Complet list of 1iet con file
Complete list of 1iet.con file
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 428
C A 0001 ASP C 2.432 C A 0002 LYS CA
C A 0001 ASP C 3.530 C A 0002 LYS C
C A 0001 ASP C 3.418 C A 0002 LYS CB
C A 0002 LYS C 2.432 C A 0003 ASP CA
C A 0002 LYS C 3.540 C A 0003 ASP C
C A 0002 LYS C 3.402 C A 0003 ASP CB
C A 0003 ASP C 2.432 C A 0004 VAL CA
C A 0003 ASP C 3.003 C A 0004 VAL C
C A 0003 ASP C 3.712 C A 0004 VAL CB
C A 0004 VAL C 2.430 C A 0005 LYS CA
C A 0004 VAL C 3.345 C A 0005 LYS C
C A 0004 VAL C 3.567 C A 0005 LYS CB
C A 0004 VAL CG1 3.776 C A 0006 TYR CE1
C A 0004 VAL CG1 3.731 C A 0077 GLY C
C A 0004 VAL CG1 3.185 C A 0078 GLU CB
C A 0004 VAL CG1 3.146 C A 0078 GLU CG
C A 0004 VAL CG1 3.560 C A 0078 GLU CD
C A 0005 LYS C 2.426 C A 0006 TYR CA
C A 0005 LYS C 3.125 C A 0006 TYR C
C A 0005 LYS C 3.682 C A 0006 TYR CB
C A 0005 LYS C 3.703 C A 0007 TYR CZ
C A 0005 LYS CB 3.662 C A 0007 TYR CE1
C A 0005 LYS CB 3.656 C A 0007 TYR CZ
C A 0006 TYR C 2.432 C A 0007 TYR CA
C A 0006 TYR C 3.495 C A 0007 TYR C
C A 0006 TYR C 3.462 C A 0007 TYR CB
C A 0006 TYR C 3.360 C A 0007 TYR CG
C A 0006 TYR C 3.672 C A 0007 TYR CD1
C A 0006 TYR CD1 3.769 C A 0078 GLU C
C A 0006 TYR CD1 3.475 C A 0078 GLU CB
C A 0006 TYR CE1 3.412 C A 0078 GLU CB
C A 0006 TYR CD1 3.695 C A 0079 LEU C
C A 0006 TYR CB 3.631 C A 0080 HIS CA
C A 0007 TYR C 2.437 C A 0008 THR CA
C A 0007 TYR C 2.984 C A 0008 THR C
C A 0007 TYR C 3.706 C A 0008 THR CB
C A 0007 TYR CD2 3.791 E A 0029 VAL CB
C A 0007 TYR CD2 3.498 E A 0029 VAL CG2
C A 0007 TYR CD2 3.527 C A 0076 ILE CD1
C A 0007 TYR CE2 3.583 C A 0076 ILE CG1
C A 0007 TYR CE2 3.079 C A 0076 ILE CD1
C A 0007 TYR CZ 3.756 C A 0076 ILE C
C A 0007 TYR CZ 3.783 C A 0076 ILE CB
C A 0007 TYR CZ 3.501 C A 0076 ILE CD1
C A 0007 TYR CE2 3.427 C A 0077 GLY CA
C A 0008 THR C 2.434 H A 0009 LEU CA
C A 0008 THR C 3.080 H A 0009 LEU C
C A 0008 THR C 3.705 H A 0009 LEU CB
H A 0009 LEU C 2.433 H A 0010 GLU CA
H A 0009 LEU C 3.062 H A 0010 GLU C
H A 0009 LEU C 3.697 H A 0010 GLU CB
H A 0009 LEU CD2 3.766 C A 0079 LEU CG
H A 0009 LEU CD2 3.214 C A 0079 LEU CD1
H A 0009 LEU CD2 3.644 C A 0079 LEU CD2
H A 0009 LEU CG 3.734 C A 0083 ASP CB
H A 0009 LEU CG 3.187 C A 0083 ASP CG
H A 0009 LEU CD1 3.222 C A 0083 ASP CB
H A 0009 LEU CD1 3.061 C A 0083 ASP CG
H A 0010 GLU C 2.433 H A 0011 GLU CA
H A 0010 GLU C 3.171 H A 0011 GLU C
H A 0010 GLU C 3.670 H A 0011 GLU CB
H A 0011 GLU C 2.434 H A 0012 ILE CA
H A 0011 GLU C 3.106 H A 0012 ILE C
H A 0011 GLU C 3.690 H A 0012 ILE CB
H A 0011 GLU C 3.768 E A 0022 TRP CZ3
H A 0012 ILE C 2.435 H A 0013 GLN CA
H A 0012 ILE C 3.238 H A 0013 GLN C
H A 0012 ILE C 3.644 H A 0013 GLN CB
H A 0012 ILE CA 3.633 E A 0022 TRP CE3
