Complet list of 1qqi con file
Complete list of 1qqi.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 436
C A 0001 MET C 2.447 C A 0002 ALA CA
C A 0001 MET C 3.701 C A 0002 ALA C
C A 0001 MET C 3.083 C A 0002 ALA CB
C A 0001 MET CE 3.452 E A 0008 GLU CD
C A 0001 MET CE 3.767 E A 0013 SER CB
C A 0002 ALA C 2.445 C A 0003 VAL CA
C A 0002 ALA C 3.683 C A 0003 VAL C
C A 0002 ALA C 3.145 C A 0003 VAL CB
C A 0002 ALA C 3.672 C A 0003 VAL CG1
C A 0003 VAL C 2.461 C A 0004 GLU CA
C A 0003 VAL C 2.942 C A 0004 GLU C
C A 0003 VAL C 3.130 C A 0004 GLU CB
C A 0003 VAL C 3.727 C A 0004 GLU CG
C A 0003 VAL CG1 3.506 C A 0006 VAL CG2
C A 0003 VAL CG1 3.644 E A 0015 ASP CG
C A 0003 VAL CG2 3.735 C A 0017 THR CB
C A 0004 GLU C 2.455 C A 0005 GLU CA
C A 0004 GLU C 3.454 C A 0005 GLU C
C A 0004 GLU C 3.525 C A 0005 GLU CB
C A 0004 GLU CD 3.491 C A 0017 THR CG2
C A 0005 GLU C 2.449 C A 0006 VAL CA
C A 0005 GLU C 3.183 C A 0006 VAL C
C A 0005 GLU C 3.685 C A 0006 VAL CB
C A 0006 VAL C 2.435 E A 0007 ILE CA
C A 0006 VAL C 3.178 E A 0007 ILE C
C A 0006 VAL C 3.662 E A 0007 ILE CB
E A 0007 ILE C 2.443 E A 0008 GLU CA
E A 0007 ILE C 3.290 E A 0008 GLU C
E A 0007 ILE C 3.619 E A 0008 GLU CB
E A 0007 ILE CG2 3.683 E A 0009 MET CG
E A 0007 ILE CD1 3.779 E A 0014 LEU CD2
E A 0007 ILE CD1 3.683 H A 0039 HIS CD2
E A 0008 GLU C 2.452 E A 0009 MET CA
E A 0008 GLU C 3.530 E A 0009 MET C
E A 0008 GLU C 3.440 E A 0009 MET CB
E A 0008 GLU C 3.512 E A 0009 MET CG
E A 0009 MET C 2.461 C A 0010 GLN CA
E A 0009 MET C 3.027 C A 0010 GLN C
E A 0009 MET C 3.016 C A 0010 GLN CB
C A 0010 GLN C 2.450 C A 0011 GLY CA
C A 0010 GLN C 3.221 C A 0011 GLY C
C A 0011 GLY C 2.442 E A 0012 LEU CA
C A 0011 GLY C 3.144 E A 0012 LEU C
C A 0011 GLY C 3.669 E A 0012 LEU CB
E A 0012 LEU C 2.445 E A 0013 SER CA
E A 0012 LEU C 3.198 E A 0013 SER C
E A 0012 LEU C 3.661 E A 0013 SER CB
E A 0012 LEU CG 3.748 E A 0021 VAL CG1
E A 0012 LEU CD1 3.552 E A 0021 VAL CG1
E A 0012 LEU CD1 3.742 E A 0023 ALA CA
E A 0012 LEU CD2 3.658 H A 0042 MET CE
E A 0012 LEU CD2 3.698 H A 0081 LEU CD2
E A 0013 SER C 2.449 E A 0014 LEU CA
E A 0013 SER C 3.325 E A 0014 LEU C
E A 0013 SER C 3.601 E A 0014 LEU CB
E A 0014 LEU C 2.463 E A 0015 ASP CA
E A 0014 LEU C 3.486 E A 0015 ASP C
E A 0014 LEU C 3.493 E A 0015 ASP CB
E A 0014 LEU CG 3.691 H A 0035 PHE CE1
E A 0014 LEU CG 3.556 H A 0035 PHE CZ
E A 0014 LEU CD1 3.725 H A 0035 PHE CE1
E A 0014 LEU CD1 3.793 H A 0035 PHE CZ
E A 0014 LEU CD2 3.611 H A 0035 PHE CZ
E A 0014 LEU CD2 3.727 H A 0039 HIS CD2
E A 0015 ASP CA 2.868 C A 0016 PRO CD
E A 0015 ASP C 2.455 C A 0016 PRO CA
E A 0015 ASP C 3.077 C A 0016 PRO C
E A 0015 ASP C 3.676 C A 0016 PRO CB
E A 0015 ASP C 3.671 C A 0016 PRO CG
E A 0015 ASP C 2.465 C A 0016 PRO CD
C A 0016 PRO C 2.441 C A 0017 THR CA
C A 0016 PRO C 3.083 C A 0017 THR C
C A 0016 PRO C 3.703 C A 0017 THR CB
C A 0017 THR C 2.448 C A 0018 SER CA
C A 0017 THR C 3.321 C A 0018 SER C
C A 0017 THR C 3.627 C A 0018 SER CB
C A 0018 SER C 2.458 C A 0019 HIS CA
C A 0018 SER C 2.893 C A 0019 HIS C
C A 0018 SER C 3.124 C A 0019 HIS CB
C A 0019 HIS C 2.452 E A 0020 ARG CA
C A 0019 HIS C 3.533 E A 0020 ARG C
C A 0019 HIS C 3.408 E A 0020 ARG CB
C A 0019 HIS CA 3.553 H A 0035 PHE CE1
C A 0019 HIS CA 3.540 H A 0035 PHE CZ
C A 0019 HIS C 3.773 H A 0035 PHE CD1
C A 0019 HIS C 3.431 H A 0035 PHE CE1
C A 0019 HIS CE1 3.746 H A 0035 PHE CD2
E A 0020 ARG C 2.452 E A 0021 VAL CA
E A 0020 ARG C 3.551 E A 0021 VAL C
E A 0020 ARG C 3.402 E A 0021 VAL CB
E A 0020 ARG C 3.306 E A 0021 VAL CG2
E A 0021 VAL C 2.448 E A 0022 MET CA
E A 0021 VAL C 3.553 E A 0022 MET C
E A 0021 VAL C 3.411 E A 0022 MET CB
E A 0021 VAL C 3.434 E A 0022 MET CG
E A 0021 VAL CG2 3.539 C A 0030 MET CE
E A 0021 VAL CG2 3.641 H A 0035 PHE CD1
E A 0021 VAL CG2 3.537 H A 0035 PHE CE1
E A 0022 MET C 2.445 E A 0023 ALA CA
E A 0022 MET C 3.119 E A 0023 ALA C
E A 0022 MET C 3.692 E A 0023 ALA CB
E A 0023 ALA C 2.443 C A 0024 GLY CA
E A 0023 ALA C 3.171 C A 0024 GLY C
E A 0023 ALA CB 3.574 E A 0028 LEU CD1
C A 0024 GLY C 2.450 C A 0025 GLU CA
C A 0024 GLY C 3.682 C A 0025 GLU C
C A 0024 GLY C 3.181 C A 0025 GLU CB
C A 0025 GLU C 2.455 E A 0026 GLU CA
C A 0025 GLU C 3.023 E A 0026 GLU C
C A 0025 GLU C 3.719 E A 0026 GLU CB
E A 0026 GLU CA 2.898 E A 0027 PRO CD
E A 0026 GLU C 2.459 E A 0027 PRO CA
