C A 0004 LYS CA 3.416 H A 0070 PHE CD1
C A 0004 LYS CA 3.600 H A 0070 PHE CE1
C A 0004 LYS CD 3.722 H A 0070 PHE CE1
C A 0004 LYS CD 3.787 H A 0070 PHE CZ
C A 0005 PRO C 2.420 C A 0006 LYS CA
C A 0005 PRO C 3.024 C A 0006 LYS C
C A 0005 PRO C 3.669 C A 0006 LYS CB
C A 0005 PRO CG 3.639 H A 0067 VAL CA
C A 0005 PRO CG 3.345 H A 0067 VAL CG1
C A 0005 PRO CD 3.601 H A 0070 PHE CB
C A 0005 PRO CD 3.514 H A 0070 PHE CG
C A 0005 PRO CD 3.538 H A 0070 PHE CD1
C A 0006 LYS C 2.423 C A 0007 ARG CA
C A 0006 LYS C 2.912 C A 0007 ARG C
C A 0006 LYS C 3.691 C A 0007 ARG CB
C A 0007 ARG CA 2.770 C A 0008 PRO CD
C A 0007 ARG C 2.448 C A 0008 PRO CA
C A 0007 ARG C 3.125 C A 0008 PRO C
C A 0007 ARG C 3.623 C A 0008 PRO CB
C A 0007 ARG C 3.647 C A 0008 PRO CG
C A 0007 ARG C 2.448 C A 0008 PRO CD
C A 0007 ARG CB 3.375 C A 0008 PRO CD
C A 0007 ARG CA 3.691 H A 0063 TYR CD1
C A 0007 ARG CA 3.598 H A 0063 TYR CE1
C A 0008 PRO C 2.421 C A 0009 LEU CA
C A 0008 PRO C 3.627 C A 0009 LEU C
C A 0008 PRO C 3.245 C A 0009 LEU CB
C A 0008 PRO C 3.541 C A 0009 LEU CD2
C A 0008 PRO CG 3.164 H A 0063 TYR CD2
C A 0008 PRO CG 3.091 H A 0063 TYR CE2
C A 0008 PRO CG 3.704 H A 0063 TYR CZ
C A 0008 PRO CD 3.335 H A 0063 TYR CG
C A 0008 PRO CD 3.387 H A 0063 TYR CD1
C A 0008 PRO CD 3.168 H A 0063 TYR CD2
C A 0008 PRO CD 3.266 H A 0063 TYR CE1
C A 0008 PRO CD 3.040 H A 0063 TYR CE2
C A 0008 PRO CD 3.086 H A 0063 TYR CZ
C A 0009 LEU CA 3.798 C A 0010 SER CA
C A 0009 LEU C 2.428 C A 0010 SER CA
C A 0009 LEU C 3.143 C A 0010 SER C
C A 0009 LEU C 3.671 C A 0010 SER CB
C A 0009 LEU CD1 2.917 H A 0013 MET CB
C A 0009 LEU CG 3.097 H A 0014 LEU CD2
C A 0009 LEU CD1 3.223 H A 0014 LEU CD2
C A 0009 LEU CD2 3.265 H A 0014 LEU CD2
C A 0010 SER C 2.430 H A 0011 ALA CA
C A 0010 SER C 3.022 H A 0011 ALA C
C A 0010 SER C 3.698 H A 0011 ALA CB
C A 0010 SER CB 3.751 H A 0013 MET CG
H A 0011 ALA C 2.419 H A 0012 TYR CA
H A 0011 ALA C 2.884 H A 0012 TYR C
H A 0011 ALA C 3.667 H A 0012 TYR CB
H A 0011 ALA CA 3.686 H A 0014 LEU CG
H A 0011 ALA C 3.649 H A 0043 TRP CZ3
H A 0011 ALA C 3.339 H A 0043 TRP CH2
H A 0011 ALA CB 3.622 H A 0043 TRP CH2
H A 0011 ALA CB 3.372 H A 0053 GLU CA
H A 0011 ALA CB 3.042 H A 0053 GLU CG
H A 0012 TYR C 2.417 H A 0013 MET CA
H A 0012 TYR C 3.118 H A 0013 MET C
H A 0012 TYR C 3.664 H A 0013 MET CB
H A 0012 TYR CE1 3.493 H A 0016 LEU CD2
H A 0012 TYR CZ 3.269 H A 0016 LEU CD2
H A 0012 TYR CE1 3.542 H A 0039 GLY C
H A 0012 TYR CZ 3.659 H A 0039 GLY C
H A 0012 TYR CE1 3.724 H A 0040 GLY CA
H A 0012 TYR CA 3.796 H A 0043 TRP CD2
H A 0012 TYR CA 3.557 H A 0043 TRP CE3
H A 0012 TYR CA 3.742 H A 0043 TRP CZ2
H A 0012 TYR CA 3.406 H A 0043 TRP CZ3
H A 0012 TYR CA 3.508 H A 0043 TRP CH2
H A 0012 TYR CD1 3.397 H A 0043 TRP CB
H A 0012 TYR CD1 3.238 H A 0043 TRP CG
H A 0012 TYR CD1 3.396 H A 0043 TRP CD2
H A 0012 TYR CD1 3.733 H A 0043 TRP CE3
H A 0012 TYR CE1 3.350 H A 0043 TRP CB
H A 0012 TYR CE1 3.765 H A 0043 TRP CG
H A 0013 MET C 2.414 H A 0014 LEU CA
H A 0013 MET C 2.836 H A 0014 LEU C
H A 0013 MET C 3.703 H A 0014 LEU CB
H A 0013 MET CA 3.760 H A 0016 LEU CB