H A 0012 ILE CA 3.689 E A 0022 TRP CZ3
H A 0012 ILE CG1 3.690 E A 0022 TRP CE3
H A 0012 ILE CG1 3.767 E A 0022 TRP CZ3
H A 0012 ILE CD1 3.237 C A 0079 LEU CD2
H A 0013 GLN C 2.435 H A 0014 LYS CA
H A 0013 GLN C 2.986 H A 0014 LYS C
H A 0013 GLN C 3.704 H A 0014 LYS CB
H A 0014 LYS C 2.432 C A 0015 HIS CA
H A 0014 LYS C 3.177 C A 0015 HIS C
H A 0014 LYS C 3.664 C A 0015 HIS CB
H A 0014 LYS C 3.640 C A 0015 HIS CD2
C A 0015 HIS C 2.431 C A 0016 LYS CA
C A 0015 HIS C 3.538 C A 0016 LYS C
C A 0015 HIS C 3.399 C A 0016 LYS CB
C A 0015 HIS CE1 3.711 E A 0022 TRP CE2
C A 0015 HIS CE1 2.987 E A 0022 TRP CZ2
C A 0015 HIS CE1 3.509 E A 0022 TRP CH2
C A 0016 LYS C 2.432 C A 0017 ASP CA
C A 0016 LYS C 3.140 C A 0017 ASP C
C A 0016 LYS C 3.678 C A 0017 ASP CB
C A 0017 ASP C 2.438 C A 0018 SER CA
C A 0017 ASP C 3.714 C A 0018 SER C
C A 0017 ASP C 2.969 C A 0018 SER CB
C A 0018 SER C 2.431 C A 0019 LYS CA
C A 0018 SER C 3.481 C A 0019 LYS C
C A 0018 SER C 3.479 C A 0019 LYS CB
C A 0019 LYS C 2.435 C A 0020 SER CA
C A 0019 LYS C 3.016 C A 0020 SER C
C A 0019 LYS C 3.703 C A 0020 SER CB
C A 0019 LYS CA 3.286 H A 0036 LEU CD1
C A 0019 LYS C 3.457 H A 0036 LEU CD1
C A 0019 LYS CB 3.784 H A 0036 LEU CD1
C A 0019 LYS CG 3.130 H A 0036 LEU CD1
C A 0020 SER C 2.431 C A 0021 THR CA
C A 0020 SER C 3.668 C A 0021 THR C
C A 0020 SER C 3.192 C A 0021 THR CB
C A 0020 SER CA 3.644 C A 0033 THR CB
C A 0020 SER CA 3.359 C A 0033 THR CG2
C A 0020 SER C 3.573 C A 0033 THR CG2
C A 0021 THR C 2.432 E A 0022 TRP CA
C A 0021 THR C 3.491 E A 0022 TRP C
C A 0021 THR C 3.486 E A 0022 TRP CB
C A 0021 THR C 3.431 E A 0022 TRP CG
C A 0021 THR C 2.993 E A 0022 TRP CD1
E A 0022 TRP C 2.434 E A 0023 VAL CA
E A 0022 TRP C 3.612 E A 0023 VAL C
E A 0022 TRP C 3.297 E A 0023 VAL CB
E A 0022 TRP C 3.126 E A 0023 VAL CG2
E A 0022 TRP CE3 3.775 E A 0029 VAL CG1
E A 0022 TRP CB 3.726 E A 0030 TYR C
E A 0022 TRP CD1 3.439 E A 0031 ASP CA
E A 0022 TRP CD1 3.749 E A 0031 ASP CB
E A 0022 TRP CD1 3.548 E A 0031 ASP CG
E A 0023 VAL C 2.431 E A 0024 ILE CA
E A 0023 VAL C 3.146 E A 0024 ILE C
E A 0023 VAL C 3.678 E A 0024 ILE CB
E A 0023 VAL CB 3.618 C A 0032 LEU CD1
E A 0023 VAL CG2 3.534 C A 0032 LEU CD1
E A 0023 VAL CG2 3.539 C A 0046 LEU CG
E A 0023 VAL CB 3.789 C A 0058 PHE CZ
E A 0023 VAL CG1 3.482 C A 0058 PHE CE1
E A 0023 VAL CG1 3.474 C A 0058 PHE CZ
E A 0024 ILE C 2.432 C A 0025 LEU CA
E A 0024 ILE C 3.644 C A 0025 LEU C
E A 0024 ILE C 3.243 C A 0025 LEU CB
C A 0025 LEU C 2.440 C A 0026 HIS CA
C A 0025 LEU C 2.980 C A 0026 HIS C
C A 0025 LEU C 3.002 C A 0026 HIS CB
C A 0025 LEU CD1 3.678 C A 0026 HIS CD2
C A 0025 LEU CB 3.624 E A 0030 TYR CD1
C A 0025 LEU CB 3.000 E A 0030 TYR CE1
C A 0025 LEU CB 3.514 E A 0030 TYR CZ