E A 0026 GLU C 3.088 E A 0027 PRO C
E A 0026 GLU C 3.676 E A 0027 PRO CB
E A 0026 GLU C 3.695 E A 0027 PRO CG
E A 0026 GLU C 2.478 E A 0027 PRO CD
E A 0027 PRO C 2.455 E A 0028 LEU CA
E A 0027 PRO C 3.527 E A 0028 LEU C
E A 0027 PRO C 3.451 E A 0028 LEU CB
E A 0027 PRO C 3.462 E A 0028 LEU CG
E A 0028 LEU C 2.452 C A 0029 GLU CA
E A 0028 LEU C 3.286 C A 0029 GLU C
E A 0028 LEU C 3.640 C A 0029 GLU CB
C A 0029 GLU C 2.458 C A 0030 MET CA
C A 0029 GLU C 3.711 C A 0030 MET C
C A 0029 GLU C 3.085 C A 0030 MET CB
C A 0029 GLU C 3.455 C A 0030 MET CG
C A 0030 MET C 2.445 H A 0031 GLY CA
C A 0030 MET C 3.094 H A 0031 GLY C
H A 0031 GLY CA 2.842 H A 0032 PRO CD
H A 0031 GLY C 2.457 H A 0032 PRO CA
H A 0031 GLY C 3.028 H A 0032 PRO C
H A 0031 GLY C 3.681 H A 0032 PRO CB
H A 0031 GLY C 3.681 H A 0032 PRO CG
H A 0031 GLY C 2.462 H A 0032 PRO CD
H A 0031 GLY CA 3.567 H A 0034 GLU CD
H A 0032 PRO C 2.445 H A 0033 THR CA
H A 0032 PRO C 2.998 H A 0033 THR C
H A 0032 PRO C 3.704 H A 0033 THR CB
H A 0033 THR C 2.443 H A 0034 GLU CA
H A 0033 THR C 2.985 H A 0034 GLU C
H A 0033 THR C 3.721 H A 0034 GLU CB
H A 0033 THR CG2 3.508 C A 0059 TRP CE2
H A 0033 THR CG2 3.365 C A 0059 TRP CZ2
H A 0033 THR CB 3.574 H A 0073 HIS CE1
H A 0033 THR CG2 3.638 H A 0073 HIS CG
H A 0034 GLU C 2.432 H A 0035 PHE CA
H A 0034 GLU C 2.990 H A 0035 PHE C
H A 0034 GLU C 3.713 H A 0035 PHE CB
H A 0034 GLU CG 3.555 H A 0076 ARG CB
H A 0035 PHE C 2.442 H A 0036 LYS CA
H A 0035 PHE C 2.989 H A 0036 LYS C
H A 0035 PHE C 3.717 H A 0036 LYS CB
H A 0036 LYS C 2.456 H A 0037 LEU CA
H A 0036 LYS C 2.903 H A 0037 LEU C
H A 0036 LYS C 3.725 H A 0037 LEU CB
H A 0036 LYS C 3.746 H A 0058 VAL CG2
H A 0036 LYS CB 3.218 H A 0058 VAL CG1
H A 0037 LEU C 2.450 H A 0038 LEU CA
H A 0037 LEU C 3.023 H A 0038 LEU C
H A 0037 LEU C 3.714 H A 0038 LEU CB
H A 0037 LEU C 3.498 H A 0041 PHE CD2
H A 0037 LEU CD2 3.653 C A 0059 TRP CZ3
H A 0038 LEU C 2.440 H A 0039 HIS CA
H A 0038 LEU C 2.976 H A 0039 HIS C
H A 0038 LEU C 3.705 H A 0039 HIS CB
H A 0038 LEU CD1 3.587 E A 0100 PHE CE1
H A 0038 LEU CD1 3.776 E A 0100 PHE CZ
H A 0039 HIS C 2.443 H A 0040 PHE CA
H A 0039 HIS C 3.006 H A 0040 PHE C
H A 0039 HIS C 3.707 H A 0040 PHE CB
H A 0040 PHE C 2.438 H A 0041 PHE CA
H A 0040 PHE C 3.010 H A 0041 PHE C
H A 0040 PHE C 3.711 H A 0041 PHE CB
H A 0040 PHE CD1 3.489 H A 0044 HIS CE1
H A 0040 PHE CE1 3.304 H A 0044 HIS CE1
H A 0040 PHE CE2 3.758 E A 0049 TYR CD1
H A 0040 PHE CE2 3.792 E A 0049 TYR CD2
H A 0040 PHE CE2 3.599 E A 0049 TYR CE1
H A 0040 PHE CE2 3.635 E A 0049 TYR CE2
H A 0040 PHE CE2 3.530 E A 0049 TYR CZ
H A 0040 PHE CZ 3.464 E A 0049 TYR CE1
H A 0040 PHE CZ 3.394 E A 0049 TYR CZ
H A 0040 PHE CD2 3.585 H A 0054 LEU CD2
H A 0040 PHE CE2 3.769 H A 0054 LEU CD2
H A 0040 PHE CZ 3.721 H A 0057 HIS CG
H A 0040 PHE CZ 3.378 H A 0057 HIS CD2
H A 0041 PHE C 2.445 H A 0042 MET CA
H A 0041 PHE C 3.076 H A 0042 MET C
H A 0041 PHE C 3.708 H A 0042 MET CB
H A 0041 PHE CB 3.621 E A 0100 PHE CB
H A 0041 PHE CB 3.563 E A 0100 PHE CG
H A 0041 PHE CB 3.740 E A 0100 PHE CD1
H A 0042 MET C 2.445 H A 0043 THR CA
H A 0042 MET C 3.103 H A 0043 THR C
H A 0042 MET C 3.711 H A 0043 THR CB
H A 0042 MET CG 3.763 E A 0100 PHE CE2
H A 0043 THR C 2.451 H A 0044 HIS CA
H A 0043 THR C 3.617 H A 0044 HIS C
H A 0043 THR C 3.318 H A 0044 HIS CB
H A 0043 THR C 3.207 H A 0044 HIS CG
H A 0043 THR CB 3.636 H A 0044 HIS CE1
H A 0043 THR C 3.540 C A 0045 PRO CD
H A 0044 HIS CA 2.868 C A 0045 PRO CD
H A 0044 HIS C 2.459 C A 0045 PRO CA
H A 0044 HIS C 3.136 C A 0045 PRO C
H A 0044 HIS C 3.664 C A 0045 PRO CB
H A 0044 HIS C 3.680 C A 0045 PRO CG
H A 0044 HIS C 2.469 C A 0045 PRO CD
H A 0044 HIS CB 3.534 E A 0049 TYR CE2
C A 0045 PRO C 2.469 C A 0046 GLU CA
C A 0045 PRO C 2.916 C A 0046 GLU C
C A 0045 PRO C 3.191 C A 0046 GLU CB
C A 0046 GLU C 2.437 C A 0047 ARG CA
C A 0046 GLU C 3.642 C A 0047 ARG C
C A 0046 GLU C 3.196 C A 0047 ARG CB
C A 0046 GLU CG 3.791 C A 0104 PHE CD1
C A 0047 ARG C 2.436 C A 0048 VAL CA
C A 0047 ARG C 3.058 C A 0048 VAL C
C A 0047 ARG C 3.709 C A 0048 VAL CB
C A 0047 ARG CG 3.691 E A 0049 TYR CE2
C A 0047 ARG CD 3.525 E A 0049 TYR CZ
C A 0047 ARG CZ 3.765 E A 0049 TYR CZ
C A 0048 VAL C 2.450 E A 0049 TYR CA
C A 0048 VAL C 3.519 E A 0049 TYR C
C A 0048 VAL C 3.444 E A 0049 TYR CB
C A 0048 VAL C 3.726 E A 0049 TYR CG
