Complet list of 2aqf con file
Complete list of 2aqf.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 423
C A 0001 GLY C 2.422 C A 0002 SER CA
C A 0001 GLY C 3.641 C A 0002 SER C
C A 0001 GLY C 3.166 C A 0002 SER CB
C A 0002 SER C 2.422 C A 0003 ASN CA
C A 0002 SER C 3.032 C A 0003 ASN C
C A 0002 SER C 3.634 C A 0003 ASN CB
C A 0003 ASN C 2.422 C A 0004 SER CA
C A 0003 ASN C 3.463 C A 0004 SER C
C A 0003 ASN C 3.430 C A 0004 SER CB
C A 0004 SER C 2.422 C A 0005 GLY CA
C A 0004 SER C 3.073 C A 0005 GLY C
C A 0005 GLY C 2.422 C A 0006 ARG CA
C A 0005 GLY C 3.429 C A 0006 ARG C
C A 0005 GLY C 3.456 C A 0006 ARG CB
C A 0005 GLY C 3.651 C A 0006 ARG CD
C A 0006 ARG C 2.423 C A 0007 ARG CA
C A 0006 ARG C 2.923 C A 0007 ARG C
C A 0006 ARG C 2.922 C A 0007 ARG CB
C A 0007 ARG C 2.423 C A 0008 SER CA
C A 0007 ARG C 3.245 C A 0008 SER C
C A 0007 ARG C 3.580 C A 0008 SER CB
C A 0008 SER C 2.446 C A 0009 ALA CA
C A 0008 SER C 3.013 C A 0009 ALA C
C A 0008 SER C 2.920 C A 0009 ALA CB
C A 0009 ALA CA 2.896 C A 0010 PRO CD
C A 0009 ALA C 2.430 C A 0010 PRO CA
C A 0009 ALA C 3.071 C A 0010 PRO C
C A 0009 ALA C 3.637 C A 0010 PRO CB
C A 0009 ALA C 3.595 C A 0010 PRO CG
C A 0009 ALA C 2.493 C A 0010 PRO CD
C A 0009 ALA CA 3.731 C A 0015 THR CG2
C A 0009 ALA CB 3.385 C A 0015 THR CB
C A 0009 ALA CB 3.210 C A 0015 THR CG2
C A 0010 PRO CA 2.878 C A 0011 PRO CD
C A 0010 PRO C 2.428 C A 0011 PRO CA
C A 0010 PRO C 3.033 C A 0011 PRO C
C A 0010 PRO C 3.637 C A 0011 PRO CB
C A 0010 PRO C 3.605 C A 0011 PRO CG
C A 0010 PRO C 2.489 C A 0011 PRO CD
C A 0010 PRO CB 3.279 C A 0011 PRO CD
C A 0010 PRO CG 3.430 H A 0028 LYS CE
C A 0010 PRO CB 3.708 H A 0032 GLN CG
C A 0010 PRO CB 2.925 H A 0032 GLN CD
C A 0010 PRO CG 3.660 H A 0032 GLN CD
C A 0011 PRO C 2.429 C A 0012 LEU CA
C A 0011 PRO C 2.943 C A 0012 LEU C
C A 0011 PRO C 2.947 C A 0012 LEU CB
C A 0012 LEU C 2.427 C A 0013 ASN CA
C A 0012 LEU C 3.229 C A 0013 ASN C
C A 0012 LEU C 3.592 C A 0013 ASN CB
C A 0012 LEU CD1 3.523 C A 0035 ARG CG
C A 0012 LEU CD2 3.539 C A 0035 ARG CA
C A 0012 LEU CD2 3.420 C A 0035 ARG CB
C A 0012 LEU CD2 3.362 C A 0035 ARG CG
C A 0013 ASN C 2.430 C A 0014 LEU CA
C A 0013 ASN C 3.706 C A 0014 LEU C
C A 0013 ASN C 2.913 C A 0014 LEU CB
C A 0013 ASN C 3.727 C A 0014 LEU CD1
C A 0013 ASN C 3.477 C A 0017 LEU CD1
C A 0014 LEU C 2.421 C A 0015 THR CA
C A 0014 LEU C 3.341 C A 0015 THR C
C A 0014 LEU C 3.517 C A 0015 THR CB
C A 0014 LEU C 3.591 C A 0015 THR CG2
C A 0014 LEU CA 3.611 C A 0017 LEU CD1
C A 0014 LEU CD1 3.728 C A 0017 LEU CD1
C A 0014 LEU CD2 3.566 C A 0023 LEU CD1
C A 0014 LEU CD1 3.758 C A 0036 LEU C
C A 0015 THR C 2.422 C A 0016 GLY CA
C A 0015 THR C 3.566 C A 0016 GLY C
C A 0016 GLY C 2.422 C A 0017 LEU CA
C A 0016 GLY C 3.058 C A 0017 LEU C
C A 0016 GLY C 3.641 C A 0017 LEU CB
C A 0017 LEU CA 2.880 C A 0018 PRO CD
C A 0017 LEU C 2.441 C A 0018 PRO CA
C A 0017 LEU C 3.139 C A 0018 PRO C
C A 0017 LEU C 3.612 C A 0018 PRO CB
C A 0017 LEU C 3.611 C A 0018 PRO CG
C A 0017 LEU C 2.496 C A 0018 PRO CD
C A 0017 LEU CB 3.274 C A 0018 PRO CD
C A 0017 LEU CD2 3.698 C A 0018 PRO CD
C A 0017 LEU CB 3.199 H A 0038 PRO CG
C A 0017 LEU CB 3.650 H A 0038 PRO CD
C A 0017 LEU CD1 3.663 H A 0038 PRO CD
C A 0018 PRO C 2.419 C A 0019 GLY CA
C A 0018 PRO C 3.538 C A 0019 GLY C
C A 0018 PRO C 3.625 H A 0038 PRO CB
C A 0019 GLY C 2.424 C A 0020 THR CA
C A 0019 GLY C 2.893 C A 0020 THR C
C A 0019 GLY C 3.638 C A 0020 THR CB
C A 0019 GLY CA 3.343 H A 0038 PRO CB