C A 0025 LEU CD2 3.443 C A 0055 THR CB
C A 0026 HIS C 2.440 C A 0027 HIS CA
C A 0026 HIS C 2.979 C A 0027 HIS C
C A 0026 HIS C 2.994 C A 0027 HIS CB
C A 0027 HIS C 2.438 C A 0028 LYS CA
C A 0027 HIS C 3.703 C A 0028 LYS C
C A 0027 HIS C 2.983 C A 0028 LYS CB
C A 0027 HIS C 3.484 C A 0028 LYS CG
C A 0027 HIS CD2 3.460 C A 0084 ARG CG
C A 0027 HIS CD2 3.572 C A 0084 ARG CD
C A 0028 LYS C 2.432 E A 0029 VAL CA
C A 0028 LYS C 3.448 E A 0029 VAL C
C A 0028 LYS C 3.492 E A 0029 VAL CB
C A 0028 LYS C 3.445 E A 0029 VAL CG2
C A 0028 LYS CB 3.648 E A 0030 TYR CE1
E A 0029 VAL C 2.425 E A 0030 TYR CA
E A 0029 VAL C 3.495 E A 0030 TYR C
E A 0029 VAL C 3.474 E A 0030 TYR CB
E A 0029 VAL C 3.644 E A 0030 TYR CG
E A 0029 VAL C 3.270 E A 0030 TYR CD1
E A 0029 VAL CB 3.780 C A 0076 ILE CD1
E A 0029 VAL CG1 3.700 C A 0076 ILE CG1
E A 0029 VAL CG1 3.232 C A 0076 ILE CD1
E A 0029 VAL CG2 3.538 C A 0078 GLU C
E A 0030 TYR C 2.418 E A 0031 ASP CA
E A 0030 TYR C 2.996 E A 0031 ASP C
E A 0030 TYR C 3.693 E A 0031 ASP CB
E A 0030 TYR C 3.626 C A 0032 LEU CG
E A 0030 TYR CB 3.503 C A 0032 LEU CG
E A 0030 TYR CB 3.347 C A 0032 LEU CD1
E A 0030 TYR CB 3.754 C A 0032 LEU CD2
E A 0030 TYR CE2 3.681 C A 0071 SER CA
E A 0030 TYR CE2 3.716 C A 0071 SER C
E A 0030 TYR CE2 3.366 C A 0071 SER CB
E A 0030 TYR CD2 3.769 C A 0075 ILE CG1
E A 0030 TYR CE2 3.449 C A 0075 ILE CG1
E A 0031 ASP C 2.425 C A 0032 LEU CA
E A 0031 ASP C 3.388 C A 0032 LEU C
E A 0031 ASP C 3.562 C A 0032 LEU CB
E A 0031 ASP C 3.604 C A 0032 LEU CG
E A 0031 ASP CB 3.116 C A 0076 ILE CG2
C A 0032 LEU C 2.431 C A 0033 THR CA
C A 0032 LEU C 2.999 C A 0033 THR C
C A 0032 LEU C 3.708 C A 0033 THR CB
C A 0032 LEU CB 3.508 H A 0035 PHE CB
C A 0032 LEU CB 3.547 C A 0046 LEU CD1
C A 0032 LEU CB 3.518 C A 0046 LEU CD2
C A 0032 LEU CG 3.717 C A 0046 LEU CD1
C A 0032 LEU CD1 3.477 C A 0046 LEU CG
C A 0032 LEU CD1 3.103 C A 0046 LEU CD1
C A 0032 LEU CD1 3.607 C A 0046 LEU CD2
C A 0032 LEU CD2 3.466 C A 0074 TYR CB
C A 0033 THR C 2.433 C A 0034 LYS CA
C A 0033 THR C 3.238 C A 0034 LYS C
C A 0033 THR C 3.646 C A 0034 LYS CB
C A 0034 LYS C 2.440 H A 0035 PHE CA
C A 0034 LYS C 2.992 H A 0035 PHE C
C A 0034 LYS C 3.706 H A 0035 PHE CB
H A 0035 PHE C 2.434 H A 0036 LEU CA
H A 0035 PHE C 2.982 H A 0036 LEU C
H A 0035 PHE C 3.706 H A 0036 LEU CB
H A 0035 PHE CA 3.729 C A 0038 GLU CB
H A 0035 PHE CE1 3.219 C A 0045 VAL CB
H A 0035 PHE CE1 3.380 C A 0045 VAL CG1
H A 0035 PHE CE1 3.582 C A 0045 VAL CG2
H A 0035 PHE CZ 3.555 C A 0045 VAL CG1
H A 0035 PHE CE2 3.336 C A 0070 LEU CD1
H A 0035 PHE CD2 3.544 C A 0074 TYR CD2
H A 0035 PHE CD2 3.434 C A 0074 TYR CE2
H A 0036 LEU C 2.432 H A 0037 GLU CA
H A 0036 LEU C 3.464 H A 0037 GLU C
H A 0036 LEU C 3.494 H A 0037 GLU CB
