Complet list of 1aqa con file
Complete list of 1aqa.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 365
C A 0005 LYS CA 3.796 C A 0006 TYR CA
C A 0005 LYS C 2.427 C A 0006 TYR CA
C A 0005 LYS C 3.235 C A 0006 TYR C
C A 0005 LYS C 3.596 C A 0006 TYR CB
C A 0005 LYS C 3.753 C A 0006 TYR CD1
C A 0006 TYR C 2.484 C A 0007 TYR CA
C A 0006 TYR C 3.585 C A 0007 TYR C
C A 0006 TYR C 3.348 C A 0007 TYR CB
C A 0006 TYR C 3.464 C A 0007 TYR CG
C A 0006 TYR C 3.773 C A 0007 TYR CD2
C A 0006 TYR CB 3.739 C A 0079 LEU C
C A 0007 TYR C 2.457 H A 0008 THR CA
C A 0007 TYR C 3.333 H A 0008 THR C
C A 0007 TYR C 3.592 H A 0008 THR CB
C A 0007 TYR CD1 3.689 E A 0022 TRP CZ3
C A 0007 TYR CE1 3.664 E A 0022 TRP CZ3
C A 0007 TYR CE1 3.679 E A 0022 TRP CH2
C A 0007 TYR CZ 3.718 E A 0022 TRP CH2
H A 0008 THR C 2.456 H A 0009 LEU CA
H A 0008 THR C 2.968 H A 0009 LEU C
H A 0008 THR C 3.722 H A 0009 LEU CB
H A 0009 LEU C 2.452 H A 0010 GLU CA
H A 0009 LEU C 2.976 H A 0010 GLU C
H A 0009 LEU C 3.730 H A 0010 GLU CB
H A 0009 LEU CB 3.708 H A 0083 ASP CG
H A 0010 GLU C 2.452 H A 0011 GLU CA
H A 0010 GLU C 2.991 H A 0011 GLU C
H A 0010 GLU C 3.746 H A 0011 GLU CB
H A 0011 GLU C 2.451 H A 0012 ILE CA
H A 0011 GLU C 2.923 H A 0012 ILE C
H A 0011 GLU C 3.709 H A 0012 ILE CB
H A 0012 ILE C 2.489 H A 0013 GLN CA
H A 0012 ILE C 3.041 H A 0013 GLN C
H A 0012 ILE C 3.754 H A 0013 GLN CB
H A 0012 ILE CD1 3.646 E A 0029 VAL CG1
H A 0012 ILE C 3.467 C A 0051 GLY CA
H A 0012 ILE CG2 3.500 C A 0051 GLY CA
H A 0012 ILE CG2 3.514 C A 0051 GLY C
H A 0012 ILE CD1 3.774 C A 0079 LEU CD1
H A 0013 GLN C 2.438 H A 0014 LYS CA
H A 0013 GLN C 2.948 H A 0014 LYS C
H A 0013 GLN C 3.746 H A 0014 LYS CB
H A 0014 LYS C 2.457 H A 0015 HIS CA
H A 0014 LYS C 3.189 H A 0015 HIS C
H A 0014 LYS C 3.666 H A 0015 HIS CB
H A 0014 LYS C 3.700 H A 0015 HIS CD2
H A 0014 LYS CB 3.690 H A 0015 HIS CD2
H A 0015 HIS C 2.460 C A 0016 LYS CA
H A 0015 HIS C 3.157 C A 0016 LYS C
H A 0015 HIS C 3.697 C A 0016 LYS CB
H A 0015 HIS CE1 3.737 E A 0022 TRP CZ2
H A 0015 HIS CE1 3.625 E A 0022 TRP CH2
C A 0016 LYS CA 3.755 C A 0017 ASP CA
C A 0016 LYS C 2.401 C A 0017 ASP CA
C A 0016 LYS C 3.694 C A 0017 ASP C
C A 0016 LYS C 2.998 C A 0017 ASP CB
C A 0016 LYS C 3.768 C A 0021 THR CA
C A 0016 LYS CA 3.783 C A 0050 ALA CB
C A 0016 LYS C 3.740 C A 0050 ALA CB
C A 0017 ASP C 2.486 C A 0018 SER CA
C A 0017 ASP C 3.145 C A 0018 SER C
C A 0017 ASP C 3.025 C A 0018 SER CB
C A 0017 ASP CB 3.743 H A 0047 ARG CG
C A 0018 SER C 2.469 C A 0019 LYS CA
C A 0018 SER C 3.231 C A 0019 LYS C
C A 0018 SER C 2.922 C A 0019 LYS CB
C A 0019 LYS C 2.489 C A 0020 SER CA
C A 0019 LYS C 3.672 C A 0020 SER C
C A 0019 LYS C 3.223 C A 0020 SER CB
C A 0019 LYS C 3.606 H A 0033 THR CB
C A 0020 SER C 2.459 C A 0021 THR CA
C A 0020 SER C 3.531 C A 0021 THR C
C A 0020 SER C 3.359 C A 0021 THR CB
C A 0021 THR C 2.442 E A 0022 TRP CA
C A 0021 THR C 3.342 E A 0022 TRP C
C A 0021 THR C 3.590 E A 0022 TRP CB
C A 0021 THR C 3.547 E A 0022 TRP CD1
C A 0021 THR CG2 3.516 C A 0032 LEU CD1
C A 0021 THR CB 3.780 H A 0033 THR CA
C A 0021 THR CG2 3.519 H A 0036 LEU CD1
E A 0022 TRP C 2.460 E A 0023 VAL CA
E A 0022 TRP C 3.589 E A 0023 VAL C
E A 0022 TRP C 3.342 E A 0023 VAL CB
E A 0022 TRP C 3.383 E A 0023 VAL CG1
E A 0022 TRP CE3 3.799 E A 0029 VAL CG1
E A 0022 TRP CD1 3.491 E A 0031 ASP CA
E A 0022 TRP CD1 3.376 E A 0031 ASP CB
E A 0022 TRP CD2 3.496 C A 0076 ILE CD1
E A 0022 TRP CE2 3.372 C A 0076 ILE CD1
E A 0022 TRP CE3 3.696 C A 0076 ILE CD1
E A 0022 TRP CZ2 3.478 C A 0076 ILE CD1
E A 0022 TRP CH2 3.692 C A 0076 ILE CD1
E A 0023 VAL C 2.424 E A 0024 ILE CA
E A 0023 VAL C 3.190 E A 0024 ILE C
E A 0023 VAL C 3.670 E A 0024 ILE CB
E A 0023 VAL CG2 3.661 C A 0025 LEU CG
E A 0023 VAL CG1 3.799 C A 0032 LEU CD2
E A 0023 VAL CG2 3.440 C A 0032 LEU CD2
E A 0024 ILE C 2.462 C A 0025 LEU CA