C A 0019 GLY C 3.435 H A 0038 PRO CB
C A 0019 GLY CA 3.726 H A 0042 LEU CD1
C A 0020 THR C 2.420 C A 0021 GLU CA
C A 0020 THR C 2.944 C A 0021 GLU C
C A 0020 THR C 3.632 C A 0021 GLU CB
C A 0020 THR CA 3.658 C A 0023 LEU CB
C A 0020 THR CA 3.490 C A 0023 LEU CG
C A 0020 THR CA 3.427 C A 0023 LEU CD1
C A 0021 GLU C 2.427 C A 0022 LYS CA
C A 0021 GLU C 3.425 C A 0022 LYS C
C A 0021 GLU C 3.469 C A 0022 LYS CB
C A 0021 GLU C 3.692 C A 0022 LYS CG
C A 0022 LYS C 2.426 C A 0023 LEU CA
C A 0022 LYS C 2.921 C A 0023 LEU C
C A 0022 LYS C 3.641 C A 0023 LEU CB
C A 0023 LEU C 2.424 H A 0024 ASN CA
C A 0023 LEU C 3.077 H A 0024 ASN C
C A 0023 LEU C 3.631 H A 0024 ASN CB
C A 0023 LEU C 3.799 H A 0028 LYS CG
C A 0023 LEU CB 3.435 H A 0028 LYS CG
C A 0023 LEU CD1 3.682 H A 0038 PRO CB
H A 0024 ASN C 2.424 H A 0025 GLU CA
H A 0024 ASN C 2.999 H A 0025 GLU C
H A 0024 ASN C 3.642 H A 0025 GLU CB
H A 0025 GLU C 2.422 H A 0026 LYS CA
H A 0025 GLU C 3.193 H A 0026 LYS C
H A 0025 GLU C 3.596 H A 0026 LYS CB
H A 0026 LYS C 2.421 H A 0027 GLU CA
H A 0026 LYS C 2.936 H A 0027 GLU C
H A 0026 LYS C 3.634 H A 0027 GLU CB
H A 0027 GLU C 2.422 H A 0028 LYS CA
H A 0027 GLU C 2.928 H A 0028 LYS C
H A 0027 GLU C 3.633 H A 0028 LYS CB
H A 0027 GLU CD 3.796 H A 0041 TYR CE2
H A 0028 LYS C 2.421 H A 0029 GLU CA
H A 0028 LYS C 2.959 H A 0029 GLU C
H A 0028 LYS C 3.636 H A 0029 GLU CB
H A 0028 LYS C 3.412 H A 0032 GLN CD
H A 0029 GLU C 2.421 H A 0030 LEU CA
H A 0029 GLU C 2.975 H A 0030 LEU C
H A 0029 GLU C 3.637 H A 0030 LEU CB
H A 0029 GLU C 3.759 H A 0033 VAL CG2
H A 0029 GLU CG 3.707 H A 0033 VAL CG2
H A 0029 GLU CD 3.775 H A 0033 VAL CG2
H A 0030 LEU C 2.420 H A 0031 CYS CA
H A 0030 LEU C 3.078 H A 0031 CYS C
H A 0030 LEU C 3.629 H A 0031 CYS CB
H A 0030 LEU CD2 3.249 H A 0041 TYR CE1
H A 0030 LEU CD2 3.434 H A 0041 TYR CZ
H A 0030 LEU CD1 3.383 H A 0080 PHE CD1
H A 0031 CYS C 2.422 H A 0032 GLN CA
H A 0031 CYS C 2.947 H A 0032 GLN C
H A 0031 CYS C 3.637 H A 0032 GLN CB
H A 0031 CYS CA 3.644 C A 0036 LEU CB
H A 0031 CYS CB 3.677 C A 0036 LEU CB
H A 0032 GLN C 2.422 H A 0033 VAL CA
H A 0032 GLN C 2.921 H A 0033 VAL C
H A 0032 GLN C 3.633 H A 0033 VAL CB
H A 0033 VAL C 2.418 H A 0034 VAL CA
H A 0033 VAL C 3.231 H A 0034 VAL C
H A 0033 VAL C 3.560 H A 0034 VAL CB
H A 0034 VAL C 2.427 C A 0035 ARG CA
H A 0034 VAL C 2.924 C A 0035 ARG C
H A 0034 VAL C 2.926 C A 0035 ARG CB
H A 0034 VAL C 3.342 C A 0035 ARG CG
H A 0034 VAL CB 3.533 C A 0036 LEU CD1
H A 0034 VAL CG1 3.446 C A 0036 LEU CG
H A 0034 VAL CG1 2.922 C A 0036 LEU CD1
H A 0034 VAL CG2 3.720 H A 0076 LYS CB
H A 0034 VAL CG2 2.922 H A 0076 LYS CD
C A 0035 ARG C 2.425 C A 0036 LEU CA
C A 0035 ARG C 3.327 C A 0036 LEU C
C A 0035 ARG C 3.542 C A 0036 LEU CB
C A 0036 LEU C 2.430 H A 0037 VAL CA
C A 0036 LEU C 3.399 H A 0037 VAL C
C A 0036 LEU C 3.462 H A 0037 VAL CB
C A 0036 LEU C 3.673 H A 0037 VAL CG2
C A 0036 LEU CD1 3.589 H A 0077 ILE CG1
C A 0036 LEU CD1 3.494 H A 0077 ILE CD1
C A 0036 LEU CD2 3.790 H A 0077 ILE CD1
H A 0037 VAL CA 2.898 H A 0038 PRO CD
H A 0037 VAL C 2.420 H A 0038 PRO CA
H A 0037 VAL C 3.011 H A 0038 PRO C
H A 0037 VAL C 3.633 H A 0038 PRO CB
H A 0037 VAL C 3.625 H A 0038 PRO CG
H A 0037 VAL C 2.495 H A 0038 PRO CD
H A 0037 VAL CB 3.554 H A 0038 PRO CD
H A 0037 VAL CG1 3.117 H A 0038 PRO CD
H A 0037 VAL CB 3.313 H A 0040 ALA CB
H A 0037 VAL CG1 3.512 H A 0040 ALA CB
H A 0038 PRO C 2.430 H A 0039 GLY CA
H A 0038 PRO C 2.905 H A 0039 GLY C