E A 0049 TYR CA 3.796 E A 0050 SER CA
E A 0049 TYR C 2.434 E A 0050 SER CA
E A 0049 TYR C 3.170 E A 0050 SER C
E A 0049 TYR C 3.662 E A 0050 SER CB
E A 0049 TYR CD1 3.791 H A 0053 GLN CB
E A 0050 SER C 2.433 H A 0051 ARG CA
E A 0050 SER C 2.930 H A 0051 ARG C
E A 0050 SER C 3.702 H A 0051 ARG CB
H A 0051 ARG C 2.453 H A 0052 GLU CA
H A 0051 ARG C 2.973 H A 0052 GLU C
H A 0051 ARG C 3.711 H A 0052 GLU CB
H A 0051 ARG CB 3.799 H A 0067 ASP CG
H A 0051 ARG CD 3.752 H A 0067 ASP CB
H A 0051 ARG CD 3.590 H A 0067 ASP CG
H A 0051 ARG CZ 3.614 H A 0071 ASP CG
H A 0051 ARG CG 3.648 E A 0098 TYR CE1
H A 0052 GLU C 2.439 H A 0053 GLN CA
H A 0052 GLU C 3.007 H A 0053 GLN C
H A 0052 GLU C 3.717 H A 0053 GLN CB
H A 0053 GLN CA 3.800 H A 0054 LEU CA
H A 0053 GLN C 2.434 H A 0054 LEU CA
H A 0053 GLN C 2.944 H A 0054 LEU C
H A 0053 GLN C 3.712 H A 0054 LEU CB
H A 0053 GLN C 3.767 H A 0057 HIS CD2
H A 0054 LEU C 2.455 H A 0055 LEU CA
H A 0054 LEU C 3.002 H A 0055 LEU C
H A 0054 LEU C 3.727 H A 0055 LEU CB
H A 0054 LEU C 3.706 C A 0059 TRP CE3
H A 0054 LEU CD1 3.378 E A 0098 TYR CD1
H A 0054 LEU CD1 3.794 E A 0098 TYR CE1
H A 0055 LEU C 2.456 H A 0056 ASN CA
H A 0055 LEU C 3.182 H A 0056 ASN C
H A 0055 LEU C 3.697 H A 0056 ASN CB
H A 0055 LEU CA 3.775 C A 0059 TRP CE3
H A 0055 LEU CD2 3.729 C A 0059 TRP CG
H A 0055 LEU CD2 3.627 C A 0059 TRP CD2
H A 0055 LEU CD2 3.499 C A 0065 VAL CG2
H A 0055 LEU CG 3.465 H A 0070 VAL CG2
H A 0055 LEU CD2 3.483 H A 0070 VAL CG2
H A 0056 ASN C 2.448 H A 0057 HIS CA
H A 0056 ASN C 3.486 H A 0057 HIS C
H A 0056 ASN C 3.497 H A 0057 HIS CB
H A 0056 ASN C 3.732 H A 0057 HIS CG
H A 0057 HIS C 2.441 H A 0058 VAL CA
H A 0057 HIS C 3.048 H A 0058 VAL C
H A 0057 HIS C 3.690 H A 0058 VAL CB
H A 0058 VAL C 2.442 C A 0059 TRP CA
H A 0058 VAL C 3.118 C A 0059 TRP C
H A 0058 VAL C 3.703 C A 0059 TRP CB
H A 0058 VAL CB 3.561 C A 0059 TRP CE3
H A 0058 VAL CG1 3.655 C A 0059 TRP CE3
C A 0059 TRP C 2.455 C A 0060 GLY CA
C A 0059 TRP C 2.991 C A 0060 GLY C
C A 0059 TRP CZ2 3.794 H A 0073 HIS CG
C A 0059 TRP CZ2 3.628 H A 0073 HIS CD2
C A 0060 GLY C 2.473 C A 0061 THR CA
C A 0060 GLY C 2.920 C A 0061 THR C
C A 0060 GLY C 3.205 C A 0061 THR CB
C A 0061 THR C 2.448 C A 0062 ASN CA
C A 0061 THR C 3.030 C A 0062 ASN C
C A 0061 THR C 3.713 C A 0062 ASN CB
C A 0062 ASN C 2.456 C A 0063 VAL CA
C A 0062 ASN C 3.585 C A 0063 VAL C
C A 0062 ASN C 3.369 C A 0063 VAL CB
C A 0062 ASN C 3.537 C A 0063 VAL CG1
C A 0062 ASN C 3.705 C A 0063 VAL CG2
C A 0063 VAL C 2.445 C A 0064 TYR CA
C A 0063 VAL C 3.148 C A 0064 TYR C
C A 0063 VAL C 3.686 C A 0064 TYR CB
C A 0063 VAL CG2 3.631 C A 0065 VAL CG1
C A 0064 TYR C 2.444 C A 0065 VAL CA
C A 0064 TYR C 3.177 C A 0065 VAL C
C A 0064 TYR C 3.689 C A 0065 VAL CB
C A 0065 VAL C 2.441 H A 0066 GLU CA
C A 0065 VAL C 3.108 H A 0066 GLU C
C A 0065 VAL C 3.699 H A 0066 GLU CB
H A 0066 GLU C 2.448 H A 0067 ASP CA
H A 0066 GLU C 2.962 H A 0067 ASP C
H A 0066 GLU C 3.719 H A 0067 ASP CB
H A 0066 GLU CD 3.682 H A 0068 ARG CZ
H A 0067 ASP C 2.460 H A 0068 ARG CA
H A 0067 ASP C 2.991 H A 0068 ARG C
H A 0067 ASP C 3.706 H A 0068 ARG CB
H A 0068 ARG C 2.446 H A 0069 THR CA
H A 0068 ARG C 2.975 H A 0069 THR C
H A 0068 ARG C 3.708 H A 0069 THR CB
H A 0069 THR C 2.431 H A 0070 VAL CA
H A 0069 THR C 2.977 H A 0070 VAL C
H A 0069 THR C 3.717 H A 0070 VAL CB
H A 0069 THR CG2 3.744 H A 0073 HIS CD2
H A 0070 VAL C 2.449 H A 0071 ASP CA
H A 0070 VAL C 2.995 H A 0071 ASP C
H A 0070 VAL C 3.723 H A 0071 ASP CB
H A 0070 VAL CG1 3.618 E A 0098 TYR CE1
H A 0071 ASP C 2.449 H A 0072 VAL CA
H A 0071 ASP C 2.999 H A 0072 VAL C
H A 0071 ASP C 3.727 H A 0072 VAL CB
H A 0072 VAL C 2.442 H A 0073 HIS CA
H A 0072 VAL C 3.054 H A 0073 HIS C
H A 0072 VAL C 3.707 H A 0073 HIS CB
H A 0073 HIS C 2.439 H A 0074 ILE CA
H A 0073 HIS C 2.978 H A 0074 ILE C
H A 0073 HIS C 3.725 H A 0074 ILE CB
H A 0074 ILE C 2.444 H A 0075 ARG CA
H A 0074 ILE C 2.999 H A 0075 ARG C
H A 0074 ILE C 3.718 H A 0075 ARG CB
H A 0075 ARG C 2.449 H A 0076 ARG CA
H A 0075 ARG C 2.995 H A 0076 ARG C
H A 0075 ARG C 3.726 H A 0076 ARG CB
H A 0076 ARG C 2.451 H A 0077 LEU CA
H A 0076 ARG C 2.978 H A 0077 LEU C
H A 0076 ARG C 3.722 H A 0077 LEU CB
H A 0077 LEU C 2.437 H A 0078 ARG CA
H A 0077 LEU C 2.970 H A 0078 ARG C
H A 0077 LEU C 3.716 H A 0078 ARG CB
H A 0077 LEU CD1 3.800 H A 0081 LEU CD1