E A 0024 ILE C 3.441 C A 0025 LEU C
E A 0024 ILE C 3.568 C A 0025 LEU CB
E A 0024 ILE C 3.784 C A 0025 LEU CG
E A 0024 ILE C 3.762 C A 0025 LEU CD2
E A 0024 ILE CD1 3.634 C A 0079 LEU CD2
C A 0025 LEU C 2.483 C A 0026 HIS CA
C A 0025 LEU C 3.010 C A 0026 HIS C
C A 0025 LEU C 3.154 C A 0026 HIS CB
C A 0025 LEU CB 3.475 E A 0030 TYR CE2
C A 0025 LEU CD1 3.734 E A 0030 TYR CD2
C A 0025 LEU CD1 3.620 E A 0030 TYR CE2
C A 0025 LEU CD2 3.302 H A 0054 ALA C
C A 0025 LEU CD2 3.410 H A 0054 ALA CB
C A 0025 LEU CD1 3.725 H A 0058 PHE CG
C A 0025 LEU CD1 3.642 H A 0058 PHE CD1
C A 0025 LEU CD1 3.774 H A 0058 PHE CE1
C A 0025 LEU CD2 3.406 H A 0058 PHE CB
C A 0025 LEU CD2 3.699 H A 0058 PHE CG
C A 0026 HIS CA 3.791 C A 0027 HIS CA
C A 0026 HIS C 2.465 C A 0027 HIS CA
C A 0026 HIS C 2.975 C A 0027 HIS C
C A 0026 HIS C 3.162 C A 0027 HIS CB
C A 0026 HIS CA 3.759 H A 0055 THR CG2
C A 0027 HIS C 2.462 C A 0028 LYS CA
C A 0027 HIS C 3.692 C A 0028 LYS C
C A 0027 HIS C 3.098 C A 0028 LYS CB
C A 0027 HIS C 3.706 C A 0028 LYS CG
C A 0028 LYS CA 3.799 E A 0029 VAL CA
C A 0028 LYS C 2.451 E A 0029 VAL CA
C A 0028 LYS C 3.172 E A 0029 VAL C
C A 0028 LYS C 3.692 E A 0029 VAL CB
C A 0028 LYS CE 3.739 C A 0078 GLU CG
E A 0029 VAL CA 3.770 E A 0030 TYR CA
E A 0029 VAL C 2.438 E A 0030 TYR CA
E A 0029 VAL C 3.294 E A 0030 TYR C
E A 0029 VAL C 3.585 E A 0030 TYR CB
E A 0029 VAL C 3.784 E A 0030 TYR CG
E A 0029 VAL C 3.440 E A 0030 TYR CD1
E A 0029 VAL CG1 3.714 C A 0076 ILE CG1
E A 0029 VAL CG1 3.754 C A 0076 ILE CD1
E A 0029 VAL CG2 3.483 C A 0079 LEU CD1
E A 0030 TYR CA 3.703 E A 0031 ASP CA
E A 0030 TYR C 2.397 E A 0031 ASP CA
E A 0030 TYR C 2.988 E A 0031 ASP C
E A 0030 TYR C 3.703 E A 0031 ASP CB
E A 0030 TYR CE2 3.797 H A 0071 SER C
E A 0030 TYR CE2 3.373 H A 0071 SER CB
E A 0030 TYR CZ 3.469 H A 0071 SER C
E A 0030 TYR CZ 3.758 H A 0071 SER CB
E A 0030 TYR CE1 3.679 H A 0075 ILE CG1
E A 0031 ASP CA 3.797 C A 0032 LEU CA
E A 0031 ASP C 2.433 C A 0032 LEU CA
E A 0031 ASP C 3.628 C A 0032 LEU C
E A 0031 ASP C 3.228 C A 0032 LEU CB
C A 0032 LEU C 2.500 H A 0033 THR CA
C A 0032 LEU C 3.187 H A 0033 THR C
C A 0032 LEU C 3.750 H A 0033 THR CB
H A 0033 THR C 2.481 H A 0034 LYS CA
H A 0033 THR C 3.693 H A 0034 LYS C
H A 0033 THR C 3.095 H A 0034 LYS CB
H A 0034 LYS C 2.485 H A 0035 PHE CA
H A 0034 LYS C 3.067 H A 0035 PHE C
H A 0034 LYS C 3.708 H A 0035 PHE CB
H A 0035 PHE C 2.485 H A 0036 LEU CA
H A 0035 PHE C 2.941 H A 0036 LEU C
H A 0035 PHE C 3.696 H A 0036 LEU CB
H A 0035 PHE CD1 3.776 H A 0038 GLU CB
H A 0035 PHE CD1 3.690 H A 0038 GLU CD
H A 0035 PHE CE2 3.571 C A 0039 HIS CB
H A 0035 PHE CE2 3.510 C A 0039 HIS CD2
H A 0035 PHE CZ 3.752 C A 0039 HIS CA
H A 0035 PHE CZ 3.758 C A 0039 HIS CD2
H A 0036 LEU C 2.472 H A 0037 GLU CA
H A 0036 LEU C 3.186 H A 0037 GLU C
H A 0036 LEU C 3.670 H A 0037 GLU CB
H A 0036 LEU CD2 3.687 H A 0043 GLU CA
H A 0036 LEU CD2 3.571 H A 0043 GLU CB
H A 0036 LEU CA 3.617 H A 0046 LEU CD1
H A 0036 LEU CD2 3.773 H A 0046 LEU CB
H A 0037 GLU C 2.490 H A 0038 GLU CA
H A 0037 GLU C 3.409 H A 0038 GLU C
H A 0037 GLU C 3.581 H A 0038 GLU CB
H A 0038 GLU C 2.473 C A 0039 HIS CA
H A 0038 GLU C 2.976 C A 0039 HIS C
H A 0038 GLU C 3.718 C A 0039 HIS CB
C A 0039 HIS CA 3.012 C A 0040 PRO CD
C A 0039 HIS C 2.452 C A 0040 PRO CA
C A 0039 HIS C 3.071 C A 0040 PRO C
C A 0039 HIS C 3.680 C A 0040 PRO CB
C A 0039 HIS C 3.679 C A 0040 PRO CG
C A 0039 HIS C 2.513 C A 0040 PRO CD
C A 0039 HIS CG 3.618 C A 0040 PRO CD
C A 0039 HIS CD2 3.597 C A 0040 PRO CD
C A 0039 HIS CE1 3.594 H A 0045 VAL CG2
C A 0040 PRO CA 3.792 C A 0041 GLY CA
C A 0040 PRO C 2.428 C A 0041 GLY CA
C A 0040 PRO C 3.319 C A 0041 GLY C
C A 0041 GLY C 2.467 H A 0042 GLY CA
C A 0041 GLY C 3.065 H A 0042 GLY C
H A 0042 GLY CA 3.776 H A 0043 GLU CA
H A 0042 GLY C 2.446 H A 0043 GLU CA
