Complet list of 1qpm con file
Complete list of 1qpm.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 258
C A 0013 LYS C 2.420 C A 0014 SER CA
C A 0013 LYS C 3.119 C A 0014 SER C
C A 0013 LYS C 3.676 C A 0014 SER CB
C A 0014 SER C 2.437 C A 0015 ILE CA
C A 0014 SER C 3.554 C A 0015 ILE C
C A 0014 SER C 3.384 C A 0015 ILE CB
C A 0014 SER C 3.326 C A 0015 ILE CG1
C A 0015 ILE CA 3.722 C A 0016 TRP CD1
C A 0015 ILE C 2.435 C A 0016 TRP CA
C A 0015 ILE C 3.583 C A 0016 TRP C
C A 0015 ILE C 3.338 C A 0016 TRP CB
C A 0015 ILE C 3.182 C A 0016 TRP CG
C A 0015 ILE C 3.048 C A 0016 TRP CD1
C A 0016 TRP C 2.449 C A 0017 CYS CA
C A 0016 TRP C 3.565 C A 0017 CYS C
C A 0016 TRP C 3.410 C A 0017 CYS CB
C A 0016 TRP CE3 3.559 E A 0047 ARG CD
C A 0016 TRP CZ3 3.692 E A 0047 ARG CD
C A 0016 TRP CD2 3.752 C A 0061 ASP CG
C A 0016 TRP CE3 3.221 C A 0061 ASP CG
C A 0016 TRP CZ3 3.056 C A 0061 ASP CG
C A 0016 TRP CH2 3.461 C A 0061 ASP CG
C A 0017 CYS C 2.433 H A 0018 SER CA
C A 0017 CYS C 3.098 H A 0018 SER C
C A 0017 CYS C 3.687 H A 0018 SER CB
H A 0018 SER CA 2.894 H A 0019 PRO CD
H A 0018 SER C 2.471 H A 0019 PRO CA
H A 0018 SER C 3.067 H A 0019 PRO C
H A 0018 SER C 3.668 H A 0019 PRO CB
H A 0018 SER C 3.597 H A 0019 PRO CG
H A 0018 SER C 2.483 H A 0019 PRO CD
H A 0018 SER CB 3.379 H A 0019 PRO CD
H A 0019 PRO C 2.415 H A 0020 GLN CA
H A 0019 PRO C 2.934 H A 0020 GLN C
H A 0019 PRO C 3.685 H A 0020 GLN CB
H A 0019 PRO CB 3.600 H A 0032 VAL CG1
H A 0020 GLN C 2.414 H A 0021 GLU CA
H A 0020 GLN C 3.020 H A 0021 GLU C
H A 0020 GLN C 3.686 H A 0021 GLU CB
H A 0021 GLU C 2.423 H A 0022 ILE CA
H A 0021 GLU C 3.059 H A 0022 ILE C
H A 0021 GLU C 3.687 H A 0022 ILE CB
H A 0022 ILE C 2.428 H A 0023 MET CA
H A 0022 ILE C 3.006 H A 0023 MET C
H A 0022 ILE C 3.710 H A 0023 MET CB
H A 0022 ILE CD1 3.509 E A 0060 TYR CD1
H A 0023 MET C 2.414 H A 0024 ALA CA
H A 0023 MET C 3.091 H A 0024 ALA C
H A 0023 MET C 3.668 H A 0024 ALA CB
H A 0023 MET CA 3.483 H A 0035 VAL CG2
H A 0023 MET CB 3.398 H A 0035 VAL CG2
H A 0024 ALA C 2.431 C A 0025 ALA CA
H A 0024 ALA C 3.143 C A 0025 ALA C
H A 0024 ALA C 3.673 C A 0025 ALA CB
C A 0025 ALA C 2.417 C A 0026 ASP CA