H A 0078 ARG C 2.431 H A 0079 LYS CA
H A 0078 ARG C 2.991 H A 0079 LYS C
H A 0078 ARG C 3.717 H A 0079 LYS CB
H A 0079 LYS C 2.442 H A 0080 ALA CA
H A 0079 LYS C 3.045 H A 0080 ALA C
H A 0079 LYS C 3.711 H A 0080 ALA CB
H A 0079 LYS C 3.772 H A 0082 GLU CB
H A 0080 ALA C 2.459 H A 0081 LEU CA
H A 0080 ALA C 3.340 H A 0081 LEU C
H A 0080 ALA C 3.628 H A 0081 LEU CB
H A 0080 ALA C 3.779 C A 0083 PRO CD
H A 0081 LEU C 2.460 H A 0082 GLU CA
H A 0081 LEU C 3.058 H A 0082 GLU C
H A 0081 LEU C 3.725 H A 0082 GLU CB
H A 0081 LEU C 3.347 C A 0083 PRO CD
H A 0081 LEU CB 3.773 H A 0086 HIS C
H A 0081 LEU CB 3.662 H A 0087 ASP CA
H A 0082 GLU CA 2.984 C A 0083 PRO CD
H A 0082 GLU C 2.461 C A 0083 PRO CA
H A 0082 GLU C 2.997 C A 0083 PRO C
H A 0082 GLU C 3.697 C A 0083 PRO CB
H A 0082 GLU C 3.711 C A 0083 PRO CG
H A 0082 GLU C 2.503 C A 0083 PRO CD
H A 0082 GLU CB 3.427 C A 0083 PRO CD
C A 0083 PRO C 2.444 C A 0084 GLY CA
C A 0083 PRO C 3.158 C A 0084 GLY C
C A 0084 GLY C 2.451 H A 0085 GLY CA
C A 0084 GLY C 3.087 H A 0085 GLY C
H A 0085 GLY C 2.453 H A 0086 HIS CA
H A 0085 GLY C 3.218 H A 0086 HIS C
H A 0085 GLY C 3.673 H A 0086 HIS CB
H A 0086 HIS C 2.454 H A 0087 ASP CA
H A 0086 HIS C 2.978 H A 0087 ASP C
H A 0086 HIS C 3.712 H A 0087 ASP CB
H A 0087 ASP C 2.458 H A 0088 ARG CA
H A 0087 ASP C 3.015 H A 0088 ARG C
H A 0087 ASP C 3.721 H A 0088 ARG CB
H A 0088 ARG C 2.447 C A 0089 MET CA
H A 0088 ARG C 2.975 C A 0089 MET C
H A 0088 ARG C 3.721 C A 0089 MET CB
C A 0089 MET C 2.445 E A 0090 VAL CA
C A 0089 MET C 3.120 E A 0090 VAL C
C A 0089 MET C 3.697 E A 0090 VAL CB
C A 0089 MET CE 3.456 E A 0100 PHE CZ
E A 0090 VAL C 2.436 E A 0091 GLN CA
E A 0090 VAL C 3.144 E A 0091 GLN C
E A 0090 VAL C 3.675 E A 0091 GLN CB
E A 0091 GLN C 2.443 E A 0092 THR CA
E A 0091 GLN C 3.266 E A 0092 THR C
E A 0091 GLN C 3.628 E A 0092 THR CB
E A 0091 GLN CD 3.567 C A 0101 SER CB
E A 0092 THR C 2.443 E A 0093 VAL CA
E A 0092 THR C 3.124 E A 0093 VAL C
E A 0092 THR C 3.700 E A 0093 VAL CB
E A 0093 VAL C 2.456 C A 0094 ARG CA
E A 0093 VAL C 2.912 C A 0094 ARG C
E A 0093 VAL C 3.104 C A 0094 ARG CB
E A 0093 VAL C 3.566 C A 0094 ARG CG
E A 0093 VAL CB 3.781 E A 0097 GLY C
C A 0094 ARG C 2.444 C A 0095 GLY CA
C A 0094 ARG C 3.356 C A 0095 GLY C
C A 0095 GLY C 2.453 C A 0096 THR CA
C A 0095 GLY C 3.267 C A 0096 THR C
C A 0095 GLY C 3.651 C A 0096 THR CB
C A 0096 THR C 2.430 E A 0097 GLY CA
C A 0096 THR C 3.712 E A 0097 GLY C
E A 0097 GLY CA 3.744 E A 0098 TYR CD1
E A 0097 GLY C 2.454 E A 0098 TYR CA
E A 0097 GLY C 3.625 E A 0098 TYR C
E A 0097 GLY C 3.287 E A 0098 TYR CB
E A 0097 GLY C 3.090 E A 0098 TYR CG
E A 0097 GLY C 3.191 E A 0098 TYR CD1
E A 0097 GLY C 3.696 E A 0098 TYR CD2
E A 0098 TYR C 2.446 E A 0099 ARG CA
E A 0098 TYR C 3.708 E A 0099 ARG C
E A 0098 TYR C 3.088 E A 0099 ARG CB
E A 0099 ARG C 2.457 E A 0100 PHE CA
E A 0099 ARG C 3.357 E A 0100 PHE C
E A 0099 ARG C 3.587 E A 0100 PHE CB
E A 0100 PHE C 2.444 C A 0101 SER CA
E A 0100 PHE C 3.283 C A 0101 SER C
E A 0100 PHE C 3.622 C A 0101 SER CB
E A 0100 PHE CD2 3.665 C A 0102 THR CG2
E A 0100 PHE CE2 3.525 C A 0102 THR CG2
C A 0101 SER C 2.435 C A 0102 THR CA
C A 0101 SER C 3.086 C A 0102 THR C
C A 0101 SER C 3.689 C A 0102 THR CB
C A 0102 THR C 2.448 C A 0103 ARG CA
C A 0102 THR C 3.700 C A 0103 ARG C
C A 0102 THR C 3.062 C A 0103 ARG CB
C A 0103 ARG C 2.458 C A 0104 PHE CA
C A 0103 ARG C 3.035 C A 0104 PHE C
C A 0103 ARG C 2.997 C A 0104 PHE CB
CHARGE_ATTR 2.00 12.00 135
C A 0004 GLU OE1 10.99 C A 0019 HIS ND1
C A 0004 GLU OE1 9.254 C A 0019 HIS NE2
C A 0004 GLU OE2 11.96 C A 0019 HIS ND1
C A 0004 GLU OE2 10.22 C A 0019 HIS NE2
C A 0004 GLU OE1 10.11 E A 0020 ARG NH2
C A 0004 GLU OE2 10.11 E A 0020 ARG NH2
C A 0004 GLU OE1 9.832 H A 0039 HIS ND1
C A 0004 GLU OE1 9.118 H A 0039 HIS NE2
C A 0004 GLU OE2 11.79 H A 0039 HIS ND1
C A 0004 GLU OE2 11.25 H A 0039 HIS NE2
C A 0005 GLU OE1 10.20 H A 0039 HIS ND1
C A 0005 GLU OE1 8.131 H A 0039 HIS NE2
C A 0005 GLU OE2 8.721 H A 0039 HIS ND1
C A 0005 GLU OE2 6.524 H A 0039 HIS NE2
C A 0005 GLU OE2 11.35 H A 0044 HIS ND1
C A 0005 GLU OE2 11.99 H A 0044 HIS NE2
E A 0008 GLU OE1 11.86 E A 0020 ARG NH2
E A 0008 GLU OE2 10.97 E A 0020 ARG NH2
E A 0008 GLU OE1 11.07 H A 0086 HIS NE2
E A 0015 ASP OD1 8.833 C A 0019 HIS ND1
E A 0015 ASP OD1 8.302 C A 0019 HIS NE2
E A 0015 ASP OD2 9.216 C A 0019 HIS ND1