H A 0042 GLY C 3.116 H A 0043 GLU C
H A 0042 GLY C 3.736 H A 0043 GLU CB
H A 0043 GLU C 2.503 H A 0044 GLU CA
H A 0043 GLU C 2.949 H A 0044 GLU C
H A 0043 GLU C 3.697 H A 0044 GLU CB
H A 0044 GLU C 2.464 H A 0045 VAL CA
H A 0044 GLU C 3.052 H A 0045 VAL C
H A 0044 GLU C 3.735 H A 0045 VAL CB
H A 0045 VAL C 2.447 H A 0046 LEU CA
H A 0045 VAL C 3.022 H A 0046 LEU C
H A 0045 VAL C 3.731 H A 0046 LEU CB
H A 0046 LEU CA 3.788 H A 0047 ARG CA
H A 0046 LEU C 2.459 H A 0047 ARG CA
H A 0046 LEU C 2.956 H A 0047 ARG C
H A 0046 LEU C 3.709 H A 0047 ARG CB
H A 0047 ARG C 2.445 H A 0048 GLU CA
H A 0047 ARG C 3.095 H A 0048 GLU C
H A 0047 ARG C 3.715 H A 0048 GLU CB
H A 0048 GLU C 2.447 C A 0049 GLN CA
H A 0048 GLU C 3.444 C A 0049 GLN C
H A 0048 GLU C 3.524 C A 0049 GLN CB
C A 0049 GLN C 2.439 C A 0050 ALA CA
C A 0049 GLN C 3.151 C A 0050 ALA C
C A 0049 GLN C 3.652 C A 0050 ALA CB
C A 0049 GLN CG 3.539 H A 0054 ALA CA
C A 0049 GLN CG 3.425 H A 0054 ALA CB
C A 0050 ALA CA 3.788 C A 0051 GLY CA
C A 0050 ALA C 2.453 C A 0051 GLY CA
C A 0050 ALA C 2.926 C A 0051 GLY C
C A 0051 GLY C 2.457 C A 0052 GLY CA
C A 0051 GLY C 3.660 C A 0052 GLY C
C A 0052 GLY C 2.504 C A 0053 ASP CA
C A 0052 GLY C 3.211 C A 0053 ASP C
C A 0052 GLY C 3.707 C A 0053 ASP CB
C A 0053 ASP CA 3.777 H A 0054 ALA CA
C A 0053 ASP C 2.438 H A 0054 ALA CA
C A 0053 ASP C 3.103 H A 0054 ALA C
C A 0053 ASP C 3.686 H A 0054 ALA CB
H A 0054 ALA C 2.524 H A 0055 THR CA
H A 0054 ALA C 2.885 H A 0055 THR C
H A 0054 ALA C 3.661 H A 0055 THR CB
H A 0055 THR CA 3.783 H A 0056 GLU CA
H A 0055 THR C 2.454 H A 0056 GLU CA
H A 0055 THR C 3.146 H A 0056 GLU C
H A 0055 THR C 3.655 H A 0056 GLU CB
H A 0055 THR CB 3.731 C A 0087 ILE CG2
H A 0056 GLU C 2.462 H A 0057 ASN CA
H A 0056 GLU C 3.093 H A 0057 ASN C
H A 0056 GLU C 3.750 H A 0057 ASN CB
H A 0057 ASN C 2.467 H A 0058 PHE CA
H A 0057 ASN C 3.140 H A 0058 PHE C
H A 0057 ASN C 3.692 H A 0058 PHE CB
H A 0058 PHE CA 3.788 H A 0059 GLU CA
H A 0058 PHE C 2.393 H A 0059 GLU CA
H A 0058 PHE C 3.142 H A 0059 GLU C
H A 0058 PHE C 3.651 H A 0059 GLU CB
H A 0058 PHE CD2 3.642 H A 0059 GLU CB
H A 0058 PHE CD1 3.629 C A 0063 HIS CE1
H A 0059 GLU C 2.460 H A 0060 ASP CA
H A 0059 GLU C 3.197 H A 0060 ASP C
H A 0059 GLU C 3.689 H A 0060 ASP CB
H A 0060 ASP C 2.442 C A 0061 VAL CA
H A 0060 ASP C 3.173 C A 0061 VAL C
H A 0060 ASP C 3.684 C A 0061 VAL CB
C A 0061 VAL C 2.454 C A 0062 GLY CA
C A 0061 VAL C 3.124 C A 0062 GLY C
C A 0061 VAL CG1 3.680 C A 0063 HIS CG
C A 0061 VAL CG1 3.460 C A 0063 HIS CE1
C A 0062 GLY C 2.434 C A 0063 HIS CA
C A 0062 GLY C 3.019 C A 0063 HIS C
C A 0062 GLY C 3.738 C A 0063 HIS CB
C A 0063 HIS C 2.438 H A 0064 SER CA
C A 0063 HIS C 3.036 H A 0064 SER C
C A 0063 HIS C 3.702 H A 0064 SER CB
C A 0063 HIS CG 3.783 H A 0067 ALA CB
C A 0063 HIS CD2 3.369 H A 0067 ALA CB
H A 0064 SER C 2.472 H A 0065 THR CA
H A 0064 SER C 2.967 H A 0065 THR C
H A 0064 SER C 3.694 H A 0065 THR CB
H A 0065 THR C 2.498 H A 0066 ASP CA
H A 0065 THR C 2.989 H A 0066 ASP C
H A 0065 THR C 3.725 H A 0066 ASP CB
H A 0066 ASP C 2.476 H A 0067 ALA CA
H A 0066 ASP C 3.095 H A 0067 ALA C
H A 0066 ASP C 3.720 H A 0067 ALA CB
H A 0067 ALA C 2.453 H A 0068 ARG CA
H A 0067 ALA C 3.200 H A 0068 ARG C
H A 0067 ALA C 3.676 H A 0068 ARG CB
H A 0067 ALA C 3.640 H A 0070 LEU CD1
H A 0068 ARG C 2.419 H A 0069 GLU CA
H A 0068 ARG C 3.036 H A 0069 GLU C
H A 0068 ARG C 3.732 H A 0069 GLU CB
H A 0068 ARG C 3.765 H A 0071 SER CB
H A 0069 GLU C 2.430 H A 0070 LEU CA
H A 0069 GLU C 2.978 H A 0070 LEU C
H A 0069 GLU C 3.746 H A 0070 LEU CB
H A 0070 LEU C 2.444 H A 0071 SER CA
H A 0070 LEU C 2.982 H A 0071 SER C
H A 0070 LEU C 3.728 H A 0071 SER CB
H A 0070 LEU CD1 3.740 H A 0071 SER CA
H A 0070 LEU CD2 3.498 H A 0074 TYR CE2
H A 0070 LEU CD2 3.665 H A 0074 TYR CZ
H A 0071 SER C 2.465 H A 0072 LYS CA
