Complet list of 1sym con file
Complete list of 1sym.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 397
C A 0000 MET C 2.424 C A 0001 SER CA
C A 0000 MET C 3.536 C A 0001 SER C
C A 0000 MET C 3.390 C A 0001 SER CB
C A 0001 SER C 2.426 H A 0002 GLU CA
C A 0001 SER C 3.166 H A 0002 GLU C
C A 0001 SER C 3.668 H A 0002 GLU CB
H A 0002 GLU C 2.430 H A 0003 LEU CA
H A 0002 GLU C 2.997 H A 0003 LEU C
H A 0002 GLU C 3.694 H A 0003 LEU CB
H A 0003 LEU C 2.412 H A 0004 GLU CA
H A 0003 LEU C 3.084 H A 0004 GLU C
H A 0003 LEU C 3.675 H A 0004 GLU CB
H A 0003 LEU C 3.682 H A 0007 MET CB
H A 0004 GLU C 2.416 H A 0005 LYS CA
H A 0004 GLU C 2.923 H A 0005 LYS C
H A 0004 GLU C 3.689 H A 0005 LYS CB
H A 0004 GLU CA 3.375 H A 0008 VAL CG2
H A 0004 GLU C 3.702 H A 0008 VAL CB
H A 0004 GLU C 3.250 H A 0008 VAL CG2
H A 0004 GLU CG 3.514 H A 0008 VAL CG2
H A 0005 LYS C 2.427 H A 0006 ALA CA
H A 0005 LYS C 3.173 H A 0006 ALA C
H A 0005 LYS C 3.665 H A 0006 ALA CB
H A 0006 ALA C 2.427 H A 0007 MET CA
H A 0006 ALA C 2.880 H A 0007 MET C
H A 0006 ALA C 3.688 H A 0007 MET CB
H A 0007 MET C 2.417 H A 0008 VAL CA
H A 0007 MET C 2.934 H A 0008 VAL C
H A 0007 MET C 3.686 H A 0008 VAL CB
H A 0007 MET CE 3.685 H A 0074 MET CE
H A 0008 VAL C 2.423 H A 0009 ALA CA
H A 0008 VAL C 2.952 H A 0009 ALA C
H A 0008 VAL C 3.700 H A 0009 ALA CB
H A 0009 ALA C 2.421 H A 0010 LEU CA
H A 0009 ALA C 2.934 H A 0010 LEU C
H A 0009 ALA C 3.695 H A 0010 LEU CB
H A 0010 LEU C 2.421 H A 0011 ILE CA
H A 0010 LEU C 2.864 H A 0011 ILE C
H A 0010 LEU C 3.686 H A 0011 ILE CB
H A 0010 LEU CD2 3.438 H A 0073 PHE CZ
H A 0010 LEU CB 3.622 H A 0074 MET CE
H A 0010 LEU CG 3.560 H A 0074 MET CE
H A 0010 LEU CD1 3.063 H A 0074 MET CE
H A 0010 LEU CD2 3.444 H A 0074 MET CE
H A 0011 ILE C 2.428 H A 0012 ASP CA
H A 0011 ILE C 3.074 H A 0012 ASP C
H A 0011 ILE C 3.682 H A 0012 ASP CB
H A 0012 ASP C 2.424 H A 0013 VAL CA
H A 0012 ASP C 2.889 H A 0013 VAL C
H A 0012 ASP C 3.695 H A 0013 VAL CB
H A 0013 VAL C 2.419 H A 0014 PHE CA
H A 0013 VAL C 2.968 H A 0014 PHE C
H A 0013 VAL C 3.698 H A 0014 PHE CB
H A 0014 PHE C 2.418 H A 0015 HIS CA
H A 0014 PHE C 3.035 H A 0015 HIS C
H A 0014 PHE C 3.685 H A 0015 HIS CB
H A 0014 PHE CE1 3.640 E A 0027 LEU CB
H A 0014 PHE CE1 3.723 E A 0027 LEU CD1
H A 0014 PHE CE2 3.647 E A 0069 ASP C
H A 0014 PHE CZ 3.359 E A 0069 ASP C
H A 0014 PHE CD2 3.456 H A 0070 PHE CB
H A 0014 PHE CE2 3.101 H A 0070 PHE CA
H A 0014 PHE CE2 3.142 H A 0070 PHE CB
H A 0014 PHE CZ 3.453 H A 0070 PHE CA
H A 0014 PHE CD1 3.766 H A 0073 PHE CG
H A 0014 PHE CD1 3.412 H A 0073 PHE CD1
H A 0014 PHE CD1 3.335 H A 0073 PHE CE1
H A 0014 PHE CD1 3.624 H A 0073 PHE CZ
H A 0014 PHE CE1 3.738 H A 0073 PHE CB
H A 0014 PHE CE1 3.327 H A 0073 PHE CG
H A 0014 PHE CE1 3.283 H A 0073 PHE CD1
H A 0014 PHE CE1 3.763 H A 0073 PHE CE1
H A 0015 HIS C 2.426 H A 0016 GLN CA
H A 0015 HIS C 3.275 H A 0016 GLN C
H A 0015 HIS C 3.612 H A 0016 GLN CB
H A 0016 GLN C 2.425 H A 0017 TYR CA
H A 0016 GLN C 2.841 H A 0017 TYR C
H A 0016 GLN C 3.677 H A 0017 TYR CB
H A 0017 TYR C 2.426 C A 0018 SER CA
H A 0017 TYR C 3.055 C A 0018 SER C
H A 0017 TYR C 3.691 C A 0018 SER CB
H A 0017 TYR C 3.739 C A 0020 ARG CG
H A 0017 TYR CD2 3.619 H A 0031 GLU CG
H A 0017 TYR CG 3.185 H A 0035 LEU CD2
H A 0017 TYR CD1 3.483 H A 0035 LEU CD2
H A 0017 TYR CD2 3.086 H A 0035 LEU CD2
H A 0017 TYR CE1 3.677 H A 0035 LEU CD2
H A 0017 TYR CE2 3.303 H A 0035 LEU CD2
H A 0017 TYR CZ 3.592 H A 0035 LEU CD2
H A 0017 TYR CE1 3.710 C A 0039 GLU CD
H A 0017 TYR CZ 3.499 C A 0039 GLU CD
C A 0018 SER C 2.425 C A 0019 GLY CA
C A 0018 SER C 3.059 C A 0019 GLY C
C A 0018 SER CA 3.661 E A 0027 LEU CD1
C A 0018 SER CB 3.535 E A 0027 LEU CD1
C A 0019 GLY C 2.424 C A 0020 ARG CA
C A 0019 GLY C 2.980 C A 0020 ARG C
C A 0019 GLY C 3.696 C A 0020 ARG CB
C A 0019 GLY CA 3.787 C A 0024 LYS CG
C A 0020 ARG C 2.423 C A 0021 GLU CA
C A 0020 ARG C 3.146 C A 0021 GLU C
C A 0020 ARG C 3.662 C A 0021 GLU CB
C A 0021 GLU C 2.426 C A 0022 GLY CA
C A 0021 GLU C 2.954 C A 0022 GLY C
C A 0022 GLY C 2.419 C A 0023 ASP CA
C A 0022 GLY C 2.843 C A 0023 ASP C
C A 0022 GLY C 3.666 C A 0023 ASP CB
C A 0023 ASP C 2.424 C A 0024 LYS CA
C A 0023 ASP C 3.590 C A 0024 LYS C
C A 0023 ASP C 3.313 C A 0024 LYS CB
C A 0023 ASP CB 3.575 E A 0026 LYS CG
C A 0024 LYS C 2.426 C A 0025 HIS CA
C A 0024 LYS C 3.657 C A 0025 HIS C
C A 0024 LYS C 3.193 C A 0025 HIS CB
C A 0024 LYS C 2.833 C A 0025 HIS CG
C A 0024 LYS C 3.208 C A 0025 HIS CD2
C A 0024 LYS C 3.559 C A 0025 HIS CE1
C A 0024 LYS CB 3.684 C A 0025 HIS CE1
C A 0025 HIS C 2.420 E A 0026 LYS CA
C A 0025 HIS C 3.634 E A 0026 LYS C
C A 0025 HIS C 3.224 E A 0026 LYS CB
C A 0025 HIS C 3.392 E A 0026 LYS CG
C A 0025 HIS C 3.269 E A 0026 LYS CD
E A 0026 LYS C 2.418 E A 0027 LEU CA
E A 0026 LYS C 3.294 E A 0027 LEU C
E A 0026 LYS C 3.593 E A 0027 LEU CB
E A 0027 LEU C 2.423 E A 0028 LYS CA
E A 0027 LEU C 3.529 E A 0028 LYS C
E A 0027 LEU C 3.384 E A 0028 LYS CB
E A 0028 LYS CA 3.772 H A 0029 LYS CE
E A 0028 LYS C 2.424 H A 0029 LYS CA
E A 0028 LYS C 2.847 H A 0029 LYS C
E A 0028 LYS C 3.703 H A 0029 LYS CB
E A 0028 LYS C 3.492 H A 0029 LYS CE
E A 0028 LYS CB 3.502 H A 0029 LYS CE
E A 0028 LYS CG 3.191 H A 0029 LYS CE
E A 0028 LYS CD 3.506 H A 0029 LYS CE
E A 0028 LYS CG 3.741 E A 0067 GLU CG
H A 0029 LYS C 2.421 H A 0030 SER CA
H A 0029 LYS C 3.146 H A 0030 SER C
H A 0029 LYS C 3.666 H A 0030 SER CB
H A 0029 LYS CG 3.568 C A 0064 GLY CA
H A 0029 LYS CD 3.273 C A 0064 GLY CA
H A 0029 LYS CD 3.333 C A 0064 GLY C
H A 0030 SER C 2.417 H A 0031 GLU CA
H A 0030 SER C 3.048 H A 0031 GLU C
H A 0030 SER C 3.684 H A 0031 GLU CB
H A 0031 GLU C 2.424 H A 0032 LEU CA
H A 0031 GLU C 3.115 H A 0032 LEU C
H A 0031 GLU C 3.673 H A 0032 LEU CB
H A 0032 LEU C 2.419 H A 0033 LYS CA
H A 0032 LEU C 2.881 H A 0033 LYS C
H A 0032 LEU C 3.684 H A 0033 LYS CB
H A 0032 LEU CD1 3.657 H A 0073 PHE CB
H A 0032 LEU CD1 3.480 H A 0073 PHE CD2
H A 0033 LYS C 2.426 H A 0034 GLU CA
H A 0033 LYS C 3.074 H A 0034 GLU C
H A 0033 LYS C 3.675 H A 0034 GLU CB
H A 0033 LYS CE 3.763 H A 0057 MET CG
H A 0033 LYS CE 3.652 H A 0057 MET CE
H A 0033 LYS CG 3.617 H A 0060 LEU CD1
H A 0034 GLU C 2.425 H A 0035 LEU CA
H A 0034 GLU C 2.947 H A 0035 LEU C
H A 0034 GLU C 3.688 H A 0035 LEU CB
H A 0034 GLU C 3.639 H A 0038 ASN CB
H A 0035 LEU C 2.429 H A 0036 ILE CA
H A 0035 LEU C 3.174 H A 0036 ILE C
H A 0035 LEU C 3.672 H A 0036 ILE CB
H A 0035 LEU C 3.790 H A 0036 ILE CG1
H A 0036 ILE C 2.429 H A 0037 ASN CA
H A 0036 ILE C 3.128 H A 0037 ASN C
H A 0036 ILE C 3.680 H A 0037 ASN CB
H A 0036 ILE CG2 3.299 H A 0080 VAL CG2
H A 0036 ILE CD1 3.707 H A 0080 VAL CG2
H A 0037 ASN C 2.416 H A 0038 ASN CA
H A 0037 ASN C 3.400 H A 0038 ASN C
H A 0037 ASN C 3.523 H A 0038 ASN CB
H A 0037 ASN C 3.543 C A 0041 SER CB
H A 0038 ASN C 2.419 C A 0039 GLU CA
H A 0038 ASN C 2.993 C A 0039 GLU C
H A 0038 ASN C 3.693 C A 0039 GLU CB
C A 0039 GLU C 2.420 C A 0040 LEU CA
C A 0039 GLU C 3.073 C A 0040 LEU C
C A 0039 GLU C 3.682 C A 0040 LEU CB
C A 0040 LEU C 2.433 C A 0041 SER CA
C A 0040 LEU C 2.830 C A 0041 SER C
C A 0040 LEU C 3.148 C A 0041 SER CB
C A 0040 LEU CD2 3.509 C A 0043 PHE CE2
C A 0041 SER C 2.422 C A 0042 HIS CA
C A 0041 SER C 3.689 C A 0042 HIS C
C A 0041 SER C 3.070 C A 0042 HIS CB
C A 0042 HIS C 2.422 C A 0043 PHE CA
C A 0042 HIS C 3.213 C A 0043 PHE C
C A 0042 HIS C 3.643 C A 0043 PHE CB
C A 0043 PHE C 2.423 C A 0044 LEU CA
C A 0043 PHE C 3.191 C A 0044 LEU C
C A 0043 PHE C 3.651 C A 0044 LEU CB
C A 0043 PHE CZ 3.494 H A 0081 THR CG2
C A 0044 LEU C 2.418 C A 0045 GLU CA
C A 0044 LEU C 3.536 C A 0045 GLU C
C A 0044 LEU C 3.384 C A 0045 GLU CB
C A 0044 LEU C 3.385 C A 0045 GLU CG
C A 0045 GLU C 2.424 C A 0046 GLU CA
C A 0045 GLU C 3.378 C A 0046 GLU C
C A 0045 GLU C 3.552 C A 0046 GLU CB
C A 0046 GLU C 2.421 C A 0047 ILE CA
C A 0046 GLU C 2.961 C A 0047 ILE C
C A 0046 GLU C 2.951 C A 0047 ILE CB
C A 0046 GLU C 3.190 C A 0047 ILE CG1
C A 0047 ILE C 2.423 C A 0048 LYS CA
C A 0047 ILE C 3.070 C A 0048 LYS C
C A 0047 ILE C 3.688 C A 0048 LYS CB
C A 0047 ILE CG2 3.344 H A 0053 VAL CG2
C A 0048 LYS C 2.420 C A 0049 GLU CA
C A 0048 LYS C 3.183 C A 0049 GLU C
C A 0048 LYS C 3.655 C A 0049 GLU CB
C A 0048 LYS CB 3.711 C A 0085 HIS CB
C A 0048 LYS CD 3.341 C A 0085 HIS CB
C A 0048 LYS CD 3.473 C A 0085 HIS CG
C A 0049 GLU C 2.415 H A 0050 GLN CA
C A 0049 GLU C 2.897 H A 0050 GLN C
C A 0049 GLU C 3.690 H A 0050 GLN CB
C A 0049 GLU CB 3.490 H A 0052 VAL CB
C A 0049 GLU CB 3.245 H A 0052 VAL CG2
C A 0049 GLU CG 3.379 H A 0052 VAL CG2
C A 0049 GLU CD 3.013 H A 0052 VAL CG2
C A 0049 GLU CB 3.399 C A 0083 ALA CA
C A 0049 GLU CB 3.568 C A 0083 ALA C
C A 0049 GLU CB 3.691 C A 0083 ALA CB
H A 0050 GLN C 2.425 H A 0051 GLU CA
H A 0050 GLN C 3.140 H A 0051 GLU C
H A 0050 GLN C 3.669 H A 0051 GLU CB
H A 0050 GLN C 3.745 H A 0054 ASP CB
H A 0051 GLU C 2.424 H A 0052 VAL CA
H A 0051 GLU C 3.034 H A 0052 VAL C
H A 0051 GLU C 3.692 H A 0052 VAL CB
H A 0052 VAL C 2.418 H A 0053 VAL CA
H A 0052 VAL C 3.068 H A 0053 VAL C
H A 0052 VAL C 3.684 H A 0053 VAL CB
H A 0052 VAL CG1 3.442 H A 0079 MET C
H A 0052 VAL CG1 3.487 H A 0079 MET CB
H A 0053 VAL C 2.415 H A 0054 ASP CA
H A 0053 VAL C 3.113 H A 0054 ASP C
H A 0053 VAL C 3.670 H A 0054 ASP CB
H A 0053 VAL CA 3.763 H A 0056 VAL CG2
H A 0053 VAL C 3.727 H A 0057 MET CB
H A 0053 VAL CG2 3.005 C A 0083 ALA CB
H A 0054 ASP C 2.421 H A 0055 LYS CA
H A 0054 ASP C 3.138 H A 0055 LYS C
H A 0054 ASP C 3.667 H A 0055 LYS CB
H A 0054 ASP C 3.763 H A 0058 GLU CG
H A 0054 ASP CG 3.734 H A 0058 GLU CG
H A 0054 ASP CG 3.488 H A 0058 GLU CD
H A 0055 LYS C 2.417 H A 0056 VAL CA
H A 0055 LYS C 3.082 H A 0056 VAL C
H A 0055 LYS C 3.680 H A 0056 VAL CB
H A 0056 VAL C 2.420 H A 0057 MET CA