H A 0013 MET C 3.710 H A 0016 LEU CB
H A 0013 MET CE 3.601 H A 0016 LEU CB
H A 0014 LEU C 2.412 H A 0015 TRP CA
H A 0014 LEU C 2.950 H A 0015 TRP C
H A 0014 LEU C 3.689 H A 0015 TRP CB
H A 0014 LEU CA 3.792 H A 0052 TRP CE3
H A 0014 LEU C 3.417 H A 0052 TRP CE3
H A 0014 LEU C 3.570 H A 0052 TRP CZ3
H A 0014 LEU CB 3.624 H A 0052 TRP CB
H A 0014 LEU CB 3.570 H A 0052 TRP CD2
H A 0014 LEU CB 2.933 H A 0052 TRP CE3
H A 0014 LEU CB 3.760 H A 0052 TRP CZ3
H A 0014 LEU CG 3.716 H A 0052 TRP CB
H A 0014 LEU CD1 3.633 H A 0052 TRP CA
H A 0014 LEU CD1 3.538 H A 0052 TRP C
H A 0014 LEU CD1 3.499 H A 0052 TRP CB
H A 0015 TRP C 2.427 H A 0016 LEU CA
H A 0015 TRP C 2.916 H A 0016 LEU C
H A 0015 TRP C 3.691 H A 0016 LEU CB
H A 0015 TRP CE3 3.731 H A 0016 LEU CA
H A 0015 TRP CE3 3.326 H A 0016 LEU CD2
H A 0015 TRP CZ3 3.250 H A 0016 LEU CD2
H A 0015 TRP CE2 3.724 H A 0019 ALA CB
H A 0015 TRP CZ2 3.650 H A 0019 ALA CB
H A 0015 TRP CZ3 3.319 H A 0039 GLY CA
H A 0015 TRP CZ3 3.319 H A 0039 GLY C
H A 0015 TRP CH2 3.429 H A 0039 GLY CA
H A 0015 TRP CH2 3.600 H A 0039 GLY C
H A 0015 TRP CZ2 3.130 H A 0042 LEU CB
H A 0015 TRP CH2 3.382 H A 0042 LEU CB
H A 0015 TRP CB 3.102 H A 0043 TRP CE3
H A 0015 TRP CB 3.132 H A 0043 TRP CZ3
H A 0015 TRP CG 3.581 H A 0043 TRP CE3
H A 0015 TRP CG 3.501 H A 0046 MET CE
H A 0015 TRP CD1 3.307 H A 0046 MET CE
H A 0015 TRP CA 3.679 H A 0052 TRP CD2
H A 0015 TRP CA 3.397 H A 0052 TRP CE2
H A 0015 TRP CA 3.436 H A 0052 TRP CZ2
H A 0015 TRP CA 3.734 H A 0052 TRP CH2
H A 0015 TRP CB 3.351 H A 0052 TRP CE2
H A 0015 TRP CB 3.729 H A 0052 TRP CZ2
H A 0015 TRP CD1 3.692 H A 0052 TRP CZ2
H A 0016 LEU C 2.423 H A 0017 ASN CA
H A 0016 LEU C 3.094 H A 0017 ASN C
H A 0016 LEU C 3.670 H A 0017 ASN CB
H A 0017 ASN C 2.420 H A 0018 SER CA
H A 0017 ASN C 3.090 H A 0018 SER C
H A 0017 ASN C 3.672 H A 0018 SER CB
H A 0018 SER C 2.420 H A 0019 ALA CA
H A 0018 SER C 3.509 H A 0019 ALA C
H A 0018 SER C 3.429 H A 0019 ALA CB
H A 0018 SER CB 3.120 H A 0052 TRP CH2
H A 0019 ALA C 2.418 H A 0020 ARG CA
H A 0019 ALA C 2.974 H A 0020 ARG C
H A 0019 ALA C 3.697 H A 0020 ARG CB
H A 0019 ALA C 3.742 H A 0023 ILE CB
H A 0019 ALA C 3.549 H A 0023 ILE CG1
H A 0019 ALA C 3.620 H A 0023 ILE CD1
H A 0019 ALA CB 3.763 H A 0023 ILE CG1
H A 0019 ALA CB 3.676 H A 0023 ILE CD1
H A 0020 ARG C 2.415 H A 0021 GLU CA
H A 0020 ARG C 3.097 H A 0021 GLU C
H A 0020 ARG C 3.673 H A 0021 GLU CB
H A 0021 GLU C 2.414 H A 0022 SER CA
H A 0021 GLU C 3.064 H A 0022 SER C
H A 0021 GLU C 3.677 H A 0022 SER CB
H A 0022 SER C 2.420 H A 0023 ILE CA
H A 0022 SER C 3.204 H A 0023 ILE C
H A 0022 SER C 3.638 H A 0023 ILE CB
H A 0023 ILE C 2.409 H A 0024 LYS CA
H A 0023 ILE C 3.049 H A 0024 LYS C
H A 0023 ILE C 3.656 H A 0024 LYS CB
H A 0023 ILE CG2 3.795 H A 0035 VAL CG1
H A 0024 LYS C 2.426 H A 0025 ARG CA
H A 0024 LYS C 3.014 H A 0025 ARG C
H A 0024 LYS C 3.700 H A 0025 ARG CB
H A 0025 ARG C 2.421 H A 0026 GLU CA
H A 0025 ARG C 2.947 H A 0026 GLU C
H A 0025 ARG C 3.692 H A 0026 GLU CB
H A 0026 GLU C 2.422 H A 0027 ASN CA
H A 0026 GLU C 3.232 H A 0027 ASN C
H A 0026 GLU C 3.633 H A 0027 ASN CB