H A 0071 SER C 3.263 H A 0072 LYS C
H A 0071 SER C 3.703 H A 0072 LYS CB
H A 0072 LYS C 2.454 H A 0073 THR CA
H A 0072 LYS C 3.237 H A 0073 THR C
H A 0072 LYS C 3.676 H A 0073 THR CB
H A 0073 THR C 2.458 H A 0074 TYR CA
H A 0073 THR C 3.205 H A 0074 TYR C
H A 0073 THR C 3.698 H A 0074 TYR CB
H A 0073 THR CG2 3.791 H A 0074 TYR CG
H A 0073 THR CG2 3.482 H A 0074 TYR CD1
H A 0073 THR CG2 3.653 H A 0074 TYR CE1
H A 0074 TYR C 2.499 H A 0075 ILE CA
H A 0074 TYR C 3.088 H A 0075 ILE C
H A 0074 TYR C 3.190 H A 0075 ILE CB
H A 0074 TYR C 3.774 H A 0075 ILE CG1
H A 0075 ILE CA 3.796 C A 0076 ILE CA
H A 0075 ILE C 2.438 C A 0076 ILE CA
H A 0075 ILE C 3.272 C A 0076 ILE C
H A 0075 ILE C 3.645 C A 0076 ILE CB
C A 0076 ILE C 2.438 C A 0077 GLY CA
C A 0076 ILE C 3.762 C A 0077 GLY C
C A 0077 GLY C 2.504 C A 0078 GLU CA
C A 0077 GLY C 3.426 C A 0078 GLU C
C A 0077 GLY C 3.618 C A 0078 GLU CB
C A 0078 GLU C 2.519 C A 0079 LEU CA
C A 0078 GLU C 3.742 C A 0079 LEU C
C A 0078 GLU C 3.068 C A 0079 LEU CB
C A 0079 LEU C 2.455 C A 0080 HIS CA
C A 0079 LEU C 3.010 C A 0080 HIS C
C A 0079 LEU C 3.714 C A 0080 HIS CB
C A 0079 LEU CD2 3.623 H A 0083 ASP CB
C A 0079 LEU CD2 3.754 C A 0087 ILE CD1
C A 0080 HIS CA 2.964 C A 0081 PRO CD
C A 0080 HIS C 2.465 C A 0081 PRO CA
C A 0080 HIS C 3.174 C A 0081 PRO C
C A 0080 HIS C 3.649 C A 0081 PRO CB
C A 0080 HIS C 3.693 C A 0081 PRO CG
C A 0080 HIS C 2.499 C A 0081 PRO CD
C A 0080 HIS CG 3.531 C A 0081 PRO CD
C A 0081 PRO C 2.500 H A 0082 ASP CA
C A 0081 PRO C 3.640 H A 0082 ASP C
C A 0081 PRO C 3.340 H A 0082 ASP CB
H A 0082 ASP C 2.471 H A 0083 ASP CA
H A 0082 ASP C 2.990 H A 0083 ASP C
H A 0082 ASP C 3.740 H A 0083 ASP CB
H A 0083 ASP C 2.496 H A 0084 ARG CA
H A 0083 ASP C 3.056 H A 0084 ARG C
H A 0083 ASP C 3.699 H A 0084 ARG CB
H A 0083 ASP CA 3.657 H A 0086 LYS CG
H A 0083 ASP C 3.774 C A 0087 ILE CD1
H A 0084 ARG C 2.454 H A 0085 SER CA
H A 0084 ARG C 3.487 H A 0085 SER C
H A 0084 ARG C 3.534 H A 0085 SER CB
H A 0085 SER C 2.466 H A 0086 LYS CA
H A 0085 SER C 3.205 H A 0086 LYS C
H A 0085 SER C 3.696 H A 0086 LYS CB
H A 0086 LYS C 2.469 C A 0087 ILE CA
H A 0086 LYS C 2.992 C A 0087 ILE C
H A 0086 LYS C 3.769 C A 0087 ILE CB
C A 0087 ILE C 2.474 C A 0088 ALA CA
C A 0087 ILE C 3.725 C A 0088 ALA C
C A 0087 ILE C 3.027 C A 0088 ALA CB
CHARGE_ATTR 2.00 12.00 151
H A 0010 GLU OE1 4.753 H A 0014 LYS NZ
H A 0010 GLU OE2 2.605 H A 0014 LYS NZ
H A 0010 GLU OE1 11.11 H A 0015 HIS ND1
H A 0010 GLU OE1 10.23 H A 0015 HIS NE2
H A 0010 GLU OE2 9.750 H A 0015 HIS ND1
H A 0010 GLU OE2 8.556 H A 0015 HIS NE2
H A 0010 GLU OE1 11.13 C A 0080 HIS ND1
H A 0010 GLU OE1 10.98 C A 0080 HIS NE2
H A 0011 GLU OE1 3.927 H A 0014 LYS NZ
H A 0011 GLU OE2 2.601 H A 0014 LYS NZ
H A 0011 GLU OE1 6.982 H A 0015 HIS ND1
H A 0011 GLU OE1 6.189 H A 0015 HIS NE2
H A 0011 GLU OE2 5.954 H A 0015 HIS ND1
H A 0011 GLU OE2 4.624 H A 0015 HIS NE2
H A 0011 GLU OE1 11.79 C A 0080 HIS ND1
H A 0011 GLU OE1 11.46 C A 0080 HIS NE2
C A 0017 ASP OD1 10.55 H A 0015 HIS ND1
C A 0017 ASP OD1 10.48 H A 0015 HIS NE2
C A 0017 ASP OD1 6.995 C A 0016 LYS NZ
C A 0017 ASP OD2 8.603 C A 0016 LYS NZ
C A 0017 ASP OD1 5.891 H A 0047 ARG NH1
C A 0017 ASP OD1 4.073 H A 0047 ARG NH2
C A 0017 ASP OD2 4.402 H A 0047 ARG NH1
C A 0017 ASP OD2 2.609 H A 0047 ARG NH2
E A 0031 ASP OD1 9.132 H A 0015 HIS ND1
E A 0031 ASP OD1 10.74 H A 0015 HIS NE2
E A 0031 ASP OD2 9.288 H A 0015 HIS ND1
E A 0031 ASP OD2 11.03 H A 0015 HIS NE2
E A 0031 ASP OD1 7.892 C A 0019 LYS NZ
E A 0031 ASP OD2 9.183 C A 0019 LYS NZ
E A 0031 ASP OD1 10.18 H A 0034 LYS NZ
H A 0037 GLU OE1 2.564 H A 0034 LYS NZ
H A 0037 GLU OE2 4.649 H A 0034 LYS NZ
H A 0038 GLU OE1 5.781 H A 0034 LYS NZ
H A 0038 GLU OE2 7.960 H A 0034 LYS NZ
H A 0038 GLU OE1 10.44 C A 0039 HIS ND1
H A 0038 GLU OE1 10.79 C A 0039 HIS NE2