H A 0038 PRO CA 3.571 H A 0042 LEU CD1
H A 0038 PRO C 2.954 H A 0042 LEU CD1
H A 0038 PRO CB 3.756 H A 0042 LEU CD1
H A 0039 GLY C 2.418 H A 0040 ALA CA
H A 0039 GLY C 2.923 H A 0040 ALA C
H A 0039 GLY C 3.633 H A 0040 ALA CB
H A 0040 ALA C 2.424 H A 0041 TYR CA
H A 0040 ALA C 2.959 H A 0041 TYR C
H A 0040 ALA C 3.636 H A 0041 TYR CB
H A 0040 ALA C 3.720 H A 0044 TYR CD2
H A 0041 TYR C 2.426 H A 0042 LEU CA
H A 0041 TYR C 2.911 H A 0042 LEU C
H A 0041 TYR C 3.635 H A 0042 LEU CB
H A 0041 TYR CE2 3.573 H A 0045 LYS CG
H A 0041 TYR CD1 3.693 H A 0077 ILE CG2
H A 0041 TYR CE1 3.727 H A 0077 ILE CG1
H A 0041 TYR CE1 3.209 H A 0077 ILE CG2
H A 0042 LEU C 2.422 H A 0043 GLU CA
H A 0042 LEU C 3.084 H A 0043 GLU C
H A 0042 LEU C 3.627 H A 0043 GLU CB
H A 0043 GLU C 2.422 H A 0044 TYR CA
H A 0043 GLU C 2.918 H A 0044 TYR C
H A 0043 GLU C 3.635 H A 0044 TYR CB
H A 0044 TYR C 2.422 H A 0045 LYS CA
H A 0044 TYR C 2.960 H A 0045 LYS C
H A 0044 TYR C 3.638 H A 0045 LYS CB
H A 0044 TYR CB 3.746 H A 0067 ILE CG2
H A 0044 TYR CB 3.729 H A 0067 ILE CD1
H A 0044 TYR CG 3.722 H A 0067 ILE CG2
H A 0044 TYR CD1 3.671 H A 0067 ILE CB
H A 0044 TYR CD1 3.216 H A 0067 ILE CG2
H A 0044 TYR CE2 3.585 C A 0069 ILE CG2
H A 0044 TYR CZ 3.692 C A 0069 ILE CG2
H A 0045 LYS C 2.424 H A 0046 SER CA
H A 0045 LYS C 3.065 H A 0046 SER C
H A 0045 LYS C 3.632 H A 0046 SER CB
H A 0045 LYS CG 3.326 H A 0081 LEU CD2
H A 0045 LYS CD 3.653 H A 0081 LEU CD2
H A 0045 LYS CE 3.611 H A 0081 LEU CD2
H A 0046 SER C 2.422 H A 0047 ALA CA
H A 0046 SER C 2.959 H A 0047 ALA C
H A 0046 SER C 3.633 H A 0047 ALA CB
H A 0047 ALA C 2.423 H A 0048 LEU CA
H A 0047 ALA C 2.942 H A 0048 LEU C
H A 0047 ALA C 3.636 H A 0048 LEU CB
H A 0048 LEU C 2.421 H A 0049 LEU CA
H A 0048 LEU C 3.005 H A 0049 LEU C
H A 0048 LEU C 3.636 H A 0049 LEU CB
H A 0048 LEU CD1 3.201 H A 0067 ILE CG2
H A 0048 LEU CD1 3.690 H A 0067 ILE CD1
H A 0048 LEU CD2 3.191 H A 0067 ILE CD1
H A 0048 LEU CG 3.711 H A 0078 TYR CE1
H A 0048 LEU CD2 3.208 H A 0078 TYR CD1
H A 0048 LEU CD2 3.350 H A 0078 TYR CE1
H A 0049 LEU C 2.422 H A 0050 ASN CA
H A 0049 LEU C 3.047 H A 0050 ASN C
H A 0049 LEU C 3.634 H A 0050 ASN CB
H A 0049 LEU CD1 3.718 C A 0086 TYR CB
H A 0050 ASN C 2.422 H A 0051 GLU CA
H A 0050 ASN C 2.979 H A 0051 GLU C
H A 0050 ASN C 3.638 H A 0051 GLU CB
H A 0051 GLU C 2.424 H A 0052 CYS CA
H A 0051 GLU C 2.916 H A 0052 CYS C
H A 0051 GLU C 3.634 H A 0052 CYS CB
H A 0051 GLU CD 3.697 H A 0066 LEU CD2
H A 0052 CYS C 2.421 H A 0053 HIS CA
H A 0052 CYS C 3.048 H A 0053 HIS C
H A 0052 CYS C 3.632 H A 0053 HIS CB
H A 0053 HIS C 2.421 H A 0054 LYS CA
H A 0053 HIS C 3.060 H A 0054 LYS C
H A 0053 HIS C 3.630 H A 0054 LYS CB
H A 0054 LYS C 2.421 H A 0055 GLN CA
H A 0054 LYS C 3.119 H A 0055 GLN C
H A 0054 LYS C 3.620 H A 0055 GLN CB
H A 0055 GLN C 2.424 H A 0056 GLY CA
H A 0055 GLN C 2.947 H A 0056 GLY C
H A 0055 GLN CD 3.626 C A 0058 LEU CD1
H A 0056 GLY C 2.420 C A 0057 GLY CA
H A 0056 GLY C 3.417 C A 0057 GLY C
C A 0057 GLY C 2.422 C A 0058 LEU CA
C A 0057 GLY C 3.214 C A 0058 LEU C
C A 0057 GLY C 3.590 C A 0058 LEU CB
C A 0058 LEU C 2.424 H A 0059 ARG CA
C A 0058 LEU C 3.393 H A 0059 ARG C
C A 0058 LEU C 3.492 H A 0059 ARG CB
C A 0058 LEU CG 3.291 H A 0062 GLN CB
C A 0058 LEU CG 3.697 H A 0062 GLN CG
C A 0058 LEU CG 3.458 H A 0062 GLN CD
C A 0058 LEU CD1 3.299 H A 0062 GLN CD
C A 0058 LEU CD2 3.467 H A 0062 GLN CB
C A 0058 LEU CD2 3.788 H A 0078 TYR CZ
H A 0059 ARG C 2.424 H A 0060 LEU CA