H A 0056 VAL C 3.036 H A 0057 MET C
H A 0056 VAL C 3.679 H A 0057 MET CB
H A 0056 VAL CA 3.126 H A 0076 PHE CE2
H A 0056 VAL C 3.530 H A 0076 PHE CE2
H A 0056 VAL CB 3.123 H A 0076 PHE CD2
H A 0056 VAL CB 2.989 H A 0076 PHE CE2
H A 0056 VAL CG1 3.641 H A 0076 PHE CG
H A 0056 VAL CG1 3.116 H A 0076 PHE CD2
H A 0056 VAL CG1 3.085 H A 0076 PHE CE2
H A 0056 VAL CG1 3.586 H A 0076 PHE CZ
H A 0056 VAL CG2 3.499 H A 0080 VAL CG1
H A 0057 MET C 2.422 H A 0058 GLU CA
H A 0057 MET C 3.062 H A 0058 GLU C
H A 0057 MET C 3.691 H A 0058 GLU CB
H A 0057 MET CA 3.763 H A 0060 LEU CB
H A 0057 MET C 3.725 H A 0060 LEU CB
H A 0058 GLU C 2.418 H A 0059 THR CA
H A 0058 GLU C 2.931 H A 0059 THR C
H A 0058 GLU C 3.698 H A 0059 THR CB
H A 0059 THR C 2.425 H A 0060 LEU CA
H A 0059 THR C 3.011 H A 0060 LEU C
H A 0059 THR C 3.687 H A 0060 LEU CB
H A 0059 THR CA 3.641 H A 0062 GLU CB
H A 0059 THR C 3.782 H A 0062 GLU CB
H A 0060 LEU C 2.428 H A 0061 ASP CA
H A 0060 LEU C 3.150 H A 0061 ASP C
H A 0060 LEU C 3.666 H A 0061 ASP CB
H A 0061 ASP C 2.424 H A 0062 GLU CA
H A 0061 ASP C 3.145 H A 0062 GLU C
H A 0061 ASP C 3.669 H A 0062 GLU CB
H A 0062 GLU C 2.417 H A 0063 ASP CA
H A 0062 GLU C 3.258 H A 0063 ASP C
H A 0062 GLU C 3.628 H A 0063 ASP CB
H A 0063 ASP C 2.418 C A 0064 GLY CA
H A 0063 ASP C 2.831 C A 0064 GLY C
C A 0064 GLY C 2.425 C A 0065 ASP CA
C A 0064 GLY C 3.635 C A 0065 ASP C
C A 0064 GLY C 3.261 C A 0065 ASP CB
C A 0065 ASP C 2.421 C A 0066 GLY CA
C A 0065 ASP C 3.443 C A 0066 GLY C
C A 0066 GLY C 2.428 E A 0067 GLU CA
C A 0066 GLY C 3.485 E A 0067 GLU C
C A 0066 GLY C 3.458 E A 0067 GLU CB
C A 0066 GLY C 3.582 E A 0067 GLU CG
E A 0067 GLU C 2.428 E A 0068 CYS CA
E A 0067 GLU C 3.318 E A 0068 CYS C
E A 0067 GLU C 3.592 E A 0068 CYS CB
E A 0068 CYS C 2.423 E A 0069 ASP CA
E A 0068 CYS C 3.325 E A 0069 ASP C
E A 0068 CYS C 3.588 E A 0069 ASP CB
E A 0069 ASP C 2.417 H A 0070 PHE CA
E A 0069 ASP C 3.237 H A 0070 PHE C
E A 0069 ASP C 3.622 H A 0070 PHE CB
H A 0070 PHE C 2.424 H A 0071 GLN CA
H A 0070 PHE C 3.112 H A 0071 GLN C
H A 0070 PHE C 3.679 H A 0071 GLN CB
H A 0070 PHE CD1 3.718 H A 0071 GLN CG
H A 0070 PHE CD2 3.701 H A 0071 GLN CG
H A 0070 PHE CE1 3.149 H A 0071 GLN CG
H A 0070 PHE CE2 3.131 H A 0071 GLN CG
H A 0070 PHE CZ 2.814 H A 0071 GLN CG
H A 0070 PHE CZ 3.576 H A 0071 GLN CD
H A 0071 GLN C 2.425 H A 0072 GLU CA
H A 0071 GLN C 3.113 H A 0072 GLU C
H A 0071 GLN C 3.668 H A 0072 GLU CB
H A 0072 GLU C 2.420 H A 0073 PHE CA
H A 0072 GLU C 2.977 H A 0073 PHE C
H A 0072 GLU C 3.699 H A 0073 PHE CB
H A 0073 PHE C 2.427 H A 0074 MET CA
H A 0073 PHE C 3.122 H A 0074 MET C
H A 0073 PHE C 3.676 H A 0074 MET CB
H A 0073 PHE CD1 3.782 H A 0074 MET CA
H A 0073 PHE CD2 3.774 H A 0077 VAL CG2
H A 0074 MET C 2.417 H A 0075 ALA CA
H A 0074 MET C 3.034 H A 0075 ALA C
H A 0074 MET C 3.683 H A 0075 ALA CB
H A 0075 ALA C 2.424 H A 0076 PHE CA
H A 0075 ALA C 3.142 H A 0076 PHE C
H A 0075 ALA C 3.670 H A 0076 PHE CB
H A 0076 PHE C 2.431 H A 0077 VAL CA
H A 0076 PHE C 3.085 H A 0077 VAL C
H A 0076 PHE C 3.687 H A 0077 VAL CB
H A 0077 VAL C 2.422 H A 0078 SER CA
H A 0077 VAL C 3.133 H A 0078 SER C
H A 0077 VAL C 3.671 H A 0078 SER CB
H A 0077 VAL CA 3.566 H A 0080 VAL CG2
H A 0077 VAL C 3.490 H A 0080 VAL CG2
H A 0078 SER C 2.423 H A 0079 MET CA
H A 0078 SER C 2.963 H A 0079 MET C
H A 0078 SER C 3.690 H A 0079 MET CB
H A 0079 MET C 2.424 H A 0080 VAL CA
H A 0079 MET C 3.073 H A 0080 VAL C
H A 0079 MET C 3.685 H A 0080 VAL CB
H A 0080 VAL C 2.420 H A 0081 THR CA
H A 0080 VAL C 3.015 H A 0081 THR C
H A 0080 VAL C 3.698 H A 0081 THR CB
H A 0081 THR C 2.425 H A 0082 THR CA
H A 0081 THR C 3.454 H A 0082 THR C
H A 0081 THR C 3.490 H A 0082 THR CB
H A 0081 THR C 3.669 H A 0082 THR CG2
H A 0082 THR C 2.425 C A 0083 ALA CA
H A 0082 THR C 2.976 C A 0083 ALA C
H A 0082 THR C 3.698 C A 0083 ALA CB
C A 0083 ALA C 2.424 C A 0084 CYS CA
C A 0083 ALA C 2.887 C A 0084 CYS C
C A 0083 ALA C 3.693 C A 0084 CYS CB
C A 0084 CYS C 2.424 C A 0085 HIS CA
C A 0084 CYS C 3.027 C A 0085 HIS C
C A 0084 CYS C 3.692 C A 0085 HIS CB
C A 0085 HIS C 2.421 C A 0086 GLU CA
C A 0085 HIS C 3.090 C A 0086 GLU C
C A 0085 HIS C 3.680 C A 0086 GLU CB
C A 0085 HIS C 3.797 C A 0087 PHE CD2
C A 0086 GLU C 2.422 C A 0087 PHE CA
C A 0086 GLU C 3.477 C A 0087 PHE C
C A 0086 GLU C 3.467 C A 0087 PHE CB
C A 0086 GLU C 3.724 C A 0087 PHE CG
C A 0087 PHE C 2.424 C A 0088 PHE CA
C A 0087 PHE C 3.460 C A 0088 PHE C
C A 0087 PHE C 3.487 C A 0088 PHE CB
C A 0087 PHE C 3.466 C A 0088 PHE CG
C A 0087 PHE C 3.057 C A 0088 PHE CD1
C A 0087 PHE CD1 3.262 C A 0088 PHE CG
C A 0087 PHE CD1 3.358 C A 0088 PHE CD1
C A 0087 PHE CD1 3.211 C A 0088 PHE CD2
C A 0087 PHE CD1 3.402 C A 0088 PHE CE1
C A 0087 PHE CD1 3.257 C A 0088 PHE CE2
C A 0087 PHE CD1 3.354 C A 0088 PHE CZ
C A 0087 PHE CE1 3.251 C A 0088 PHE CD2
C A 0087 PHE CE1 3.129 C A 0088 PHE CE2
C A 0087 PHE CE1 3.625 C A 0088 PHE CZ
C A 0088 PHE C 2.422 C A 0089 GLU CA
C A 0088 PHE C 3.488 C A 0089 GLU C
C A 0088 PHE C 3.455 C A 0089 GLU CB
C A 0089 GLU C 2.422 C A 0090 HIS CA
C A 0089 GLU C 3.468 C A 0090 HIS C
C A 0089 GLU C 3.475 C A 0090 HIS CB
C A 0090 HIS C 2.424 C A 0091 GLU CA
C A 0090 HIS C 3.239 C A 0091 GLU C
C A 0090 HIS C 3.632 C A 0091 GLU CB
CHARGE_ATTR 2.00 12.00 141
H A 0002 GLU OE1 6.298 H A 0005 LYS NZ
H A 0002 GLU OE2 5.244 H A 0005 LYS NZ
H A 0004 GLU OE1 7.219 H A 0005 LYS NZ
H A 0004 GLU OE2 8.373 H A 0005 LYS NZ
H A 0012 ASP OD1 6.646 H A 0015 HIS ND1
H A 0012 ASP OD1 6.327 H A 0015 HIS NE2
H A 0012 ASP OD2 8.053 H A 0015 HIS ND1
H A 0012 ASP OD2 7.827 H A 0015 HIS NE2
H A 0012 ASP OD1 11.77 C A 0024 LYS NZ
C A 0021 GLU OE1 9.617 C A 0020 ARG NH1
C A 0021 GLU OE1 11.49 C A 0020 ARG NH2
C A 0021 GLU OE2 9.469 C A 0020 ARG NH1
C A 0021 GLU OE2 11.15 C A 0020 ARG NH2
C A 0021 GLU OE1 11.23 C A 0024 LYS NZ
C A 0021 GLU OE1 7.588 E A 0028 LYS NZ
C A 0021 GLU OE2 6.024 E A 0028 LYS NZ
C A 0021 GLU OE2 11.63 H A 0029 LYS NZ
C A 0023 ASP OD1 10.36 H A 0015 HIS ND1
C A 0023 ASP OD2 9.250 H A 0015 HIS ND1
C A 0023 ASP OD2 11.15 H A 0015 HIS NE2
C A 0023 ASP OD1 10.91 C A 0020 ARG NH1
C A 0023 ASP OD2 11.65 C A 0020 ARG NH1
C A 0023 ASP OD1 9.492 C A 0024 LYS NZ
C A 0023 ASP OD2 9.388 C A 0024 LYS NZ
C A 0023 ASP OD1 9.228 C A 0025 HIS ND1
C A 0023 ASP OD1 8.844 C A 0025 HIS NE2
C A 0023 ASP OD2 7.668 C A 0025 HIS ND1
C A 0023 ASP OD2 7.713 C A 0025 HIS NE2
C A 0023 ASP OD1 8.545 E A 0026 LYS NZ
C A 0023 ASP OD2 7.344 E A 0026 LYS NZ
C A 0023 ASP OD1 7.143 E A 0028 LYS NZ
C A 0023 ASP OD2 8.205 E A 0028 LYS NZ
C A 0023 ASP OD1 10.71 H A 0029 LYS NZ
C A 0023 ASP OD2 10.80 H A 0029 LYS NZ
H A 0031 GLU OE1 8.436 C A 0020 ARG NH1
H A 0031 GLU OE1 7.870 C A 0020 ARG NH2
H A 0031 GLU OE2 6.924 C A 0020 ARG NH1
H A 0031 GLU OE2 6.726 C A 0020 ARG NH2
H A 0031 GLU OE1 7.156 E A 0028 LYS NZ
H A 0031 GLU OE2 6.976 E A 0028 LYS NZ
H A 0031 GLU OE1 9.626 H A 0029 LYS NZ
H A 0031 GLU OE2 10.31 H A 0029 LYS NZ
H A 0034 GLU OE1 10.20 C A 0020 ARG NH1
H A 0034 GLU OE1 8.879 C A 0020 ARG NH2
H A 0034 GLU OE2 10.70 C A 0020 ARG NH2
H A 0034 GLU OE1 10.65 E A 0028 LYS NZ
H A 0034 GLU OE2 11.81 E A 0028 LYS NZ
H A 0034 GLU OE1 11.03 H A 0033 LYS NZ
H A 0034 GLU OE2 9.937 H A 0033 LYS NZ
C A 0039 GLU OE1 10.35 C A 0020 ARG NH1
C A 0039 GLU OE1 8.401 C A 0020 ARG NH2
C A 0039 GLU OE2 9.936 C A 0020 ARG NH1
C A 0039 GLU OE2 7.803 C A 0020 ARG NH2
C A 0039 GLU OE1 12.00 C A 0042 HIS ND1
C A 0039 GLU OE2 11.37 C A 0042 HIS ND1
C A 0039 GLU OE2 11.92 C A 0042 HIS NE2
C A 0045 GLU OE1 11.90 C A 0042 HIS ND1
C A 0045 GLU OE1 11.86 C A 0042 HIS NE2
C A 0045 GLU OE2 10.48 C A 0042 HIS ND1
C A 0045 GLU OE2 10.15 C A 0042 HIS NE2
C A 0045 GLU OE1 10.37 C A 0090 HIS ND1
C A 0045 GLU OE1 11.95 C A 0090 HIS NE2
C A 0045 GLU OE2 10.64 C A 0090 HIS ND1
C A 0045 GLU OE2 11.98 C A 0090 HIS NE2
C A 0046 GLU OE1 6.167 C A 0048 LYS NZ
C A 0046 GLU OE2 6.182 C A 0048 LYS NZ
C A 0046 GLU OE1 7.839 C A 0085 HIS ND1
C A 0046 GLU OE1 9.445 C A 0085 HIS NE2
C A 0046 GLU OE2 7.744 C A 0085 HIS ND1
C A 0046 GLU OE2 9.591 C A 0085 HIS NE2
C A 0049 GLU OE1 10.34 C A 0048 LYS NZ
C A 0049 GLU OE2 9.636 C A 0048 LYS NZ
C A 0049 GLU OE1 10.31 H A 0055 LYS NZ
C A 0049 GLU OE2 11.20 H A 0055 LYS NZ
C A 0049 GLU OE1 8.675 C A 0085 HIS ND1
C A 0049 GLU OE1 7.382 C A 0085 HIS NE2
C A 0049 GLU OE2 7.513 C A 0085 HIS ND1
C A 0049 GLU OE2 5.846 C A 0085 HIS NE2
H A 0051 GLU OE1 8.852 H A 0055 LYS NZ
H A 0051 GLU OE2 10.83 H A 0055 LYS NZ
H A 0054 ASP OD1 8.558 H A 0033 LYS NZ
H A 0054 ASP OD2 10.71 H A 0033 LYS NZ
H A 0054 ASP OD1 11.12 H A 0055 LYS NZ
H A 0054 ASP OD2 11.15 H A 0055 LYS NZ
H A 0058 GLU OE1 10.84 H A 0033 LYS NZ
H A 0058 GLU OE2 10.53 H A 0033 LYS NZ
H A 0058 GLU OE1 8.699 H A 0055 LYS NZ
H A 0058 GLU OE2 10.51 H A 0055 LYS NZ
H A 0061 ASP OD1 10.96 H A 0029 LYS NZ
H A 0061 ASP OD2 11.34 H A 0029 LYS NZ
H A 0061 ASP OD1 2.689 H A 0033 LYS NZ
H A 0061 ASP OD2 4.751 H A 0033 LYS NZ
H A 0062 GLU OE1 11.39 H A 0033 LYS NZ
H A 0062 GLU OE1 9.853 H A 0055 LYS NZ
H A 0062 GLU OE2 11.55 H A 0055 LYS NZ
H A 0063 ASP OD1 11.65 E A 0028 LYS NZ
H A 0063 ASP OD1 6.249 H A 0029 LYS NZ
H A 0063 ASP OD2 8.182 H A 0029 LYS NZ
H A 0063 ASP OD1 9.344 H A 0033 LYS NZ
H A 0063 ASP OD2 10.22 H A 0033 LYS NZ
H A 0063 ASP OD2 11.09 H A 0055 LYS NZ
C A 0065 ASP OD1 8.929 E A 0028 LYS NZ
C A 0065 ASP OD2 11.08 E A 0028 LYS NZ
C A 0065 ASP OD1 5.122 H A 0029 LYS NZ
C A 0065 ASP OD2 6.872 H A 0029 LYS NZ
E A 0067 GLU OE1 7.519 E A 0026 LYS NZ
E A 0067 GLU OE2 7.205 E A 0026 LYS NZ
E A 0067 GLU OE1 8.008 E A 0028 LYS NZ
E A 0067 GLU OE2 6.798 E A 0028 LYS NZ
E A 0067 GLU OE1 6.059 H A 0029 LYS NZ
E A 0067 GLU OE2 6.592 H A 0029 LYS NZ
E A 0069 ASP OD1 8.225 C A 0025 HIS ND1