H A 0038 GLU OE2 9.641 C A 0039 HIS ND1
H A 0038 GLU OE2 9.586 C A 0039 HIS NE2
H A 0038 GLU OE2 11.96 C A 0063 HIS NE2
H A 0043 GLU OE1 10.85 H A 0034 LYS NZ
H A 0043 GLU OE2 11.98 H A 0034 LYS NZ
H A 0043 GLU OE1 10.48 C A 0039 HIS ND1
H A 0043 GLU OE2 10.97 C A 0039 HIS ND1
H A 0043 GLU OE1 6.147 H A 0047 ARG NH1
H A 0043 GLU OE1 6.574 H A 0047 ARG NH2
H A 0043 GLU OE2 6.435 H A 0047 ARG NH1
H A 0043 GLU OE2 7.347 H A 0047 ARG NH2
H A 0044 GLU OE1 9.327 C A 0039 HIS ND1
H A 0044 GLU OE1 11.13 C A 0039 HIS NE2
H A 0044 GLU OE2 10.75 C A 0039 HIS ND1
H A 0044 GLU OE1 9.393 H A 0047 ARG NH1
H A 0044 GLU OE1 11.52 H A 0047 ARG NH2
H A 0044 GLU OE2 8.345 H A 0047 ARG NH1
H A 0044 GLU OE2 10.47 H A 0047 ARG NH2
H A 0048 GLU OE1 11.14 C A 0016 LYS NZ
H A 0048 GLU OE1 11.34 C A 0039 HIS ND1
H A 0048 GLU OE2 9.561 C A 0039 HIS ND1
H A 0048 GLU OE2 10.36 C A 0039 HIS NE2
H A 0048 GLU OE1 9.053 H A 0047 ARG NH1
H A 0048 GLU OE1 10.88 H A 0047 ARG NH2
H A 0048 GLU OE2 10.36 H A 0047 ARG NH1
H A 0048 GLU OE2 11.60 C A 0063 HIS ND1
H A 0048 GLU OE2 11.28 C A 0063 HIS NE2
C A 0053 ASP OD1 10.50 C A 0016 LYS NZ
C A 0053 ASP OD1 11.22 C A 0027 HIS ND1
C A 0053 ASP OD1 10.15 C A 0027 HIS NE2
C A 0053 ASP OD2 10.14 C A 0027 HIS ND1
C A 0053 ASP OD2 9.011 C A 0027 HIS NE2
C A 0053 ASP OD1 11.41 H A 0086 LYS NZ
C A 0053 ASP OD2 10.66 H A 0086 LYS NZ
H A 0056 GLU OE1 10.33 C A 0026 HIS ND1
H A 0056 GLU OE1 12.00 C A 0026 HIS NE2
H A 0056 GLU OE2 9.140 C A 0026 HIS ND1
H A 0056 GLU OE2 10.57 C A 0026 HIS NE2
H A 0056 GLU OE1 10.37 C A 0027 HIS ND1
H A 0056 GLU OE1 10.08 C A 0027 HIS NE2
H A 0056 GLU OE2 8.299 C A 0027 HIS ND1
H A 0056 GLU OE2 7.939 C A 0027 HIS NE2
H A 0056 GLU OE2 11.68 H A 0068 ARG NH2
H A 0059 GLU OE1 3.722 C A 0026 HIS ND1
H A 0059 GLU OE1 5.483 C A 0026 HIS NE2
H A 0059 GLU OE2 2.673 C A 0026 HIS ND1
H A 0059 GLU OE2 4.694 C A 0026 HIS NE2
H A 0059 GLU OE1 9.841 C A 0027 HIS ND1
H A 0059 GLU OE1 11.55 C A 0027 HIS NE2
H A 0059 GLU OE2 8.216 C A 0027 HIS ND1
H A 0059 GLU OE2 9.820 C A 0027 HIS NE2
H A 0059 GLU OE1 11.86 C A 0028 LYS NZ
H A 0059 GLU OE2 11.73 C A 0028 LYS NZ
H A 0059 GLU OE1 7.813 C A 0063 HIS ND1
H A 0059 GLU OE1 9.853 C A 0063 HIS NE2
H A 0059 GLU OE2 9.144 C A 0063 HIS ND1
H A 0059 GLU OE2 11.26 C A 0063 HIS NE2
H A 0059 GLU OE1 4.378 H A 0068 ARG NH1
H A 0059 GLU OE1 2.613 H A 0068 ARG NH2
H A 0059 GLU OE2 5.766 H A 0068 ARG NH1
H A 0059 GLU OE2 3.510 H A 0068 ARG NH2
H A 0060 ASP OD1 11.21 C A 0026 HIS ND1
H A 0060 ASP OD1 9.663 C A 0063 HIS ND1
H A 0060 ASP OD1 11.56 C A 0063 HIS NE2
H A 0060 ASP OD2 9.696 C A 0063 HIS ND1
H A 0060 ASP OD2 11.40 C A 0063 HIS NE2
H A 0060 ASP OD1 10.59 H A 0068 ARG NH2
H A 0066 ASP OD1 11.99 C A 0039 HIS NE2
H A 0066 ASP OD1 9.865 C A 0063 HIS ND1
H A 0066 ASP OD1 9.703 C A 0063 HIS NE2
H A 0066 ASP OD2 11.51 C A 0063 HIS ND1
H A 0066 ASP OD2 11.07 C A 0063 HIS NE2
H A 0066 ASP OD1 11.44 H A 0068 ARG NH1
H A 0066 ASP OD2 11.70 H A 0072 LYS NZ
H A 0069 GLU OE1 10.68 H A 0068 ARG NH1
H A 0069 GLU OE2 10.54 H A 0068 ARG NH1
H A 0069 GLU OE1 4.796 H A 0072 LYS NZ
H A 0069 GLU OE2 2.562 H A 0072 LYS NZ
C A 0078 GLU OE1 11.24 C A 0026 HIS NE2
C A 0078 GLU OE2 10.99 C A 0026 HIS ND1
C A 0078 GLU OE2 9.798 C A 0026 HIS NE2
C A 0078 GLU OE1 8.798 C A 0027 HIS ND1
C A 0078 GLU OE1 9.354 C A 0027 HIS NE2
C A 0078 GLU OE2 8.614 C A 0027 HIS ND1
C A 0078 GLU OE2 9.659 C A 0027 HIS NE2
C A 0078 GLU OE1 4.703 C A 0028 LYS NZ
C A 0078 GLU OE2 2.550 C A 0028 LYS NZ
C A 0078 GLU OE1 11.27 C A 0080 HIS ND1
C A 0078 GLU OE1 11.97 C A 0080 HIS NE2
C A 0078 GLU OE1 9.260 H A 0084 ARG NH1
C A 0078 GLU OE1 7.777 H A 0084 ARG NH2
C A 0078 GLU OE2 10.09 H A 0084 ARG NH1
C A 0078 GLU OE2 8.339 H A 0084 ARG NH2
H A 0082 ASP OD1 10.18 C A 0027 HIS NE2
H A 0082 ASP OD2 11.38 C A 0027 HIS NE2
H A 0082 ASP OD1 5.431 C A 0080 HIS ND1