H A 0059 ARG C 3.013 H A 0060 LEU C
H A 0059 ARG C 3.646 H A 0060 LEU CB
H A 0059 ARG C 3.314 H A 0078 TYR CE2
H A 0059 ARG CD 3.585 C A 0089 LYS CG
H A 0059 ARG CD 3.462 C A 0089 LYS CE
H A 0059 ARG CZ 3.413 C A 0089 LYS CE
H A 0059 ARG CG 3.605 C A 0090 ALA CB
H A 0060 LEU C 2.432 H A 0061 ALA CA
H A 0060 LEU C 2.904 H A 0061 ALA C
H A 0060 LEU C 3.631 H A 0061 ALA CB
H A 0060 LEU CA 3.572 H A 0078 TYR CD2
H A 0060 LEU CA 3.747 H A 0078 TYR CE2
H A 0060 LEU CD1 3.440 H A 0078 TYR CB
H A 0060 LEU CD1 3.528 H A 0078 TYR CD2
H A 0060 LEU CD2 3.498 H A 0078 TYR CD2
H A 0060 LEU CD2 3.790 C A 0089 LYS CE
H A 0061 ALA C 2.419 H A 0062 GLN CA
H A 0061 ALA C 2.957 H A 0062 GLN C
H A 0061 ALA C 3.639 H A 0062 GLN CB
H A 0062 GLN C 2.422 H A 0063 ALA CA
H A 0062 GLN C 3.014 H A 0063 ALA C
H A 0062 GLN C 3.634 H A 0063 ALA CB
H A 0063 ALA C 2.423 H A 0064 ARG CA
H A 0063 ALA C 2.948 H A 0064 ARG C
H A 0063 ALA C 3.637 H A 0064 ARG CB
H A 0063 ALA C 3.073 H A 0074 THR CG2
H A 0063 ALA CB 3.673 H A 0074 THR CG2
H A 0063 ALA CB 3.619 H A 0078 TYR CB
H A 0063 ALA CB 2.929 H A 0078 TYR CG
H A 0063 ALA CB 2.913 H A 0078 TYR CD1
H A 0063 ALA CB 3.274 H A 0078 TYR CD2
H A 0063 ALA CB 3.221 H A 0078 TYR CE1
H A 0063 ALA CB 3.554 H A 0078 TYR CE2
H A 0063 ALA CB 3.531 H A 0078 TYR CZ
H A 0064 ARG C 2.426 H A 0065 ALA CA
H A 0064 ARG C 3.260 H A 0065 ALA C
H A 0064 ARG C 3.574 H A 0065 ALA CB
H A 0064 ARG CA 3.800 H A 0074 THR CB
H A 0064 ARG CA 3.180 H A 0074 THR CG2
H A 0064 ARG CG 3.792 H A 0074 THR CG2
H A 0065 ALA C 2.427 H A 0066 LEU CA
H A 0065 ALA C 2.925 H A 0066 LEU C
H A 0065 ALA C 3.638 H A 0066 LEU CB
H A 0066 LEU C 2.423 H A 0067 ILE CA
H A 0066 LEU C 3.327 H A 0067 ILE C
H A 0066 LEU C 3.539 H A 0067 ILE CB
H A 0066 LEU C 3.640 H A 0067 ILE CG2
H A 0067 ILE C 2.430 C A 0068 LYS CA
H A 0067 ILE C 3.075 C A 0068 LYS C
H A 0067 ILE C 3.636 C A 0068 LYS CB
H A 0067 ILE CG1 3.575 H A 0074 THR CG2
C A 0068 LYS C 2.416 C A 0069 ILE CA
C A 0068 LYS C 3.027 C A 0069 ILE C
C A 0068 LYS C 3.642 C A 0069 ILE CB
C A 0069 ILE C 2.429 C A 0070 ASP CA
C A 0069 ILE C 3.707 C A 0070 ASP C
C A 0069 ILE C 2.917 C A 0070 ASP CB
C A 0069 ILE C 3.622 C A 0070 ASP CG
C A 0069 ILE CG1 3.528 H A 0073 LYS CB
C A 0069 ILE CD1 3.500 H A 0073 LYS CB
C A 0069 ILE CD1 3.619 H A 0077 ILE CD1
C A 0070 ASP C 2.426 H A 0071 VAL CA
C A 0070 ASP C 3.344 H A 0071 VAL C
C A 0070 ASP C 3.561 H A 0071 VAL CB
C A 0070 ASP C 3.592 H A 0071 VAL CG2
C A 0070 ASP CB 3.337 H A 0073 LYS CB
C A 0070 ASP CB 3.631 H A 0073 LYS CG
C A 0070 ASP CB 3.175 H A 0073 LYS CE
C A 0070 ASP CG 3.371 H A 0073 LYS CE
H A 0071 VAL C 2.419 H A 0072 ASN CA
H A 0071 VAL C 3.152 H A 0072 ASN C
H A 0071 VAL C 3.607 H A 0072 ASN CB
H A 0072 ASN C 2.424 H A 0073 LYS CA
H A 0072 ASN C 2.986 H A 0073 LYS C
H A 0072 ASN C 3.623 H A 0073 LYS CB
H A 0073 LYS C 2.421 H A 0074 THR CA
H A 0073 LYS C 3.075 H A 0074 THR C
H A 0073 LYS C 3.632 H A 0074 THR CB
H A 0074 THR C 2.416 H A 0075 ARG CA
H A 0074 THR C 3.029 H A 0075 ARG C
H A 0074 THR C 3.632 H A 0075 ARG CB
H A 0075 ARG C 2.416 H A 0076 LYS CA
H A 0075 ARG C 3.092 H A 0076 LYS C
H A 0075 ARG C 3.617 H A 0076 LYS CB
H A 0076 LYS C 2.418 H A 0077 ILE CA
H A 0076 LYS C 2.980 H A 0077 ILE C
H A 0076 LYS C 3.637 H A 0077 ILE CB
H A 0077 ILE C 2.420 H A 0078 TYR CA
H A 0077 ILE C 3.049 H A 0078 TYR C
H A 0077 ILE C 3.639 H A 0078 TYR CB
H A 0077 ILE C 3.718 H A 0081 LEU CD1
H A 0078 TYR C 2.422 H A 0079 ASP CA