H A 0027 ASN CA 2.764 C A 0028 PRO CD
H A 0027 ASN C 2.440 C A 0028 PRO CA
H A 0027 ASN C 3.160 C A 0028 PRO C
H A 0027 ASN C 3.598 C A 0028 PRO CB
H A 0027 ASN C 3.632 C A 0028 PRO CG
H A 0027 ASN C 2.444 C A 0028 PRO CD
H A 0027 ASN CB 3.311 C A 0028 PRO CD
H A 0027 ASN CB 3.767 C A 0030 ILE CB
H A 0027 ASN CB 3.531 C A 0030 ILE CG2
C A 0028 PRO C 2.416 C A 0029 GLY CA
C A 0028 PRO C 2.803 C A 0029 GLY C
C A 0029 GLY C 2.433 C A 0030 ILE CA
C A 0029 GLY C 2.832 C A 0030 ILE C
C A 0029 GLY C 3.637 C A 0030 ILE CB
C A 0030 ILE C 2.420 C A 0031 LYS CA
C A 0030 ILE C 3.056 C A 0031 LYS C
C A 0030 ILE C 3.676 C A 0031 LYS CB
C A 0030 ILE CG1 3.721 H A 0034 GLU C
C A 0030 ILE CG1 3.338 H A 0034 GLU CB
C A 0030 ILE CD1 3.258 H A 0034 GLU C
C A 0030 ILE CD1 3.474 H A 0034 GLU CB
C A 0030 ILE CG2 2.963 H A 0035 VAL CG2
C A 0031 LYS C 2.417 C A 0032 VAL CA
C A 0031 LYS C 3.024 C A 0032 VAL C
C A 0031 LYS C 3.687 C A 0032 VAL CB
C A 0031 LYS CD 3.224 H A 0034 GLU CD
C A 0031 LYS CE 3.191 H A 0034 GLU CD
C A 0031 LYS C 3.645 H A 0035 VAL CG2
C A 0032 VAL C 2.421 H A 0033 THR CA
C A 0032 VAL C 3.101 H A 0033 THR C
C A 0032 VAL C 3.678 H A 0033 THR CB
H A 0033 THR C 2.422 H A 0034 GLU CA
H A 0033 THR C 3.223 H A 0034 GLU C
H A 0033 THR C 3.636 H A 0034 GLU CB
H A 0034 GLU C 2.422 H A 0035 VAL CA
H A 0034 GLU C 3.089 H A 0035 VAL C
H A 0034 GLU C 3.673 H A 0035 VAL CB
H A 0035 VAL C 2.420 H A 0036 ALA CA
H A 0035 VAL C 3.142 H A 0036 ALA C
H A 0035 VAL C 3.664 H A 0036 ALA CB
H A 0036 ALA C 2.419 H A 0037 LYS CA
H A 0036 ALA C 2.956 H A 0037 LYS C
H A 0036 ALA C 3.678 H A 0037 LYS CB
H A 0037 LYS C 2.419 H A 0038 ARG CA
H A 0037 LYS C 3.156 H A 0038 ARG C
H A 0037 LYS C 3.649 H A 0038 ARG CB
H A 0038 ARG C 2.421 H A 0039 GLY CA
H A 0038 ARG C 2.977 H A 0039 GLY C
H A 0039 GLY C 2.424 H A 0040 GLY CA
H A 0039 GLY C 3.119 H A 0040 GLY C
H A 0040 GLY C 2.422 H A 0041 GLU CA
H A 0040 GLY C 3.092 H A 0041 GLU C
H A 0040 GLY C 3.684 H A 0041 GLU CB
H A 0041 GLU C 2.422 H A 0042 LEU CA
H A 0041 GLU C 3.018 H A 0042 LEU C
H A 0041 GLU C 3.688 H A 0042 LEU CB
H A 0041 GLU C 3.769 H A 0045 ALA CB
H A 0042 LEU C 2.425 H A 0043 TRP CA
H A 0042 LEU C 2.908 H A 0043 TRP C
H A 0042 LEU C 3.690 H A 0043 TRP CB
H A 0043 TRP C 2.421 H A 0044 ARG CA
H A 0043 TRP C 3.243 H A 0044 ARG C
H A 0043 TRP C 3.628 H A 0044 ARG CB
H A 0043 TRP CA 3.542 H A 0046 MET CE
H A 0043 TRP C 3.516 H A 0046 MET CG
H A 0043 TRP C 3.726 H A 0046 MET CE
H A 0043 TRP CD2 3.611 H A 0046 MET CE
H A 0043 TRP CE3 3.076 H A 0046 MET CE
H A 0043 TRP CZ3 3.583 H A 0046 MET CE
H A 0043 TRP CE2 3.286 H A 0049 LYS CG
H A 0043 TRP CZ2 3.254 H A 0049 LYS CB
H A 0043 TRP CZ2 2.906 H A 0049 LYS CG
H A 0043 TRP CH2 3.783 H A 0049 LYS CB
H A 0043 TRP CZ3 3.627 H A 0052 TRP CG
H A 0043 TRP CZ3 2.990 H A 0052 TRP CD1
H A 0043 TRP CH2 3.355 H A 0052 TRP CD1
H A 0044 ARG C 2.421 H A 0045 ALA CA
H A 0044 ARG C 3.364 H A 0045 ALA C
H A 0044 ARG C 3.556 H A 0045 ALA CB
H A 0045 ALA C 2.414 H A 0046 MET CA
H A 0045 ALA C 3.163 H A 0046 MET C
H A 0045 ALA C 3.626 H A 0046 MET CB
H A 0046 MET C 2.418 C A 0047 LYS CA