E A 0015 ASP OD2 9.057 C A 0019 HIS NE2
E A 0015 ASP OD1 7.052 E A 0020 ARG NH1
E A 0015 ASP OD1 4.879 E A 0020 ARG NH2
E A 0015 ASP OD2 4.862 E A 0020 ARG NH1
E A 0015 ASP OD2 2.755 E A 0020 ARG NH2
E A 0015 ASP OD1 9.217 H A 0039 HIS ND1
E A 0015 ASP OD1 8.774 H A 0039 HIS NE2
E A 0015 ASP OD2 10.85 H A 0039 HIS ND1
E A 0015 ASP OD2 10.64 H A 0039 HIS NE2
C A 0025 GLU OE2 11.84 E A 0020 ARG NH1
E A 0026 GLU OE1 7.780 H A 0086 HIS ND1
E A 0026 GLU OE1 8.355 H A 0086 HIS NE2
E A 0026 GLU OE2 9.959 H A 0086 HIS ND1
E A 0026 GLU OE2 10.58 H A 0086 HIS NE2
E A 0026 GLU OE1 11.90 H A 0088 ARG NH1
C A 0029 GLU OE1 11.53 C A 0019 HIS ND1
C A 0029 GLU OE1 10.28 E A 0020 ARG NH1
C A 0029 GLU OE1 11.63 E A 0020 ARG NH2
C A 0029 GLU OE2 10.38 E A 0020 ARG NH1
C A 0029 GLU OE1 11.19 H A 0076 ARG NH1
H A 0034 GLU OE1 9.852 C A 0019 HIS ND1
H A 0034 GLU OE1 11.82 C A 0019 HIS NE2
H A 0034 GLU OE2 10.65 C A 0019 HIS ND1
H A 0034 GLU OE1 10.20 H A 0036 LYS NZ
H A 0034 GLU OE1 2.832 H A 0073 HIS ND1
H A 0034 GLU OE1 4.883 H A 0073 HIS NE2
H A 0034 GLU OE2 4.512 H A 0073 HIS ND1
H A 0034 GLU OE2 6.461 H A 0073 HIS NE2
H A 0034 GLU OE1 4.316 H A 0076 ARG NH1
H A 0034 GLU OE1 6.216 H A 0076 ARG NH2
H A 0034 GLU OE2 2.704 H A 0076 ARG NH1
H A 0034 GLU OE2 4.967 H A 0076 ARG NH2
C A 0046 GLU OE1 11.60 C A 0047 ARG NH1
C A 0046 GLU OE1 2.668 E A 0099 ARG NH1
C A 0046 GLU OE1 4.757 E A 0099 ARG NH2
C A 0046 GLU OE2 3.318 E A 0099 ARG NH1
C A 0046 GLU OE2 4.512 E A 0099 ARG NH2
C A 0046 GLU OE2 11.16 C A 0103 ARG NH1
C A 0046 GLU OE2 11.78 C A 0103 ARG NH2
H A 0052 GLU OE1 9.141 H A 0051 ARG NH1
H A 0052 GLU OE1 10.93 H A 0051 ARG NH2
H A 0052 GLU OE2 9.848 H A 0051 ARG NH1
H A 0052 GLU OE2 11.83 H A 0051 ARG NH2
H A 0052 GLU OE1 11.26 H A 0057 HIS NE2
H A 0052 GLU OE2 11.85 H A 0057 HIS NE2
H A 0066 GLU OE1 9.770 H A 0051 ARG NH1
H A 0066 GLU OE1 10.77 H A 0051 ARG NH2
H A 0066 GLU OE2 11.28 H A 0051 ARG NH1
H A 0066 GLU OE1 2.734 H A 0068 ARG NH1
H A 0066 GLU OE1 3.501 H A 0068 ARG NH2
H A 0066 GLU OE2 3.596 H A 0068 ARG NH1
H A 0066 GLU OE2 2.737 H A 0068 ARG NH2
H A 0066 GLU OE2 11.41 H A 0073 HIS NE2
H A 0067 ASP OD1 5.740 H A 0051 ARG NH1
H A 0067 ASP OD1 7.555 H A 0051 ARG NH2
H A 0067 ASP OD2 3.850 H A 0051 ARG NH1
H A 0067 ASP OD2 5.856 H A 0051 ARG NH2
H A 0067 ASP OD1 9.078 H A 0068 ARG NH1
H A 0067 ASP OD1 10.38 H A 0068 ARG NH2
H A 0067 ASP OD2 9.395 H A 0068 ARG NH1
H A 0067 ASP OD2 11.01 H A 0068 ARG NH2
H A 0071 ASP OD1 4.721 H A 0051 ARG NH1
H A 0071 ASP OD1 2.740 H A 0051 ARG NH2
H A 0071 ASP OD2 4.001 H A 0051 ARG NH1
H A 0071 ASP OD2 2.934 H A 0051 ARG NH2
H A 0071 ASP OD1 9.741 H A 0068 ARG NH1
H A 0071 ASP OD1 10.95 H A 0068 ARG NH2
H A 0071 ASP OD2 7.720 H A 0068 ARG NH1
H A 0071 ASP OD2 8.943 H A 0068 ARG NH2
H A 0071 ASP OD1 11.50 H A 0073 HIS ND1
H A 0071 ASP OD1 11.50 H A 0073 HIS NE2
H A 0071 ASP OD2 10.92 H A 0073 HIS ND1
H A 0071 ASP OD2 10.50 H A 0073 HIS NE2
H A 0071 ASP OD1 8.696 H A 0075 ARG NH1
H A 0071 ASP OD1 10.93 H A 0075 ARG NH2
H A 0071 ASP OD2 9.853 H A 0075 ARG NH1
H A 0071 ASP OD2 11.93 H A 0075 ARG NH2
H A 0071 ASP OD1 9.600 H A 0078 ARG NH1
H A 0071 ASP OD1 11.79 H A 0078 ARG NH2
H A 0071 ASP OD2 11.70 H A 0078 ARG NH1
H A 0082 GLU OE1 9.304 H A 0075 ARG NH1
H A 0082 GLU OE1 8.311 H A 0075 ARG NH2
H A 0082 GLU OE2 8.819 H A 0075 ARG NH1
H A 0082 GLU OE2 7.814 H A 0075 ARG NH2
H A 0082 GLU OE1 10.99 H A 0078 ARG NH1
H A 0082 GLU OE1 9.693 H A 0078 ARG NH2
H A 0082 GLU OE2 10.06 H A 0078 ARG NH1
H A 0082 GLU OE2 8.585 H A 0078 ARG NH2
H A 0082 GLU OE1 2.672 H A 0079 LYS NZ
H A 0082 GLU OE2 4.077 H A 0079 LYS NZ
H A 0082 GLU OE1 11.90 H A 0086 HIS ND1
H A 0082 GLU OE1 8.604 H A 0088 ARG NH1
H A 0082 GLU OE1 8.555 H A 0088 ARG NH2
H A 0082 GLU OE2 7.462 H A 0088 ARG NH1
H A 0082 GLU OE2 6.952 H A 0088 ARG NH2
H A 0087 ASP OD1 9.498 H A 0075 ARG NH1
H A 0087 ASP OD1 10.10 H A 0075 ARG NH2
H A 0087 ASP OD2 10.81 H A 0075 ARG NH1
H A 0087 ASP OD2 11.07 H A 0075 ARG NH2
H A 0087 ASP OD1 4.889 H A 0078 ARG NH1
H A 0087 ASP OD1 2.748 H A 0078 ARG NH2
H A 0087 ASP OD2 7.063 H A 0078 ARG NH1
H A 0087 ASP OD2 4.968 H A 0078 ARG NH2
H A 0087 ASP OD1 9.678 H A 0079 LYS NZ
H A 0087 ASP OD2 9.094 H A 0079 LYS NZ
H A 0087 ASP OD1 8.837 H A 0086 HIS ND1
H A 0087 ASP OD1 10.75 H A 0086 HIS NE2