E A 0069 ASP OD1 9.578 C A 0025 HIS NE2
E A 0069 ASP OD2 9.868 C A 0025 HIS ND1
E A 0069 ASP OD2 11.23 C A 0025 HIS NE2
E A 0069 ASP OD1 5.528 E A 0026 LYS NZ
E A 0069 ASP OD2 6.852 E A 0026 LYS NZ
H A 0072 GLU OE1 7.878 H A 0055 LYS NZ
H A 0072 GLU OE2 8.615 H A 0055 LYS NZ
C A 0086 GLU OE1 6.783 C A 0048 LYS NZ
C A 0086 GLU OE2 8.775 C A 0048 LYS NZ
C A 0086 GLU OE1 7.035 C A 0085 HIS ND1
C A 0086 GLU OE1 8.776 C A 0085 HIS NE2
C A 0086 GLU OE2 8.945 C A 0085 HIS ND1
C A 0086 GLU OE2 10.50 C A 0085 HIS NE2
C A 0086 GLU OE1 11.19 C A 0090 HIS ND1
C A 0086 GLU OE2 10.52 C A 0090 HIS ND1
C A 0089 GLU OE1 10.19 C A 0048 LYS NZ
C A 0089 GLU OE2 11.06 C A 0048 LYS NZ
C A 0089 GLU OE1 10.16 C A 0085 HIS ND1
C A 0089 GLU OE1 11.82 C A 0085 HIS NE2
C A 0089 GLU OE2 10.51 C A 0085 HIS ND1
C A 0089 GLU OE2 11.89 C A 0085 HIS NE2
C A 0089 GLU OE1 8.510 C A 0090 HIS ND1
C A 0089 GLU OE1 10.44 C A 0090 HIS NE2
C A 0089 GLU OE2 8.523 C A 0090 HIS ND1
C A 0089 GLU OE2 10.18 C A 0090 HIS NE2
C A 0091 GLU OE1 6.422 C A 0090 HIS ND1
C A 0091 GLU OE1 8.438 C A 0090 HIS NE2
C A 0091 GLU OE2 5.037 C A 0090 HIS ND1
C A 0091 GLU OE2 6.806 C A 0090 HIS NE2
CHARGE_REPU 2.00 12.00 174
H A 0002 GLU OE1 9.686 H A 0004 GLU OE1
H A 0002 GLU OE1 11.55 H A 0004 GLU OE2
H A 0002 GLU OE2 7.910 H A 0004 GLU OE1
H A 0002 GLU OE2 9.871 H A 0004 GLU OE2
H A 0012 ASP OD2 11.98 C A 0039 GLU OE1
H A 0012 ASP OD2 11.35 C A 0039 GLU OE2
H A 0015 HIS ND1 5.727 C A 0024 LYS NZ
H A 0015 HIS NE2 5.646 C A 0024 LYS NZ
H A 0015 HIS ND1 6.466 C A 0025 HIS ND1
H A 0015 HIS ND1 7.216 C A 0025 HIS NE2
H A 0015 HIS NE2 8.138 C A 0025 HIS ND1
H A 0015 HIS NE2 8.585 C A 0025 HIS NE2
C A 0020 ARG NH1 11.97 E A 0028 LYS NZ
C A 0021 GLU OE1 5.683 C A 0023 ASP OD1
C A 0021 GLU OE1 7.790 C A 0023 ASP OD2
C A 0021 GLU OE2 6.402 C A 0023 ASP OD1
C A 0021 GLU OE2 8.438 C A 0023 ASP OD2
C A 0021 GLU OE1 11.00 H A 0031 GLU OE1
C A 0021 GLU OE1 9.388 H A 0031 GLU OE2
C A 0021 GLU OE2 9.774 H A 0031 GLU OE1
C A 0021 GLU OE2 8.464 H A 0031 GLU OE2
C A 0021 GLU OE1 10.23 E A 0067 GLU OE2
C A 0021 GLU OE2 11.90 E A 0067 GLU OE1
C A 0021 GLU OE2 9.941 E A 0067 GLU OE2
C A 0023 ASP OD1 9.789 H A 0031 GLU OE1
C A 0023 ASP OD1 8.135 H A 0031 GLU OE2
C A 0023 ASP OD2 9.919 H A 0031 GLU OE1
C A 0023 ASP OD2 8.346 H A 0031 GLU OE2
C A 0023 ASP OD1 8.788 E A 0067 GLU OE1
C A 0023 ASP OD1 6.916 E A 0067 GLU OE2
C A 0023 ASP OD2 8.577 E A 0067 GLU OE1
C A 0023 ASP OD2 7.047 E A 0067 GLU OE2
C A 0023 ASP OD1 10.98 E A 0069 ASP OD1
C A 0023 ASP OD2 9.057 E A 0069 ASP OD1
C A 0023 ASP OD2 11.18 E A 0069 ASP OD2
C A 0024 LYS NZ 7.630 C A 0025 HIS ND1
C A 0024 LYS NZ 6.564 C A 0025 HIS NE2
C A 0025 HIS ND1 7.328 E A 0026 LYS NZ
C A 0025 HIS NE2 7.298 E A 0026 LYS NZ
E A 0028 LYS NZ 5.724 H A 0029 LYS NZ
H A 0031 GLU OE1 4.271 H A 0034 GLU OE1
H A 0031 GLU OE1 6.153 H A 0034 GLU OE2
H A 0031 GLU OE2 6.070 H A 0034 GLU OE1
H A 0031 GLU OE2 8.085 H A 0034 GLU OE2
H A 0031 GLU OE1 7.624 C A 0039 GLU OE1
H A 0031 GLU OE1 9.002 C A 0039 GLU OE2
H A 0031 GLU OE2 8.101 C A 0039 GLU OE1
H A 0031 GLU OE2 9.213 C A 0039 GLU OE2
H A 0031 GLU OE2 11.64 E A 0067 GLU OE2
H A 0034 GLU OE1 6.435 C A 0039 GLU OE1
H A 0034 GLU OE1 7.674 C A 0039 GLU OE2
H A 0034 GLU OE2 7.794 C A 0039 GLU OE1
H A 0034 GLU OE2 8.966 C A 0039 GLU OE2
H A 0034 GLU OE2 11.18 H A 0061 ASP OD1
C A 0042 HIS ND1 11.10 C A 0090 HIS ND1
C A 0042 HIS ND1 10.36 C A 0090 HIS NE2
C A 0042 HIS NE2 11.50 C A 0090 HIS NE2
C A 0045 GLU OE1 8.169 C A 0046 GLU OE1
C A 0045 GLU OE1 6.619 C A 0046 GLU OE2
C A 0045 GLU OE2 9.848 C A 0046 GLU OE1
C A 0045 GLU OE2 8.529 C A 0046 GLU OE2
C A 0045 GLU OE1 5.785 C A 0086 GLU OE1
C A 0045 GLU OE1 3.853 C A 0086 GLU OE2
C A 0045 GLU OE2 7.760 C A 0086 GLU OE1
C A 0045 GLU OE2 5.690 C A 0086 GLU OE2
C A 0045 GLU OE1 9.959 C A 0089 GLU OE1
C A 0045 GLU OE1 11.71 C A 0089 GLU OE2
C A 0045 GLU OE2 11.69 C A 0089 GLU OE1
C A 0045 GLU OE1 10.93 C A 0091 GLU OE1
C A 0045 GLU OE1 11.71 C A 0091 GLU OE2
C A 0046 GLU OE1 10.98 C A 0049 GLU OE1
C A 0046 GLU OE1 11.42 C A 0049 GLU OE2
C A 0046 GLU OE1 5.305 C A 0086 GLU OE1
C A 0046 GLU OE1 5.908 C A 0086 GLU OE2
C A 0046 GLU OE2 3.530 C A 0086 GLU OE1
C A 0046 GLU OE2 4.235 C A 0086 GLU OE2
C A 0046 GLU OE1 11.78 C A 0089 GLU OE1
C A 0046 GLU OE2 9.805 C A 0089 GLU OE1
C A 0046 GLU OE2 11.48 C A 0089 GLU OE2
C A 0048 LYS NZ 3.386 C A 0085 HIS ND1
C A 0048 LYS NZ 5.341 C A 0085 HIS NE2
C A 0049 GLU OE1 5.523 H A 0051 GLU OE1
C A 0049 GLU OE1 6.538 H A 0051 GLU OE2
C A 0049 GLU OE2 6.714 H A 0051 GLU OE1
C A 0049 GLU OE2 7.753 H A 0051 GLU OE2
C A 0049 GLU OE1 10.60 H A 0054 ASP OD1
C A 0049 GLU OE1 9.747 H A 0054 ASP OD2
C A 0049 GLU OE2 11.87 H A 0054 ASP OD2
C A 0049 GLU OE1 11.38 H A 0058 GLU OE1
C A 0049 GLU OE1 11.39 H A 0058 GLU OE2
H A 0051 GLU OE1 9.472 H A 0054 ASP OD1
H A 0051 GLU OE1 7.929 H A 0054 ASP OD2
H A 0051 GLU OE2 9.619 H A 0054 ASP OD1
H A 0051 GLU OE2 7.763 H A 0054 ASP OD2
H A 0051 GLU OE1 8.386 H A 0058 GLU OE1
H A 0051 GLU OE1 8.714 H A 0058 GLU OE2
H A 0051 GLU OE2 8.850 H A 0058 GLU OE1
H A 0051 GLU OE2 8.744 H A 0058 GLU OE2
H A 0054 ASP OD1 4.398 H A 0058 GLU OE1
H A 0054 ASP OD1 3.017 H A 0058 GLU OE2
H A 0054 ASP OD2 4.205 H A 0058 GLU OE1
H A 0054 ASP OD2 2.527 H A 0058 GLU OE2
H A 0054 ASP OD1 9.143 H A 0061 ASP OD1
H A 0054 ASP OD1 9.474 H A 0061 ASP OD2
H A 0054 ASP OD2 11.21 H A 0061 ASP OD1
H A 0054 ASP OD2 11.36 H A 0061 ASP OD2
H A 0054 ASP OD1 9.832 H A 0062 GLU OE1
H A 0054 ASP OD1 11.63 H A 0062 GLU OE2
H A 0054 ASP OD2 10.55 H A 0062 GLU OE1
H A 0058 GLU OE1 10.74 H A 0061 ASP OD1
H A 0058 GLU OE1 10.65 H A 0061 ASP OD2
H A 0058 GLU OE2 10.49 H A 0061 ASP OD1
H A 0058 GLU OE2 10.33 H A 0061 ASP OD2
H A 0058 GLU OE1 6.645 H A 0062 GLU OE1
H A 0058 GLU OE1 8.326 H A 0062 GLU OE2
H A 0058 GLU OE2 8.249 H A 0062 GLU OE1
H A 0058 GLU OE2 9.811 H A 0062 GLU OE2
H A 0058 GLU OE1 11.67 H A 0063 ASP OD1
H A 0058 GLU OE1 10.33 H A 0063 ASP OD2
H A 0058 GLU OE2 11.78 H A 0063 ASP OD2
H A 0061 ASP OD1 10.22 H A 0062 GLU OE1
H A 0061 ASP OD1 11.47 H A 0062 GLU OE2
H A 0061 ASP OD2 9.690 H A 0062 GLU OE1
H A 0061 ASP OD2 10.62 H A 0062 GLU OE2
H A 0061 ASP OD1 8.343 H A 0063 ASP OD1
H A 0061 ASP OD1 9.166 H A 0063 ASP OD2
H A 0061 ASP OD2 8.635 H A 0063 ASP OD1
H A 0061 ASP OD2 9.204 H A 0063 ASP OD2
H A 0062 GLU OE1 6.951 H A 0063 ASP OD1
H A 0062 GLU OE1 5.030 H A 0063 ASP OD2
H A 0062 GLU OE2 7.710 H A 0063 ASP OD1
H A 0062 GLU OE2 5.772 H A 0063 ASP OD2
H A 0062 GLU OE2 11.71 C A 0065 ASP OD2
H A 0062 GLU OE1 10.15 H A 0072 GLU OE1
H A 0062 GLU OE1 10.25 H A 0072 GLU OE2
H A 0062 GLU OE2 11.36 H A 0072 GLU OE1
H A 0062 GLU OE2 11.11 H A 0072 GLU OE2
H A 0063 ASP OD1 8.467 C A 0065 ASP OD1
H A 0063 ASP OD1 8.765 C A 0065 ASP OD2
H A 0063 ASP OD2 9.660 C A 0065 ASP OD1
H A 0063 ASP OD2 9.522 C A 0065 ASP OD2
H A 0063 ASP OD1 9.405 E A 0067 GLU OE1
H A 0063 ASP OD1 10.93 E A 0067 GLU OE2
H A 0063 ASP OD2 10.55 E A 0067 GLU OE1
H A 0063 ASP OD1 8.054 H A 0072 GLU OE1
H A 0063 ASP OD1 8.653 H A 0072 GLU OE2
H A 0063 ASP OD2 7.607 H A 0072 GLU OE1
H A 0063 ASP OD2 7.918 H A 0072 GLU OE2
C A 0065 ASP OD1 7.853 E A 0067 GLU OE1
C A 0065 ASP OD1 8.713 E A 0067 GLU OE2
C A 0065 ASP OD2 9.096 E A 0067 GLU OE1
C A 0065 ASP OD2 10.26 E A 0067 GLU OE2
E A 0067 GLU OE1 9.403 E A 0069 ASP OD1
E A 0067 GLU OE1 10.46 E A 0069 ASP OD2
E A 0067 GLU OE2 9.862 E A 0069 ASP OD1
E A 0067 GLU OE2 11.25 E A 0069 ASP OD2
E A 0067 GLU OE1 11.86 H A 0072 GLU OE1
E A 0067 GLU OE1 11.50 H A 0072 GLU OE2
E A 0069 ASP OD1 8.593 H A 0072 GLU OE1
E A 0069 ASP OD1 8.176 H A 0072 GLU OE2
E A 0069 ASP OD2 7.996 H A 0072 GLU OE1
E A 0069 ASP OD2 7.172 H A 0072 GLU OE2
C A 0086 GLU OE1 7.136 C A 0089 GLU OE1
C A 0086 GLU OE1 8.600 C A 0089 GLU OE2
C A 0086 GLU OE2 8.158 C A 0089 GLU OE1
C A 0086 GLU OE2 9.692 C A 0089 GLU OE2
C A 0086 GLU OE1 10.80 C A 0091 GLU OE1
C A 0086 GLU OE1 11.97 C A 0091 GLU OE2
C A 0086 GLU OE2 10.89 C A 0091 GLU OE1
C A 0086 GLU OE2 11.85 C A 0091 GLU OE2
C A 0089 GLU OE1 5.236 C A 0091 GLU OE1
C A 0089 GLU OE1 6.723 C A 0091 GLU OE2
C A 0089 GLU OE2 5.795 C A 0091 GLU OE1
C A 0089 GLU OE2 6.835 C A 0091 GLU OE2
HB_MM 2.00 3.20 165
C A 0001 SER N 2.198 C A 0000 MET O
H A 0002 GLU N 2.198 C A 0001 SER O
H A 0003 LEU N 2.193 H A 0002 GLU O
H A 0004 GLU N 3.134 H A 0002 GLU O
H A 0004 GLU N 2.190 H A 0003 LEU O
H A 0005 LYS N 2.187 H A 0004 GLU O
H A 0006 ALA N 2.957 H A 0002 GLU O
H A 0006 ALA N 3.037 H A 0004 GLU O
H A 0006 ALA N 2.196 H A 0005 LYS O
H A 0007 MET N 2.715 H A 0003 LEU O
H A 0007 MET N 2.197 H A 0006 ALA O
H A 0008 VAL N 2.798 H A 0004 GLU O
H A 0008 VAL N 3.164 H A 0006 ALA O
H A 0008 VAL N 2.194 H A 0007 MET O
H A 0009 ALA N 2.735 H A 0006 ALA O
H A 0009 ALA N 3.043 H A 0007 MET O
H A 0009 ALA N 2.197 H A 0008 VAL O
H A 0010 LEU N 3.178 H A 0006 ALA O
H A 0010 LEU N 2.830 H A 0007 MET O
H A 0010 LEU N 3.170 H A 0008 VAL O
H A 0010 LEU N 2.197 H A 0009 ALA O
H A 0011 ILE N 3.122 H A 0008 VAL O
H A 0011 ILE N 2.198 H A 0010 LEU O
H A 0012 ASP N 2.826 H A 0009 ALA O
H A 0012 ASP N 2.721 H A 0010 LEU O
H A 0012 ASP N 2.200 H A 0011 ILE O
H A 0013 VAL N 3.191 H A 0009 ALA O
H A 0013 VAL N 2.751 H A 0010 LEU O
H A 0013 VAL N 2.197 H A 0012 ASP O
H A 0014 PHE N 3.069 H A 0012 ASP O
H A 0014 PHE N 2.192 H A 0013 VAL O
H A 0015 HIS N 2.824 H A 0012 ASP O
H A 0015 HIS N 2.195 H A 0014 PHE O
H A 0016 GLN N 2.830 H A 0012 ASP O
H A 0016 GLN N 2.904 H A 0013 VAL O
H A 0016 GLN N 3.163 H A 0014 PHE O
H A 0016 GLN N 2.197 H A 0015 HIS O
H A 0017 TYR N 2.763 H A 0013 VAL O
H A 0017 TYR N 2.196 H A 0016 GLN O
C A 0018 SER N 3.146 H A 0014 PHE O
C A 0018 SER N 2.977 H A 0016 GLN O
C A 0018 SER N 2.197 H A 0017 TYR O
C A 0019 GLY N 2.611 H A 0016 GLN O