H A 0046 MET C 3.357 C A 0047 LYS C
H A 0046 MET C 3.537 C A 0047 LYS CB
C A 0047 LYS C 2.423 C A 0048 ASP CA
C A 0047 LYS C 3.654 C A 0048 ASP C
C A 0047 LYS C 3.176 C A 0048 ASP CB
C A 0047 LYS C 3.252 C A 0048 ASP CG
C A 0048 ASP C 2.421 H A 0049 LYS CA
C A 0048 ASP C 3.394 H A 0049 LYS C
C A 0048 ASP C 3.533 H A 0049 LYS CB
C A 0048 ASP C 3.566 H A 0049 LYS CG
C A 0048 ASP C 3.686 H A 0049 LYS CD
H A 0049 LYS C 2.419 H A 0050 SER CA
H A 0049 LYS C 2.847 H A 0050 SER C
H A 0049 LYS C 3.682 H A 0050 SER CB
H A 0050 SER C 2.421 H A 0051 GLU CA
H A 0050 SER C 2.983 H A 0051 GLU C
H A 0050 SER C 3.669 H A 0051 GLU CB
H A 0051 GLU C 2.417 H A 0052 TRP CA
H A 0051 GLU C 3.027 H A 0052 TRP C
H A 0051 GLU C 3.670 H A 0052 TRP CB
H A 0052 TRP C 2.437 H A 0053 GLU CA
H A 0052 TRP C 2.812 H A 0053 GLU C
H A 0052 TRP C 3.662 H A 0053 GLU CB
H A 0052 TRP CA 3.701 H A 0055 LYS CB
H A 0052 TRP C 3.636 H A 0055 LYS CB
H A 0053 GLU C 2.414 H A 0054 ALA CA
H A 0053 GLU C 2.914 H A 0054 ALA C
H A 0053 GLU C 3.691 H A 0054 ALA CB
H A 0054 ALA C 2.426 H A 0055 LYS CA
H A 0054 ALA C 2.933 H A 0055 LYS C
H A 0054 ALA C 3.688 H A 0055 LYS CB
H A 0055 LYS C 2.418 H A 0056 ALA CA
H A 0055 LYS C 2.941 H A 0056 ALA C
H A 0055 LYS C 3.695 H A 0056 ALA CB
H A 0056 ALA C 2.418 H A 0057 ALA CA
H A 0056 ALA C 2.885 H A 0057 ALA C
H A 0056 ALA C 3.687 H A 0057 ALA CB
H A 0057 ALA C 2.423 H A 0058 LYS CA
H A 0057 ALA C 2.872 H A 0058 LYS C
H A 0057 ALA C 3.688 H A 0058 LYS CB
H A 0057 ALA C 3.556 H A 0060 LYS CB
H A 0058 LYS C 2.408 H A 0059 ALA CA
H A 0058 LYS C 2.841 H A 0059 ALA C
H A 0058 LYS C 3.696 H A 0059 ALA CB
H A 0059 ALA C 2.416 H A 0060 LYS CA
H A 0059 ALA C 2.904 H A 0060 LYS C
H A 0059 ALA C 3.659 H A 0060 LYS CB
H A 0059 ALA C 3.513 H A 0063 TYR CB
H A 0060 LYS CA 3.798 H A 0061 ASP CA
H A 0060 LYS C 2.411 H A 0061 ASP CA
H A 0060 LYS C 2.954 H A 0061 ASP C
H A 0060 LYS C 3.681 H A 0061 ASP CB
H A 0060 LYS C 3.788 H A 0063 TYR CB
H A 0061 ASP C 2.425 H A 0062 ASP CA
H A 0061 ASP C 3.074 H A 0062 ASP C
H A 0061 ASP C 3.675 H A 0062 ASP CB
H A 0062 ASP C 2.424 H A 0063 TYR CA
H A 0062 ASP C 3.315 H A 0063 TYR C
H A 0062 ASP C 3.562 H A 0063 TYR CB
H A 0063 TYR C 2.409 H A 0064 ASP CA
H A 0063 TYR C 3.022 H A 0064 ASP C
H A 0063 TYR C 3.656 H A 0064 ASP CB
H A 0063 TYR C 3.608 H A 0067 VAL CG1
H A 0063 TYR CD1 3.068 H A 0067 VAL CG1
H A 0063 TYR CE1 2.918 H A 0067 VAL CG1
H A 0063 TYR CZ 3.575 H A 0067 VAL CG1
H A 0064 ASP CA 3.792 H A 0065 ARG CA
H A 0064 ASP C 2.417 H A 0065 ARG CA
H A 0064 ASP C 3.150 H A 0065 ARG C
H A 0064 ASP C 3.660 H A 0065 ARG CB
H A 0064 ASP CA 3.791 H A 0067 VAL CG2
H A 0064 ASP C 3.612 H A 0067 VAL CG2
H A 0065 ARG C 2.426 H A 0066 ALA CA
H A 0065 ARG C 3.156 H A 0066 ALA C
H A 0065 ARG C 3.670 H A 0066 ALA CB
H A 0066 ALA C 2.406 H A 0067 VAL CA
H A 0066 ALA C 2.816 H A 0067 VAL C
H A 0066 ALA C 3.670 H A 0067 VAL CB
H A 0067 VAL C 2.414 H A 0068 LYS CA
H A 0067 VAL C 2.843 H A 0068 LYS C
H A 0067 VAL C 3.687 H A 0068 LYS CB
H A 0067 VAL CA 3.559 H A 0070 PHE CB
H A 0067 VAL C 3.555 H A 0070 PHE CB