C A 0025 ALA C 2.936 C A 0026 ASP C
C A 0025 ALA C 3.693 C A 0026 ASP CB
C A 0026 ASP C 2.426 C A 0027 GLY CA
C A 0026 ASP C 2.948 C A 0027 GLY C
C A 0027 GLY C 2.447 C A 0028 MET CA
C A 0027 GLY C 3.501 C A 0028 MET C
C A 0027 GLY C 3.479 C A 0028 MET CB
C A 0027 GLY C 3.402 C A 0028 MET CG
C A 0027 GLY C 3.464 C A 0029 PRO CD
C A 0028 MET CA 2.903 C A 0029 PRO CD
C A 0028 MET C 2.464 C A 0029 PRO CA
C A 0028 MET C 3.239 C A 0029 PRO C
C A 0028 MET C 3.602 C A 0029 PRO CB
C A 0028 MET C 3.645 C A 0029 PRO CG
C A 0028 MET C 2.488 C A 0029 PRO CD
C A 0028 MET CE 3.541 C A 0044 TRP CH2
C A 0028 MET CE 3.243 H A 0069 GLU CG
C A 0028 MET CE 3.785 H A 0069 GLU CD
C A 0029 PRO C 2.430 C A 0030 GLY CA
C A 0029 PRO C 3.289 C A 0030 GLY C
C A 0030 GLY C 2.402 H A 0031 SER CA
C A 0030 GLY C 3.012 H A 0031 SER C
C A 0030 GLY C 3.675 H A 0031 SER CB
H A 0031 SER CA 3.798 H A 0032 VAL CA
H A 0031 SER C 2.403 H A 0032 VAL CA
H A 0031 SER C 2.925 H A 0032 VAL C
H A 0031 SER C 3.676 H A 0032 VAL CB
H A 0032 VAL C 2.421 H A 0033 ALA CA
H A 0032 VAL C 2.974 H A 0033 ALA C
H A 0032 VAL C 3.697 H A 0033 ALA CB
H A 0032 VAL CG1 3.565 H A 0036 HIS CE1
H A 0033 ALA C 2.413 H A 0034 GLY CA
H A 0033 ALA C 2.863 H A 0034 GLY C
H A 0034 GLY C 2.414 H A 0035 VAL CA
H A 0034 GLY C 2.957 H A 0035 VAL C
H A 0034 GLY C 3.693 H A 0035 VAL CB
H A 0035 VAL C 2.433 H A 0036 HIS CA
H A 0035 VAL C 2.962 H A 0036 HIS C
H A 0035 VAL C 3.724 H A 0036 HIS CB
H A 0036 HIS C 2.416 H A 0037 TYR CA
H A 0036 HIS C 2.943 H A 0037 TYR C
H A 0036 HIS C 3.691 H A 0037 TYR CB
H A 0037 TYR C 2.407 H A 0038 ARG CA
H A 0037 TYR C 2.974 H A 0038 ARG C
H A 0037 TYR C 3.685 H A 0038 ARG CB
H A 0038 ARG C 2.434 H A 0039 ALA CA
H A 0038 ARG C 3.102 H A 0039 ALA C
H A 0038 ARG C 3.685 H A 0039 ALA CB
H A 0039 ALA C 2.417 H A 0040 ASN CA
H A 0039 ALA C 3.082 H A 0040 ASN C
H A 0039 ALA C 3.697 H A 0040 ASN CB
H A 0039 ALA CB 3.787 C A 0044 TRP CG
H A 0039 ALA CB 3.482 C A 0044 TRP CD2
H A 0039 ALA CB 3.621 C A 0044 TRP CE3
H A 0040 ASN C 2.432 H A 0041 VAL CA
H A 0040 ASN C 3.089 H A 0041 VAL C
H A 0040 ASN C 3.684 H A 0041 VAL CB
H A 0041 VAL C 2.425 H A 0042 GLN CA
H A 0041 VAL C 3.158 H A 0042 GLN C