H A 0078 TYR C 2.900 H A 0079 ASP C
H A 0078 TYR C 3.636 H A 0079 ASP CB
H A 0078 TYR C 3.680 H A 0082 ILE CG1
H A 0078 TYR CD2 3.524 H A 0082 ILE CG1
H A 0078 TYR CE2 3.596 H A 0082 ILE CD1
H A 0078 TYR CD1 3.790 C A 0087 ILE CD1
H A 0078 TYR CE1 3.457 C A 0087 ILE CD1
H A 0078 TYR CE2 3.793 C A 0087 ILE CD1
H A 0078 TYR CZ 3.457 C A 0087 ILE CD1
H A 0079 ASP C 2.421 H A 0080 PHE CA
H A 0079 ASP C 3.091 H A 0080 PHE C
H A 0079 ASP C 3.627 H A 0080 PHE CB
H A 0080 PHE C 2.423 H A 0081 LEU CA
H A 0080 PHE C 2.985 H A 0081 LEU C
H A 0080 PHE C 3.648 H A 0081 LEU CB
H A 0080 PHE C 3.584 H A 0084 GLU CG
H A 0081 LEU C 2.428 H A 0082 ILE CA
H A 0081 LEU C 3.052 H A 0082 ILE C
H A 0081 LEU C 3.632 H A 0082 ILE CB
H A 0081 LEU CD2 3.715 C A 0086 TYR CB
H A 0081 LEU C 3.262 C A 0087 ILE CG1
H A 0081 LEU CB 3.292 C A 0087 ILE CG1
H A 0081 LEU CB 3.341 C A 0087 ILE CD1
H A 0082 ILE C 2.425 H A 0083 ARG CA
H A 0082 ILE C 3.021 H A 0083 ARG C
H A 0082 ILE C 3.633 H A 0083 ARG CB
H A 0082 ILE C 3.790 H A 0083 ARG CD
H A 0082 ILE CG2 3.542 H A 0083 ARG CD
H A 0082 ILE CA 3.669 C A 0087 ILE CG1
H A 0082 ILE CG1 3.738 C A 0087 ILE CG1
H A 0082 ILE CG1 3.459 C A 0087 ILE CD1
H A 0082 ILE CD1 3.376 C A 0087 ILE CG1
H A 0082 ILE CD1 3.283 C A 0087 ILE CD1
H A 0082 ILE CD1 3.512 C A 0088 THR C
H A 0083 ARG C 2.423 H A 0084 GLU CA
H A 0083 ARG C 3.027 H A 0084 GLU C
H A 0083 ARG C 3.638 H A 0084 GLU CB
H A 0084 GLU C 2.422 H A 0085 GLY CA
H A 0084 GLU C 3.585 H A 0085 GLY C
H A 0084 GLU CB 3.618 C A 0086 TYR CD2
H A 0085 GLY C 2.423 C A 0086 TYR CA
H A 0085 GLY C 2.972 C A 0086 TYR C
H A 0085 GLY C 3.641 C A 0086 TYR CB
C A 0086 TYR C 2.422 C A 0087 ILE CA
C A 0086 TYR C 3.542 C A 0087 ILE C
C A 0086 TYR C 3.325 C A 0087 ILE CB
C A 0086 TYR C 3.224 C A 0087 ILE CG2
C A 0087 ILE C 2.417 C A 0088 THR CA
C A 0087 ILE C 3.489 C A 0088 THR C
C A 0087 ILE C 3.397 C A 0088 THR CB
C A 0087 ILE C 3.621 C A 0088 THR CG2
C A 0088 THR C 2.424 C A 0089 LYS CA
C A 0088 THR C 3.439 C A 0089 LYS C
C A 0088 THR C 3.446 C A 0089 LYS CB
C A 0089 LYS C 2.424 C A 0090 ALA CA
C A 0089 LYS C 2.931 C A 0090 ALA C
C A 0089 LYS C 2.919 C A 0090 ALA CB
CHARGE_ATTR 2.00 12.00 62
C A 0021 GLU OE1 6.132 C A 0006 ARG NH1
C A 0021 GLU OE1 8.041 C A 0006 ARG NH2
C A 0021 GLU OE2 5.988 C A 0006 ARG NH1
C A 0021 GLU OE2 7.972 C A 0006 ARG NH2
C A 0021 GLU OE1 7.612 C A 0022 LYS NZ
C A 0021 GLU OE2 8.502 C A 0022 LYS NZ
H A 0025 GLU OE1 7.236 C A 0007 ARG NH1
H A 0025 GLU OE1 8.531 C A 0007 ARG NH2
H A 0025 GLU OE2 9.201 C A 0007 ARG NH1
H A 0025 GLU OE2 10.39 C A 0007 ARG NH2
H A 0025 GLU OE1 6.511 H A 0026 LYS NZ
H A 0025 GLU OE2 4.403 H A 0026 LYS NZ
H A 0025 GLU OE1 7.753 H A 0028 LYS NZ
H A 0025 GLU OE2 8.654 H A 0028 LYS NZ
H A 0027 GLU OE1 10.60 C A 0022 LYS NZ
H A 0027 GLU OE1 11.04 H A 0026 LYS NZ
H A 0027 GLU OE2 10.79 H A 0026 LYS NZ
H A 0027 GLU OE1 10.59 H A 0028 LYS NZ
H A 0027 GLU OE2 11.82 H A 0028 LYS NZ
H A 0027 GLU OE1 5.366 H A 0045 LYS NZ
H A 0027 GLU OE2 4.901 H A 0045 LYS NZ
H A 0029 GLU OE1 7.182 H A 0026 LYS NZ
H A 0029 GLU OE2 9.194 H A 0026 LYS NZ
H A 0029 GLU OE1 9.298 H A 0028 LYS NZ
H A 0029 GLU OE2 10.25 H A 0028 LYS NZ
H A 0029 GLU OE1 9.646 H A 0076 LYS NZ
H A 0029 GLU OE2 8.009 H A 0076 LYS NZ
H A 0051 GLU OE1 5.654 H A 0054 LYS NZ
H A 0051 GLU OE2 5.464 H A 0054 LYS NZ
C A 0070 ASP OD1 11.35 C A 0035 ARG NH1
C A 0070 ASP OD2 9.999 C A 0035 ARG NH1
C A 0070 ASP OD2 10.85 C A 0035 ARG NH2
C A 0070 ASP OD1 10.57 H A 0064 ARG NH1