H A 0037 GLU C 2.434 C A 0038 GLU CA
H A 0037 GLU C 3.409 C A 0038 GLU C
H A 0037 GLU C 3.546 C A 0038 GLU CB
C A 0038 GLU C 2.432 C A 0039 HIS CA
C A 0038 GLU C 3.603 C A 0039 HIS C
C A 0038 GLU C 3.324 C A 0039 HIS CB
C A 0038 GLU C 3.212 C A 0039 HIS CG
C A 0039 HIS CA 2.890 C A 0040 PRO CD
C A 0039 HIS C 2.477 C A 0040 PRO CA
C A 0039 HIS C 3.236 C A 0040 PRO C
C A 0039 HIS C 3.615 C A 0040 PRO CB
C A 0039 HIS C 3.676 C A 0040 PRO CG
C A 0039 HIS C 2.512 C A 0040 PRO CD
C A 0039 HIS CD2 3.248 C A 0063 HIS CD2
C A 0039 HIS CE1 3.047 C A 0070 LEU CD1
C A 0040 PRO C 2.433 C A 0041 GLY CA
C A 0040 PRO C 3.703 C A 0041 GLY C
C A 0041 GLY C 2.433 C A 0042 GLY CA
C A 0041 GLY C 3.315 C A 0042 GLY C
C A 0042 GLY C 2.432 C A 0043 GLU CA
C A 0042 GLY C 3.266 C A 0043 GLU C
C A 0042 GLY C 3.629 C A 0043 GLU CB
C A 0042 GLY C 3.732 C A 0045 VAL CG2
C A 0043 GLU C 2.434 C A 0044 GLU CA
C A 0043 GLU C 2.996 C A 0044 GLU C
C A 0043 GLU C 3.705 C A 0044 GLU CB
C A 0043 GLU CG 3.599 C A 0047 ARG CD
C A 0043 GLU CD 3.628 C A 0047 ARG CD
C A 0044 GLU C 2.431 C A 0045 VAL CA
C A 0044 GLU C 3.000 C A 0045 VAL C
C A 0044 GLU C 3.704 C A 0045 VAL CB
C A 0044 GLU CA 3.755 C A 0048 GLU CG
C A 0044 GLU CB 3.461 C A 0048 GLU CG
C A 0044 GLU CB 3.725 C A 0048 GLU CD
C A 0044 GLU CD 3.456 C A 0059 GLU CA
C A 0045 VAL C 2.440 C A 0046 LEU CA
C A 0045 VAL C 2.978 C A 0046 LEU C
C A 0045 VAL C 2.992 C A 0046 LEU CB
C A 0046 LEU C 2.432 C A 0047 ARG CA
C A 0046 LEU C 3.604 C A 0047 ARG C
C A 0046 LEU C 3.313 C A 0047 ARG CB
C A 0046 LEU CA 3.397 C A 0058 PHE CE1
C A 0046 LEU CA 3.313 C A 0058 PHE CZ
C A 0046 LEU CG 3.659 C A 0058 PHE CZ
C A 0046 LEU CD1 3.753 C A 0058 PHE CE2
C A 0046 LEU CD1 3.462 C A 0058 PHE CZ
C A 0047 ARG C 2.432 C A 0048 GLU CA
C A 0047 ARG C 2.997 C A 0048 GLU C
C A 0047 ARG C 3.703 C A 0048 GLU CB
C A 0048 GLU C 2.433 C A 0049 GLN CA
C A 0048 GLU C 3.701 C A 0049 GLN C
C A 0048 GLU C 3.017 C A 0049 GLN CB
C A 0048 GLU CD 3.435 C A 0057 ASN CB
C A 0049 GLN C 2.432 C A 0050 ALA CA
C A 0049 GLN C 3.175 C A 0050 ALA C
C A 0049 GLN C 3.667 C A 0050 ALA CB
C A 0050 ALA C 2.433 C A 0051 GLY CA
C A 0050 ALA C 2.999 C A 0051 GLY C
C A 0051 GLY C 2.433 C A 0052 GLY CA
C A 0051 GLY C 3.410 C A 0052 GLY C
C A 0052 GLY C 2.432 C A 0053 ASP CA
C A 0052 GLY C 3.421 C A 0053 ASP C
C A 0052 GLY C 3.526 C A 0053 ASP CB
C A 0053 ASP C 2.432 C A 0054 ALA CA
C A 0053 ASP C 3.702 C A 0054 ALA C
C A 0053 ASP C 2.999 C A 0054 ALA CB
C A 0054 ALA C 2.432 C A 0055 THR CA
C A 0054 ALA C 3.082 C A 0055 THR C
C A 0054 ALA C 3.692 C A 0055 THR CB
C A 0055 THR C 2.432 C A 0056 GLU CA
C A 0055 THR C 3.413 C A 0056 GLU C
C A 0055 THR C 3.533 C A 0056 GLU CB
C A 0056 GLU C 2.432 C A 0057 ASN CA