H A 0041 VAL C 3.673 H A 0042 GLN CB
H A 0042 GLN C 2.439 C A 0043 GLY CA
H A 0042 GLN C 3.232 C A 0043 GLY C
H A 0042 GLN CB 3.548 C A 0044 TRP CD1
C A 0043 GLY C 2.427 C A 0044 TRP CA
C A 0043 GLY C 2.978 C A 0044 TRP C
C A 0043 GLY C 3.691 C A 0044 TRP CB
C A 0044 TRP C 2.415 C A 0045 THR CA
C A 0044 TRP C 3.061 C A 0045 THR C
C A 0044 TRP C 3.686 C A 0045 THR CB
C A 0044 TRP CE3 3.739 E A 0060 TYR CD2
C A 0044 TRP CG 3.670 H A 0065 MET CE
C A 0044 TRP CD2 3.208 H A 0065 MET CE
C A 0044 TRP CE3 2.974 H A 0065 MET CE
C A 0044 TRP CZ3 3.547 H A 0065 MET CE
C A 0045 THR C 2.440 E A 0046 LYS CA
C A 0045 THR C 3.536 E A 0046 LYS C
C A 0045 THR C 3.423 E A 0046 LYS CB
C A 0045 THR C 3.338 E A 0046 LYS CG
C A 0045 THR CB 3.471 C A 0061 ASP CG
C A 0045 THR CG2 3.142 C A 0061 ASP CG
E A 0046 LYS C 2.431 E A 0047 ARG CA
E A 0046 LYS C 3.601 E A 0047 ARG C
E A 0046 LYS C 3.305 E A 0047 ARG CB
E A 0046 LYS CG 3.730 E A 0060 TYR CD2
E A 0046 LYS CG 3.522 E A 0060 TYR CE2
E A 0046 LYS CD 3.528 E A 0060 TYR CE2
E A 0047 ARG C 2.430 E A 0048 LYS CA
E A 0047 ARG C 3.234 E A 0048 LYS C
E A 0047 ARG C 3.633 E A 0048 LYS CB
E A 0048 LYS C 2.424 E A 0049 LYS CA
E A 0048 LYS C 3.140 E A 0049 LYS C
E A 0048 LYS C 3.666 E A 0049 LYS CB
E A 0049 LYS C 2.434 C A 0050 GLU CA
E A 0049 LYS C 3.077 C A 0050 GLU C
E A 0049 LYS C 3.692 C A 0050 GLU CB
C A 0050 GLU C 2.419 C A 0051 GLY CA
C A 0050 GLU C 3.131 C A 0051 GLY C
C A 0051 GLY C 2.434 C A 0052 VAL CA
C A 0051 GLY C 3.272 C A 0052 VAL C
C A 0051 GLY C 3.627 C A 0052 VAL CB
C A 0051 GLY CA 3.567 E A 0057 ALA CB
C A 0052 VAL C 2.418 C A 0053 LYS CA
C A 0052 VAL C 2.872 C A 0053 LYS C
C A 0052 VAL C 3.034 C A 0053 LYS CB
C A 0052 VAL C 3.646 C A 0053 LYS CG
C A 0053 LYS C 2.427 C A 0054 GLY CA
C A 0053 LYS C 3.651 C A 0054 GLY C
C A 0054 GLY C 2.415 C A 0055 GLY CA
C A 0054 GLY C 3.688 C A 0055 GLY C
C A 0055 GLY C 2.430 C A 0056 LYS CA
C A 0055 GLY C 2.991 C A 0056 LYS C
C A 0055 GLY C 2.987 C A 0056 LYS CB
C A 0056 LYS C 2.444 E A 0057 ALA CA
C A 0056 LYS C 3.338 E A 0057 ALA C
C A 0056 LYS C 3.599 E A 0057 ALA CB
E A 0057 ALA C 2.453 E A 0058 VAL CA
E A 0057 ALA C 3.523 E A 0058 VAL C
E A 0057 ALA C 3.467 E A 0058 VAL CB