C A 0070 ASP OD1 10.56 C A 0068 LYS NZ
C A 0070 ASP OD2 11.31 C A 0068 LYS NZ
C A 0070 ASP OD1 4.572 H A 0073 LYS NZ
C A 0070 ASP OD2 4.148 H A 0073 LYS NZ
C A 0070 ASP OD1 11.16 H A 0076 LYS NZ
C A 0070 ASP OD2 10.54 H A 0076 LYS NZ
H A 0079 ASP OD1 11.73 H A 0059 ARG NH1
H A 0079 ASP OD2 9.784 H A 0059 ARG NH1
H A 0079 ASP OD2 10.66 H A 0059 ARG NH2
H A 0079 ASP OD2 11.62 H A 0064 ARG NH1
H A 0079 ASP OD1 7.116 H A 0075 ARG NH1
H A 0079 ASP OD1 8.798 H A 0075 ARG NH2
H A 0079 ASP OD2 5.224 H A 0075 ARG NH1
H A 0079 ASP OD2 7.125 H A 0075 ARG NH2
H A 0079 ASP OD1 9.770 H A 0076 LYS NZ
H A 0079 ASP OD2 10.32 H A 0076 LYS NZ
H A 0079 ASP OD1 6.602 H A 0083 ARG NH1
H A 0079 ASP OD1 6.520 H A 0083 ARG NH2
H A 0079 ASP OD2 6.014 H A 0083 ARG NH1
H A 0079 ASP OD2 5.320 H A 0083 ARG NH2
H A 0079 ASP OD1 7.509 C A 0089 LYS NZ
H A 0079 ASP OD2 5.673 C A 0089 LYS NZ
H A 0084 GLU OE1 6.422 H A 0026 LYS NZ
H A 0084 GLU OE2 6.040 H A 0026 LYS NZ
H A 0084 GLU OE1 11.37 H A 0045 LYS NZ
H A 0084 GLU OE2 9.717 H A 0045 LYS NZ
H A 0084 GLU OE1 9.431 H A 0083 ARG NH1
H A 0084 GLU OE1 11.10 H A 0083 ARG NH2
H A 0084 GLU OE2 11.13 H A 0083 ARG NH1
CHARGE_REPU 2.00 12.00 73
C A 0007 ARG NH1 6.210 H A 0028 LYS NZ
C A 0007 ARG NH2 7.475 H A 0028 LYS NZ
C A 0022 LYS NZ 10.79 H A 0045 LYS NZ
H A 0025 GLU OE1 11.38 H A 0027 GLU OE1
H A 0025 GLU OE2 10.58 H A 0027 GLU OE1
H A 0025 GLU OE2 11.19 H A 0027 GLU OE2
H A 0025 GLU OE1 9.872 H A 0029 GLU OE1
H A 0025 GLU OE1 11.75 H A 0029 GLU OE2
H A 0025 GLU OE2 8.673 H A 0029 GLU OE1
H A 0025 GLU OE2 10.69 H A 0029 GLU OE2
H A 0025 GLU OE1 10.76 H A 0084 GLU OE2
H A 0025 GLU OE2 9.915 H A 0084 GLU OE1
H A 0025 GLU OE2 8.786 H A 0084 GLU OE2
H A 0026 LYS NZ 11.50 H A 0028 LYS NZ
H A 0027 GLU OE1 11.02 H A 0029 GLU OE1
H A 0027 GLU OE2 10.50 H A 0029 GLU OE1
H A 0027 GLU OE2 11.92 H A 0029 GLU OE2
H A 0027 GLU OE2 11.84 H A 0079 ASP OD1
H A 0027 GLU OE1 10.19 H A 0084 GLU OE1
H A 0027 GLU OE1 8.088 H A 0084 GLU OE2
H A 0027 GLU OE2 8.909 H A 0084 GLU OE1
H A 0027 GLU OE2 6.953 H A 0084 GLU OE2
H A 0029 GLU OE1 10.26 H A 0079 ASP OD1
H A 0029 GLU OE2 10.43 H A 0079 ASP OD1
H A 0029 GLU OE1 9.916 H A 0084 GLU OE1
H A 0029 GLU OE1 9.196 H A 0084 GLU OE2
H A 0029 GLU OE2 11.58 H A 0084 GLU OE1
H A 0029 GLU OE2 11.00 H A 0084 GLU OE2
C A 0035 ARG NH1 8.015 H A 0073 LYS NZ
C A 0035 ARG NH2 8.061 H A 0073 LYS NZ
C A 0035 ARG NH1 9.614 H A 0076 LYS NZ
C A 0035 ARG NH2 8.236 H A 0076 LYS NZ
H A 0043 GLU OE1 11.69 H A 0051 GLU OE1
H A 0043 GLU OE2 10.42 H A 0051 GLU OE1
H A 0045 LYS NZ 11.97 H A 0053 HIS ND1
H A 0053 HIS ND1 8.933 H A 0054 LYS NZ
H A 0053 HIS NE2 9.162 H A 0054 LYS NZ
H A 0059 ARG NH1 10.08 H A 0064 ARG NH1
H A 0059 ARG NH1 9.106 H A 0064 ARG NH2
H A 0059 ARG NH2 11.33 H A 0064 ARG NH2
H A 0059 ARG NH1 8.175 H A 0075 ARG NH1
H A 0059 ARG NH1 9.722 H A 0075 ARG NH2
H A 0059 ARG NH2 9.833 H A 0075 ARG NH1
H A 0059 ARG NH2 11.51 H A 0075 ARG NH2
H A 0059 ARG NH1 9.265 H A 0083 ARG NH1
H A 0059 ARG NH1 8.087 H A 0083 ARG NH2
H A 0059 ARG NH2 8.763 H A 0083 ARG NH1
H A 0059 ARG NH2 7.815 H A 0083 ARG NH2
H A 0059 ARG NH1 4.317 C A 0089 LYS NZ
H A 0059 ARG NH2 5.038 C A 0089 LYS NZ
H A 0064 ARG NH1 11.54 H A 0073 LYS NZ
H A 0064 ARG NH1 7.474 H A 0075 ARG NH1
H A 0064 ARG NH1 6.948 H A 0075 ARG NH2
H A 0064 ARG NH2 8.560 H A 0075 ARG NH1
H A 0064 ARG NH2 8.438 H A 0075 ARG NH2
H A 0064 ARG NH1 10.50 C A 0089 LYS NZ
H A 0064 ARG NH2 10.31 C A 0089 LYS NZ