H A 0068 LYS C 2.432 H A 0069 GLU CA
H A 0068 LYS C 2.931 H A 0069 GLU C
H A 0068 LYS C 3.689 H A 0069 GLU CB
H A 0069 GLU C 2.448 H A 0070 PHE CA
H A 0069 GLU C 3.067 H A 0070 PHE C
H A 0069 GLU C 3.640 H A 0070 PHE CB
H A 0070 PHE CA 3.792 H A 0071 GLU CA
H A 0070 PHE C 2.401 H A 0071 GLU CA
H A 0070 PHE C 3.247 H A 0071 GLU C
H A 0070 PHE C 3.583 H A 0071 GLU CB
H A 0070 PHE C 3.770 H A 0071 GLU CG
H A 0070 PHE CD2 3.262 H A 0071 GLU CG
H A 0070 PHE CE2 3.789 H A 0071 GLU CG
H A 0071 GLU CA 3.792 H A 0072 ALA CA
H A 0071 GLU C 2.421 H A 0072 ALA CA
H A 0071 GLU C 3.216 H A 0072 ALA C
H A 0071 GLU C 3.600 H A 0072 ALA CB
H A 0072 ALA C 2.422 H A 0073 ASN CA
H A 0072 ALA C 3.421 H A 0073 ASN C
H A 0072 ALA C 3.512 H A 0073 ASN CB
H A 0073 ASN C 2.424 C A 0074 GLY CA
H A 0073 ASN C 2.849 C A 0074 GLY C
CHARGE_ATTR 2.00 12.00 89
C A 0003 ASP OD1 10.11 C A 0004 LYS NZ
C A 0003 ASP OD2 8.324 C A 0004 LYS NZ
C A 0003 ASP OD1 11.00 C A 0006 LYS NZ
C A 0003 ASP OD2 9.897 C A 0006 LYS NZ
C A 0003 ASP OD1 11.96 C A 0007 ARG NH1
C A 0003 ASP OD1 10.99 C A 0007 ARG NH2
C A 0003 ASP OD2 9.908 C A 0007 ARG NH1
C A 0003 ASP OD2 8.895 C A 0007 ARG NH2
H A 0021 GLU OE2 11.02 H A 0020 ARG NH1
H A 0021 GLU OE2 11.69 H A 0020 ARG NH2
H A 0021 GLU OE1 8.641 H A 0024 LYS NZ
H A 0021 GLU OE2 9.294 H A 0024 LYS NZ
H A 0021 GLU OE1 7.435 H A 0025 ARG NH1
H A 0021 GLU OE1 9.011 H A 0025 ARG NH2
H A 0021 GLU OE2 9.588 H A 0025 ARG NH1
H A 0021 GLU OE2 11.11 H A 0025 ARG NH2
H A 0026 GLU OE1 9.996 H A 0025 ARG NH1
H A 0026 GLU OE1 8.423 H A 0025 ARG NH2
H A 0026 GLU OE2 9.849 H A 0025 ARG NH1
H A 0026 GLU OE2 7.938 H A 0025 ARG NH2
H A 0026 GLU OE1 11.53 H A 0038 ARG NH1
H A 0026 GLU OE1 11.58 H A 0038 ARG NH2
H A 0034 GLU OE1 3.285 C A 0031 LYS NZ
H A 0034 GLU OE2 2.901 C A 0031 LYS NZ
H A 0034 GLU OE1 8.741 H A 0037 LYS NZ
H A 0034 GLU OE2 9.094 H A 0037 LYS NZ
H A 0034 GLU OE1 8.302 H A 0038 ARG NH1
H A 0034 GLU OE1 6.174 H A 0038 ARG NH2
H A 0034 GLU OE2 9.899 H A 0038 ARG NH1
H A 0034 GLU OE2 7.846 H A 0038 ARG NH2
H A 0041 GLU OE1 10.56 H A 0037 LYS NZ
H A 0041 GLU OE2 9.391 H A 0037 LYS NZ
H A 0041 GLU OE1 5.680 H A 0038 ARG NH1
H A 0041 GLU OE1 7.358 H A 0038 ARG NH2
H A 0041 GLU OE2 4.612 H A 0038 ARG NH1
H A 0041 GLU OE2 5.865 H A 0038 ARG NH2
H A 0041 GLU OE1 11.13 H A 0044 ARG NH2
C A 0048 ASP OD1 8.906 H A 0044 ARG NH1
C A 0048 ASP OD1 8.661 H A 0044 ARG NH2
C A 0048 ASP OD2 10.95 H A 0044 ARG NH1
C A 0048 ASP OD2 10.70 H A 0044 ARG NH2
C A 0048 ASP OD1 8.942 C A 0047 LYS NZ
C A 0048 ASP OD2 7.688 C A 0047 LYS NZ
C A 0048 ASP OD1 6.888 H A 0049 LYS NZ
C A 0048 ASP OD2 8.708 H A 0049 LYS NZ
H A 0051 GLU OE1 6.494 C A 0047 LYS NZ
H A 0051 GLU OE2 5.767 C A 0047 LYS NZ
H A 0051 GLU OE2 11.02 H A 0049 LYS NZ
H A 0051 GLU OE1 10.27 H A 0055 LYS NZ
H A 0051 GLU OE2 11.12 H A 0055 LYS NZ
H A 0053 GLU OE2 11.41 H A 0044 ARG NH1
H A 0053 GLU OE1 7.206 H A 0049 LYS NZ
H A 0053 GLU OE2 5.139 H A 0049 LYS NZ
H A 0053 GLU OE1 10.58 H A 0060 LYS NZ
H A 0061 ASP OD1 9.256 H A 0058 LYS NZ
H A 0061 ASP OD2 7.396 H A 0058 LYS NZ
H A 0061 ASP OD1 11.09 H A 0060 LYS NZ