C A 0019 GLY N 2.200 C A 0018 SER O
C A 0020 ARG N 2.929 H A 0016 GLN O
C A 0020 ARG N 3.135 H A 0017 TYR O
C A 0020 ARG N 2.976 C A 0018 SER O
C A 0020 ARG N 2.196 C A 0019 GLY O
C A 0021 GLU N 2.195 C A 0020 ARG O
C A 0022 GLY N 2.198 C A 0021 GLU O
C A 0023 ASP N 2.194 C A 0022 GLY O
C A 0024 LYS N 2.197 C A 0023 ASP O
C A 0025 HIS N 2.198 C A 0024 LYS O
E A 0026 LYS N 2.194 C A 0025 HIS O
E A 0027 LEU N 2.196 E A 0026 LYS O
E A 0027 LEU N 2.950 E A 0068 CYS O
E A 0028 LYS N 2.196 E A 0027 LEU O
H A 0029 LYS N 2.190 E A 0028 LYS O
H A 0030 SER N 2.548 E A 0028 LYS O
H A 0030 SER N 2.192 H A 0029 LYS O
H A 0031 GLU N 2.622 E A 0028 LYS O
H A 0031 GLU N 2.193 H A 0030 SER O
H A 0032 LEU N 2.842 E A 0028 LYS O
H A 0032 LEU N 2.199 H A 0031 GLU O
H A 0033 LYS N 3.153 H A 0029 LYS O
H A 0033 LYS N 2.202 H A 0032 LEU O
H A 0034 GLU N 2.953 H A 0030 SER O
H A 0034 GLU N 3.005 H A 0032 LEU O
H A 0034 GLU N 2.201 H A 0033 LYS O
H A 0035 LEU N 2.791 H A 0031 GLU O
H A 0035 LEU N 2.770 H A 0032 LEU O
H A 0035 LEU N 2.194 H A 0034 GLU O
H A 0036 ILE N 3.045 H A 0032 LEU O
H A 0036 ILE N 3.159 H A 0034 GLU O
H A 0036 ILE N 2.198 H A 0035 LEU O
H A 0037 ASN N 3.062 H A 0033 LYS O
H A 0037 ASN N 2.197 H A 0036 ILE O
H A 0038 ASN N 2.657 H A 0034 GLU O
H A 0038 ASN N 3.113 H A 0036 ILE O
H A 0038 ASN N 2.190 H A 0037 ASN O
C A 0039 GLU N 3.181 H A 0035 LEU O
C A 0039 GLU N 2.195 H A 0038 ASN O
C A 0040 LEU N 2.198 C A 0039 GLU O
C A 0041 SER N 3.123 H A 0036 ILE O
C A 0041 SER N 2.202 C A 0040 LEU O
C A 0042 HIS N 2.196 C A 0041 SER O
C A 0043 PHE N 2.197 C A 0042 HIS O
C A 0044 LEU N 3.150 C A 0042 HIS O
C A 0044 LEU N 2.196 C A 0043 PHE O
C A 0045 GLU N 2.197 C A 0044 LEU O
C A 0046 GLU N 2.195 C A 0045 GLU O
C A 0047 ILE N 2.194 C A 0046 GLU O
C A 0048 LYS N 2.197 C A 0047 ILE O
C A 0049 GLU N 2.194 C A 0048 LYS O
H A 0050 GLN N 2.917 C A 0048 LYS O
H A 0050 GLN N 2.195 C A 0049 GLU O
H A 0051 GLU N 2.745 C A 0049 GLU O
H A 0051 GLU N 2.194 H A 0050 GLN O
H A 0052 VAL N 2.761 C A 0049 GLU O
H A 0052 VAL N 2.198 H A 0051 GLU O
H A 0053 VAL N 3.130 C A 0049 GLU O
H A 0053 VAL N 2.197 H A 0052 VAL O
H A 0054 ASP N 2.907 H A 0050 GLN O
H A 0054 ASP N 2.187 H A 0053 VAL O
H A 0055 LYS N 2.717 H A 0051 GLU O
H A 0055 LYS N 2.198 H A 0054 ASP O
H A 0056 VAL N 3.150 H A 0052 VAL O
H A 0056 VAL N 2.198 H A 0055 LYS O
H A 0057 MET N 2.870 H A 0053 VAL O
H A 0057 MET N 2.197 H A 0056 VAL O
H A 0058 GLU N 2.982 H A 0054 ASP O
H A 0058 GLU N 2.196 H A 0057 MET O
H A 0059 THR N 2.196 H A 0058 GLU O
H A 0060 LEU N 2.952 H A 0056 VAL O
H A 0060 LEU N 3.006 H A 0058 GLU O
H A 0060 LEU N 2.198 H A 0059 THR O
H A 0061 ASP N 3.020 H A 0057 MET O
H A 0061 ASP N 3.130 H A 0058 GLU O
H A 0061 ASP N 2.198 H A 0060 LEU O
H A 0062 GLU N 2.685 H A 0058 GLU O
H A 0062 GLU N 2.196 H A 0061 ASP O
H A 0063 ASP N 2.193 H A 0062 GLU O
C A 0064 GLY N 2.195 H A 0063 ASP O
C A 0065 ASP N 2.526 H A 0063 ASP O
C A 0065 ASP N 2.200 C A 0064 GLY O
C A 0066 GLY N 2.195 C A 0065 ASP O
E A 0067 GLU N 2.200 C A 0066 GLY O
E A 0068 CYS N 2.899 E A 0027 LEU O
E A 0068 CYS N 2.199 E A 0067 GLU O
E A 0069 ASP N 2.197 E A 0068 CYS O
H A 0070 PHE N 2.195 E A 0069 ASP O
H A 0071 GLN N 2.198 H A 0070 PHE O
H A 0072 GLU N 2.201 H A 0071 GLN O
H A 0073 PHE N 2.195 H A 0072 GLU O
H A 0074 MET N 3.140 H A 0070 PHE O
H A 0074 MET N 3.006 H A 0072 GLU O
H A 0074 MET N 2.200 H A 0073 PHE O
H A 0075 ALA N 3.054 H A 0071 GLN O
H A 0075 ALA N 2.196 H A 0074 MET O
H A 0076 PHE N 2.869 H A 0072 GLU O
H A 0076 PHE N 3.156 H A 0074 MET O
H A 0076 PHE N 2.197 H A 0075 ALA O
H A 0077 VAL N 3.142 H A 0073 PHE O
H A 0077 VAL N 2.198 H A 0076 PHE O
H A 0078 SER N 2.193 H A 0077 VAL O
H A 0079 MET N 2.196 H A 0078 SER O
H A 0080 VAL N 2.195 H A 0079 MET O
H A 0081 THR N 2.191 H A 0080 VAL O
H A 0082 THR N 3.117 H A 0078 SER O
H A 0082 THR N 3.186 H A 0079 MET O
H A 0082 THR N 2.919 H A 0080 VAL O
H A 0082 THR N 2.200 H A 0081 THR O
C A 0083 ALA N 2.911 H A 0079 MET O
C A 0083 ALA N 3.050 H A 0080 VAL O
C A 0083 ALA N 2.196 H A 0082 THR O
C A 0084 CYS N 2.196 C A 0083 ALA O
C A 0085 HIS N 3.139 C A 0083 ALA O
C A 0085 HIS N 2.196 C A 0084 CYS O
C A 0086 GLU N 2.196 C A 0085 HIS O
C A 0087 PHE N 2.998 C A 0085 HIS O
C A 0087 PHE N 2.197 C A 0086 GLU O
C A 0088 PHE N 2.196 C A 0087 PHE O
C A 0089 GLU N 2.198 C A 0088 PHE O
C A 0090 HIS N 2.198 C A 0089 GLU O
C A 0091 GLU N 2.195 C A 0090 HIS O
HB_MS 2.00 3.20 12
C A 0000 MET N 2.664 H A 0004 GLU OE1
H A 0002 GLU N 3.115 C A 0001 SER OG
H A 0004 GLU N 3.031 C A 0001 SER OG
C A 0024 LYS O 2.513 C A 0025 HIS ND1
E A 0026 LYS O 2.732 C A 0018 SER OG
H A 0055 LYS O 3.192 H A 0059 THR OG1
C A 0064 GLY N 2.928 H A 0063 ASP OD1
C A 0066 GLY O 2.539 H A 0029 LYS NZ
H A 0074 MET O 2.872 H A 0078 SER OG
H A 0077 VAL O 2.330 H A 0081 THR OG1
H A 0078 SER O 2.546 H A 0082 THR OG1
H A 0079 MET O 2.814 H A 0082 THR OG1
HB_SS 2.00 3.20 3
C A 0023 ASP OD2 2.924 C A 0018 SER OG
C A 0039 GLU OE1 2.409 H A 0017 TYR OH
C A 0039 GLU OE2 2.647 H A 0017 TYR OH
AROMATIC 0.00 8.00 3
E A 0026 LYS 6.607 C A 0025 HIS
C A 0048 LYS 4.540 C A 0085 HIS
H A 0055 LYS 6.282 H A 0076 PHE
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 83
C A 0001 SER CB 3.641 C B 0039 GLU CG
H A 0002 GLU CB 3.004 H B 0013 VAL CG2
H A 0003 LEU CD1 3.422 H B 0010 LEU CD2
H A 0003 LEU CD1 3.563 H B 0035 LEU CD1
H A 0003 LEU CD2 3.397 H B 0035 LEU CD1
H A 0003 LEU CB 3.080 C B 0039 GLU CB
H A 0003 LEU CB 3.734 C B 0039 GLU CG
H A 0003 LEU CD2 3.778 C B 0040 LEU CD1
H A 0003 LEU CD2 3.345 H B 0077 VAL CG1
H A 0006 ALA CB 3.361 H B 0009 ALA CB
H A 0007 MET CG 3.631 C B 0040 LEU CD1
H A 0007 MET CE 3.359 H B 0078 SER CA
H A 0007 MET CG 3.792 H B 0081 THR CB
H A 0007 MET CG 3.528 H B 0081 THR CG2
H A 0007 MET CE 3.565 H B 0081 THR CB
H A 0008 VAL CG2 3.156 C B 0040 LEU CD2
H A 0009 ALA CB 3.370 H B 0006 ALA CB
H A 0010 LEU CD2 3.435 H B 0003 LEU CD1
H A 0011 ILE CD1 3.584 H B 0081 THR CG2
H A 0011 ILE CG2 3.415 C B 0088 PHE CD1
H A 0011 ILE CG2 3.173 C B 0088 PHE CE1
H A 0013 VAL CG2 3.012 H B 0002 GLU CB
H A 0014 PHE CB 3.279 C B 0088 PHE CZ
H A 0014 PHE CD2 3.565 C B 0088 PHE CE2
H A 0014 PHE CD2 3.392 C B 0088 PHE CZ
H A 0035 LEU CD1 3.561 H B 0003 LEU CD1
H A 0035 LEU CD1 3.418 H B 0003 LEU CD2
C A 0039 GLU CG 3.655 C B 0001 SER CB
C A 0039 GLU CB 3.079 H B 0003 LEU CB
C A 0039 GLU CG 3.742 H B 0003 LEU CB
C A 0040 LEU CD1 3.750 H B 0003 LEU CD2
C A 0040 LEU CD1 3.635 H B 0007 MET CG
C A 0040 LEU CD2 3.169 H B 0008 VAL CG2
H A 0070 PHE CD2 3.708 H B 0082 THR CB
H A 0070 PHE CD2 3.592 H B 0082 THR CG2
H A 0070 PHE CE2 3.489 H B 0082 THR CA
H A 0070 PHE CE2 3.569 H B 0082 THR C
H A 0070 PHE CE2 3.181 H B 0082 THR CB
H A 0070 PHE CE2 3.652 H B 0082 THR CG2
H A 0070 PHE CG 3.489 C B 0087 PHE CE2
H A 0070 PHE CG 3.734 C B 0087 PHE CZ
H A 0070 PHE CD1 3.745 C B 0087 PHE CE2
H A 0070 PHE CD2 3.532 C B 0087 PHE CD2
H A 0070 PHE CD2 3.125 C B 0087 PHE CE2
H A 0070 PHE CE1 3.672 C B 0087 PHE CE2
H A 0070 PHE CE2 3.411 C B 0087 PHE CD2
H A 0070 PHE CE2 3.034 C B 0087 PHE CE2
H A 0070 PHE CZ 3.325 C B 0087 PHE CE2
H A 0071 GLN CG 3.655 H B 0082 THR CB
H A 0071 GLN CD 3.525 H B 0082 THR CB
H A 0074 MET CB 3.689 H B 0082 THR CG2
H A 0074 MET CG 3.197 H B 0082 THR CG2
H A 0077 VAL CG1 3.798 H B 0003 LEU CG
H A 0077 VAL CG1 3.336 H B 0003 LEU CD2
H A 0078 SER CA 3.354 H B 0007 MET CE
H A 0081 THR CB 3.775 H B 0007 MET CG
H A 0081 THR CB 3.563 H B 0007 MET CE
H A 0081 THR CG2 3.513 H B 0007 MET CG
H A 0081 THR CG2 3.603 H B 0011 ILE CD1
H A 0082 THR CA 3.517 H B 0070 PHE CE2
H A 0082 THR C 3.602 H B 0070 PHE CE2
H A 0082 THR CB 3.731 H B 0070 PHE CD2
H A 0082 THR CB 3.199 H B 0070 PHE CE2
H A 0082 THR CG2 3.607 H B 0070 PHE CD2
H A 0082 THR CG2 3.658 H B 0070 PHE CE2
H A 0082 THR CB 3.673 H B 0071 GLN CG
H A 0082 THR CB 3.535 H B 0071 GLN CD
H A 0082 THR CG2 3.708 H B 0074 MET CB
H A 0082 THR CG2 3.213 H B 0074 MET CG
C A 0087 PHE CD2 3.557 H B 0070 PHE CD2
C A 0087 PHE CD2 3.424 H B 0070 PHE CE2
C A 0087 PHE CE2 3.521 H B 0070 PHE CG
C A 0087 PHE CE2 3.778 H B 0070 PHE CD1
C A 0087 PHE CE2 3.142 H B 0070 PHE CD2
C A 0087 PHE CE2 3.692 H B 0070 PHE CE1
C A 0087 PHE CE2 3.037 H B 0070 PHE CE2
C A 0087 PHE CE2 3.332 H B 0070 PHE CZ
C A 0087 PHE CZ 3.758 H B 0070 PHE CG
C A 0088 PHE CD1 3.394 H B 0011 ILE CG2
C A 0088 PHE CE1 3.146 H B 0011 ILE CG2
C A 0088 PHE CE2 3.605 H B 0014 PHE CD2
C A 0088 PHE CZ 3.314 H B 0014 PHE CB
C A 0088 PHE CZ 3.432 H B 0014 PHE CD2
CHARGE_ATTR 2.00 12.00 80
H A 0002 GLU OE1 11.87 H B 0005 LYS NZ
H A 0002 GLU OE1 11.67 H B 0015 HIS ND1
H A 0002 GLU OE1 11.69 H B 0015 HIS NE2
H A 0002 GLU OE1 11.23 C B 0020 ARG NH2
H A 0002 GLU OE2 10.78 C B 0020 ARG NH2
H A 0004 GLU OE1 5.200 C B 0042 HIS ND1
H A 0004 GLU OE1 6.408 C B 0042 HIS NE2
H A 0004 GLU OE2 3.477 C B 0042 HIS ND1
H A 0004 GLU OE2 5.028 C B 0042 HIS NE2
H A 0004 GLU OE2 11.32 C B 0090 HIS NE2
H A 0005 LYS NZ 11.88 H B 0002 GLU OE1
H A 0005 LYS NZ 11.75 H B 0012 ASP OD1
H A 0005 LYS NZ 9.860 H B 0012 ASP OD2
H A 0005 LYS NZ 10.98 C B 0039 GLU OE2
H A 0012 ASP OD1 11.77 H B 0005 LYS NZ
H A 0012 ASP OD2 9.876 H B 0005 LYS NZ
H A 0012 ASP OD1 8.842 C B 0090 HIS ND1
H A 0012 ASP OD1 7.151 C B 0090 HIS NE2
H A 0012 ASP OD2 10.85 C B 0090 HIS ND1
H A 0012 ASP OD2 9.027 C B 0090 HIS NE2
H A 0015 HIS ND1 11.69 H B 0002 GLU OE1
H A 0015 HIS NE2 11.71 H B 0002 GLU OE1
H A 0015 HIS ND1 10.09 C B 0089 GLU OE1
H A 0015 HIS ND1 8.311 C B 0089 GLU OE2
H A 0015 HIS NE2 10.01 C B 0089 GLU OE1
H A 0015 HIS NE2 8.363 C B 0089 GLU OE2
H A 0015 HIS ND1 11.01 C B 0091 GLU OE1
H A 0015 HIS ND1 10.19 C B 0091 GLU OE2
H A 0015 HIS NE2 9.848 C B 0091 GLU OE1
H A 0015 HIS NE2 8.698 C B 0091 GLU OE2
C A 0020 ARG NH2 11.22 H B 0002 GLU OE1