H A 0087 ASP OD2 7.275 H A 0086 HIS ND1
H A 0087 ASP OD2 9.367 H A 0086 HIS NE2
H A 0087 ASP OD1 3.793 H A 0088 ARG NH1
H A 0087 ASP OD1 4.823 H A 0088 ARG NH2
H A 0087 ASP OD2 2.636 H A 0088 ARG NH1
H A 0087 ASP OD2 4.074 H A 0088 ARG NH2
CHARGE_REPU 2.00 12.00 114
C A 0004 GLU OE1 9.028 C A 0005 GLU OE1
C A 0004 GLU OE1 9.089 C A 0005 GLU OE2
C A 0004 GLU OE2 10.83 C A 0005 GLU OE1
C A 0004 GLU OE2 11.12 C A 0005 GLU OE2
C A 0004 GLU OE1 6.094 E A 0015 ASP OD1
C A 0004 GLU OE1 7.865 E A 0015 ASP OD2
C A 0004 GLU OE2 6.967 E A 0015 ASP OD1
C A 0004 GLU OE2 8.271 E A 0015 ASP OD2
C A 0005 GLU OE1 8.983 E A 0008 GLU OE1
C A 0005 GLU OE1 7.358 E A 0008 GLU OE2
C A 0005 GLU OE2 10.63 E A 0008 GLU OE1
C A 0005 GLU OE2 9.250 E A 0008 GLU OE2
C A 0005 GLU OE1 8.592 E A 0015 ASP OD1
C A 0005 GLU OE1 10.39 E A 0015 ASP OD2
C A 0005 GLU OE2 9.233 E A 0015 ASP OD1
C A 0005 GLU OE2 11.22 E A 0015 ASP OD2
E A 0008 GLU OE1 11.53 E A 0015 ASP OD1
E A 0008 GLU OE1 11.73 E A 0015 ASP OD2
E A 0008 GLU OE2 10.24 E A 0015 ASP OD1
E A 0008 GLU OE2 10.65 E A 0015 ASP OD2
E A 0008 GLU OE1 11.63 C A 0025 GLU OE2
C A 0019 HIS ND1 11.20 E A 0020 ARG NH2
C A 0019 HIS NE2 11.31 E A 0020 ARG NH2
C A 0019 HIS ND1 7.415 H A 0036 LYS NZ
C A 0019 HIS NE2 7.263 H A 0036 LYS NZ
C A 0019 HIS ND1 6.952 H A 0039 HIS ND1
C A 0019 HIS ND1 8.708 H A 0039 HIS NE2
C A 0019 HIS NE2 6.421 H A 0039 HIS ND1
C A 0019 HIS NE2 8.019 H A 0039 HIS NE2
C A 0019 HIS ND1 11.84 H A 0073 HIS ND1
C A 0025 GLU OE1 7.843 E A 0026 GLU OE1
C A 0025 GLU OE1 7.369 E A 0026 GLU OE2
C A 0025 GLU OE2 9.677 E A 0026 GLU OE1
C A 0025 GLU OE2 9.408 E A 0026 GLU OE2
E A 0026 GLU OE1 11.76 H A 0087 ASP OD2
C A 0029 GLU OE1 10.99 H A 0034 GLU OE2
H A 0036 LYS NZ 8.748 H A 0039 HIS ND1
H A 0036 LYS NZ 10.88 H A 0039 HIS NE2
H A 0036 LYS NZ 10.53 H A 0057 HIS ND1
H A 0036 LYS NZ 10.38 H A 0073 HIS ND1
H A 0036 LYS NZ 10.70 H A 0073 HIS NE2
H A 0039 HIS ND1 8.426 H A 0044 HIS ND1
H A 0039 HIS ND1 9.634 H A 0044 HIS NE2
H A 0039 HIS NE2 8.082 H A 0044 HIS ND1
H A 0039 HIS NE2 9.177 H A 0044 HIS NE2
H A 0039 HIS ND1 11.15 H A 0057 HIS ND1
H A 0039 HIS NE2 12.00 H A 0057 HIS ND1
H A 0044 HIS ND1 6.030 C A 0047 ARG NH1
H A 0044 HIS ND1 7.527 C A 0047 ARG NH2
H A 0044 HIS NE2 5.003 C A 0047 ARG NH1
H A 0044 HIS NE2 6.535 C A 0047 ARG NH2
H A 0044 HIS ND1 7.253 H A 0057 HIS ND1
H A 0044 HIS ND1 7.179 H A 0057 HIS NE2
H A 0044 HIS NE2 6.736 H A 0057 HIS ND1
H A 0044 HIS NE2 6.577 H A 0057 HIS NE2
C A 0047 ARG NH1 8.512 H A 0057 HIS ND1
C A 0047 ARG NH1 6.977 H A 0057 HIS NE2
C A 0047 ARG NH2 8.011 H A 0057 HIS ND1
C A 0047 ARG NH2 6.078 H A 0057 HIS NE2
H A 0051 ARG NH1 8.775 H A 0068 ARG NH1
H A 0051 ARG NH1 10.64 H A 0068 ARG NH2
H A 0051 ARG NH2 9.244 H A 0068 ARG NH1
H A 0051 ARG NH2 10.92 H A 0068 ARG NH2
H A 0051 ARG NH2 10.70 H A 0075 ARG NH1
H A 0051 ARG NH2 11.55 H A 0078 ARG NH1
H A 0052 GLU OE1 6.511 H A 0067 ASP OD1
H A 0052 GLU OE1 6.171 H A 0067 ASP OD2
H A 0052 GLU OE2 6.035 H A 0067 ASP OD1
H A 0052 GLU OE2 6.361 H A 0067 ASP OD2
H A 0052 GLU OE1 11.79 H A 0071 ASP OD2
H A 0066 GLU OE1 8.582 H A 0067 ASP OD1
H A 0066 GLU OE1 9.370 H A 0067 ASP OD2
H A 0066 GLU OE2 9.703 H A 0067 ASP OD1
H A 0066 GLU OE2 10.76 H A 0067 ASP OD2
H A 0066 GLU OE1 11.55 H A 0071 ASP OD1
H A 0066 GLU OE1 9.392 H A 0071 ASP OD2
H A 0066 GLU OE2 10.23 H A 0071 ASP OD2
H A 0067 ASP OD1 8.684 H A 0071 ASP OD1
H A 0067 ASP OD1 7.109 H A 0071 ASP OD2
H A 0067 ASP OD2 7.436 H A 0071 ASP OD1
H A 0067 ASP OD2 6.190 H A 0071 ASP OD2
H A 0068 ARG NH1 11.78 H A 0073 HIS NE2
H A 0068 ARG NH2 10.66 H A 0073 HIS NE2
H A 0073 HIS ND1 5.587 H A 0076 ARG NH1
H A 0073 HIS ND1 6.763 H A 0076 ARG NH2
H A 0073 HIS NE2 6.902 H A 0076 ARG NH1
H A 0073 HIS NE2 7.439 H A 0076 ARG NH2
H A 0075 ARG NH1 7.947 H A 0078 ARG NH1
H A 0075 ARG NH1 8.704 H A 0078 ARG NH2
H A 0075 ARG NH2 9.540 H A 0078 ARG NH1
H A 0075 ARG NH2 9.830 H A 0078 ARG NH2
H A 0075 ARG NH1 8.503 H A 0079 LYS NZ
H A 0075 ARG NH2 7.137 H A 0079 LYS NZ
H A 0076 ARG NH1 11.34 H A 0079 LYS NZ
H A 0076 ARG NH2 11.57 H A 0079 LYS NZ
H A 0078 ARG NH2 11.22 H A 0079 LYS NZ
H A 0078 ARG NH2 10.87 H A 0086 HIS ND1
H A 0078 ARG NH1 8.359 H A 0088 ARG NH1
H A 0078 ARG NH1 9.078 H A 0088 ARG NH2
H A 0078 ARG NH2 6.060 H A 0088 ARG NH1
H A 0078 ARG NH2 6.790 H A 0088 ARG NH2
H A 0078 ARG NH1 10.90 E A 0099 ARG NH2