E A 0057 ALA C 3.420 E A 0058 VAL CG2
E A 0058 VAL C 2.453 E A 0059 GLU CA
E A 0058 VAL C 3.596 E A 0059 GLU C
E A 0058 VAL C 3.394 E A 0059 GLU CB
E A 0058 VAL C 3.409 E A 0059 GLU CG
E A 0059 GLU C 2.465 E A 0060 TYR CA
E A 0059 GLU C 3.565 E A 0060 TYR C
E A 0059 GLU C 3.445 E A 0060 TYR CB
E A 0059 GLU C 3.403 E A 0060 TYR CG
E A 0059 GLU C 3.395 E A 0060 TYR CD1
E A 0060 TYR C 2.435 C A 0061 ASP CA
E A 0060 TYR C 3.276 C A 0061 ASP C
E A 0060 TYR C 3.639 C A 0061 ASP CB
E A 0060 TYR C 3.783 C A 0061 ASP CG
E A 0060 TYR CB 3.745 H A 0065 MET CE
C A 0061 ASP C 2.435 H A 0062 VAL CA
C A 0061 ASP C 3.068 H A 0062 VAL C
C A 0061 ASP C 3.698 H A 0062 VAL CB
H A 0062 VAL C 2.427 H A 0063 MET CA
H A 0062 VAL C 3.074 H A 0063 MET C
H A 0062 VAL C 3.686 H A 0063 MET CB
H A 0062 VAL CA 3.718 H A 0065 MET CG
H A 0063 MET C 2.439 H A 0064 SER CA
H A 0063 MET C 3.341 H A 0064 SER C
H A 0063 MET C 3.602 H A 0064 SER CB
H A 0064 SER C 2.425 H A 0065 MET CA
H A 0064 SER C 3.122 H A 0065 MET C
H A 0064 SER C 3.689 H A 0065 MET CB
H A 0065 MET CA 2.953 H A 0066 PRO CD
H A 0065 MET C 2.451 H A 0066 PRO CA
H A 0065 MET C 2.907 H A 0066 PRO C
H A 0065 MET C 3.610 H A 0066 PRO CB
H A 0065 MET C 3.670 H A 0066 PRO CG
H A 0065 MET C 2.499 H A 0066 PRO CD
H A 0065 MET CB 3.628 H A 0066 PRO CD
H A 0065 MET CB 3.785 H A 0069 GLU CB
H A 0065 MET CB 3.785 H A 0069 GLU CG
H A 0065 MET CB 3.585 H A 0069 GLU CD
H A 0066 PRO C 2.422 H A 0067 THR CA
H A 0066 PRO C 2.955 H A 0067 THR C
H A 0066 PRO C 3.690 H A 0067 THR CB
H A 0067 THR C 2.430 H A 0068 LYS CA
H A 0067 THR C 2.927 H A 0068 LYS C
H A 0067 THR C 3.684 H A 0068 LYS CB
H A 0068 LYS C 2.422 H A 0069 GLU CA
H A 0068 LYS C 2.980 H A 0069 GLU C
H A 0068 LYS C 3.696 H A 0069 GLU CB
H A 0069 GLU C 2.431 H A 0070 ARG CA
H A 0069 GLU C 2.976 H A 0070 ARG C
H A 0069 GLU C 3.700 H A 0070 ARG CB
H A 0069 GLU CD 3.760 H A 0073 VAL CG2
H A 0070 ARG C 2.422 H A 0071 GLU CA
H A 0070 ARG C 2.945 H A 0071 GLU C
H A 0070 ARG C 3.702 H A 0071 GLU CB
H A 0071 GLU C 2.422 H A 0072 GLN CA
H A 0071 GLU C 3.000 H A 0072 GLN C
H A 0071 GLU C 3.692 H A 0072 GLN CB
H A 0072 GLN C 2.416 H A 0073 VAL CA
H A 0072 GLN C 3.008 H A 0073 VAL C