C A 0020 ARG NH2 10.78 H B 0002 GLU OE2
C A 0024 LYS NZ 10.26 C B 0089 GLU OE1
C A 0024 LYS NZ 8.198 C B 0089 GLU OE2
C A 0024 LYS NZ 10.64 C B 0091 GLU OE1
C A 0024 LYS NZ 10.21 C B 0091 GLU OE2
C A 0025 HIS ND1 11.37 C B 0086 GLU OE1
C A 0025 HIS ND1 8.181 C B 0089 GLU OE1
C A 0025 HIS ND1 6.479 C B 0089 GLU OE2
C A 0025 HIS NE2 8.078 C B 0089 GLU OE1
C A 0025 HIS NE2 6.203 C B 0089 GLU OE2
C A 0025 HIS ND1 11.89 C B 0091 GLU OE1
C A 0025 HIS NE2 11.58 C B 0091 GLU OE1
C A 0039 GLU OE2 10.98 H B 0005 LYS NZ
C A 0042 HIS ND1 5.171 H B 0004 GLU OE1
C A 0042 HIS ND1 3.460 H B 0004 GLU OE2
C A 0042 HIS NE2 6.387 H B 0004 GLU OE1
C A 0042 HIS NE2 5.021 H B 0004 GLU OE2
E A 0069 ASP OD1 9.471 C B 0085 HIS ND1
E A 0069 ASP OD1 7.819 C B 0085 HIS NE2
E A 0069 ASP OD2 9.000 C B 0085 HIS ND1
E A 0069 ASP OD2 7.054 C B 0085 HIS NE2
C A 0085 HIS ND1 9.519 E B 0069 ASP OD1
C A 0085 HIS ND1 9.047 E B 0069 ASP OD2
C A 0085 HIS NE2 7.865 E B 0069 ASP OD1
C A 0085 HIS NE2 7.100 E B 0069 ASP OD2
C A 0086 GLU OE1 11.43 C B 0025 HIS ND1
C A 0089 GLU OE1 10.14 H B 0015 HIS ND1
C A 0089 GLU OE1 10.04 H B 0015 HIS NE2
C A 0089 GLU OE2 8.348 H B 0015 HIS ND1
C A 0089 GLU OE2 8.391 H B 0015 HIS NE2
C A 0089 GLU OE1 10.33 C B 0024 LYS NZ
C A 0089 GLU OE2 8.262 C B 0024 LYS NZ
C A 0089 GLU OE1 8.241 C B 0025 HIS ND1
C A 0089 GLU OE1 8.148 C B 0025 HIS NE2
C A 0089 GLU OE2 6.533 C B 0025 HIS ND1
C A 0089 GLU OE2 6.269 C B 0025 HIS NE2
C A 0090 HIS NE2 11.29 H B 0004 GLU OE2
C A 0090 HIS ND1 8.874 H B 0012 ASP OD1
C A 0090 HIS ND1 10.88 H B 0012 ASP OD2
C A 0090 HIS NE2 7.186 H B 0012 ASP OD1
C A 0090 HIS NE2 9.058 H B 0012 ASP OD2
C A 0091 GLU OE1 11.07 H B 0015 HIS ND1
C A 0091 GLU OE1 9.896 H B 0015 HIS NE2
C A 0091 GLU OE2 10.24 H B 0015 HIS ND1
C A 0091 GLU OE2 8.750 H B 0015 HIS NE2
C A 0091 GLU OE1 10.72 C B 0024 LYS NZ
C A 0091 GLU OE2 10.28 C B 0024 LYS NZ
C A 0091 GLU OE1 11.94 C B 0025 HIS ND1
C A 0091 GLU OE1 11.63 C B 0025 HIS NE2
CHARGE_REPU 2.00 12.00 60
H A 0002 GLU OE1 6.317 H B 0012 ASP OD1
H A 0002 GLU OE1 4.217 H B 0012 ASP OD2
H A 0002 GLU OE2 8.431 H B 0012 ASP OD1
H A 0002 GLU OE2 6.304 H B 0012 ASP OD2
H A 0002 GLU OE1 9.462 C B 0039 GLU OE1
H A 0002 GLU OE1 8.369 C B 0039 GLU OE2
H A 0002 GLU OE2 8.590 C B 0039 GLU OE1
H A 0002 GLU OE2 7.149 C B 0039 GLU OE2
H A 0004 GLU OE1 8.923 C B 0039 GLU OE1
H A 0004 GLU OE1 7.753 C B 0039 GLU OE2
H A 0004 GLU OE2 10.62 C B 0039 GLU OE1
H A 0004 GLU OE2 9.657 C B 0039 GLU OE2
H A 0005 LYS NZ 8.752 H B 0005 LYS NZ
H A 0005 LYS NZ 11.83 C B 0042 HIS ND1
H A 0012 ASP OD1 6.341 H B 0002 GLU OE1
H A 0012 ASP OD1 8.459 H B 0002 GLU OE2
H A 0012 ASP OD2 4.239 H B 0002 GLU OE1
H A 0012 ASP OD2 6.329 H B 0002 GLU OE2
H A 0015 HIS ND1 8.900 C B 0090 HIS ND1
H A 0015 HIS ND1 8.666 C B 0090 HIS NE2
H A 0015 HIS NE2 7.558 C B 0090 HIS ND1
H A 0015 HIS NE2 7.221 C B 0090 HIS NE2
C A 0024 LYS NZ 11.62 C B 0090 HIS ND1
C A 0025 HIS ND1 11.63 C B 0048 LYS NZ
C A 0025 HIS ND1 9.453 C B 0085 HIS ND1
C A 0025 HIS ND1 9.609 C B 0085 HIS NE2
C A 0025 HIS NE2 10.52 C B 0085 HIS ND1
C A 0025 HIS NE2 10.90 C B 0085 HIS NE2
E A 0026 LYS NZ 10.86 C B 0085 HIS ND1
E A 0026 LYS NZ 10.06 C B 0085 HIS NE2
C A 0039 GLU OE1 9.436 H B 0002 GLU OE1
C A 0039 GLU OE1 8.572 H B 0002 GLU OE2
C A 0039 GLU OE2 8.342 H B 0002 GLU OE1
C A 0039 GLU OE2 7.129 H B 0002 GLU OE2
C A 0039 GLU OE1 8.954 H B 0004 GLU OE1
C A 0039 GLU OE1 10.66 H B 0004 GLU OE2
C A 0039 GLU OE2 7.783 H B 0004 GLU OE1
C A 0039 GLU OE2 9.691 H B 0004 GLU OE2
C A 0042 HIS ND1 11.81 H B 0005 LYS NZ
C A 0048 LYS NZ 11.67 C B 0025 HIS ND1
C A 0049 GLU OE1 10.57 E B 0069 ASP OD2
C A 0049 GLU OE2 10.14 E B 0069 ASP OD1
C A 0049 GLU OE2 8.457 E B 0069 ASP OD2
C A 0049 GLU OE2 11.83 H B 0072 GLU OE2
H A 0055 LYS NZ 11.93 H B 0055 LYS NZ
E A 0069 ASP OD1 10.11 C B 0049 GLU OE2
E A 0069 ASP OD2 10.53 C B 0049 GLU OE1
E A 0069 ASP OD2 8.419 C B 0049 GLU OE2
H A 0072 GLU OE2 11.80 C B 0049 GLU OE2
C A 0085 HIS ND1 9.495 C B 0025 HIS ND1
C A 0085 HIS ND1 10.57 C B 0025 HIS NE2
C A 0085 HIS NE2 9.641 C B 0025 HIS ND1
C A 0085 HIS NE2 10.94 C B 0025 HIS NE2
C A 0085 HIS ND1 10.92 E B 0026 LYS NZ
C A 0085 HIS NE2 10.12 E B 0026 LYS NZ
C A 0090 HIS ND1 8.956 H B 0015 HIS ND1
C A 0090 HIS ND1 7.615 H B 0015 HIS NE2
C A 0090 HIS NE2 8.714 H B 0015 HIS ND1
C A 0090 HIS NE2 7.272 H B 0015 HIS NE2
C A 0090 HIS ND1 11.67 C B 0024 LYS NZ
HB_MS 2.00 3.20 2
C A 0001 SER OG 2.984 C B 0039 GLU O
C A 0039 GLU O 2.959 C B 0001 SER OG
HB_SS 2.00 3.20 2
H A 0071 GLN NE2 2.587 H B 0082 THR OG1
H A 0082 THR OG1 2.599 H B 0071 GLN NE2
AROMATIC 0.00 8.00 2
C A 0088 PHE 5.898 H B 0015 HIS
H A 0015 HIS 5.885 C B 0088 PHE
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 397
C B 0000 MET C 2.426 C B 0001 SER CA
C B 0000 MET C 3.540 C B 0001 SER C
C B 0000 MET C 3.393 C B 0001 SER CB
C B 0001 SER C 2.426 H B 0002 GLU CA
C B 0001 SER C 3.166 H B 0002 GLU C
C B 0001 SER C 3.671 H B 0002 GLU CB
H B 0002 GLU C 2.427 H B 0003 LEU CA
H B 0002 GLU C 2.993 H B 0003 LEU C
H B 0002 GLU C 3.693 H B 0003 LEU CB
H B 0003 LEU C 2.414 H B 0004 GLU CA
H B 0003 LEU C 3.087 H B 0004 GLU C
H B 0003 LEU C 3.678 H B 0004 GLU CB
H B 0003 LEU C 3.679 H B 0007 MET CB
H B 0004 GLU C 2.416 H B 0005 LYS CA
H B 0004 GLU C 2.921 H B 0005 LYS C
H B 0004 GLU C 3.687 H B 0005 LYS CB
H B 0004 GLU CA 3.376 H B 0008 VAL CG2
H B 0004 GLU C 3.699 H B 0008 VAL CB
H B 0004 GLU C 3.249 H B 0008 VAL CG2
H B 0004 GLU CG 3.513 H B 0008 VAL CG2
H B 0005 LYS C 2.428 H B 0006 ALA CA
H B 0005 LYS C 3.174 H B 0006 ALA C
H B 0005 LYS C 3.667 H B 0006 ALA CB
H B 0006 ALA C 2.426 H B 0007 MET CA
H B 0006 ALA C 2.877 H B 0007 MET C
H B 0006 ALA C 3.687 H B 0007 MET CB
H B 0007 MET C 2.419 H B 0008 VAL CA
H B 0007 MET C 2.936 H B 0008 VAL C
H B 0007 MET C 3.688 H B 0008 VAL CB
H B 0007 MET CE 3.685 H B 0074 MET CE
H B 0008 VAL C 2.422 H B 0009 ALA CA
H B 0008 VAL C 2.952 H B 0009 ALA C
H B 0008 VAL C 3.698 H B 0009 ALA CB
H B 0009 ALA C 2.420 H B 0010 LEU CA
H B 0009 ALA C 2.932 H B 0010 LEU C
H B 0009 ALA C 3.697 H B 0010 LEU CB
H B 0010 LEU C 2.420 H B 0011 ILE CA
H B 0010 LEU C 2.864 H B 0011 ILE C
H B 0010 LEU C 3.688 H B 0011 ILE CB
H B 0010 LEU CD2 3.435 H B 0073 PHE CZ
H B 0010 LEU CB 3.623 H B 0074 MET CE
H B 0010 LEU CG 3.558 H B 0074 MET CE
H B 0010 LEU CD1 3.060 H B 0074 MET CE
H B 0010 LEU CD2 3.443 H B 0074 MET CE
H B 0011 ILE C 2.427 H B 0012 ASP CA
H B 0011 ILE C 3.075 H B 0012 ASP C
H B 0011 ILE C 3.682 H B 0012 ASP CB
H B 0012 ASP C 2.424 H B 0013 VAL CA
H B 0012 ASP C 2.888 H B 0013 VAL C
H B 0012 ASP C 3.697 H B 0013 VAL CB
H B 0013 VAL C 2.417 H B 0014 PHE CA
H B 0013 VAL C 2.966 H B 0014 PHE C
H B 0013 VAL C 3.698 H B 0014 PHE CB
H B 0014 PHE C 2.419 H B 0015 HIS CA
H B 0014 PHE C 3.037 H B 0015 HIS C
H B 0014 PHE C 3.686 H B 0015 HIS CB
H B 0014 PHE CE1 3.640 E B 0027 LEU CB
H B 0014 PHE CE1 3.725 E B 0027 LEU CD1
H B 0014 PHE CE2 3.649 E B 0069 ASP C
H B 0014 PHE CZ 3.361 E B 0069 ASP C
H B 0014 PHE CD2 3.456 H B 0070 PHE CB
H B 0014 PHE CE2 3.103 H B 0070 PHE CA
H B 0014 PHE CE2 3.142 H B 0070 PHE CB
H B 0014 PHE CZ 3.454 H B 0070 PHE CA
H B 0014 PHE CD1 3.769 H B 0073 PHE CG
H B 0014 PHE CD1 3.416 H B 0073 PHE CD1
H B 0014 PHE CD1 3.336 H B 0073 PHE CE1
H B 0014 PHE CD1 3.623 H B 0073 PHE CZ
H B 0014 PHE CE1 3.742 H B 0073 PHE CB
H B 0014 PHE CE1 3.327 H B 0073 PHE CG
H B 0014 PHE CE1 3.284 H B 0073 PHE CD1
H B 0014 PHE CE1 3.762 H B 0073 PHE CE1
H B 0015 HIS C 2.424 H B 0016 GLN CA
H B 0015 HIS C 3.275 H B 0016 GLN C
H B 0015 HIS C 3.609 H B 0016 GLN CB
H B 0016 GLN C 2.425 H B 0017 TYR CA
H B 0016 GLN C 2.842 H B 0017 TYR C
H B 0016 GLN C 3.680 H B 0017 TYR CB
H B 0017 TYR C 2.425 C B 0018 SER CA
H B 0017 TYR C 3.054 C B 0018 SER C
H B 0017 TYR C 3.689 C B 0018 SER CB
H B 0017 TYR C 3.740 C B 0020 ARG CG
H B 0017 TYR CD2 3.618 H B 0031 GLU CG
H B 0017 TYR CG 3.187 H B 0035 LEU CD2
H B 0017 TYR CD1 3.486 H B 0035 LEU CD2
H B 0017 TYR CD2 3.089 H B 0035 LEU CD2
H B 0017 TYR CE1 3.679 H B 0035 LEU CD2
H B 0017 TYR CE2 3.304 H B 0035 LEU CD2
H B 0017 TYR CZ 3.594 H B 0035 LEU CD2
H B 0017 TYR CE1 3.709 C B 0039 GLU CD
H B 0017 TYR CZ 3.498 C B 0039 GLU CD
C B 0018 SER C 2.427 C B 0019 GLY CA
C B 0018 SER C 3.061 C B 0019 GLY C
C B 0018 SER CA 3.666 E B 0027 LEU CD1
C B 0018 SER CB 3.537 E B 0027 LEU CD1
C B 0019 GLY C 2.424 C B 0020 ARG CA
C B 0019 GLY C 2.979 C B 0020 ARG C
C B 0019 GLY C 3.695 C B 0020 ARG CB
C B 0019 GLY CA 3.785 C B 0024 LYS CG
C B 0020 ARG C 2.422 C B 0021 GLU CA
C B 0020 ARG C 3.143 C B 0021 GLU C
C B 0020 ARG C 3.660 C B 0021 GLU CB
C B 0021 GLU C 2.425 C B 0022 GLY CA
C B 0021 GLU C 2.953 C B 0022 GLY C
C B 0022 GLY C 2.421 C B 0023 ASP CA
C B 0022 GLY C 2.845 C B 0023 ASP C
C B 0022 GLY C 3.671 C B 0023 ASP CB
C B 0023 ASP C 2.423 C B 0024 LYS CA
C B 0023 ASP C 3.589 C B 0024 LYS C
C B 0023 ASP C 3.312 C B 0024 LYS CB
C B 0023 ASP CB 3.577 E B 0026 LYS CG
C B 0024 LYS C 2.428 C B 0025 HIS CA
C B 0024 LYS C 3.661 C B 0025 HIS C
C B 0024 LYS C 3.193 C B 0025 HIS CB
C B 0024 LYS C 2.834 C B 0025 HIS CG
C B 0024 LYS C 3.207 C B 0025 HIS CD2
C B 0024 LYS C 3.561 C B 0025 HIS CE1
C B 0024 LYS CB 3.682 C B 0025 HIS CE1
C B 0025 HIS C 2.419 E B 0026 LYS CA
C B 0025 HIS C 3.634 E B 0026 LYS C
C B 0025 HIS C 3.223 E B 0026 LYS CB
C B 0025 HIS C 3.391 E B 0026 LYS CG
C B 0025 HIS C 3.268 E B 0026 LYS CD
E B 0026 LYS C 2.419 E B 0027 LEU CA
E B 0026 LYS C 3.296 E B 0027 LEU C
E B 0026 LYS C 3.592 E B 0027 LEU CB
E B 0027 LEU C 2.422 E B 0028 LYS CA
E B 0027 LEU C 3.529 E B 0028 LYS C
E B 0027 LEU C 3.383 E B 0028 LYS CB
E B 0028 LYS CA 3.773 H B 0029 LYS CE
E B 0028 LYS C 2.427 H B 0029 LYS CA
E B 0028 LYS C 2.849 H B 0029 LYS C
E B 0028 LYS C 3.707 H B 0029 LYS CB
E B 0028 LYS C 3.491 H B 0029 LYS CE