H A 0061 ASP OD2 11.61 H A 0060 LYS NZ
H A 0061 ASP OD1 8.014 H A 0065 ARG NH1
H A 0061 ASP OD1 7.829 H A 0065 ARG NH2
H A 0061 ASP OD2 9.409 H A 0065 ARG NH1
H A 0061 ASP OD2 8.981 H A 0065 ARG NH2
H A 0062 ASP OD1 10.74 C A 0006 LYS NZ
H A 0062 ASP OD2 9.368 C A 0006 LYS NZ
H A 0062 ASP OD2 10.21 H A 0055 LYS NZ
H A 0062 ASP OD1 6.629 H A 0058 LYS NZ
H A 0062 ASP OD2 5.432 H A 0058 LYS NZ
H A 0062 ASP OD1 9.061 H A 0065 ARG NH1
H A 0062 ASP OD1 9.393 H A 0065 ARG NH2
H A 0062 ASP OD2 11.06 H A 0065 ARG NH1
H A 0062 ASP OD2 11.51 H A 0065 ARG NH2
H A 0064 ASP OD1 9.348 H A 0060 LYS NZ
H A 0064 ASP OD2 10.84 H A 0060 LYS NZ
H A 0064 ASP OD1 10.54 H A 0065 ARG NH1
H A 0064 ASP OD1 11.35 H A 0065 ARG NH2
H A 0064 ASP OD2 8.659 H A 0065 ARG NH1
H A 0064 ASP OD2 9.341 H A 0065 ARG NH2
H A 0064 ASP OD1 9.584 H A 0068 LYS NZ
H A 0064 ASP OD2 7.974 H A 0068 LYS NZ
H A 0069 GLU OE1 7.797 H A 0065 ARG NH1
H A 0069 GLU OE1 9.834 H A 0065 ARG NH2
H A 0069 GLU OE2 5.799 H A 0065 ARG NH1
H A 0069 GLU OE2 7.757 H A 0065 ARG NH2
H A 0069 GLU OE1 11.06 H A 0068 LYS NZ
H A 0069 GLU OE2 9.886 H A 0068 LYS NZ
H A 0071 GLU OE1 10.43 C A 0004 LYS NZ
H A 0071 GLU OE2 9.216 C A 0004 LYS NZ
H A 0071 GLU OE1 8.440 H A 0068 LYS NZ
H A 0071 GLU OE2 10.27 H A 0068 LYS NZ
CHARGE_REPU 2.00 12.00 61
C A 0003 ASP OD1 10.66 H A 0069 GLU OE1
C A 0003 ASP OD2 11.53 H A 0069 GLU OE1
C A 0004 LYS NZ 3.597 C A 0007 ARG NH1
C A 0004 LYS NZ 4.856 C A 0007 ARG NH2
C A 0006 LYS NZ 11.06 C A 0007 ARG NH1
C A 0006 LYS NZ 9.006 C A 0007 ARG NH2
C A 0006 LYS NZ 8.876 H A 0055 LYS NZ
C A 0007 ARG NH1 10.29 H A 0020 ARG NH1
C A 0007 ARG NH2 9.689 H A 0020 ARG NH1
C A 0007 ARG NH2 11.84 H A 0020 ARG NH2
H A 0020 ARG NH1 10.01 H A 0024 LYS NZ
H A 0020 ARG NH2 9.274 H A 0024 LYS NZ
H A 0024 LYS NZ 10.28 H A 0025 ARG NH1
H A 0024 LYS NZ 11.69 H A 0025 ARG NH2
H A 0026 GLU OE1 8.698 H A 0041 GLU OE1
H A 0026 GLU OE1 8.317 H A 0041 GLU OE2
H A 0026 GLU OE2 10.01 H A 0041 GLU OE1
H A 0026 GLU OE2 9.910 H A 0041 GLU OE2
C A 0031 LYS NZ 11.67 H A 0037 LYS NZ
C A 0031 LYS NZ 11.27 H A 0038 ARG NH1
C A 0031 LYS NZ 9.047 H A 0038 ARG NH2
H A 0034 GLU OE1 10.64 H A 0041 GLU OE2
H A 0037 LYS NZ 6.279 H A 0038 ARG NH1
H A 0037 LYS NZ 6.461 H A 0038 ARG NH2
H A 0044 ARG NH1 6.590 H A 0049 LYS NZ
H A 0044 ARG NH2 7.493 H A 0049 LYS NZ
C A 0048 ASP OD1 8.686 H A 0051 GLU OE1
C A 0048 ASP OD1 7.271 H A 0051 GLU OE2
C A 0048 ASP OD2 7.655 H A 0051 GLU OE1
C A 0048 ASP OD2 6.589 H A 0051 GLU OE2
C A 0048 ASP OD1 9.925 H A 0053 GLU OE1
C A 0048 ASP OD1 8.724 H A 0053 GLU OE2
C A 0048 ASP OD2 10.40 H A 0053 GLU OE1
C A 0048 ASP OD2 9.579 H A 0053 GLU OE2
H A 0051 GLU OE1 11.53 H A 0053 GLU OE1
H A 0051 GLU OE1 11.20 H A 0053 GLU OE2
H A 0051 GLU OE2 11.47 H A 0053 GLU OE1
H A 0051 GLU OE2 10.75 H A 0053 GLU OE2
H A 0055 LYS NZ 10.05 H A 0058 LYS NZ
H A 0061 ASP OD1 4.353 H A 0062 ASP OD1
H A 0061 ASP OD1 6.068 H A 0062 ASP OD2
H A 0061 ASP OD2 3.899 H A 0062 ASP OD1
H A 0061 ASP OD2 5.325 H A 0062 ASP OD2
H A 0061 ASP OD1 8.243 H A 0064 ASP OD1
H A 0061 ASP OD1 7.313 H A 0064 ASP OD2