H A 0072 GLN C 3.693 H A 0073 VAL CB
H A 0073 VAL C 2.422 H A 0074 ILE CA
H A 0073 VAL C 2.959 H A 0074 ILE C
H A 0073 VAL C 3.698 H A 0074 ILE CB
H A 0074 ILE C 2.414 H A 0075 ALA CA
H A 0074 ILE C 2.937 H A 0075 ALA C
H A 0074 ILE C 3.690 H A 0075 ALA CB
H A 0075 ALA C 2.415 H A 0076 HIS CA
H A 0075 ALA C 2.937 H A 0076 HIS C
H A 0075 ALA C 3.692 H A 0076 HIS CB
H A 0076 HIS C 2.417 H A 0077 LEU CA
H A 0076 HIS C 3.024 H A 0077 LEU C
H A 0076 HIS C 3.686 H A 0077 LEU CB
H A 0077 LEU C 2.423 H A 0078 GLY CA
H A 0077 LEU C 2.987 H A 0078 GLY C
H A 0077 LEU C 3.781 C A 0081 THR C
H A 0078 GLY C 2.426 H A 0079 LEU CA
H A 0078 GLY C 3.162 H A 0079 LEU C
H A 0078 GLY C 3.684 H A 0079 LEU CB
H A 0079 LEU C 2.426 C A 0080 SER CA
H A 0079 LEU C 3.652 C A 0080 SER C
H A 0079 LEU C 3.212 C A 0080 SER CB
C A 0080 SER C 2.426 C A 0081 THR CA
C A 0080 SER C 3.654 C A 0081 THR C
C A 0080 SER C 3.187 C A 0081 THR CB
C A 0080 SER C 3.499 C A 0081 THR CG2
CHARGE_ATTR 2.00 12.00 47
H A 0021 GLU OE1 11.74 H A 0036 HIS ND1
H A 0021 GLU OE1 11.72 H A 0036 HIS NE2
H A 0021 GLU OE1 9.829 H A 0076 HIS ND1
H A 0021 GLU OE1 9.230 H A 0076 HIS NE2
H A 0021 GLU OE2 9.877 H A 0076 HIS ND1
H A 0021 GLU OE2 8.817 H A 0076 HIS NE2
C A 0026 ASP OD1 10.28 H A 0038 ARG NH1
C A 0026 ASP OD1 8.777 H A 0038 ARG NH2
C A 0026 ASP OD2 10.81 H A 0038 ARG NH2
C A 0026 ASP OD1 8.983 H A 0076 HIS ND1
C A 0026 ASP OD1 11.00 H A 0076 HIS NE2
C A 0026 ASP OD2 8.756 H A 0076 HIS ND1
C A 0026 ASP OD2 10.67 H A 0076 HIS NE2
C A 0050 GLU OE1 10.73 E A 0047 ARG NH2
C A 0050 GLU OE2 10.59 E A 0047 ARG NH2
C A 0050 GLU OE2 11.37 E A 0048 LYS NZ
C A 0050 GLU OE1 6.613 E A 0049 LYS NZ
C A 0050 GLU OE2 8.161 E A 0049 LYS NZ
E A 0059 GLU OE1 5.523 E A 0047 ARG NH1
E A 0059 GLU OE1 6.876 E A 0047 ARG NH2
E A 0059 GLU OE2 5.159 E A 0047 ARG NH1
E A 0059 GLU OE2 5.896 E A 0047 ARG NH2
E A 0059 GLU OE1 7.980 E A 0049 LYS NZ
E A 0059 GLU OE2 6.329 E A 0049 LYS NZ
E A 0059 GLU OE2 11.76 C A 0056 LYS NZ
C A 0061 ASP OD1 11.75 C A 0013 LYS NZ
C A 0061 ASP OD2 9.895 C A 0013 LYS NZ
C A 0061 ASP OD1 11.82 H A 0036 HIS NE2
C A 0061 ASP OD1 10.73 E A 0046 LYS NZ
C A 0061 ASP OD1 5.918 E A 0047 ARG NH1