E B 0028 LYS CB 3.503 H B 0029 LYS CE
E B 0028 LYS CG 3.195 H B 0029 LYS CE
E B 0028 LYS CD 3.510 H B 0029 LYS CE
E B 0028 LYS CG 3.739 E B 0067 GLU CG
H B 0029 LYS C 2.421 H B 0030 SER CA
H B 0029 LYS C 3.147 H B 0030 SER C
H B 0029 LYS C 3.666 H B 0030 SER CB
H B 0029 LYS CG 3.568 C B 0064 GLY CA
H B 0029 LYS CD 3.273 C B 0064 GLY CA
H B 0029 LYS CD 3.332 C B 0064 GLY C
H B 0030 SER C 2.417 H B 0031 GLU CA
H B 0030 SER C 3.046 H B 0031 GLU C
H B 0030 SER C 3.685 H B 0031 GLU CB
H B 0031 GLU C 2.427 H B 0032 LEU CA
H B 0031 GLU C 3.118 H B 0032 LEU C
H B 0031 GLU C 3.675 H B 0032 LEU CB
H B 0032 LEU C 2.421 H B 0033 LYS CA
H B 0032 LEU C 2.881 H B 0033 LYS C
H B 0032 LEU C 3.686 H B 0033 LYS CB
H B 0032 LEU CD1 3.657 H B 0073 PHE CB
H B 0032 LEU CD1 3.482 H B 0073 PHE CD2
H B 0033 LYS C 2.427 H B 0034 GLU CA
H B 0033 LYS C 3.074 H B 0034 GLU C
H B 0033 LYS C 3.677 H B 0034 GLU CB
H B 0033 LYS CE 3.767 H B 0057 MET CG
H B 0033 LYS CE 3.654 H B 0057 MET CE
H B 0033 LYS CG 3.617 H B 0060 LEU CD1
H B 0034 GLU C 2.427 H B 0035 LEU CA
H B 0034 GLU C 2.948 H B 0035 LEU C
H B 0034 GLU C 3.689 H B 0035 LEU CB
H B 0034 GLU C 3.637 H B 0038 ASN CB
H B 0035 LEU C 2.431 H B 0036 ILE CA
H B 0035 LEU C 3.176 H B 0036 ILE C
H B 0035 LEU C 3.675 H B 0036 ILE CB
H B 0035 LEU C 3.792 H B 0036 ILE CG1
H B 0036 ILE C 2.429 H B 0037 ASN CA
H B 0036 ILE C 3.128 H B 0037 ASN C
H B 0036 ILE C 3.680 H B 0037 ASN CB
H B 0036 ILE CG2 3.301 H B 0080 VAL CG2
H B 0036 ILE CD1 3.708 H B 0080 VAL CG2
H B 0037 ASN C 2.419 H B 0038 ASN CA
H B 0037 ASN C 3.402 H B 0038 ASN C
H B 0037 ASN C 3.525 H B 0038 ASN CB
H B 0037 ASN C 3.541 C B 0041 SER CB
H B 0038 ASN C 2.420 C B 0039 GLU CA
H B 0038 ASN C 2.994 C B 0039 GLU C
H B 0038 ASN C 3.693 C B 0039 GLU CB
C B 0039 GLU C 2.421 C B 0040 LEU CA
C B 0039 GLU C 3.075 C B 0040 LEU C
C B 0039 GLU C 3.685 C B 0040 LEU CB
C B 0040 LEU C 2.433 C B 0041 SER CA
C B 0040 LEU C 2.830 C B 0041 SER C
C B 0040 LEU C 3.149 C B 0041 SER CB
C B 0040 LEU CD2 3.510 C B 0043 PHE CE2
C B 0041 SER C 2.421 C B 0042 HIS CA
C B 0041 SER C 3.689 C B 0042 HIS C
C B 0041 SER C 3.069 C B 0042 HIS CB
C B 0042 HIS C 2.424 C B 0043 PHE CA
C B 0042 HIS C 3.216 C B 0043 PHE C
C B 0042 HIS C 3.646 C B 0043 PHE CB
C B 0043 PHE C 2.421 C B 0044 LEU CA
C B 0043 PHE C 3.191 C B 0044 LEU C
C B 0043 PHE C 3.648 C B 0044 LEU CB
C B 0043 PHE CZ 3.494 H B 0081 THR CG2
C B 0044 LEU C 2.420 C B 0045 GLU CA
C B 0044 LEU C 3.540 C B 0045 GLU C
C B 0044 LEU C 3.385 C B 0045 GLU CB
C B 0044 LEU C 3.383 C B 0045 GLU CG
C B 0045 GLU C 2.423 C B 0046 GLU CA
C B 0045 GLU C 3.377 C B 0046 GLU C
C B 0045 GLU C 3.554 C B 0046 GLU CB
C B 0046 GLU C 2.419 C B 0047 ILE CA
C B 0046 GLU C 2.960 C B 0047 ILE C
C B 0046 GLU C 2.949 C B 0047 ILE CB
C B 0046 GLU C 3.191 C B 0047 ILE CG1
C B 0047 ILE C 2.424 C B 0048 LYS CA
C B 0047 ILE C 3.073 C B 0048 LYS C
C B 0047 ILE C 3.689 C B 0048 LYS CB
C B 0047 ILE CG2 3.345 H B 0053 VAL CG2
C B 0048 LYS C 2.417 C B 0049 GLU CA
C B 0048 LYS C 3.181 C B 0049 GLU C
C B 0048 LYS C 3.654 C B 0049 GLU CB
C B 0048 LYS CB 3.711 C B 0085 HIS CB
C B 0048 LYS CD 3.343 C B 0085 HIS CB
C B 0048 LYS CD 3.472 C B 0085 HIS CG
C B 0049 GLU C 2.415 H B 0050 GLN CA
C B 0049 GLU C 2.896 H B 0050 GLN C
C B 0049 GLU C 3.690 H B 0050 GLN CB
C B 0049 GLU CB 3.490 H B 0052 VAL CB
C B 0049 GLU CB 3.243 H B 0052 VAL CG2
C B 0049 GLU CG 3.377 H B 0052 VAL CG2
C B 0049 GLU CD 3.012 H B 0052 VAL CG2
C B 0049 GLU CB 3.402 C B 0083 ALA CA
C B 0049 GLU CB 3.567 C B 0083 ALA C
C B 0049 GLU CB 3.693 C B 0083 ALA CB
H B 0050 GLN C 2.423 H B 0051 GLU CA
H B 0050 GLN C 3.140 H B 0051 GLU C
H B 0050 GLN C 3.671 H B 0051 GLU CB
H B 0050 GLN C 3.743 H B 0054 ASP CB
H B 0051 GLU C 2.424 H B 0052 VAL CA
H B 0051 GLU C 3.035 H B 0052 VAL C
H B 0051 GLU C 3.691 H B 0052 VAL CB
H B 0052 VAL C 2.418 H B 0053 VAL CA
H B 0052 VAL C 3.067 H B 0053 VAL C
H B 0052 VAL C 3.683 H B 0053 VAL CB
H B 0052 VAL CG1 3.444 H B 0079 MET C
H B 0052 VAL CG1 3.490 H B 0079 MET CB
H B 0053 VAL C 2.416 H B 0054 ASP CA
H B 0053 VAL C 3.112 H B 0054 ASP C
H B 0053 VAL C 3.672 H B 0054 ASP CB
H B 0053 VAL CA 3.762 H B 0056 VAL CG2
H B 0053 VAL C 3.728 H B 0057 MET CB
H B 0053 VAL CG2 3.007 C B 0083 ALA CB
H B 0054 ASP C 2.420 H B 0055 LYS CA
H B 0054 ASP C 3.138 H B 0055 LYS C
H B 0054 ASP C 3.665 H B 0055 LYS CB
H B 0054 ASP C 3.762 H B 0058 GLU CG
H B 0054 ASP CG 3.731 H B 0058 GLU CG
H B 0054 ASP CG 3.484 H B 0058 GLU CD
H B 0055 LYS C 2.420 H B 0056 VAL CA
H B 0055 LYS C 3.085 H B 0056 VAL C
H B 0055 LYS C 3.682 H B 0056 VAL CB
H B 0056 VAL C 2.419 H B 0057 MET CA
H B 0056 VAL C 3.036 H B 0057 MET C
H B 0056 VAL C 3.678 H B 0057 MET CB
H B 0056 VAL CA 3.127 H B 0076 PHE CE2
H B 0056 VAL C 3.530 H B 0076 PHE CE2
H B 0056 VAL CB 3.123 H B 0076 PHE CD2
H B 0056 VAL CB 2.988 H B 0076 PHE CE2
H B 0056 VAL CG1 3.643 H B 0076 PHE CG
H B 0056 VAL CG1 3.118 H B 0076 PHE CD2
H B 0056 VAL CG1 3.085 H B 0076 PHE CE2
H B 0056 VAL CG1 3.584 H B 0076 PHE CZ
H B 0056 VAL CG2 3.498 H B 0080 VAL CG1
H B 0057 MET C 2.423 H B 0058 GLU CA
H B 0057 MET C 3.060 H B 0058 GLU C
H B 0057 MET C 3.693 H B 0058 GLU CB
H B 0057 MET CA 3.763 H B 0060 LEU CB
H B 0057 MET C 3.727 H B 0060 LEU CB
H B 0058 GLU C 2.418 H B 0059 THR CA
H B 0058 GLU C 2.933 H B 0059 THR C
H B 0058 GLU C 3.698 H B 0059 THR CB
H B 0059 THR C 2.426 H B 0060 LEU CA
H B 0059 THR C 3.012 H B 0060 LEU C
H B 0059 THR C 3.685 H B 0060 LEU CB
H B 0059 THR CA 3.641 H B 0062 GLU CB
H B 0059 THR C 3.783 H B 0062 GLU CB
H B 0060 LEU C 2.428 H B 0061 ASP CA
H B 0060 LEU C 3.150 H B 0061 ASP C
H B 0060 LEU C 3.665 H B 0061 ASP CB
H B 0061 ASP C 2.422 H B 0062 GLU CA
H B 0061 ASP C 3.142 H B 0062 GLU C
H B 0061 ASP C 3.670 H B 0062 GLU CB
H B 0062 GLU C 2.418 H B 0063 ASP CA
H B 0062 GLU C 3.261 H B 0063 ASP C
H B 0062 GLU C 3.629 H B 0063 ASP CB
H B 0063 ASP C 2.419 C B 0064 GLY CA
H B 0063 ASP C 2.834 C B 0064 GLY C
C B 0064 GLY C 2.423 C B 0065 ASP CA
C B 0064 GLY C 3.634 C B 0065 ASP C
C B 0064 GLY C 3.257 C B 0065 ASP CB
C B 0065 ASP C 2.420 C B 0066 GLY CA
C B 0065 ASP C 3.443 C B 0066 GLY C
C B 0066 GLY C 2.427 E B 0067 GLU CA
C B 0066 GLY C 3.484 E B 0067 GLU C
C B 0066 GLY C 3.460 E B 0067 GLU CB
C B 0066 GLY C 3.585 E B 0067 GLU CG
E B 0067 GLU C 2.427 E B 0068 CYS CA
E B 0067 GLU C 3.318 E B 0068 CYS C
E B 0067 GLU C 3.591 E B 0068 CYS CB
E B 0068 CYS C 2.423 E B 0069 ASP CA
E B 0068 CYS C 3.325 E B 0069 ASP C
E B 0068 CYS C 3.588 E B 0069 ASP CB
E B 0069 ASP C 2.416 H B 0070 PHE CA
E B 0069 ASP C 3.236 H B 0070 PHE C
E B 0069 ASP C 3.624 H B 0070 PHE CB
H B 0070 PHE C 2.424 H B 0071 GLN CA
H B 0070 PHE C 3.116 H B 0071 GLN C
H B 0070 PHE C 3.679 H B 0071 GLN CB
H B 0070 PHE CD1 3.721 H B 0071 GLN CG
H B 0070 PHE CD2 3.703 H B 0071 GLN CG
H B 0070 PHE CE1 3.152 H B 0071 GLN CG
H B 0070 PHE CE2 3.135 H B 0071 GLN CG
H B 0070 PHE CZ 2.816 H B 0071 GLN CG
H B 0070 PHE CZ 3.579 H B 0071 GLN CD
H B 0071 GLN C 2.425 H B 0072 GLU CA
H B 0071 GLN C 3.112 H B 0072 GLU C
H B 0071 GLN C 3.669 H B 0072 GLU CB
H B 0072 GLU C 2.418 H B 0073 PHE CA
H B 0072 GLU C 2.975 H B 0073 PHE C
H B 0072 GLU C 3.699 H B 0073 PHE CB
H B 0073 PHE C 2.426 H B 0074 MET CA
H B 0073 PHE C 3.122 H B 0074 MET C
H B 0073 PHE C 3.676 H B 0074 MET CB
H B 0073 PHE CD1 3.784 H B 0074 MET CA
H B 0073 PHE CD2 3.774 H B 0077 VAL CG2
H B 0074 MET C 2.418 H B 0075 ALA CA
H B 0074 MET C 3.036 H B 0075 ALA C
H B 0074 MET C 3.685 H B 0075 ALA CB
H B 0075 ALA C 2.425 H B 0076 PHE CA
H B 0075 ALA C 3.143 H B 0076 PHE C
H B 0075 ALA C 3.671 H B 0076 PHE CB
H B 0076 PHE C 2.431 H B 0077 VAL CA
H B 0076 PHE C 3.084 H B 0077 VAL C
H B 0076 PHE C 3.688 H B 0077 VAL CB
H B 0077 VAL C 2.422 H B 0078 SER CA
H B 0077 VAL C 3.135 H B 0078 SER C
H B 0077 VAL C 3.670 H B 0078 SER CB
H B 0077 VAL CA 3.566 H B 0080 VAL CG2
H B 0077 VAL C 3.488 H B 0080 VAL CG2
H B 0078 SER C 2.424 H B 0079 MET CA
H B 0078 SER C 2.964 H B 0079 MET C
H B 0078 SER C 3.691 H B 0079 MET CB
H B 0079 MET C 2.424 H B 0080 VAL CA
H B 0079 MET C 3.072 H B 0080 VAL C
H B 0079 MET C 3.686 H B 0080 VAL CB
H B 0080 VAL C 2.420 H B 0081 THR CA
H B 0080 VAL C 3.014 H B 0081 THR C
H B 0080 VAL C 3.698 H B 0081 THR CB
H B 0081 THR C 2.427 H B 0082 THR CA
H B 0081 THR C 3.458 H B 0082 THR C
H B 0081 THR C 3.491 H B 0082 THR CB
H B 0081 THR C 3.671 H B 0082 THR CG2
H B 0082 THR C 2.423 C B 0083 ALA CA
H B 0082 THR C 2.975 C B 0083 ALA C
H B 0082 THR C 3.695 C B 0083 ALA CB
C B 0083 ALA C 2.422 C B 0084 CYS CA
C B 0083 ALA C 2.886 C B 0084 CYS C
C B 0083 ALA C 3.690 C B 0084 CYS CB
C B 0084 CYS C 2.423 C B 0085 HIS CA
C B 0084 CYS C 3.024 C B 0085 HIS C
C B 0084 CYS C 3.693 C B 0085 HIS CB
C B 0085 HIS C 2.420 C B 0086 GLU CA
C B 0085 HIS C 3.092 C B 0086 GLU C
C B 0085 HIS C 3.678 C B 0086 GLU CB
C B 0085 HIS C 3.798 C B 0087 PHE CD2
C B 0086 GLU C 2.421 C B 0087 PHE CA
C B 0086 GLU C 3.478 C B 0087 PHE C
C B 0086 GLU C 3.466 C B 0087 PHE CB
C B 0086 GLU C 3.721 C B 0087 PHE CG
C B 0087 PHE C 2.422 C B 0088 PHE CA
C B 0087 PHE C 3.456 C B 0088 PHE C
C B 0087 PHE C 3.486 C B 0088 PHE CB
C B 0087 PHE C 3.467 C B 0088 PHE CG
C B 0087 PHE C 3.057 C B 0088 PHE CD1
C B 0087 PHE CD1 3.261 C B 0088 PHE CG
C B 0087 PHE CD1 3.359 C B 0088 PHE CD1
C B 0087 PHE CD1 3.211 C B 0088 PHE CD2
C B 0087 PHE CD1 3.404 C B 0088 PHE CE1
C B 0087 PHE CD1 3.258 C B 0088 PHE CE2
C B 0087 PHE CD1 3.355 C B 0088 PHE CZ
C B 0087 PHE CE1 3.252 C B 0088 PHE CD2
C B 0087 PHE CE1 3.133 C B 0088 PHE CE2
C B 0087 PHE CE1 3.630 C B 0088 PHE CZ
C B 0088 PHE C 2.424 C B 0089 GLU CA
C B 0088 PHE C 3.488 C B 0089 GLU C
C B 0088 PHE C 3.456 C B 0089 GLU CB
C B 0089 GLU C 2.422 C B 0090 HIS CA
C B 0089 GLU C 3.468 C B 0090 HIS C
C B 0089 GLU C 3.478 C B 0090 HIS CB