H A 0061 ASP OD2 10.22 H A 0064 ASP OD1
H A 0061 ASP OD2 9.418 H A 0064 ASP OD2
H A 0061 ASP OD1 11.64 H A 0069 GLU OE2
H A 0062 ASP OD1 11.03 H A 0064 ASP OD1
H A 0062 ASP OD1 10.40 H A 0064 ASP OD2
H A 0062 ASP OD2 11.83 H A 0064 ASP OD2
H A 0062 ASP OD1 11.43 H A 0069 GLU OE1
H A 0062 ASP OD1 10.57 H A 0069 GLU OE2
H A 0062 ASP OD2 11.88 H A 0069 GLU OE2
H A 0064 ASP OD1 7.869 H A 0071 GLU OE1
H A 0064 ASP OD1 9.690 H A 0071 GLU OE2
H A 0064 ASP OD2 8.219 H A 0071 GLU OE1
H A 0064 ASP OD2 10.25 H A 0071 GLU OE2
H A 0065 ARG NH1 7.294 H A 0068 LYS NZ
H A 0065 ARG NH2 8.345 H A 0068 LYS NZ
H A 0069 GLU OE1 11.90 H A 0071 GLU OE1
HB_MM 2.00 3.20 141
C A 0003 ASP N 2.197 C A 0002 SER O
C A 0004 LYS N 2.196 C A 0003 ASP O
C A 0005 PRO N 3.139 C A 0003 ASP O
C A 0005 PRO N 2.225 C A 0004 LYS O
C A 0006 LYS N 2.198 C A 0005 PRO O
C A 0007 ARG N 2.717 C A 0005 PRO O
C A 0007 ARG N 2.196 C A 0006 LYS O
C A 0008 PRO N 2.228 C A 0007 ARG O
C A 0009 LEU N 2.196 C A 0008 PRO O
C A 0010 SER N 2.196 C A 0009 LEU O
H A 0011 ALA N 2.204 C A 0010 SER O
H A 0012 TYR N 2.201 H A 0011 ALA O
H A 0013 MET N 3.112 C A 0010 SER O
H A 0013 MET N 2.695 H A 0011 ALA O
H A 0013 MET N 2.199 H A 0012 TYR O
H A 0014 LEU N 2.821 H A 0011 ALA O
H A 0014 LEU N 2.197 H A 0013 MET O
H A 0015 TRP N 3.066 H A 0013 MET O
H A 0015 TRP N 2.196 H A 0014 LEU O
H A 0016 LEU N 3.167 H A 0012 TYR O
H A 0016 LEU N 2.692 H A 0013 MET O
H A 0016 LEU N 2.198 H A 0015 TRP O
H A 0017 ASN N 2.955 H A 0013 MET O
H A 0017 ASN N 3.026 H A 0014 LEU O
H A 0017 ASN N 3.032 H A 0015 TRP O
H A 0017 ASN N 2.199 H A 0016 LEU O
H A 0018 SER N 3.158 H A 0014 LEU O
H A 0018 SER N 2.902 H A 0015 TRP O
H A 0018 SER N 2.195 H A 0017 ASN O
H A 0019 ALA N 2.924 H A 0015 TRP O
H A 0019 ALA N 3.146 H A 0017 ASN O
H A 0019 ALA N 2.195 H A 0018 SER O
H A 0020 ARG N 2.741 H A 0016 LEU O
H A 0020 ARG N 2.190 H A 0019 ALA O
H A 0021 GLU N 2.193 H A 0020 ARG O
H A 0022 SER N 2.193 H A 0021 GLU O
H A 0023 ILE N 2.585 H A 0019 ALA O
H A 0023 ILE N 3.088 H A 0021 GLU O
H A 0023 ILE N 2.197 H A 0022 SER O
H A 0024 LYS N 3.194 H A 0020 ARG O
H A 0024 LYS N 2.196 H A 0023 ILE O
H A 0025 ARG N 3.156 H A 0021 GLU O
H A 0025 ARG N 2.198 H A 0024 LYS O
H A 0026 GLU N 2.196 H A 0025 ARG O
H A 0027 ASN N 3.002 H A 0023 ILE O
H A 0027 ASN N 2.979 H A 0025 ARG O
H A 0027 ASN N 2.196 H A 0026 GLU O
C A 0028 PRO N 2.227 H A 0027 ASN O
C A 0029 GLY N 2.898 H A 0027 ASN O
C A 0029 GLY N 2.197 C A 0028 PRO O
C A 0030 ILE N 2.588 C A 0028 PRO O
C A 0030 ILE N 2.206 C A 0029 GLY O
C A 0031 LYS N 2.196 C A 0030 ILE O
C A 0032 VAL N 2.196 C A 0031 LYS O
H A 0033 THR N 2.195 C A 0032 VAL O
H A 0034 GLU N 2.197 H A 0033 THR O
H A 0035 VAL N 2.926 C A 0031 LYS O
H A 0035 VAL N 2.195 H A 0034 GLU O
H A 0036 ALA N 2.195 H A 0035 VAL O
H A 0037 LYS N 2.195 H A 0036 ALA O
H A 0038 ARG N 2.196 H A 0037 LYS O
H A 0039 GLY N 2.964 H A 0035 VAL O
H A 0039 GLY N 2.192 H A 0038 ARG O
H A 0040 GLY N 3.058 H A 0036 ALA O
H A 0040 GLY N 2.983 H A 0038 ARG O
H A 0040 GLY N 2.195 H A 0039 GLY O
H A 0041 GLU N 2.924 H A 0038 ARG O