H A 0073 LYS NZ 11.77 H A 0075 ARG NH2
H A 0073 LYS NZ 6.977 H A 0076 LYS NZ
H A 0075 ARG NH1 10.47 H A 0076 LYS NZ
H A 0075 ARG NH2 9.944 H A 0076 LYS NZ
H A 0075 ARG NH1 9.621 H A 0083 ARG NH1
H A 0075 ARG NH1 7.953 H A 0083 ARG NH2
H A 0075 ARG NH2 11.76 H A 0083 ARG NH1
H A 0075 ARG NH2 9.997 H A 0083 ARG NH2
H A 0075 ARG NH1 6.007 C A 0089 LYS NZ
H A 0075 ARG NH2 8.148 C A 0089 LYS NZ
H A 0079 ASP OD1 8.309 H A 0084 GLU OE1
H A 0079 ASP OD1 9.090 H A 0084 GLU OE2
H A 0079 ASP OD2 10.09 H A 0084 GLU OE1
H A 0079 ASP OD2 11.01 H A 0084 GLU OE2
H A 0083 ARG NH1 5.640 C A 0089 LYS NZ
H A 0083 ARG NH2 4.544 C A 0089 LYS NZ
HB_MM 2.00 3.20 165
C A 0002 SER N 2.195 C A 0001 GLY O
C A 0003 ASN N 2.196 C A 0002 SER O
C A 0004 SER N 2.196 C A 0003 ASN O
C A 0005 GLY N 2.196 C A 0004 SER O
C A 0006 ARG N 2.196 C A 0005 GLY O
C A 0007 ARG N 2.196 C A 0006 ARG O
C A 0008 SER N 2.196 C A 0007 ARG O
C A 0009 ALA N 2.205 C A 0008 SER O
C A 0010 PRO N 2.225 C A 0009 ALA O
C A 0011 PRO N 2.229 C A 0010 PRO O
C A 0012 LEU N 2.197 C A 0011 PRO O
C A 0013 ASN N 2.198 C A 0012 LEU O
C A 0014 LEU N 2.199 C A 0013 ASN O
C A 0015 THR N 2.196 C A 0014 LEU O
C A 0016 GLY N 2.197 C A 0015 THR O
C A 0017 LEU N 2.198 C A 0016 GLY O
C A 0018 PRO N 2.229 C A 0017 LEU O
C A 0019 GLY N 3.070 C A 0017 LEU O
C A 0019 GLY N 2.193 C A 0018 PRO O
C A 0020 THR N 2.198 C A 0019 GLY O
C A 0021 GLU N 2.838 C A 0019 GLY O
C A 0021 GLU N 2.199 C A 0020 THR O
C A 0022 LYS N 2.539 C A 0019 GLY O
C A 0022 LYS N 2.857 C A 0020 THR O
C A 0022 LYS N 2.199 C A 0021 GLU O
C A 0023 LEU N 2.924 C A 0019 GLY O
C A 0023 LEU N 3.073 C A 0020 THR O
C A 0023 LEU N 2.198 C A 0022 LYS O
H A 0024 ASN N 3.046 C A 0022 LYS O
H A 0024 ASN N 2.197 C A 0023 LEU O
H A 0025 GLU N 2.197 H A 0024 ASN O
H A 0026 LYS N 3.027 H A 0024 ASN O
H A 0026 LYS N 2.197 H A 0025 GLU O
H A 0027 GLU N 2.198 H A 0026 LYS O
H A 0028 LYS N 2.918 H A 0024 ASN O
H A 0028 LYS N 3.036 H A 0026 LYS O
H A 0028 LYS N 2.197 H A 0027 GLU O
H A 0029 GLU N 3.178 H A 0026 LYS O
H A 0029 GLU N 2.195 H A 0028 LYS O
H A 0030 LEU N 3.175 H A 0026 LYS O
H A 0030 LEU N 3.060 H A 0027 GLU O
H A 0030 LEU N 3.165 H A 0028 LYS O
H A 0030 LEU N 2.197 H A 0029 GLU O
H A 0031 CYS N 2.872 H A 0027 GLU O
H A 0031 CYS N 3.118 H A 0028 LYS O
H A 0031 CYS N 2.197 H A 0030 LEU O
H A 0032 GLN N 2.790 H A 0028 LYS O
H A 0032 GLN N 2.196 H A 0031 CYS O
H A 0033 VAL N 2.834 H A 0029 GLU O
H A 0033 VAL N 2.197 H A 0032 GLN O
H A 0034 VAL N 3.173 H A 0030 LEU O
H A 0034 VAL N 3.106 H A 0031 CYS O
H A 0034 VAL N 3.098 H A 0032 GLN O
H A 0034 VAL N 2.197 H A 0033 VAL O
C A 0035 ARG N 2.521 H A 0031 CYS O
C A 0035 ARG N 2.728 H A 0032 GLN O
C A 0035 ARG N 2.198 H A 0034 VAL O
C A 0036 LEU N 2.672 H A 0031 CYS O
C A 0036 LEU N 2.198 C A 0035 ARG O
H A 0037 VAL N 2.198 C A 0036 LEU O
H A 0038 PRO N 2.225 H A 0037 VAL O
H A 0039 GLY N 3.138 C A 0018 PRO O
H A 0039 GLY N 2.200 H A 0038 PRO O
H A 0040 ALA N 3.059 H A 0038 PRO O
H A 0040 ALA N 2.196 H A 0039 GLY O
H A 0041 TYR N 2.922 H A 0037 VAL O
H A 0041 TYR N 3.147 H A 0038 PRO O
H A 0041 TYR N 2.198 H A 0040 ALA O
H A 0042 LEU N 2.689 H A 0038 PRO O
H A 0042 LEU N 2.197 H A 0041 TYR O
H A 0043 GLU N 2.816 H A 0039 GLY O
H A 0043 GLU N 2.946 H A 0040 ALA O
H A 0043 GLU N 2.878 H A 0041 TYR O
H A 0043 GLU N 2.198 H A 0042 LEU O
H A 0044 TYR N 3.153 H A 0040 ALA O
H A 0044 TYR N 3.175 H A 0041 TYR O
H A 0044 TYR N 2.197 H A 0043 GLU O
H A 0045 LYS N 2.801 H A 0041 TYR O