H A 0082 ASP OD1 7.214 C A 0080 HIS NE2
H A 0082 ASP OD2 5.478 C A 0080 HIS ND1
H A 0082 ASP OD2 6.867 C A 0080 HIS NE2
H A 0082 ASP OD1 10.95 H A 0084 ARG NH1
H A 0082 ASP OD2 10.79 H A 0084 ARG NH1
H A 0082 ASP OD1 4.180 H A 0086 LYS NZ
H A 0082 ASP OD2 5.773 H A 0086 LYS NZ
H A 0083 ASP OD2 11.67 H A 0014 LYS NZ
H A 0083 ASP OD1 11.14 C A 0027 HIS ND1
H A 0083 ASP OD1 9.075 C A 0027 HIS NE2
H A 0083 ASP OD2 11.17 C A 0027 HIS ND1
H A 0083 ASP OD2 9.307 C A 0027 HIS NE2
H A 0083 ASP OD1 5.991 C A 0080 HIS ND1
H A 0083 ASP OD1 7.868 C A 0080 HIS NE2
H A 0083 ASP OD2 5.155 C A 0080 HIS ND1
H A 0083 ASP OD2 6.805 C A 0080 HIS NE2
H A 0083 ASP OD1 5.215 H A 0086 LYS NZ
H A 0083 ASP OD2 7.366 H A 0086 LYS NZ
CHARGE_REPU 2.00 12.00 120
H A 0010 GLU OE1 5.467 H A 0011 GLU OE1
H A 0010 GLU OE1 6.067 H A 0011 GLU OE2
H A 0010 GLU OE2 4.598 H A 0011 GLU OE1
H A 0010 GLU OE2 4.446 H A 0011 GLU OE2
H A 0010 GLU OE1 9.919 H A 0083 ASP OD1
H A 0010 GLU OE1 9.110 H A 0083 ASP OD2
H A 0010 GLU OE2 11.35 H A 0083 ASP OD1
H A 0010 GLU OE2 10.39 H A 0083 ASP OD2
H A 0011 GLU OE1 11.49 H A 0083 ASP OD1
H A 0011 GLU OE1 9.782 H A 0083 ASP OD2
H A 0011 GLU OE2 11.06 H A 0083 ASP OD2
H A 0014 LYS NZ 7.932 H A 0015 HIS ND1
H A 0014 LYS NZ 6.384 H A 0015 HIS NE2
H A 0015 HIS ND1 10.26 C A 0019 LYS NZ
H A 0015 HIS NE2 10.28 C A 0019 LYS NZ
C A 0016 LYS NZ 9.255 H A 0047 ARG NH1
C A 0016 LYS NZ 8.634 H A 0047 ARG NH2
C A 0017 ASP OD1 8.087 H A 0043 GLU OE1
C A 0017 ASP OD1 9.704 H A 0043 GLU OE2
C A 0017 ASP OD2 6.142 H A 0043 GLU OE1
C A 0017 ASP OD2 7.615 H A 0043 GLU OE2
C A 0017 ASP OD2 11.71 H A 0044 GLU OE2
C A 0017 ASP OD2 11.76 H A 0048 GLU OE1
C A 0019 LYS NZ 10.51 H A 0034 LYS NZ
C A 0026 HIS ND1 6.399 C A 0027 HIS ND1
C A 0026 HIS ND1 8.332 C A 0027 HIS NE2
C A 0026 HIS NE2 6.183 C A 0027 HIS ND1
C A 0026 HIS NE2 8.340 C A 0027 HIS NE2
C A 0026 HIS ND1 9.220 C A 0028 LYS NZ
C A 0026 HIS NE2 8.064 C A 0028 LYS NZ
C A 0026 HIS ND1 11.03 C A 0063 HIS ND1
C A 0026 HIS ND1 5.587 H A 0068 ARG NH1
C A 0026 HIS ND1 3.635 H A 0068 ARG NH2
C A 0026 HIS NE2 5.716 H A 0068 ARG NH1
C A 0026 HIS NE2 4.335 H A 0068 ARG NH2
C A 0026 HIS ND1 11.78 H A 0084 ARG NH2
C A 0026 HIS NE2 11.42 H A 0084 ARG NH1
C A 0026 HIS NE2 10.32 H A 0084 ARG NH2
C A 0027 HIS ND1 8.385 C A 0028 LYS NZ
C A 0027 HIS NE2 9.870 C A 0028 LYS NZ
C A 0027 HIS ND1 11.70 H A 0068 ARG NH1
C A 0027 HIS ND1 9.968 H A 0068 ARG NH2
C A 0027 HIS NE2 11.95 H A 0068 ARG NH2
C A 0027 HIS NE2 10.81 C A 0080 HIS ND1
C A 0027 HIS ND1 7.163 H A 0084 ARG NH1
C A 0027 HIS ND1 7.019 H A 0084 ARG NH2
C A 0027 HIS NE2 6.840 H A 0084 ARG NH1
C A 0027 HIS NE2 7.330 H A 0084 ARG NH2
C A 0027 HIS NE2 11.55 H A 0086 LYS NZ
C A 0028 LYS NZ 11.36 H A 0068 ARG NH1
C A 0028 LYS NZ 11.15 H A 0068 ARG NH2
C A 0028 LYS NZ 11.69 H A 0072 LYS NZ
C A 0028 LYS NZ 11.26 H A 0084 ARG NH1
C A 0028 LYS NZ 9.460 H A 0084 ARG NH2
E A 0031 ASP OD1 10.36 H A 0038 GLU OE1
E A 0031 ASP OD1 11.16 H A 0038 GLU OE2
E A 0031 ASP OD2 11.65 H A 0038 GLU OE1
H A 0037 GLU OE1 7.051 H A 0038 GLU OE1
H A 0037 GLU OE1 9.040 H A 0038 GLU OE2
H A 0037 GLU OE2 8.560 H A 0038 GLU OE1
H A 0037 GLU OE2 10.40 H A 0038 GLU OE2
H A 0037 GLU OE1 9.476 H A 0043 GLU OE1
H A 0037 GLU OE1 10.23 H A 0043 GLU OE2
H A 0037 GLU OE2 9.770 H A 0043 GLU OE1
H A 0037 GLU OE2 10.05 H A 0043 GLU OE2
C A 0039 HIS ND1 8.101 C A 0063 HIS ND1
C A 0039 HIS ND1 6.114 C A 0063 HIS NE2
C A 0039 HIS NE2 6.118 C A 0063 HIS ND1
C A 0039 HIS NE2 4.015 C A 0063 HIS NE2
H A 0043 GLU OE1 8.756 H A 0044 GLU OE1
H A 0043 GLU OE1 7.868 H A 0044 GLU OE2
H A 0043 GLU OE2 7.671 H A 0044 GLU OE1
H A 0043 GLU OE2 6.383 H A 0044 GLU OE2
H A 0043 GLU OE1 11.28 H A 0048 GLU OE1
H A 0043 GLU OE1 11.44 H A 0048 GLU OE2
H A 0043 GLU OE2 11.39 H A 0048 GLU OE1
H A 0043 GLU OE2 11.63 H A 0048 GLU OE2