C A 0056 GLU C 3.306 C A 0057 ASN C
C A 0056 GLU C 3.607 C A 0057 ASN CB
C A 0057 ASN C 2.432 C A 0058 PHE CA
C A 0057 ASN C 3.062 C A 0058 PHE C
C A 0057 ASN C 3.695 C A 0058 PHE CB
C A 0058 PHE C 2.433 C A 0059 GLU CA
C A 0058 PHE C 3.686 C A 0059 GLU C
C A 0058 PHE C 3.109 C A 0059 GLU CB
C A 0059 GLU C 2.432 C A 0060 ASP CA
C A 0059 GLU C 3.491 C A 0060 ASP C
C A 0059 GLU C 3.462 C A 0060 ASP CB
C A 0059 GLU C 3.566 C A 0069 GLU CD
C A 0059 GLU CB 3.497 C A 0069 GLU CD
C A 0060 ASP C 2.432 C A 0061 VAL CA
C A 0060 ASP C 3.613 C A 0061 VAL C
C A 0060 ASP C 3.287 C A 0061 VAL CB
C A 0061 VAL C 2.432 C A 0062 GLY CA
C A 0061 VAL C 3.471 C A 0062 GLY C
C A 0062 GLY C 2.432 C A 0063 HIS CA
C A 0062 GLY C 3.676 C A 0063 HIS C
C A 0062 GLY C 3.148 C A 0063 HIS CB
C A 0063 HIS C 2.441 C A 0064 SER CA
C A 0063 HIS C 3.024 C A 0064 SER C
C A 0063 HIS C 2.972 C A 0064 SER CB
C A 0063 HIS CB 3.561 C A 0067 ALA CB
C A 0063 HIS CD2 3.281 C A 0070 LEU CD1
C A 0064 SER C 2.436 C A 0065 THR CA
C A 0064 SER C 3.662 C A 0065 THR C
C A 0064 SER C 3.209 C A 0065 THR CB
C A 0064 SER C 2.982 C A 0065 THR CG2
C A 0065 THR C 2.432 C A 0066 ASP CA
C A 0065 THR C 3.589 C A 0066 ASP C
C A 0065 THR C 3.334 C A 0066 ASP CB
C A 0065 THR C 3.372 C A 0066 ASP CG
C A 0066 ASP C 2.433 C A 0067 ALA CA
C A 0066 ASP C 2.996 C A 0067 ALA C
C A 0066 ASP C 3.703 C A 0067 ALA CB
C A 0067 ALA C 2.433 C A 0068 ARG CA
C A 0067 ALA C 3.000 C A 0068 ARG C
C A 0067 ALA C 3.703 C A 0068 ARG CB
C A 0068 ARG C 2.432 C A 0069 GLU CA
C A 0068 ARG C 3.694 C A 0069 GLU C
C A 0068 ARG C 3.074 C A 0069 GLU CB
C A 0069 GLU C 2.432 C A 0070 LEU CA
C A 0069 GLU C 2.999 C A 0070 LEU C
C A 0069 GLU C 3.708 C A 0070 LEU CB
C A 0070 LEU C 2.447 C A 0071 SER CA
C A 0070 LEU C 2.952 C A 0071 SER C
C A 0070 LEU C 3.709 C A 0071 SER CB
C A 0070 LEU CD2 3.723 C A 0074 TYR CD2
C A 0070 LEU CD2 3.347 C A 0074 TYR CE2
C A 0071 SER C 2.438 C A 0072 LYS CA
C A 0071 SER C 3.700 C A 0072 LYS C
C A 0071 SER C 2.985 C A 0072 LYS CB
C A 0072 LYS C 2.431 C A 0073 THR CA
C A 0072 LYS C 3.296 C A 0073 THR C
C A 0072 LYS C 3.613 C A 0073 THR CB
C A 0073 THR C 2.436 C A 0074 TYR CA
C A 0073 THR C 3.614 C A 0074 TYR C
C A 0073 THR C 3.314 C A 0074 TYR CB
C A 0073 THR C 3.284 C A 0074 TYR CG
C A 0073 THR C 3.568 C A 0074 TYR CD2
C A 0074 TYR C 2.436 C A 0075 ILE CA
C A 0074 TYR C 3.268 C A 0075 ILE C
C A 0074 TYR C 3.646 C A 0075 ILE CB
C A 0074 TYR C 3.769 C A 0075 ILE CG1
C A 0075 ILE C 2.437 C A 0076 ILE CA
C A 0075 ILE C 3.414 C A 0076 ILE C
C A 0075 ILE C 3.571 C A 0076 ILE CB
C A 0076 ILE C 2.429 C A 0077 GLY CA
C A 0076 ILE C 3.694 C A 0077 GLY C
C A 0077 GLY C 2.431 C A 0078 GLU CA
C A 0077 GLY C 3.497 C A 0078 GLU C