H A 0045 LYS N 3.088 H A 0043 GLU O
H A 0045 LYS N 2.195 H A 0044 TYR O
H A 0046 SER N 3.197 H A 0042 LEU O
H A 0046 SER N 2.884 H A 0043 GLU O
H A 0046 SER N 2.198 H A 0045 LYS O
H A 0047 ALA N 2.870 H A 0043 GLU O
H A 0047 ALA N 2.197 H A 0046 SER O
H A 0048 LEU N 2.790 H A 0044 TYR O
H A 0048 LEU N 2.197 H A 0047 ALA O
H A 0049 LEU N 3.195 H A 0045 LYS O
H A 0049 LEU N 3.106 H A 0046 SER O
H A 0049 LEU N 3.147 H A 0047 ALA O
H A 0049 LEU N 2.195 H A 0048 LEU O
H A 0050 ASN N 3.066 H A 0046 SER O
H A 0050 ASN N 3.061 H A 0047 ALA O
H A 0050 ASN N 2.197 H A 0049 LEU O
H A 0051 GLU N 2.841 H A 0047 ALA O
H A 0051 GLU N 2.197 H A 0050 ASN O
H A 0052 CYS N 2.792 H A 0048 LEU O
H A 0052 CYS N 2.196 H A 0051 GLU O
H A 0053 HIS N 3.135 H A 0049 LEU O
H A 0053 HIS N 3.090 H A 0051 GLU O
H A 0053 HIS N 2.197 H A 0052 CYS O
H A 0054 LYS N 2.900 H A 0050 ASN O
H A 0054 LYS N 2.820 H A 0051 GLU O
H A 0054 LYS N 2.197 H A 0053 HIS O
H A 0055 GLN N 2.830 H A 0051 GLU O
H A 0055 GLN N 2.197 H A 0054 LYS O
H A 0056 GLY N 2.534 H A 0052 CYS O
H A 0056 GLY N 2.197 H A 0055 GLN O
C A 0057 GLY N 2.195 H A 0056 GLY O
C A 0058 LEU N 2.196 C A 0057 GLY O
H A 0059 ARG N 2.196 C A 0058 LEU O
H A 0060 LEU N 2.198 H A 0059 ARG O
H A 0061 ALA N 2.199 H A 0060 LEU O
H A 0062 GLN N 3.095 H A 0060 LEU O
H A 0062 GLN N 2.195 H A 0061 ALA O
H A 0063 ALA N 2.702 H A 0060 LEU O
H A 0063 ALA N 3.143 H A 0061 ALA O
H A 0063 ALA N 2.197 H A 0062 GLN O
H A 0064 ARG N 2.957 H A 0060 LEU O
H A 0064 ARG N 2.198 H A 0063 ALA O
H A 0065 ALA N 3.052 H A 0061 ALA O
H A 0065 ALA N 3.184 H A 0062 GLN O
H A 0065 ALA N 2.809 H A 0063 ALA O
H A 0065 ALA N 2.197 H A 0064 ARG O
H A 0066 LEU N 2.638 H A 0062 GLN O
H A 0066 LEU N 2.198 H A 0065 ALA O
H A 0067 ILE N 3.026 H A 0063 ALA O
H A 0067 ILE N 2.197 H A 0066 LEU O
C A 0068 LYS N 2.198 H A 0067 ILE O
C A 0069 ILE N 2.497 H A 0067 ILE O
C A 0069 ILE N 2.194 C A 0068 LYS O
C A 0070 ASP N 2.200 C A 0069 ILE O
H A 0071 VAL N 2.194 C A 0070 ASP O
H A 0072 ASN N 2.195 H A 0071 VAL O
H A 0073 LYS N 2.199 H A 0072 ASN O
H A 0074 THR N 2.197 H A 0073 LYS O
H A 0075 ARG N 2.196 H A 0074 THR O
H A 0076 LYS N 2.963 H A 0072 ASN O
H A 0076 LYS N 2.194 H A 0075 ARG O
H A 0077 ILE N 2.198 H A 0076 LYS O
H A 0078 TYR N 2.838 H A 0074 THR O
H A 0078 TYR N 2.199 H A 0077 ILE O
H A 0079 ASP N 2.799 H A 0075 ARG O
H A 0079 ASP N 2.195 H A 0078 TYR O
H A 0080 PHE N 3.057 H A 0076 LYS O
H A 0080 PHE N 2.737 H A 0078 TYR O
H A 0080 PHE N 2.198 H A 0079 ASP O
H A 0081 LEU N 2.962 H A 0078 TYR O
H A 0081 LEU N 2.196 H A 0080 PHE O
H A 0082 ILE N 2.764 H A 0078 TYR O
H A 0082 ILE N 3.178 H A 0080 PHE O
H A 0082 ILE N 2.197 H A 0081 LEU O
H A 0083 ARG N 3.070 H A 0079 ASP O
H A 0083 ARG N 2.198 H A 0082 ILE O
H A 0084 GLU N 2.795 H A 0080 PHE O
H A 0084 GLU N 2.195 H A 0083 ARG O
H A 0085 GLY N 3.044 H A 0081 LEU O
H A 0085 GLY N 2.196 H A 0084 GLU O
C A 0086 TYR N 3.031 H A 0081 LEU O
C A 0086 TYR N 2.195 H A 0085 GLY O
C A 0087 ILE N 3.118 H A 0081 LEU O
C A 0087 ILE N 2.196 C A 0086 TYR O
C A 0088 THR N 2.194 C A 0087 ILE O
C A 0089 LYS N 2.198 C A 0088 THR O
C A 0090 ALA N 2.197 C A 0089 LYS O
HB_MS 2.00 3.20 3
C A 0001 GLY O 2.881 C A 0002 SER OG
C A 0016 GLY N 2.862 C A 0015 THR OG1
H A 0067 ILE O 2.647 H A 0074 THR OG1
HB_SS 2.00 3.20 1
H A 0054 LYS NZ 2.714 H A 0050 ASN OD1
AROMATIC 0.00 8.00 3
H A 0026 LYS 7.905 H A 0080 PHE
H A 0045 LYS 7.368 H A 0041 TYR
H A 0045 LYS 4.998 C A 0086 TYR