H A 0044 GLU OE1 7.005 H A 0048 GLU OE1
H A 0044 GLU OE1 6.838 H A 0048 GLU OE2
H A 0044 GLU OE2 8.199 H A 0048 GLU OE1
H A 0044 GLU OE2 8.477 H A 0048 GLU OE2
H A 0048 GLU OE1 11.69 C A 0053 ASP OD1
H A 0048 GLU OE2 11.55 C A 0053 ASP OD1
C A 0053 ASP OD1 6.527 H A 0056 GLU OE1
C A 0053 ASP OD1 6.623 H A 0056 GLU OE2
C A 0053 ASP OD2 5.013 H A 0056 GLU OE1
C A 0053 ASP OD2 4.800 H A 0056 GLU OE2
C A 0053 ASP OD2 11.66 H A 0059 GLU OE2
C A 0053 ASP OD2 11.97 H A 0060 ASP OD2
C A 0053 ASP OD1 10.26 H A 0083 ASP OD1
C A 0053 ASP OD1 11.11 H A 0083 ASP OD2
C A 0053 ASP OD2 10.09 H A 0083 ASP OD1
C A 0053 ASP OD2 11.21 H A 0083 ASP OD2
H A 0056 GLU OE1 10.67 H A 0059 GLU OE1
H A 0056 GLU OE1 8.947 H A 0059 GLU OE2
H A 0056 GLU OE2 10.23 H A 0059 GLU OE1
H A 0056 GLU OE2 8.282 H A 0059 GLU OE2
H A 0056 GLU OE1 8.444 H A 0060 ASP OD1
H A 0056 GLU OE1 7.645 H A 0060 ASP OD2
H A 0056 GLU OE2 9.732 H A 0060 ASP OD1
H A 0056 GLU OE2 9.325 H A 0060 ASP OD2
H A 0059 GLU OE1 9.055 H A 0060 ASP OD1
H A 0059 GLU OE1 10.21 H A 0060 ASP OD2
H A 0059 GLU OE2 8.613 H A 0060 ASP OD1
H A 0059 GLU OE2 9.675 H A 0060 ASP OD2
C A 0063 HIS ND1 10.68 H A 0068 ARG NH1
C A 0063 HIS ND1 10.05 H A 0068 ARG NH2
H A 0066 ASP OD1 8.295 H A 0069 GLU OE1
H A 0066 ASP OD1 9.964 H A 0069 GLU OE2
H A 0066 ASP OD2 7.592 H A 0069 GLU OE1
H A 0066 ASP OD2 9.405 H A 0069 GLU OE2
H A 0068 ARG NH1 10.84 H A 0072 LYS NZ
C A 0080 HIS ND1 10.70 H A 0084 ARG NH1
C A 0080 HIS ND1 11.74 H A 0084 ARG NH2
C A 0080 HIS ND1 9.261 H A 0086 LYS NZ
C A 0080 HIS NE2 10.98 H A 0086 LYS NZ
H A 0082 ASP OD1 4.230 H A 0083 ASP OD1
H A 0082 ASP OD1 5.649 H A 0083 ASP OD2
H A 0082 ASP OD2 6.308 H A 0083 ASP OD1
H A 0082 ASP OD2 7.379 H A 0083 ASP OD2
HB_MM 2.00 3.20 149
C A 0006 TYR N 2.235 C A 0005 LYS O
C A 0007 TYR N 2.255 C A 0006 TYR O
H A 0008 THR N 2.255 C A 0007 TYR O
H A 0009 LEU N 2.257 H A 0008 THR O
H A 0010 GLU N 3.000 H A 0008 THR O
H A 0010 GLU N 2.248 H A 0009 LEU O
H A 0011 GLU N 3.070 H A 0008 THR O
H A 0011 GLU N 2.253 H A 0010 GLU O
H A 0012 ILE N 3.114 H A 0008 THR O
H A 0012 ILE N 2.256 H A 0011 GLU O
H A 0013 GLN N 2.782 H A 0009 LEU O
H A 0013 GLN N 2.245 H A 0012 ILE O
H A 0014 LYS N 3.026 H A 0010 GLU O
H A 0014 LYS N 2.250 H A 0013 GLN O
H A 0015 HIS N 3.109 H A 0011 GLU O
H A 0015 HIS N 2.806 H A 0012 ILE O
H A 0015 HIS N 2.249 H A 0014 LYS O
C A 0016 LYS N 2.802 H A 0014 LYS O
C A 0016 LYS N 2.259 H A 0015 HIS O
C A 0017 ASP N 2.246 C A 0016 LYS O
C A 0017 ASP N 3.132 C A 0020 SER O
C A 0018 SER N 2.260 C A 0017 ASP O
C A 0019 LYS N 2.253 C A 0018 SER O
C A 0020 SER N 3.006 C A 0018 SER O
C A 0020 SER N 2.246 C A 0019 LYS O
C A 0021 THR N 2.256 C A 0020 SER O
E A 0022 TRP N 2.857 H A 0015 HIS O
E A 0022 TRP N 2.247 C A 0021 THR O
E A 0023 VAL N 2.246 E A 0022 TRP O
E A 0023 VAL N 3.007 E A 0030 TYR O
E A 0024 ILE N 2.256 E A 0023 VAL O
E A 0024 ILE N 3.021 C A 0052 GLY O
C A 0025 LEU N 2.254 E A 0024 ILE O
C A 0025 LEU N 2.779 C A 0028 LYS O
C A 0026 HIS N 2.255 C A 0025 LEU O
C A 0027 HIS N 2.265 C A 0026 HIS O
C A 0028 LYS N 2.252 C A 0027 HIS O
E A 0029 VAL N 2.252 C A 0028 LYS O
E A 0029 VAL N 2.771 C A 0077 GLY O
E A 0030 TYR N 2.262 E A 0029 VAL O
E A 0031 ASP N 2.264 E A 0030 TYR O
C A 0032 LEU N 2.793 C A 0021 THR O
C A 0032 LEU N 2.247 E A 0031 ASP O
H A 0033 THR N 2.260 C A 0032 LEU O
H A 0034 LYS N 2.728 C A 0032 LEU O
H A 0034 LYS N 2.238 H A 0033 THR O
H A 0035 PHE N 2.267 H A 0034 LYS O
H A 0036 LEU N 3.033 H A 0034 LYS O
H A 0036 LEU N 2.251 H A 0035 PHE O
H A 0037 GLU N 2.918 H A 0034 LYS O
H A 0037 GLU N 3.081 H A 0035 PHE O
H A 0037 GLU N 2.250 H A 0036 LEU O
H A 0038 GLU N 2.742 H A 0035 PHE O
H A 0038 GLU N 2.248 H A 0037 GLU O
C A 0039 HIS N 2.873 H A 0035 PHE O
C A 0039 HIS N 2.252 H A 0038 GLU O
C A 0040 PRO N 2.242 C A 0039 HIS O
C A 0041 GLY N 3.143 C A 0039 HIS O