C B 0090 HIS C 2.424 C B 0091 GLU CA
C B 0090 HIS C 3.239 C B 0091 GLU C
C B 0090 HIS C 3.634 C B 0091 GLU CB
CHARGE_ATTR 2.00 12.00 141
H B 0002 GLU OE1 6.304 H B 0005 LYS NZ
H B 0002 GLU OE2 5.247 H B 0005 LYS NZ
H B 0004 GLU OE1 7.216 H B 0005 LYS NZ
H B 0004 GLU OE2 8.369 H B 0005 LYS NZ
H B 0012 ASP OD1 6.642 H B 0015 HIS ND1
H B 0012 ASP OD1 6.324 H B 0015 HIS NE2
H B 0012 ASP OD2 8.046 H B 0015 HIS ND1
H B 0012 ASP OD2 7.823 H B 0015 HIS NE2
H B 0012 ASP OD1 11.77 C B 0024 LYS NZ
C B 0021 GLU OE1 9.609 C B 0020 ARG NH1
C B 0021 GLU OE1 11.48 C B 0020 ARG NH2
C B 0021 GLU OE2 9.462 C B 0020 ARG NH1
C B 0021 GLU OE2 11.14 C B 0020 ARG NH2
C B 0021 GLU OE1 11.23 C B 0024 LYS NZ
C B 0021 GLU OE1 7.594 E B 0028 LYS NZ
C B 0021 GLU OE2 6.029 E B 0028 LYS NZ
C B 0021 GLU OE2 11.64 H B 0029 LYS NZ
C B 0023 ASP OD1 10.36 H B 0015 HIS ND1
C B 0023 ASP OD2 9.250 H B 0015 HIS ND1
C B 0023 ASP OD2 11.16 H B 0015 HIS NE2
C B 0023 ASP OD1 10.90 C B 0020 ARG NH1
C B 0023 ASP OD2 11.65 C B 0020 ARG NH1
C B 0023 ASP OD1 9.498 C B 0024 LYS NZ
C B 0023 ASP OD2 9.396 C B 0024 LYS NZ
C B 0023 ASP OD1 9.228 C B 0025 HIS ND1
C B 0023 ASP OD1 8.844 C B 0025 HIS NE2
C B 0023 ASP OD2 7.669 C B 0025 HIS ND1
C B 0023 ASP OD2 7.714 C B 0025 HIS NE2
C B 0023 ASP OD1 8.543 E B 0026 LYS NZ
C B 0023 ASP OD2 7.340 E B 0026 LYS NZ
C B 0023 ASP OD1 7.144 E B 0028 LYS NZ
C B 0023 ASP OD2 8.205 E B 0028 LYS NZ
C B 0023 ASP OD1 10.72 H B 0029 LYS NZ
C B 0023 ASP OD2 10.81 H B 0029 LYS NZ
H B 0031 GLU OE1 8.442 C B 0020 ARG NH1
H B 0031 GLU OE1 7.872 C B 0020 ARG NH2
H B 0031 GLU OE2 6.929 C B 0020 ARG NH1
H B 0031 GLU OE2 6.727 C B 0020 ARG NH2
H B 0031 GLU OE1 7.149 E B 0028 LYS NZ
H B 0031 GLU OE2 6.970 E B 0028 LYS NZ
H B 0031 GLU OE1 9.621 H B 0029 LYS NZ
H B 0031 GLU OE2 10.30 H B 0029 LYS NZ
H B 0034 GLU OE1 10.21 C B 0020 ARG NH1
H B 0034 GLU OE1 8.885 C B 0020 ARG NH2
H B 0034 GLU OE2 10.71 C B 0020 ARG NH2
H B 0034 GLU OE1 10.64 E B 0028 LYS NZ
H B 0034 GLU OE2 11.80 E B 0028 LYS NZ
H B 0034 GLU OE1 11.04 H B 0033 LYS NZ
H B 0034 GLU OE2 9.943 H B 0033 LYS NZ
C B 0039 GLU OE1 10.36 C B 0020 ARG NH1
C B 0039 GLU OE1 8.406 C B 0020 ARG NH2
C B 0039 GLU OE2 9.937 C B 0020 ARG NH1
C B 0039 GLU OE2 7.802 C B 0020 ARG NH2
C B 0039 GLU OE1 11.99 C B 0042 HIS ND1
C B 0039 GLU OE2 11.37 C B 0042 HIS ND1
C B 0039 GLU OE2 11.91 C B 0042 HIS NE2
C B 0045 GLU OE1 11.91 C B 0042 HIS ND1
C B 0045 GLU OE1 11.87 C B 0042 HIS NE2
C B 0045 GLU OE2 10.49 C B 0042 HIS ND1
C B 0045 GLU OE2 10.16 C B 0042 HIS NE2
C B 0045 GLU OE1 10.37 C B 0090 HIS ND1
C B 0045 GLU OE1 11.96 C B 0090 HIS NE2
C B 0045 GLU OE2 10.64 C B 0090 HIS ND1
C B 0045 GLU OE2 11.98 C B 0090 HIS NE2
C B 0046 GLU OE1 6.168 C B 0048 LYS NZ
C B 0046 GLU OE2 6.182 C B 0048 LYS NZ
C B 0046 GLU OE1 7.840 C B 0085 HIS ND1
C B 0046 GLU OE1 9.444 C B 0085 HIS NE2
C B 0046 GLU OE2 7.743 C B 0085 HIS ND1
C B 0046 GLU OE2 9.587 C B 0085 HIS NE2
C B 0049 GLU OE1 10.34 C B 0048 LYS NZ
C B 0049 GLU OE2 9.630 C B 0048 LYS NZ
C B 0049 GLU OE1 10.30 H B 0055 LYS NZ
C B 0049 GLU OE2 11.19 H B 0055 LYS NZ
C B 0049 GLU OE1 8.667 C B 0085 HIS ND1
C B 0049 GLU OE1 7.377 C B 0085 HIS NE2
C B 0049 GLU OE2 7.507 C B 0085 HIS ND1
C B 0049 GLU OE2 5.843 C B 0085 HIS NE2
H B 0051 GLU OE1 8.855 H B 0055 LYS NZ
H B 0051 GLU OE2 10.84 H B 0055 LYS NZ
H B 0054 ASP OD1 8.564 H B 0033 LYS NZ
H B 0054 ASP OD2 10.72 H B 0033 LYS NZ
H B 0054 ASP OD1 11.12 H B 0055 LYS NZ
H B 0054 ASP OD2 11.15 H B 0055 LYS NZ
H B 0058 GLU OE1 10.85 H B 0033 LYS NZ
H B 0058 GLU OE2 10.54 H B 0033 LYS NZ
H B 0058 GLU OE1 8.700 H B 0055 LYS NZ
H B 0058 GLU OE2 10.51 H B 0055 LYS NZ
H B 0061 ASP OD1 10.96 H B 0029 LYS NZ
H B 0061 ASP OD2 11.35 H B 0029 LYS NZ
H B 0061 ASP OD1 2.688 H B 0033 LYS NZ
H B 0061 ASP OD2 4.748 H B 0033 LYS NZ
H B 0062 GLU OE1 11.38 H B 0033 LYS NZ
H B 0062 GLU OE1 9.851 H B 0055 LYS NZ
H B 0062 GLU OE2 11.54 H B 0055 LYS NZ
H B 0063 ASP OD1 11.66 E B 0028 LYS NZ
H B 0063 ASP OD1 6.254 H B 0029 LYS NZ
H B 0063 ASP OD2 8.189 H B 0029 LYS NZ
H B 0063 ASP OD1 9.338 H B 0033 LYS NZ
H B 0063 ASP OD2 10.21 H B 0033 LYS NZ
H B 0063 ASP OD2 11.09 H B 0055 LYS NZ
C B 0065 ASP OD1 8.931 E B 0028 LYS NZ
C B 0065 ASP OD2 11.08 E B 0028 LYS NZ
C B 0065 ASP OD1 5.119 H B 0029 LYS NZ
C B 0065 ASP OD2 6.869 H B 0029 LYS NZ
E B 0067 GLU OE1 7.519 E B 0026 LYS NZ
E B 0067 GLU OE2 7.206 E B 0026 LYS NZ
E B 0067 GLU OE1 8.007 E B 0028 LYS NZ
E B 0067 GLU OE2 6.795 E B 0028 LYS NZ
E B 0067 GLU OE1 6.059 H B 0029 LYS NZ
E B 0067 GLU OE2 6.593 H B 0029 LYS NZ
E B 0069 ASP OD1 8.231 C B 0025 HIS ND1
E B 0069 ASP OD1 9.586 C B 0025 HIS NE2
E B 0069 ASP OD2 9.875 C B 0025 HIS ND1
E B 0069 ASP OD2 11.24 C B 0025 HIS NE2
E B 0069 ASP OD1 5.528 E B 0026 LYS NZ
E B 0069 ASP OD2 6.855 E B 0026 LYS NZ
H B 0072 GLU OE1 7.884 H B 0055 LYS NZ
H B 0072 GLU OE2 8.618 H B 0055 LYS NZ
C B 0086 GLU OE1 6.787 C B 0048 LYS NZ
C B 0086 GLU OE2 8.780 C B 0048 LYS NZ
C B 0086 GLU OE1 7.033 C B 0085 HIS ND1
C B 0086 GLU OE1 8.773 C B 0085 HIS NE2
C B 0086 GLU OE2 8.946 C B 0085 HIS ND1
C B 0086 GLU OE2 10.50 C B 0085 HIS NE2
C B 0086 GLU OE1 11.19 C B 0090 HIS ND1
C B 0086 GLU OE2 10.52 C B 0090 HIS ND1
C B 0089 GLU OE1 10.19 C B 0048 LYS NZ
C B 0089 GLU OE2 11.06 C B 0048 LYS NZ
C B 0089 GLU OE1 10.15 C B 0085 HIS ND1
C B 0089 GLU OE1 11.81 C B 0085 HIS NE2
C B 0089 GLU OE2 10.50 C B 0085 HIS ND1
C B 0089 GLU OE2 11.88 C B 0085 HIS NE2
C B 0089 GLU OE1 8.518 C B 0090 HIS ND1
C B 0089 GLU OE1 10.45 C B 0090 HIS NE2
C B 0089 GLU OE2 8.530 C B 0090 HIS ND1
C B 0089 GLU OE2 10.19 C B 0090 HIS NE2
C B 0091 GLU OE1 6.427 C B 0090 HIS ND1
C B 0091 GLU OE1 8.444 C B 0090 HIS NE2
C B 0091 GLU OE2 5.040 C B 0090 HIS ND1
C B 0091 GLU OE2 6.809 C B 0090 HIS NE2
CHARGE_REPU 2.00 12.00 174
H B 0002 GLU OE1 9.687 H B 0004 GLU OE1
H B 0002 GLU OE1 11.55 H B 0004 GLU OE2
H B 0002 GLU OE2 7.909 H B 0004 GLU OE1
H B 0002 GLU OE2 9.869 H B 0004 GLU OE2
H B 0012 ASP OD2 11.99 C B 0039 GLU OE1
H B 0012 ASP OD2 11.35 C B 0039 GLU OE2
H B 0015 HIS ND1 5.727 C B 0024 LYS NZ
H B 0015 HIS NE2 5.644 C B 0024 LYS NZ
H B 0015 HIS ND1 6.462 C B 0025 HIS ND1
H B 0015 HIS ND1 7.208 C B 0025 HIS NE2
H B 0015 HIS NE2 8.135 C B 0025 HIS ND1
H B 0015 HIS NE2 8.579 C B 0025 HIS NE2
C B 0020 ARG NH1 11.97 E B 0028 LYS NZ
C B 0021 GLU OE1 5.686 C B 0023 ASP OD1
C B 0021 GLU OE1 7.793 C B 0023 ASP OD2
C B 0021 GLU OE2 6.405 C B 0023 ASP OD1
C B 0021 GLU OE2 8.441 C B 0023 ASP OD2
C B 0021 GLU OE1 11.00 H B 0031 GLU OE1
C B 0021 GLU OE1 9.388 H B 0031 GLU OE2
C B 0021 GLU OE2 9.775 H B 0031 GLU OE1
C B 0021 GLU OE2 8.463 H B 0031 GLU OE2
C B 0021 GLU OE1 10.23 E B 0067 GLU OE2
C B 0021 GLU OE2 11.91 E B 0067 GLU OE1
C B 0021 GLU OE2 9.944 E B 0067 GLU OE2
C B 0023 ASP OD1 9.785 H B 0031 GLU OE1
C B 0023 ASP OD1 8.130 H B 0031 GLU OE2
C B 0023 ASP OD2 9.916 H B 0031 GLU OE1
C B 0023 ASP OD2 8.341 H B 0031 GLU OE2
C B 0023 ASP OD1 8.789 E B 0067 GLU OE1
C B 0023 ASP OD1 6.915 E B 0067 GLU OE2
C B 0023 ASP OD2 8.576 E B 0067 GLU OE1
C B 0023 ASP OD2 7.045 E B 0067 GLU OE2
C B 0023 ASP OD1 10.98 E B 0069 ASP OD1
C B 0023 ASP OD2 9.061 E B 0069 ASP OD1
C B 0023 ASP OD2 11.18 E B 0069 ASP OD2
C B 0024 LYS NZ 7.635 C B 0025 HIS ND1
C B 0024 LYS NZ 6.565 C B 0025 HIS NE2
C B 0025 HIS ND1 7.328 E B 0026 LYS NZ
C B 0025 HIS NE2 7.301 E B 0026 LYS NZ
E B 0028 LYS NZ 5.728 H B 0029 LYS NZ
H B 0031 GLU OE1 4.269 H B 0034 GLU OE1
H B 0031 GLU OE1 6.151 H B 0034 GLU OE2
H B 0031 GLU OE2 6.070 H B 0034 GLU OE1
H B 0031 GLU OE2 8.085 H B 0034 GLU OE2
H B 0031 GLU OE1 7.620 C B 0039 GLU OE1
H B 0031 GLU OE1 8.994 C B 0039 GLU OE2
H B 0031 GLU OE2 8.098 C B 0039 GLU OE1
H B 0031 GLU OE2 9.206 C B 0039 GLU OE2
H B 0031 GLU OE2 11.63 E B 0067 GLU OE2
H B 0034 GLU OE1 6.433 C B 0039 GLU OE1
H B 0034 GLU OE1 7.671 C B 0039 GLU OE2
H B 0034 GLU OE2 7.793 C B 0039 GLU OE1
H B 0034 GLU OE2 8.964 C B 0039 GLU OE2
H B 0034 GLU OE2 11.19 H B 0061 ASP OD1
C B 0042 HIS ND1 11.10 C B 0090 HIS ND1
C B 0042 HIS ND1 10.35 C B 0090 HIS NE2
C B 0042 HIS NE2 11.50 C B 0090 HIS NE2
C B 0045 GLU OE1 8.170 C B 0046 GLU OE1
C B 0045 GLU OE1 6.624 C B 0046 GLU OE2
C B 0045 GLU OE2 9.850 C B 0046 GLU OE1
C B 0045 GLU OE2 8.535 C B 0046 GLU OE2
C B 0045 GLU OE1 5.787 C B 0086 GLU OE1
C B 0045 GLU OE1 3.853 C B 0086 GLU OE2
C B 0045 GLU OE2 7.764 C B 0086 GLU OE1
C B 0045 GLU OE2 5.692 C B 0086 GLU OE2
C B 0045 GLU OE1 9.961 C B 0089 GLU OE1
C B 0045 GLU OE1 11.72 C B 0089 GLU OE2
C B 0045 GLU OE2 11.70 C B 0089 GLU OE1
C B 0045 GLU OE1 10.92 C B 0091 GLU OE1
C B 0045 GLU OE1 11.71 C B 0091 GLU OE2
C B 0046 GLU OE1 10.97 C B 0049 GLU OE1
C B 0046 GLU OE1 11.41 C B 0049 GLU OE2
C B 0046 GLU OE1 5.305 C B 0086 GLU OE1
C B 0046 GLU OE1 5.910 C B 0086 GLU OE2
C B 0046 GLU OE2 3.532 C B 0086 GLU OE1
C B 0046 GLU OE2 4.240 C B 0086 GLU OE2
C B 0046 GLU OE1 11.78 C B 0089 GLU OE1
C B 0046 GLU OE2 9.803 C B 0089 GLU OE1
C B 0046 GLU OE2 11.48 C B 0089 GLU OE2
C B 0048 LYS NZ 3.387 C B 0085 HIS ND1
C B 0048 LYS NZ 5.339 C B 0085 HIS NE2
C B 0049 GLU OE1 5.522 H B 0051 GLU OE1
C B 0049 GLU OE1 6.538 H B 0051 GLU OE2
C B 0049 GLU OE2 6.711 H B 0051 GLU OE1
C B 0049 GLU OE2 7.750 H B 0051 GLU OE2
C B 0049 GLU OE1 10.60 H B 0054 ASP OD1
C B 0049 GLU OE1 9.745 H B 0054 ASP OD2
C B 0049 GLU OE2 11.87 H B 0054 ASP OD2
C B 0049 GLU OE1 11.38 H B 0058 GLU OE1
C B 0049 GLU OE1 11.39 H B 0058 GLU OE2
H B 0051 GLU OE1 9.475 H B 0054 ASP OD1
H B 0051 GLU OE1 7.928 H B 0054 ASP OD2
H B 0051 GLU OE2 9.625 H B 0054 ASP OD1
H B 0051 GLU OE2 7.766 H B 0054 ASP OD2
H B 0051 GLU OE1 8.385 H B 0058 GLU OE1
H B 0051 GLU OE1 8.713 H B 0058 GLU OE2
H B 0051 GLU OE2 8.852 H B 0058 GLU OE1
H B 0051 GLU OE2 8.746 H B 0058 GLU OE2
H B 0054 ASP OD1 4.395 H B 0058 GLU OE1