C A 0061 ASP OD1 7.918 E A 0047 ARG NH2
C A 0061 ASP OD2 6.106 E A 0047 ARG NH1
C A 0061 ASP OD2 7.988 E A 0047 ARG NH2
H A 0069 GLU OE2 11.65 H A 0038 ARG NH1
H A 0069 GLU OE1 8.478 H A 0070 ARG NH1
H A 0069 GLU OE1 7.638 H A 0070 ARG NH2
H A 0069 GLU OE2 10.42 H A 0070 ARG NH1
H A 0069 GLU OE2 9.735 H A 0070 ARG NH2
H A 0069 GLU OE1 11.82 H A 0076 HIS ND1
H A 0069 GLU OE2 10.22 H A 0076 HIS ND1
H A 0069 GLU OE2 11.64 H A 0076 HIS NE2
H A 0071 GLU OE1 8.840 H A 0068 LYS NZ
H A 0071 GLU OE2 8.368 H A 0068 LYS NZ
H A 0071 GLU OE1 9.889 H A 0070 ARG NH1
H A 0071 GLU OE1 10.43 H A 0070 ARG NH2
H A 0071 GLU OE2 8.456 H A 0070 ARG NH1
H A 0071 GLU OE2 9.003 H A 0070 ARG NH2
CHARGE_REPU 2.00 12.00 30
C A 0013 LYS NZ 11.80 E A 0047 ARG NH1
H A 0021 GLU OE1 8.247 E A 0059 GLU OE1
H A 0021 GLU OE1 9.555 E A 0059 GLU OE2
H A 0021 GLU OE2 9.202 E A 0059 GLU OE1
H A 0021 GLU OE2 10.52 E A 0059 GLU OE2
H A 0021 GLU OE1 11.30 H A 0069 GLU OE2
H A 0036 HIS ND1 7.555 E A 0046 LYS NZ
H A 0036 HIS NE2 6.167 E A 0046 LYS NZ
H A 0036 HIS ND1 11.19 E A 0048 LYS NZ
H A 0036 HIS NE2 9.177 E A 0048 LYS NZ
H A 0036 HIS ND1 9.327 C A 0056 LYS NZ
H A 0036 HIS NE2 7.478 C A 0056 LYS NZ
E A 0046 LYS NZ 8.919 E A 0048 LYS NZ
E A 0046 LYS NZ 8.866 C A 0056 LYS NZ
E A 0047 ARG NH1 9.397 E A 0049 LYS NZ
E A 0047 ARG NH2 8.492 E A 0049 LYS NZ
E A 0048 LYS NZ 2.550 C A 0056 LYS NZ
E A 0049 LYS NZ 10.17 C A 0053 LYS NZ
C A 0050 GLU OE1 11.39 E A 0059 GLU OE2
E A 0059 GLU OE1 7.372 C A 0061 ASP OD1
E A 0059 GLU OE1 8.745 C A 0061 ASP OD2
E A 0059 GLU OE2 8.019 C A 0061 ASP OD1
E A 0059 GLU OE2 9.377 C A 0061 ASP OD2
C A 0061 ASP OD1 10.76 H A 0069 GLU OE1
C A 0061 ASP OD1 10.96 H A 0069 GLU OE2
C A 0061 ASP OD2 11.47 H A 0069 GLU OE1
H A 0069 GLU OE1 9.673 H A 0071 GLU OE1
H A 0069 GLU OE1 9.782 H A 0071 GLU OE2
H A 0069 GLU OE2 10.50 H A 0071 GLU OE1
H A 0069 GLU OE2 11.00 H A 0071 GLU OE2
HB_MM 2.00 3.20 115
C A 0014 SER N 2.195 C A 0013 LYS O
C A 0015 ILE N 2.201 C A 0014 SER O
C A 0016 TRP N 2.199 C A 0015 ILE O
C A 0017 CYS N 2.204 C A 0016 TRP O
C A 0017 CYS N 3.032 E A 0060 TYR O
H A 0018 SER N 2.198 C A 0017 CYS O
H A 0019 PRO N 2.207 H A 0018 SER O