C A 0077 GLY C 3.458 C A 0078 GLU CB
C A 0077 GLY C 3.644 C A 0078 GLU CG
C A 0078 GLU C 2.434 C A 0079 LEU CA
C A 0078 GLU C 3.247 C A 0079 LEU C
C A 0078 GLU C 3.646 C A 0079 LEU CB
C A 0079 LEU C 2.442 C A 0080 HIS CA
C A 0079 LEU C 2.944 C A 0080 HIS C
C A 0079 LEU C 3.698 C A 0080 HIS CB
C A 0080 HIS CA 2.924 C A 0081 PRO CD
C A 0080 HIS C 2.472 C A 0081 PRO CA
C A 0080 HIS C 3.151 C A 0081 PRO C
C A 0080 HIS C 3.643 C A 0081 PRO CB
C A 0080 HIS C 3.684 C A 0081 PRO CG
C A 0080 HIS C 2.519 C A 0081 PRO CD
C A 0080 HIS CB 3.695 C A 0081 PRO CD
C A 0080 HIS CG 3.307 C A 0081 PRO CD
C A 0080 HIS CD2 3.473 C A 0081 PRO CD
C A 0080 HIS CE1 3.373 C A 0082 ASP CB
C A 0081 PRO C 2.433 C A 0082 ASP CA
C A 0081 PRO C 2.992 C A 0082 ASP C
C A 0081 PRO C 3.703 C A 0082 ASP CB
C A 0082 ASP C 2.434 C A 0083 ASP CA
C A 0082 ASP C 3.282 C A 0083 ASP C
C A 0082 ASP C 3.623 C A 0083 ASP CB
C A 0082 ASP C 3.765 C A 0083 ASP CG
C A 0083 ASP C 2.434 C A 0084 ARG CA
C A 0083 ASP C 2.988 C A 0084 ARG C
C A 0083 ASP C 3.705 C A 0084 ARG CB
C A 0084 ARG C 2.434 C A 0085 SER CA
C A 0084 ARG C 2.999 C A 0085 SER C
C A 0084 ARG C 3.703 C A 0085 SER CB
C A 0085 SER C 2.432 C A 0086 LYS CA
C A 0085 SER C 3.697 C A 0086 LYS C
C A 0085 SER C 3.055 C A 0086 LYS CB
C A 0086 LYS C 2.432 C A 0087 ILE CA
C A 0086 LYS C 3.500 C A 0087 ILE C
C A 0086 LYS C 3.455 C A 0087 ILE CB
C A 0086 LYS C 3.383 C A 0087 ILE CG1
C A 0087 ILE C 2.433 C A 0088 ALA CA
C A 0087 ILE C 3.236 C A 0088 ALA C
C A 0087 ILE C 3.644 C A 0088 ALA CB
C A 0088 ALA C 2.433 C A 0089 LYS CA
C A 0088 ALA C 3.527 C A 0089 LYS C
C A 0088 ALA C 3.429 C A 0089 LYS CB
C A 0089 LYS CA 2.889 C A 0090 PRO CD
C A 0089 LYS C 2.477 C A 0090 PRO CA
C A 0089 LYS C 3.239 C A 0090 PRO C
C A 0089 LYS C 3.614 C A 0090 PRO CB
C A 0089 LYS C 3.676 C A 0090 PRO CG
C A 0089 LYS C 2.512 C A 0090 PRO CD
C A 0089 LYS CB 3.128 C A 0090 PRO CD
C A 0089 LYS CG 3.626 C A 0090 PRO CD
C A 0090 PRO C 2.457 C A 0091 SER CA
C A 0090 PRO C 2.967 C A 0091 SER C
C A 0090 PRO C 3.115 C A 0091 SER CB
C A 0090 PRO CA 3.176 C A 0093 THR CG2
C A 0090 PRO C 3.474 C A 0093 THR CG2
C A 0090 PRO CB 3.063 C A 0093 THR CG2
C A 0091 SER C 2.438 C A 0092 GLU CA
C A 0091 SER C 2.994 C A 0092 GLU C
C A 0091 SER C 3.709 C A 0092 GLU CB
C A 0092 GLU C 2.432 C A 0093 THR CA
C A 0092 GLU C 3.144 C A 0093 THR C
C A 0092 GLU C 3.680 C A 0093 THR CB
C A 0093 THR C 2.432 C A 0094 LEU CA
C A 0093 THR C 3.611 C A 0094 LEU C
C A 0093 THR C 3.299 C A 0094 LEU CB
C A 0093 THR C 3.467 C A 0094 LEU CG
C A 0093 THR C 3.218 C A 0094 LEU CD1
CHARGE_ATTR 2.00 12.00 138
C A 0001 ASP OD1 8.425 C A 0002 LYS NZ
C A 0001 ASP OD2 7.929 C A 0002 LYS NZ
C A 0003 ASP OD1 7.438 C A 0002 LYS NZ
C A 0003 ASP OD2 7.280 C A 0002 LYS NZ