H A 0041 GLU N 2.196 H A 0040 GLY O
H A 0042 LEU N 2.198 H A 0041 GLU O
H A 0043 TRP N 3.108 H A 0039 GLY O
H A 0043 TRP N 2.196 H A 0042 LEU O
H A 0044 ARG N 3.197 H A 0042 LEU O
H A 0044 ARG N 2.198 H A 0043 TRP O
H A 0045 ALA N 2.800 H A 0041 GLU O
H A 0045 ALA N 2.907 H A 0042 LEU O
H A 0045 ALA N 2.194 H A 0044 ARG O
H A 0046 MET N 2.710 H A 0042 LEU O
H A 0046 MET N 2.194 H A 0045 ALA O
C A 0047 LYS N 2.193 H A 0046 MET O
C A 0048 ASP N 2.198 C A 0047 LYS O
H A 0049 LYS N 2.196 C A 0048 ASP O
H A 0050 SER N 2.193 H A 0049 LYS O
H A 0051 GLU N 2.606 H A 0049 LYS O
H A 0051 GLU N 2.199 H A 0050 SER O
H A 0052 TRP N 2.967 H A 0049 LYS O
H A 0052 TRP N 2.196 H A 0051 GLU O
H A 0053 GLU N 2.835 H A 0049 LYS O
H A 0053 GLU N 2.197 H A 0052 TRP O
H A 0054 ALA N 2.946 H A 0052 TRP O
H A 0054 ALA N 2.194 H A 0053 GLU O
H A 0055 LYS N 3.199 H A 0051 GLU O
H A 0055 LYS N 2.461 H A 0052 TRP O
H A 0055 LYS N 3.160 H A 0053 GLU O
H A 0055 LYS N 2.196 H A 0054 ALA O
H A 0056 ALA N 2.806 H A 0052 TRP O
H A 0056 ALA N 2.928 H A 0053 GLU O
H A 0056 ALA N 3.043 H A 0054 ALA O
H A 0056 ALA N 2.195 H A 0055 LYS O
H A 0057 ALA N 2.894 H A 0054 ALA O
H A 0057 ALA N 2.196 H A 0056 ALA O
H A 0058 LYS N 3.153 H A 0055 LYS O
H A 0058 LYS N 2.197 H A 0057 ALA O
H A 0059 ALA N 3.119 H A 0056 ALA O
H A 0059 ALA N 2.193 H A 0058 LYS O
H A 0060 LYS N 2.974 H A 0056 ALA O
H A 0060 LYS N 2.655 H A 0057 ALA O
H A 0060 LYS N 2.860 H A 0058 LYS O
H A 0060 LYS N 2.189 H A 0059 ALA O
H A 0061 ASP N 3.107 H A 0057 ALA O
H A 0061 ASP N 2.955 H A 0058 LYS O
H A 0061 ASP N 2.181 H A 0060 LYS O
H A 0062 ASP N 3.059 H A 0058 LYS O
H A 0062 ASP N 2.191 H A 0061 ASP O
H A 0063 TYR N 2.520 H A 0059 ALA O
H A 0063 TYR N 2.898 H A 0060 LYS O
H A 0063 TYR N 3.035 H A 0061 ASP O
H A 0063 TYR N 2.194 H A 0062 ASP O
H A 0064 ASP N 2.866 H A 0060 LYS O
H A 0064 ASP N 2.179 H A 0063 TYR O
H A 0065 ARG N 2.199 H A 0064 ASP O
H A 0066 ALA N 2.193 H A 0065 ARG O
H A 0067 VAL N 2.937 H A 0063 TYR O
H A 0067 VAL N 2.188 H A 0066 ALA O
H A 0068 LYS N 2.803 H A 0066 ALA O
H A 0068 LYS N 2.178 H A 0067 VAL O
H A 0069 GLU N 2.647 H A 0066 ALA O
H A 0069 GLU N 3.120 H A 0067 VAL O
H A 0069 GLU N 2.201 H A 0068 LYS O
H A 0070 PHE N 2.985 H A 0066 ALA O
H A 0070 PHE N 2.706 H A 0067 VAL O
H A 0070 PHE N 3.172 H A 0068 LYS O
H A 0070 PHE N 2.201 H A 0069 GLU O
H A 0071 GLU N 2.566 H A 0067 VAL O
H A 0071 GLU N 2.849 H A 0068 LYS O
H A 0071 GLU N 2.189 H A 0070 PHE O
H A 0072 ALA N 2.730 H A 0068 LYS O
H A 0072 ALA N 3.121 H A 0069 GLU O
H A 0072 ALA N 2.201 H A 0071 GLU O
H A 0073 ASN N 3.105 H A 0071 GLU O
H A 0073 ASN N 2.197 H A 0072 ALA O
C A 0074 GLY N 2.197 H A 0073 ASN O
HB_MS 2.00 3.20 8
C A 0003 ASP N 2.618 C A 0002 SER OG
C A 0004 LYS N 3.194 C A 0003 ASP OD2
H A 0013 MET O 3.015 H A 0017 ASN ND2
H A 0015 TRP O 3.101 H A 0018 SER OG
H A 0023 ILE O 2.460 H A 0027 ASN ND2
H A 0034 GLU N 2.913 H A 0033 THR OG1
H A 0036 ALA O 2.949 H A 0012 TYR OH
H A 0040 GLY N 2.870 H A 0012 TYR OH
AROMATIC 0.00 8.00 3
H A 0055 LYS 5.582 H A 0052 TRP
H A 0012 TYR 5.471 H A 0043 TRP
H A 0049 LYS 5.622 H A 0043 TRP