H A 0020 GLN N 3.091 H A 0018 SER O
H A 0020 GLN N 2.194 H A 0019 PRO O
H A 0021 GLU N 3.155 H A 0018 SER O
H A 0021 GLU N 2.194 H A 0020 GLN O
H A 0022 ILE N 3.109 H A 0019 PRO O
H A 0022 ILE N 2.197 H A 0021 GLU O
H A 0023 MET N 2.649 H A 0019 PRO O
H A 0023 MET N 2.197 H A 0022 ILE O
H A 0024 ALA N 3.153 H A 0020 GLN O
H A 0024 ALA N 2.923 H A 0022 ILE O
H A 0024 ALA N 2.193 H A 0023 MET O
C A 0025 ALA N 2.699 H A 0022 ILE O
C A 0025 ALA N 2.204 H A 0024 ALA O
C A 0026 ASP N 2.193 C A 0025 ALA O
C A 0027 GLY N 2.197 C A 0026 ASP O
C A 0028 MET N 2.868 C A 0025 ALA O
C A 0028 MET N 2.913 C A 0026 ASP O
C A 0028 MET N 2.206 C A 0027 GLY O
C A 0029 PRO N 2.203 C A 0028 MET O
C A 0030 GLY N 2.200 C A 0029 PRO O
H A 0031 SER N 2.186 C A 0030 GLY O
H A 0032 VAL N 2.189 H A 0031 SER O
H A 0033 ALA N 2.188 H A 0032 VAL O
H A 0034 GLY N 3.067 H A 0031 SER O
H A 0034 GLY N 2.181 H A 0033 ALA O
H A 0035 VAL N 3.055 H A 0032 VAL O
H A 0035 VAL N 2.971 H A 0033 ALA O
H A 0035 VAL N 2.195 H A 0034 GLY O
H A 0036 HIS N 2.663 H A 0033 ALA O
H A 0036 HIS N 2.203 H A 0035 VAL O
H A 0037 TYR N 2.955 H A 0033 ALA O
H A 0037 TYR N 3.044 H A 0034 GLY O
H A 0037 TYR N 3.144 H A 0035 VAL O
H A 0037 TYR N 2.197 H A 0036 HIS O
H A 0038 ARG N 3.139 H A 0035 VAL O
H A 0038 ARG N 2.185 H A 0037 TYR O
H A 0039 ALA N 3.085 H A 0035 VAL O
H A 0039 ALA N 3.100 H A 0036 HIS O
H A 0039 ALA N 2.201 H A 0038 ARG O
H A 0040 ASN N 2.878 H A 0036 HIS O
H A 0040 ASN N 3.026 H A 0037 TYR O
H A 0040 ASN N 2.998 H A 0038 ARG O
H A 0040 ASN N 2.193 H A 0039 ALA O
H A 0041 VAL N 2.200 H A 0040 ASN O
H A 0042 GLN N 2.194 H A 0041 VAL O
C A 0043 GLY N 2.204 H A 0042 GLN O
C A 0044 TRP N 3.064 H A 0042 GLN O
C A 0044 TRP N 2.195 C A 0043 GLY O
C A 0045 THR N 2.198 C A 0044 TRP O
E A 0046 LYS N 2.208 C A 0045 THR O
E A 0047 ARG N 2.201 E A 0046 LYS O
E A 0048 LYS N 2.209 E A 0047 ARG O
E A 0049 LYS N 2.195 E A 0048 LYS O
E A 0049 LYS N 2.914 E A 0057 ALA O
C A 0050 GLU N 2.198 E A 0049 LYS O
C A 0051 GLY N 2.589 E A 0049 LYS O
C A 0051 GLY N 2.191 C A 0050 GLU O
C A 0052 VAL N 2.201 C A 0051 GLY O
C A 0053 LYS N 2.192 C A 0052 VAL O
C A 0054 GLY N 2.823 C A 0052 VAL O
C A 0054 GLY N 2.197 C A 0053 LYS O