C A 0003 ASP OD1 10.09 C A 0005 LYS NZ
C A 0003 ASP OD2 8.752 C A 0005 LYS NZ
C A 0003 ASP OD2 11.89 C A 0080 HIS NE2
H A 0010 GLU OE1 7.379 H A 0014 LYS NZ
H A 0010 GLU OE2 9.389 H A 0014 LYS NZ
H A 0010 GLU OE1 11.30 C A 0015 HIS NE2
H A 0010 GLU OE1 11.01 C A 0080 HIS ND1
H A 0010 GLU OE1 11.99 C A 0080 HIS NE2
H A 0010 GLU OE2 9.364 C A 0080 HIS ND1
H A 0010 GLU OE2 10.59 C A 0080 HIS NE2
H A 0011 GLU OE1 9.311 C A 0005 LYS NZ
H A 0011 GLU OE2 10.61 C A 0005 LYS NZ
H A 0011 GLU OE1 10.11 H A 0014 LYS NZ
H A 0011 GLU OE2 8.375 H A 0014 LYS NZ
H A 0011 GLU OE1 7.627 C A 0015 HIS ND1
H A 0011 GLU OE1 5.978 C A 0015 HIS NE2
H A 0011 GLU OE2 7.601 C A 0015 HIS ND1
H A 0011 GLU OE2 5.574 C A 0015 HIS NE2
H A 0011 GLU OE1 10.56 C A 0080 HIS ND1
H A 0011 GLU OE1 10.37 C A 0080 HIS NE2
H A 0011 GLU OE2 11.88 C A 0080 HIS ND1
H A 0011 GLU OE2 11.72 C A 0080 HIS NE2
C A 0017 ASP OD1 11.39 H A 0014 LYS NZ
C A 0017 ASP OD1 9.424 C A 0015 HIS ND1
C A 0017 ASP OD1 10.19 C A 0015 HIS NE2
C A 0017 ASP OD2 9.457 C A 0015 HIS ND1
C A 0017 ASP OD2 10.52 C A 0015 HIS NE2
C A 0017 ASP OD1 11.45 C A 0016 LYS NZ
C A 0017 ASP OD1 11.60 C A 0019 LYS NZ
C A 0017 ASP OD2 9.591 C A 0019 LYS NZ
E A 0031 ASP OD2 10.84 C A 0005 LYS NZ
E A 0031 ASP OD1 7.638 C A 0015 HIS ND1
E A 0031 ASP OD1 9.359 C A 0015 HIS NE2
E A 0031 ASP OD2 5.937 C A 0015 HIS ND1
E A 0031 ASP OD2 7.432 C A 0015 HIS NE2
E A 0031 ASP OD1 11.90 C A 0019 LYS NZ
E A 0031 ASP OD1 8.934 C A 0034 LYS NZ
E A 0031 ASP OD2 10.77 C A 0034 LYS NZ
H A 0037 GLU OE1 4.225 C A 0019 LYS NZ
H A 0037 GLU OE2 6.254 C A 0019 LYS NZ
H A 0037 GLU OE1 9.549 C A 0034 LYS NZ
H A 0037 GLU OE2 9.925 C A 0034 LYS NZ
H A 0037 GLU OE1 11.22 C A 0039 HIS ND1
H A 0037 GLU OE2 11.13 C A 0039 HIS ND1
C A 0038 GLU OE1 9.475 C A 0019 LYS NZ
C A 0038 GLU OE2 10.79 C A 0019 LYS NZ
C A 0038 GLU OE1 4.763 C A 0034 LYS NZ
C A 0038 GLU OE2 4.822 C A 0034 LYS NZ
C A 0038 GLU OE1 6.213 C A 0039 HIS ND1
C A 0038 GLU OE1 7.307 C A 0039 HIS NE2
C A 0038 GLU OE2 6.464 C A 0039 HIS ND1
C A 0038 GLU OE2 6.949 C A 0039 HIS NE2
C A 0038 GLU OE1 10.05 C A 0063 HIS NE2
C A 0038 GLU OE2 11.87 C A 0063 HIS ND1
C A 0038 GLU OE2 9.654 C A 0063 HIS NE2
C A 0043 GLU OE1 6.043 C A 0047 ARG NH1
C A 0043 GLU OE1 6.325 C A 0047 ARG NH2
C A 0043 GLU OE2 5.993 C A 0047 ARG NH1
C A 0043 GLU OE2 6.724 C A 0047 ARG NH2
C A 0044 GLU OE2 11.81 C A 0039 HIS ND1
C A 0044 GLU OE2 11.59 C A 0063 HIS ND1
C A 0048 GLU OE1 11.33 C A 0047 ARG NH2
C A 0048 GLU OE2 11.65 C A 0047 ARG NH1
C A 0048 GLU OE2 11.30 C A 0047 ARG NH2
C A 0053 ASP OD1 11.54 C A 0026 HIS ND1
C A 0053 ASP OD1 10.49 C A 0026 HIS NE2
C A 0053 ASP OD2 9.958 C A 0026 HIS ND1
C A 0053 ASP OD2 8.758 C A 0026 HIS NE2