H A 0078 ARG NH2 11.54 E A 0099 ARG NH2
H A 0079 LYS NZ 11.09 H A 0088 ARG NH1
H A 0079 LYS NZ 10.94 H A 0088 ARG NH2
H A 0082 GLU OE1 7.709 H A 0087 ASP OD1
H A 0082 GLU OE1 6.744 H A 0087 ASP OD2
H A 0082 GLU OE2 6.684 H A 0087 ASP OD1
H A 0082 GLU OE2 5.953 H A 0087 ASP OD2
H A 0086 HIS ND1 6.968 H A 0088 ARG NH1
H A 0086 HIS ND1 9.025 H A 0088 ARG NH2
H A 0086 HIS NE2 9.041 H A 0088 ARG NH1
H A 0086 HIS NE2 11.12 H A 0088 ARG NH2
H A 0086 HIS NE2 11.72 C A 0103 ARG NH1
HB_MM 2.00 3.20 191
C A 0002 ALA N 2.255 C A 0001 MET O
C A 0003 VAL N 2.256 C A 0002 ALA O
C A 0004 GLU N 2.259 C A 0003 VAL O
C A 0005 GLU N 3.083 C A 0003 VAL O
C A 0005 GLU N 2.262 C A 0004 GLU O
C A 0006 VAL N 2.258 C A 0005 GLU O
E A 0007 ILE N 2.253 C A 0006 VAL O
E A 0007 ILE N 2.866 E A 0014 LEU O
E A 0008 GLU N 3.196 C A 0006 VAL O
E A 0008 GLU N 2.254 E A 0007 ILE O
E A 0009 MET N 2.261 E A 0008 GLU O
C A 0010 GLN N 2.259 E A 0009 MET O
C A 0011 GLY N 3.181 E A 0009 MET O
C A 0011 GLY N 2.253 C A 0010 GLN O
E A 0012 LEU N 2.856 E A 0009 MET O
E A 0012 LEU N 2.255 C A 0011 GLY O
E A 0013 SER N 3.101 C A 0011 GLY O
E A 0013 SER N 2.258 E A 0012 LEU O
E A 0013 SER N 2.853 E A 0022 MET O
E A 0014 LEU N 2.861 E A 0007 ILE O
E A 0014 LEU N 2.260 E A 0013 SER O
E A 0015 ASP N 2.262 E A 0014 LEU O
E A 0015 ASP N 2.816 E A 0020 ARG O
C A 0016 PRO N 2.263 E A 0015 ASP O
C A 0017 THR N 3.200 E A 0015 ASP O
C A 0017 THR N 2.252 C A 0016 PRO O
C A 0018 SER N 2.257 C A 0017 THR O
C A 0019 HIS N 2.883 E A 0015 ASP O
C A 0019 HIS N 2.263 C A 0018 SER O
E A 0020 ARG N 3.147 E A 0015 ASP O
E A 0020 ARG N 2.260 C A 0019 HIS O
E A 0021 VAL N 2.259 E A 0020 ARG O
E A 0022 MET N 2.909 E A 0013 SER O
E A 0022 MET N 2.258 E A 0021 VAL O
E A 0023 ALA N 2.259 E A 0022 MET O
E A 0023 ALA N 2.885 E A 0026 GLU O
C A 0024 GLY N 2.829 C A 0011 GLY O
C A 0024 GLY N 2.851 E A 0022 MET O
C A 0024 GLY N 2.255 E A 0023 ALA O
C A 0025 GLU N 2.877 E A 0023 ALA O
C A 0025 GLU N 2.260 C A 0024 GLY O
E A 0026 GLU N 2.259 C A 0025 GLU O
E A 0027 PRO N 3.179 C A 0025 GLU O
E A 0027 PRO N 2.265 E A 0026 GLU O
E A 0028 LEU N 2.822 E A 0021 VAL O
E A 0028 LEU N 2.261 E A 0027 PRO O
C A 0029 GLU N 2.260 E A 0028 LEU O
C A 0030 MET N 2.262 C A 0029 GLU O
H A 0031 GLY N 2.257 C A 0030 MET O
H A 0032 PRO N 2.264 H A 0031 GLY O
H A 0033 THR N 2.251 H A 0032 PRO O
H A 0034 GLU N 2.257 H A 0033 THR O
H A 0035 PHE N 3.003 H A 0031 GLY O
H A 0035 PHE N 3.137 H A 0032 PRO O
H A 0035 PHE N 2.257 H A 0034 GLU O
H A 0036 LYS N 2.825 H A 0032 PRO O
H A 0036 LYS N 3.130 H A 0033 THR O
H A 0036 LYS N 2.253 H A 0035 PHE O
H A 0037 LEU N 2.954 H A 0033 THR O
H A 0037 LEU N 2.251 H A 0036 LYS O
H A 0038 LEU N 3.113 H A 0034 GLU O
H A 0038 LEU N 2.255 H A 0037 LEU O
H A 0039 HIS N 2.816 H A 0035 PHE O
H A 0039 HIS N 3.126 H A 0036 LYS O
H A 0039 HIS N 2.248 H A 0038 LEU O
H A 0040 PHE N 2.757 H A 0036 LYS O
H A 0040 PHE N 2.255 H A 0039 HIS O
H A 0041 PHE N 2.792 H A 0037 LEU O
H A 0041 PHE N 3.128 H A 0038 LEU O
H A 0041 PHE N 2.248 H A 0040 PHE O
H A 0042 MET N 2.815 H A 0038 LEU O
H A 0042 MET N 3.146 H A 0039 HIS O
H A 0042 MET N 2.253 H A 0041 PHE O
H A 0043 THR N 2.978 H A 0039 HIS O
H A 0043 THR N 2.252 H A 0042 MET O
H A 0044 HIS N 3.036 H A 0040 PHE O
H A 0044 HIS N 2.258 H A 0043 THR O
C A 0045 PRO N 2.264 H A 0044 HIS O
C A 0046 GLU N 2.269 C A 0045 PRO O
C A 0046 GLU N 2.971 E A 0100 PHE O
C A 0047 ARG N 2.252 C A 0046 GLU O
C A 0048 VAL N 2.255 C A 0047 ARG O
E A 0049 TYR N 2.260 C A 0048 VAL O
E A 0049 TYR N 2.907 E A 0098 TYR O
E A 0050 SER N 2.249 E A 0049 TYR O
H A 0051 ARG N 2.256 E A 0050 SER O
H A 0052 GLU N 2.252 H A 0051 ARG O
H A 0053 GLN N 3.085 E A 0050 SER O
H A 0053 GLN N 2.253 H A 0052 GLU O
H A 0054 LEU N 3.105 E A 0050 SER O
H A 0054 LEU N 3.183 H A 0051 ARG O
H A 0054 LEU N 2.252 H A 0053 GLN O
H A 0055 LEU N 2.811 H A 0051 ARG O
H A 0055 LEU N 2.251 H A 0054 LEU O
H A 0056 ASN N 2.877 H A 0052 GLU O
H A 0056 ASN N 2.976 H A 0053 GLN O
H A 0056 ASN N 2.250 H A 0055 LEU O
H A 0057 HIS N 2.951 H A 0053 GLN O
H A 0057 HIS N 2.982 H A 0054 LEU O
H A 0057 HIS N 2.252 H A 0056 ASN O
H A 0058 VAL N 2.700 H A 0054 LEU O
H A 0058 VAL N 2.251 H A 0057 HIS O
C A 0059 TRP N 2.255 H A 0058 VAL O
C A 0060 GLY N 2.771 H A 0055 LEU O
C A 0060 GLY N 2.263 C A 0059 TRP O
C A 0061 THR N 2.938 H A 0055 LEU O