C A 0055 GLY N 2.195 C A 0054 GLY O
C A 0056 LYS N 2.198 C A 0055 GLY O
E A 0057 ALA N 2.202 C A 0056 LYS O
E A 0058 VAL N 2.205 E A 0057 ALA O
E A 0059 GLU N 2.209 E A 0058 VAL O
E A 0060 TYR N 3.130 C A 0017 CYS O
E A 0060 TYR N 2.217 E A 0059 GLU O
C A 0061 ASP N 2.199 E A 0060 TYR O
H A 0062 VAL N 2.197 C A 0061 ASP O
H A 0063 MET N 2.193 H A 0062 VAL O
H A 0064 SER N 3.169 H A 0062 VAL O
H A 0064 SER N 2.197 H A 0063 MET O
H A 0065 MET N 2.194 H A 0064 SER O
H A 0066 PRO N 2.202 H A 0065 MET O
H A 0067 THR N 2.193 H A 0066 PRO O
H A 0068 LYS N 2.198 H A 0067 THR O
H A 0069 GLU N 3.068 H A 0066 PRO O
H A 0069 GLU N 3.182 H A 0067 THR O
H A 0069 GLU N 2.200 H A 0068 LYS O
H A 0070 ARG N 3.079 H A 0066 PRO O
H A 0070 ARG N 2.866 H A 0067 THR O
H A 0070 ARG N 2.200 H A 0069 GLU O
H A 0071 GLU N 3.045 H A 0067 THR O
H A 0071 GLU N 2.194 H A 0070 ARG O
H A 0072 GLN N 3.046 H A 0069 GLU O
H A 0072 GLN N 2.197 H A 0071 GLU O
H A 0073 VAL N 3.112 H A 0070 ARG O
H A 0073 VAL N 2.192 H A 0072 GLN O
H A 0074 ILE N 3.058 H A 0070 ARG O
H A 0074 ILE N 2.196 H A 0073 VAL O
H A 0075 ALA N 2.743 H A 0071 GLU O
H A 0075 ALA N 2.196 H A 0074 ILE O
H A 0076 HIS N 3.144 H A 0072 GLN O
H A 0076 HIS N 3.141 H A 0073 VAL O
H A 0076 HIS N 2.195 H A 0075 ALA O
H A 0077 LEU N 3.012 H A 0074 ILE O
H A 0077 LEU N 2.195 H A 0076 HIS O
H A 0078 GLY N 2.732 H A 0074 ILE O
H A 0078 GLY N 2.932 H A 0075 ALA O
H A 0078 GLY N 2.198 H A 0077 LEU O
H A 0079 LEU N 3.103 H A 0076 HIS O
H A 0079 LEU N 2.917 H A 0077 LEU O
H A 0079 LEU N 2.199 H A 0078 GLY O
C A 0080 SER N 2.855 H A 0077 LEU O
C A 0080 SER N 2.195 H A 0079 LEU O
C A 0081 THR N 2.446 H A 0077 LEU O
C A 0081 THR N 2.196 C A 0080 SER O
HB_MS 2.00 3.20 5
H A 0032 VAL N 3.025 H A 0031 SER OG
H A 0032 VAL O 2.877 H A 0036 HIS ND1
C A 0061 ASP O 2.843 H A 0064 SER OG
H A 0070 ARG N 2.849 H A 0069 GLU OE1
H A 0079 LEU O 2.829 C A 0080 SER OG
HB_SS 2.00 3.20 2
H A 0021 GLU OE1 2.511 H A 0018 SER OG
H A 0036 HIS NE2 2.359 E A 0060 TYR OH
AROMATIC 0.00 8.00 5
H A 0036 HIS 5.655 E A 0060 TYR
C A 0044 TRP 5.856 E A 0060 TYR
E A 0046 LYS 6.986 E A 0060 TYR
E A 0046 LYS 6.361 H A 0036 HIS
H A 0038 ARG 6.691 H A 0037 TYR