C A 0041 GLY N 2.244 C A 0040 PRO O
H A 0042 GLY N 2.793 C A 0039 HIS O
H A 0042 GLY N 2.248 C A 0041 GLY O
H A 0043 GLU N 2.267 H A 0042 GLY O
H A 0044 GLU N 2.261 H A 0043 GLU O
H A 0045 VAL N 3.030 H A 0043 GLU O
H A 0045 VAL N 2.258 H A 0044 GLU O
H A 0046 LEU N 2.745 H A 0043 GLU O
H A 0046 LEU N 2.241 H A 0045 VAL O
H A 0047 ARG N 2.803 H A 0043 GLU O
H A 0047 ARG N 3.119 H A 0044 GLU O
H A 0047 ARG N 2.258 H A 0046 LEU O
H A 0048 GLU N 2.853 H A 0044 GLU O
H A 0048 GLU N 2.249 H A 0047 ARG O
C A 0049 GLN N 2.898 H A 0046 LEU O
C A 0049 GLN N 3.073 H A 0047 ARG O
C A 0049 GLN N 2.257 H A 0048 GLU O
C A 0050 ALA N 2.930 H A 0046 LEU O
C A 0050 ALA N 2.959 H A 0047 ARG O
C A 0050 ALA N 2.248 C A 0049 GLN O
C A 0051 GLY N 2.790 E A 0022 TRP O
C A 0051 GLY N 2.249 C A 0050 ALA O
C A 0052 GLY N 2.256 C A 0051 GLY O
C A 0053 ASP N 2.265 C A 0052 GLY O
H A 0054 ALA N 2.837 C A 0052 GLY O
H A 0054 ALA N 2.244 C A 0053 ASP O
H A 0055 THR N 2.737 E A 0024 ILE O
H A 0055 THR N 3.095 C A 0053 ASP O
H A 0055 THR N 2.268 H A 0054 ALA O
H A 0056 GLU N 2.814 H A 0054 ALA O
H A 0056 GLU N 2.254 H A 0055 THR O
H A 0057 ASN N 3.058 H A 0054 ALA O
H A 0057 ASN N 2.250 H A 0056 GLU O
H A 0058 PHE N 2.711 H A 0054 ALA O
H A 0058 PHE N 2.973 H A 0056 GLU O
H A 0058 PHE N 2.236 H A 0057 ASN O
H A 0059 GLU N 3.010 H A 0055 THR O
H A 0059 GLU N 3.012 H A 0056 GLU O
H A 0059 GLU N 2.240 H A 0058 PHE O
H A 0060 ASP N 2.823 H A 0056 GLU O
H A 0060 ASP N 2.248 H A 0059 GLU O
C A 0061 VAL N 3.115 H A 0058 PHE O
C A 0061 VAL N 2.229 H A 0060 ASP O
C A 0062 GLY N 2.966 H A 0060 ASP O
C A 0062 GLY N 2.242 C A 0061 VAL O
C A 0063 HIS N 2.251 C A 0062 GLY O
H A 0064 SER N 2.246 C A 0063 HIS O
H A 0065 THR N 2.250 H A 0064 SER O
H A 0066 ASP N 2.940 H A 0064 SER O
H A 0066 ASP N 2.246 H A 0065 THR O
H A 0067 ALA N 2.813 H A 0064 SER O
H A 0067 ALA N 2.259 H A 0066 ASP O
H A 0068 ARG N 2.802 H A 0065 THR O
H A 0068 ARG N 2.241 H A 0067 ALA O
H A 0069 GLU N 2.749 H A 0065 THR O
H A 0069 GLU N 3.029 H A 0066 ASP O
H A 0069 GLU N 2.236 H A 0068 ARG O
H A 0070 LEU N 3.177 H A 0066 ASP O
H A 0070 LEU N 2.246 H A 0069 GLU O
H A 0071 SER N 2.895 H A 0068 ARG O
H A 0071 SER N 3.058 H A 0069 GLU O
H A 0071 SER N 2.243 H A 0070 LEU O
H A 0072 LYS N 3.185 H A 0070 LEU O
H A 0072 LYS N 2.252 H A 0071 SER O
H A 0073 THR N 2.821 H A 0070 LEU O
H A 0073 THR N 3.158 H A 0071 SER O
H A 0073 THR N 2.242 H A 0072 LYS O
H A 0074 TYR N 2.251 H A 0073 THR O
H A 0075 ILE N 2.256 H A 0074 TYR O
C A 0076 ILE N 2.849 E A 0029 VAL O
C A 0076 ILE N 2.246 H A 0075 ILE O
C A 0077 GLY N 2.246 C A 0076 ILE O
C A 0078 GLU N 2.732 C A 0005 LYS O
C A 0078 GLU N 2.263 C A 0077 GLY O
C A 0079 LEU N 2.267 C A 0078 GLU O
C A 0080 HIS N 2.776 C A 0007 TYR O
C A 0080 HIS N 2.254 C A 0079 LEU O
C A 0081 PRO N 2.250 C A 0080 HIS O
H A 0082 ASP N 2.751 C A 0080 HIS O
H A 0082 ASP N 2.251 C A 0081 PRO O
H A 0083 ASP N 2.266 H A 0082 ASP O
H A 0084 ARG N 2.991 H A 0082 ASP O
H A 0084 ARG N 2.248 H A 0083 ASP O
H A 0085 SER N 2.830 H A 0082 ASP O
H A 0085 SER N 2.884 H A 0083 ASP O
H A 0085 SER N 2.244 H A 0084 ARG O
H A 0086 LYS N 2.775 H A 0083 ASP O
H A 0086 LYS N 2.246 H A 0085 SER O
C A 0087 ILE N 2.261 H A 0086 LYS O
C A 0088 ALA N 2.893 H A 0086 LYS O
C A 0088 ALA N 2.253 C A 0087 ILE O
HB_MS 2.00 3.20 10
H A 0009 LEU N 2.703 H A 0083 ASP OD2
C A 0019 LYS O 2.786 C A 0020 SER OG
C A 0019 LYS N 3.191 H A 0033 THR OG1
E A 0024 ILE O 2.703 H A 0055 THR OG1
C A 0026 HIS N 2.753 H A 0055 THR OG1
H A 0058 PHE O 2.760 C A 0063 HIS ND1
H A 0068 ARG O 2.677 H A 0071 SER OG
H A 0072 LYS N 3.134 H A 0071 SER OG
H A 0084 ARG O 3.086 C A 0027 HIS NE2
C A 0088 ALA N 3.160 H A 0056 GLU OE2
HB_SS 2.00 3.20 1
H A 0057 ASN ND2 2.793 C A 0049 GLN OE1
AROMATIC 0.00 8.00 2
H A 0015 HIS 4.276 E A 0022 TRP
H A 0068 ARG 4.158 C A 0026 HIS