H B 0054 ASP OD1 3.016 H B 0058 GLU OE2
H B 0054 ASP OD2 4.202 H B 0058 GLU OE1
H B 0054 ASP OD2 2.525 H B 0058 GLU OE2
H B 0054 ASP OD1 9.148 H B 0061 ASP OD1
H B 0054 ASP OD1 9.476 H B 0061 ASP OD2
H B 0054 ASP OD2 11.21 H B 0061 ASP OD1
H B 0054 ASP OD2 11.37 H B 0061 ASP OD2
H B 0054 ASP OD1 9.825 H B 0062 GLU OE1
H B 0054 ASP OD1 11.62 H B 0062 GLU OE2
H B 0054 ASP OD2 10.54 H B 0062 GLU OE1
H B 0058 GLU OE1 10.75 H B 0061 ASP OD1
H B 0058 GLU OE1 10.65 H B 0061 ASP OD2
H B 0058 GLU OE2 10.50 H B 0061 ASP OD1
H B 0058 GLU OE2 10.34 H B 0061 ASP OD2
H B 0058 GLU OE1 6.645 H B 0062 GLU OE1
H B 0058 GLU OE1 8.322 H B 0062 GLU OE2
H B 0058 GLU OE2 8.247 H B 0062 GLU OE1
H B 0058 GLU OE2 9.807 H B 0062 GLU OE2
H B 0058 GLU OE1 11.68 H B 0063 ASP OD1
H B 0058 GLU OE1 10.34 H B 0063 ASP OD2
H B 0058 GLU OE2 11.78 H B 0063 ASP OD2
H B 0061 ASP OD1 10.22 H B 0062 GLU OE1
H B 0061 ASP OD1 11.46 H B 0062 GLU OE2
H B 0061 ASP OD2 9.689 H B 0062 GLU OE1
H B 0061 ASP OD2 10.62 H B 0062 GLU OE2
H B 0061 ASP OD1 8.339 H B 0063 ASP OD1
H B 0061 ASP OD1 9.160 H B 0063 ASP OD2
H B 0061 ASP OD2 8.635 H B 0063 ASP OD1
H B 0061 ASP OD2 9.203 H B 0063 ASP OD2
H B 0062 GLU OE1 6.957 H B 0063 ASP OD1
H B 0062 GLU OE1 5.034 H B 0063 ASP OD2
H B 0062 GLU OE2 7.715 H B 0063 ASP OD1
H B 0062 GLU OE2 5.775 H B 0063 ASP OD2
H B 0062 GLU OE2 11.72 C B 0065 ASP OD2
H B 0062 GLU OE1 10.15 H B 0072 GLU OE1
H B 0062 GLU OE1 10.25 H B 0072 GLU OE2
H B 0062 GLU OE2 11.37 H B 0072 GLU OE1
H B 0062 GLU OE2 11.11 H B 0072 GLU OE2
H B 0063 ASP OD1 8.466 C B 0065 ASP OD1
H B 0063 ASP OD1 8.762 C B 0065 ASP OD2
H B 0063 ASP OD2 9.664 C B 0065 ASP OD1
H B 0063 ASP OD2 9.522 C B 0065 ASP OD2
H B 0063 ASP OD1 9.409 E B 0067 GLU OE1
H B 0063 ASP OD1 10.93 E B 0067 GLU OE2
H B 0063 ASP OD2 10.56 E B 0067 GLU OE1
H B 0063 ASP OD1 8.054 H B 0072 GLU OE1
H B 0063 ASP OD1 8.653 H B 0072 GLU OE2
H B 0063 ASP OD2 7.605 H B 0072 GLU OE1
H B 0063 ASP OD2 7.917 H B 0072 GLU OE2
C B 0065 ASP OD1 7.856 E B 0067 GLU OE1
C B 0065 ASP OD1 8.715 E B 0067 GLU OE2
C B 0065 ASP OD2 9.099 E B 0067 GLU OE1
C B 0065 ASP OD2 10.26 E B 0067 GLU OE2
E B 0067 GLU OE1 9.401 E B 0069 ASP OD1
E B 0067 GLU OE1 10.46 E B 0069 ASP OD2
E B 0067 GLU OE2 9.863 E B 0069 ASP OD1
E B 0067 GLU OE2 11.25 E B 0069 ASP OD2
E B 0067 GLU OE1 11.86 H B 0072 GLU OE1
E B 0067 GLU OE1 11.51 H B 0072 GLU OE2
E B 0069 ASP OD1 8.598 H B 0072 GLU OE1
E B 0069 ASP OD1 8.184 H B 0072 GLU OE2
E B 0069 ASP OD2 7.998 H B 0072 GLU OE1
E B 0069 ASP OD2 7.177 H B 0072 GLU OE2
C B 0086 GLU OE1 7.132 C B 0089 GLU OE1
C B 0086 GLU OE1 8.596 C B 0089 GLU OE2
C B 0086 GLU OE2 8.156 C B 0089 GLU OE1
C B 0086 GLU OE2 9.690 C B 0089 GLU OE2
C B 0086 GLU OE1 10.79 C B 0091 GLU OE1
C B 0086 GLU OE1 11.96 C B 0091 GLU OE2
C B 0086 GLU OE2 10.89 C B 0091 GLU OE1
C B 0086 GLU OE2 11.85 C B 0091 GLU OE2
C B 0089 GLU OE1 5.234 C B 0091 GLU OE1
C B 0089 GLU OE1 6.723 C B 0091 GLU OE2
C B 0089 GLU OE2 5.793 C B 0091 GLU OE1
C B 0089 GLU OE2 6.835 C B 0091 GLU OE2
HB_MM 2.00 3.20 165
C B 0001 SER N 2.199 C B 0000 MET O
H B 0002 GLU N 2.198 C B 0001 SER O
H B 0003 LEU N 2.193 H B 0002 GLU O
H B 0004 GLU N 3.132 H B 0002 GLU O
H B 0004 GLU N 2.187 H B 0003 LEU O
H B 0005 LYS N 2.184 H B 0004 GLU O
H B 0006 ALA N 2.958 H B 0002 GLU O
H B 0006 ALA N 3.036 H B 0004 GLU O
H B 0006 ALA N 2.196 H B 0005 LYS O
H B 0007 MET N 2.716 H B 0003 LEU O
H B 0007 MET N 2.196 H B 0006 ALA O
H B 0008 VAL N 2.796 H B 0004 GLU O
H B 0008 VAL N 3.163 H B 0006 ALA O
H B 0008 VAL N 2.194 H B 0007 MET O
H B 0009 ALA N 2.737 H B 0006 ALA O
H B 0009 ALA N 3.044 H B 0007 MET O
H B 0009 ALA N 2.195 H B 0008 VAL O
H B 0010 LEU N 3.176 H B 0006 ALA O
H B 0010 LEU N 2.831 H B 0007 MET O
H B 0010 LEU N 3.171 H B 0008 VAL O
H B 0010 LEU N 2.198 H B 0009 ALA O
H B 0011 ILE N 3.121 H B 0008 VAL O
H B 0011 ILE N 2.199 H B 0010 LEU O
H B 0012 ASP N 2.824 H B 0009 ALA O
H B 0012 ASP N 2.722 H B 0010 LEU O
H B 0012 ASP N 2.199 H B 0011 ILE O
H B 0013 VAL N 3.190 H B 0009 ALA O
H B 0013 VAL N 2.752 H B 0010 LEU O
H B 0013 VAL N 2.197 H B 0012 ASP O
H B 0014 PHE N 3.070 H B 0012 ASP O
H B 0014 PHE N 2.193 H B 0013 VAL O
H B 0015 HIS N 2.820 H B 0012 ASP O
H B 0015 HIS N 2.194 H B 0014 PHE O
H B 0016 GLN N 2.830 H B 0012 ASP O
H B 0016 GLN N 2.907 H B 0013 VAL O
H B 0016 GLN N 3.163 H B 0014 PHE O
H B 0016 GLN N 2.198 H B 0015 HIS O
H B 0017 TYR N 2.763 H B 0013 VAL O
H B 0017 TYR N 2.197 H B 0016 GLN O
C B 0018 SER N 3.147 H B 0014 PHE O
C B 0018 SER N 2.976 H B 0016 GLN O
C B 0018 SER N 2.197 H B 0017 TYR O
C B 0019 GLY N 2.609 H B 0016 GLN O
C B 0019 GLY N 2.198 C B 0018 SER O
C B 0020 ARG N 2.926 H B 0016 GLN O
C B 0020 ARG N 3.137 H B 0017 TYR O
C B 0020 ARG N 2.976 C B 0018 SER O
C B 0020 ARG N 2.198 C B 0019 GLY O
C B 0021 GLU N 2.197 C B 0020 ARG O
C B 0022 GLY N 2.197 C B 0021 GLU O
C B 0023 ASP N 2.194 C B 0022 GLY O
C B 0024 LYS N 2.197 C B 0023 ASP O
C B 0025 HIS N 2.199 C B 0024 LYS O
E B 0026 LYS N 2.196 C B 0025 HIS O
E B 0027 LEU N 2.197 E B 0026 LYS O
E B 0027 LEU N 2.950 E B 0068 CYS O
E B 0028 LYS N 2.194 E B 0027 LEU O
H B 0029 LYS N 2.187 E B 0028 LYS O
H B 0030 SER N 2.550 E B 0028 LYS O
H B 0030 SER N 2.193 H B 0029 LYS O
H B 0031 GLU N 2.623 E B 0028 LYS O
H B 0031 GLU N 2.193 H B 0030 SER O
H B 0032 LEU N 2.841 E B 0028 LYS O
H B 0032 LEU N 2.198 H B 0031 GLU O
H B 0033 LYS N 3.151 H B 0029 LYS O
H B 0033 LYS N 2.201 H B 0032 LEU O
H B 0034 GLU N 2.952 H B 0030 SER O
H B 0034 GLU N 3.004 H B 0032 LEU O
H B 0034 GLU N 2.200 H B 0033 LYS O
H B 0035 LEU N 2.789 H B 0031 GLU O
H B 0035 LEU N 2.771 H B 0032 LEU O
H B 0035 LEU N 2.194 H B 0034 GLU O
H B 0036 ILE N 3.042 H B 0032 LEU O
H B 0036 ILE N 3.161 H B 0034 GLU O
H B 0036 ILE N 2.199 H B 0035 LEU O
H B 0037 ASN N 3.058 H B 0033 LYS O
H B 0037 ASN N 2.196 H B 0036 ILE O
H B 0038 ASN N 2.655 H B 0034 GLU O
H B 0038 ASN N 3.114 H B 0036 ILE O
H B 0038 ASN N 2.190 H B 0037 ASN O
C B 0039 GLU N 3.180 H B 0035 LEU O
C B 0039 GLU N 2.195 H B 0038 ASN O
C B 0040 LEU N 2.196 C B 0039 GLU O
C B 0041 SER N 3.120 H B 0036 ILE O
C B 0041 SER N 2.202 C B 0040 LEU O
C B 0042 HIS N 2.197 C B 0041 SER O
C B 0043 PHE N 2.197 C B 0042 HIS O
C B 0044 LEU N 3.149 C B 0042 HIS O
C B 0044 LEU N 2.196 C B 0043 PHE O
C B 0045 GLU N 2.197 C B 0044 LEU O
C B 0046 GLU N 2.195 C B 0045 GLU O
C B 0047 ILE N 2.195 C B 0046 GLU O
C B 0048 LYS N 2.196 C B 0047 ILE O
C B 0049 GLU N 2.196 C B 0048 LYS O
H B 0050 GLN N 2.916 C B 0048 LYS O
H B 0050 GLN N 2.196 C B 0049 GLU O
H B 0051 GLU N 2.745 C B 0049 GLU O
H B 0051 GLU N 2.196 H B 0050 GLN O
H B 0052 VAL N 2.759 C B 0049 GLU O
H B 0052 VAL N 2.197 H B 0051 GLU O
H B 0053 VAL N 3.131 C B 0049 GLU O
H B 0053 VAL N 2.195 H B 0052 VAL O
H B 0054 ASP N 2.909 H B 0050 GLN O
H B 0054 ASP N 2.188 H B 0053 VAL O
H B 0055 LYS N 2.717 H B 0051 GLU O
H B 0055 LYS N 2.197 H B 0054 ASP O
H B 0056 VAL N 3.149 H B 0052 VAL O
H B 0056 VAL N 2.196 H B 0055 LYS O
H B 0057 MET N 2.869 H B 0053 VAL O
H B 0057 MET N 2.196 H B 0056 VAL O
H B 0058 GLU N 2.984 H B 0054 ASP O
H B 0058 GLU N 2.199 H B 0057 MET O
H B 0059 THR N 2.198 H B 0058 GLU O
H B 0060 LEU N 2.949 H B 0056 VAL O
H B 0060 LEU N 3.008 H B 0058 GLU O
H B 0060 LEU N 2.198 H B 0059 THR O
H B 0061 ASP N 3.019 H B 0057 MET O
H B 0061 ASP N 3.132 H B 0058 GLU O
H B 0061 ASP N 2.199 H B 0060 LEU O
H B 0062 GLU N 2.685 H B 0058 GLU O
H B 0062 GLU N 2.196 H B 0061 ASP O
H B 0063 ASP N 2.194 H B 0062 GLU O
C B 0064 GLY N 2.194 H B 0063 ASP O
C B 0065 ASP N 2.529 H B 0063 ASP O
C B 0065 ASP N 2.197 C B 0064 GLY O
C B 0066 GLY N 2.195 C B 0065 ASP O
E B 0067 GLU N 2.199 C B 0066 GLY O
E B 0068 CYS N 2.902 E B 0027 LEU O
E B 0068 CYS N 2.198 E B 0067 GLU O
E B 0069 ASP N 2.199 E B 0068 CYS O
H B 0070 PHE N 2.194 E B 0069 ASP O
H B 0071 GLN N 2.196 H B 0070 PHE O
H B 0072 GLU N 2.200 H B 0071 GLN O
H B 0073 PHE N 2.197 H B 0072 GLU O
H B 0074 MET N 3.140 H B 0070 PHE O
H B 0074 MET N 3.006 H B 0072 GLU O
H B 0074 MET N 2.198 H B 0073 PHE O
H B 0075 ALA N 3.052 H B 0071 GLN O
H B 0075 ALA N 2.196 H B 0074 MET O
H B 0076 PHE N 2.868 H B 0072 GLU O
H B 0076 PHE N 3.156 H B 0074 MET O
H B 0076 PHE N 2.199 H B 0075 ALA O
H B 0077 VAL N 3.144 H B 0073 PHE O
H B 0077 VAL N 2.198 H B 0076 PHE O
H B 0078 SER N 2.193 H B 0077 VAL O
H B 0079 MET N 2.195 H B 0078 SER O
H B 0080 VAL N 2.196 H B 0079 MET O
H B 0081 THR N 2.193 H B 0080 VAL O
H B 0082 THR N 3.116 H B 0078 SER O
H B 0082 THR N 3.185 H B 0079 MET O
H B 0082 THR N 2.920 H B 0080 VAL O
H B 0082 THR N 2.197 H B 0081 THR O
C B 0083 ALA N 2.910 H B 0079 MET O
C B 0083 ALA N 3.051 H B 0080 VAL O
C B 0083 ALA N 2.196 H B 0082 THR O
C B 0084 CYS N 2.198 C B 0083 ALA O
C B 0085 HIS N 3.137 C B 0083 ALA O
C B 0085 HIS N 2.197 C B 0084 CYS O
C B 0086 GLU N 2.197 C B 0085 HIS O
C B 0087 PHE N 2.999 C B 0085 HIS O
C B 0087 PHE N 2.196 C B 0086 GLU O
C B 0088 PHE N 2.197 C B 0087 PHE O
C B 0089 GLU N 2.198 C B 0088 PHE O
C B 0090 HIS N 2.196 C B 0089 GLU O
C B 0091 GLU N 2.198 C B 0090 HIS O
HB_MS 2.00 3.20 12
C B 0000 MET N 2.662 H B 0004 GLU OE1
H B 0002 GLU N 3.111 C B 0001 SER OG
H B 0004 GLU N 3.030 C B 0001 SER OG
C B 0024 LYS O 2.512 C B 0025 HIS ND1
E B 0026 LYS O 2.732 C B 0018 SER OG
H B 0055 LYS O 3.189 H B 0059 THR OG1
C B 0064 GLY N 2.928 H B 0063 ASP OD1
C B 0066 GLY O 2.540 H B 0029 LYS NZ
H B 0074 MET O 2.870 H B 0078 SER OG
H B 0077 VAL O 2.329 H B 0081 THR OG1
H B 0078 SER O 2.547 H B 0082 THR OG1
H B 0079 MET O 2.814 H B 0082 THR OG1
HB_SS 2.00 3.20 3
C B 0023 ASP OD2 2.923 C B 0018 SER OG
C B 0039 GLU OE1 2.410 H B 0017 TYR OH
C B 0039 GLU OE2 2.643 H B 0017 TYR OH
AROMATIC 0.00 8.00 3
E B 0026 LYS 6.608 C B 0025 HIS
C B 0048 LYS 4.541 C B 0085 HIS
H B 0055 LYS 6.286 H B 0076 PHE