C A 0061 THR N 3.166 C A 0059 TRP O
C A 0061 THR N 2.270 C A 0060 GLY O
C A 0062 ASN N 3.075 C A 0059 TRP O
C A 0062 ASN N 2.895 C A 0060 GLY O
C A 0062 ASN N 2.257 C A 0061 THR O
C A 0063 VAL N 2.261 C A 0062 ASN O
C A 0064 TYR N 2.259 C A 0063 VAL O
C A 0065 VAL N 2.830 C A 0063 VAL O
C A 0065 VAL N 2.255 C A 0064 TYR O
H A 0066 GLU N 2.257 C A 0065 VAL O
H A 0067 ASP N 2.257 H A 0066 GLU O
H A 0068 ARG N 3.198 H A 0066 GLU O
H A 0068 ARG N 2.260 H A 0067 ASP O
H A 0069 THR N 2.983 H A 0066 GLU O
H A 0069 THR N 3.172 H A 0067 ASP O
H A 0069 THR N 2.253 H A 0068 ARG O
H A 0070 VAL N 2.951 H A 0067 ASP O
H A 0070 VAL N 3.125 H A 0068 ARG O
H A 0070 VAL N 2.246 H A 0069 THR O
H A 0071 ASP N 2.947 H A 0068 ARG O
H A 0071 ASP N 2.257 H A 0070 VAL O
H A 0072 VAL N 2.998 H A 0068 ARG O
H A 0072 VAL N 2.255 H A 0071 ASP O
H A 0073 HIS N 3.087 H A 0069 THR O
H A 0073 HIS N 2.253 H A 0072 VAL O
H A 0074 ILE N 2.818 H A 0070 VAL O
H A 0074 ILE N 2.249 H A 0073 HIS O
H A 0075 ARG N 2.792 H A 0071 ASP O
H A 0075 ARG N 3.187 H A 0072 VAL O
H A 0075 ARG N 2.254 H A 0074 ILE O
H A 0076 ARG N 3.040 H A 0072 VAL O
H A 0076 ARG N 3.155 H A 0073 HIS O
H A 0076 ARG N 2.256 H A 0075 ARG O
H A 0077 LEU N 2.868 H A 0073 HIS O
H A 0077 LEU N 2.258 H A 0076 ARG O
H A 0078 ARG N 2.845 H A 0074 ILE O
H A 0078 ARG N 2.249 H A 0077 LEU O
H A 0079 LYS N 2.819 H A 0075 ARG O
H A 0079 LYS N 2.246 H A 0078 ARG O
H A 0080 ALA N 2.833 H A 0076 ARG O
H A 0080 ALA N 3.034 H A 0077 LEU O
H A 0080 ALA N 2.249 H A 0079 LYS O
H A 0081 LEU N 3.044 H A 0077 LEU O
H A 0081 LEU N 2.890 H A 0078 ARG O
H A 0081 LEU N 2.259 H A 0080 ALA O
H A 0082 GLU N 2.848 H A 0078 ARG O
H A 0082 GLU N 3.034 H A 0079 LYS O
H A 0082 GLU N 2.260 H A 0081 LEU O
C A 0083 PRO N 2.264 H A 0082 GLU O
C A 0084 GLY N 2.255 C A 0083 PRO O
H A 0085 GLY N 2.837 H A 0081 LEU O
H A 0085 GLY N 2.926 H A 0082 GLU O
H A 0085 GLY N 2.256 C A 0084 GLY O
H A 0086 HIS N 2.888 H A 0081 LEU O
H A 0086 HIS N 2.261 H A 0085 GLY O
H A 0087 ASP N 2.254 H A 0086 HIS O
H A 0088 ARG N 3.006 H A 0086 HIS O
H A 0088 ARG N 2.259 H A 0087 ASP O
C A 0089 MET N 2.886 H A 0086 HIS O
C A 0089 MET N 3.173 H A 0087 ASP O
C A 0089 MET N 2.257 H A 0088 ARG O
E A 0090 VAL N 3.035 H A 0087 ASP O
E A 0090 VAL N 2.257 C A 0089 MET O
E A 0091 GLN N 3.006 C A 0089 MET O
E A 0091 GLN N 2.253 E A 0090 VAL O
E A 0091 GLN N 2.789 E A 0099 ARG O
E A 0092 THR N 2.259 E A 0091 GLN O
E A 0093 VAL N 2.258 E A 0092 THR O
E A 0093 VAL N 2.901 E A 0097 GLY O
C A 0094 ARG N 2.804 E A 0092 THR O
C A 0094 ARG N 2.268 E A 0093 VAL O
C A 0095 GLY N 2.257 C A 0094 ARG O
C A 0096 THR N 2.944 E A 0093 VAL O
C A 0096 THR N 2.263 C A 0095 GLY O
E A 0097 GLY N 2.255 C A 0096 THR O
E A 0098 TYR N 2.774 E A 0049 TYR O
E A 0098 TYR N 2.262 E A 0097 GLY O
E A 0099 ARG N 3.110 E A 0091 GLN O
E A 0099 ARG N 2.254 E A 0098 TYR O
E A 0100 PHE N 2.259 E A 0099 ARG O
C A 0101 SER N 2.833 C A 0089 MET O
C A 0101 SER N 2.258 E A 0100 PHE O
C A 0102 THR N 2.252 C A 0101 SER O
C A 0103 ARG N 2.257 C A 0102 THR O
C A 0104 PHE N 2.266 C A 0103 ARG O
HB_MS 2.00 3.20 16
C A 0006 VAL N 3.142 C A 0005 GLU OE1
C A 0010 GLN O 3.158 H A 0086 HIS NE2
C A 0017 THR N 2.914 E A 0015 ASP OD1
H A 0031 GLY N 2.889 H A 0034 GLU OE2
H A 0039 HIS O 2.911 H A 0043 THR OG1
H A 0040 PHE O 2.858 H A 0043 THR OG1
H A 0040 PHE O 2.789 H A 0044 HIS ND1
H A 0052 GLU O 2.831 H A 0056 ASN ND2
C A 0060 GLY O 2.715 C A 0061 THR OG1
H A 0066 GLU O 3.134 H A 0069 THR OG1
C A 0084 GLY O 2.859 H A 0086 HIS ND1
H A 0085 GLY O 2.800 H A 0088 ARG NH1
H A 0088 ARG N 3.068 H A 0087 ASP OD1
E A 0090 VAL O 3.088 H A 0078 ARG NH1
C A 0102 THR O 2.798 C A 0010 GLN NE2
C A 0103 ARG N 2.785 C A 0102 THR OG1
HB_SS 2.00 3.20 8
E A 0015 ASP OD1 2.777 C A 0017 THR OG1
E A 0015 ASP OD2 2.729 C A 0018 SER OG
H A 0044 HIS ND1 2.879 H A 0043 THR OG1
C A 0046 GLU OE2 2.702 C A 0101 SER OG
C A 0047 ARG NH1 3.102 E A 0049 TYR OH
H A 0071 ASP OD1 2.670 E A 0098 TYR OH
H A 0078 ARG NH1 2.889 E A 0092 THR OG1
E A 0099 ARG NH2 2.704 E A 0091 GLN OE1
AROMATIC 0.00 8.00 8
H A 0041 PHE 5.925 E A 0100 PHE
C A 0047 ARG 7.352 H A 0040 PHE
C A 0059 TRP 5.339 H A 0073 HIS
H A 0088 ARG 7.932 H A 0086 HIS
C A 0047 ARG 7.228 H A 0057 HIS
H A 0036 LYS 7.878 C A 0019 HIS
H A 0044 HIS 5.766 E A 0049 TYR
C A 0047 ARG 5.203 E A 0049 TYR