C A 0053 ASP OD1 11.68 C A 0084 ARG NH2
C A 0053 ASP OD2 11.47 C A 0084 ARG NH2
C A 0056 GLU OE1 9.774 C A 0026 HIS ND1
C A 0056 GLU OE1 7.902 C A 0026 HIS NE2
C A 0056 GLU OE2 8.098 C A 0026 HIS ND1
C A 0056 GLU OE2 6.469 C A 0026 HIS NE2
C A 0059 GLU OE1 8.627 C A 0039 HIS ND1
C A 0059 GLU OE1 8.864 C A 0039 HIS NE2
C A 0059 GLU OE2 6.688 C A 0039 HIS ND1
C A 0059 GLU OE2 7.259 C A 0039 HIS NE2
C A 0059 GLU OE1 6.840 C A 0063 HIS ND1
C A 0059 GLU OE1 7.490 C A 0063 HIS NE2
C A 0059 GLU OE2 6.495 C A 0063 HIS ND1
C A 0059 GLU OE2 6.491 C A 0063 HIS NE2
C A 0059 GLU OE1 11.89 C A 0068 ARG NH1
C A 0066 ASP OD1 10.53 C A 0063 HIS ND1
C A 0066 ASP OD2 10.87 C A 0063 HIS ND1
C A 0066 ASP OD1 10.49 C A 0068 ARG NH1
C A 0066 ASP OD1 11.47 C A 0068 ARG NH2
C A 0066 ASP OD2 10.35 C A 0068 ARG NH1
C A 0066 ASP OD2 11.55 C A 0068 ARG NH2
C A 0069 GLU OE1 10.86 C A 0026 HIS NE2
C A 0069 GLU OE2 10.10 C A 0026 HIS ND1
C A 0069 GLU OE2 8.734 C A 0026 HIS NE2
C A 0069 GLU OE1 11.74 C A 0039 HIS ND1
C A 0069 GLU OE1 11.98 C A 0039 HIS NE2
C A 0069 GLU OE1 9.449 C A 0063 HIS ND1
C A 0069 GLU OE1 10.41 C A 0063 HIS NE2
C A 0069 GLU OE2 11.32 C A 0063 HIS ND1
C A 0069 GLU OE1 10.70 C A 0068 ARG NH1
C A 0069 GLU OE1 10.94 C A 0068 ARG NH2
C A 0069 GLU OE2 11.56 C A 0068 ARG NH1
C A 0069 GLU OE2 11.47 C A 0068 ARG NH2
C A 0078 GLU OE2 11.25 C A 0026 HIS ND1
C A 0078 GLU OE1 4.488 C A 0027 HIS ND1
C A 0078 GLU OE1 5.058 C A 0027 HIS NE2
C A 0078 GLU OE2 3.896 C A 0027 HIS ND1
C A 0078 GLU OE2 5.346 C A 0027 HIS NE2
C A 0078 GLU OE1 7.122 C A 0028 LYS NZ
C A 0078 GLU OE2 5.039 C A 0028 LYS NZ
C A 0078 GLU OE1 10.81 C A 0080 HIS ND1
C A 0078 GLU OE1 10.62 C A 0080 HIS NE2
C A 0078 GLU OE1 9.652 C A 0084 ARG NH1
C A 0078 GLU OE1 11.01 C A 0084 ARG NH2
C A 0078 GLU OE2 9.082 C A 0084 ARG NH1
C A 0078 GLU OE2 10.57 C A 0084 ARG NH2
C A 0082 ASP OD1 11.95 C A 0027 HIS NE2
C A 0082 ASP OD1 5.138 C A 0080 HIS ND1
C A 0082 ASP OD1 6.505 C A 0080 HIS NE2
C A 0082 ASP OD2 4.686 C A 0080 HIS ND1
C A 0082 ASP OD2 6.283 C A 0080 HIS NE2
C A 0083 ASP OD1 10.49 C A 0027 HIS NE2
C A 0083 ASP OD2 10.58 C A 0027 HIS ND1
C A 0083 ASP OD2 8.925 C A 0027 HIS NE2
C A 0083 ASP OD1 5.780 C A 0080 HIS ND1
C A 0083 ASP OD1 7.917 C A 0080 HIS NE2
C A 0083 ASP OD2 4.556 C A 0080 HIS ND1
C A 0083 ASP OD2 6.606 C A 0080 HIS NE2
C A 0083 ASP OD1 11.19 C A 0084 ARG NH1
C A 0083 ASP OD1 10.00 C A 0084 ARG NH2
C A 0083 ASP OD2 10.33 C A 0084 ARG NH1
C A 0083 ASP OD2 9.369 C A 0084 ARG NH2
C A 0092 GLU OE1 9.043 C A 0084 ARG NH1
C A 0092 GLU OE1 7.271 C A 0084 ARG NH2
C A 0092 GLU OE2 10.04 C A 0084 ARG NH1
C A 0092 GLU OE2 8.272 C A 0084 ARG NH2
CHARGE_REPU 2.00 12.00 155
C A 0001 ASP OD1 8.732 C A 0003 ASP OD1
C A 0001 ASP OD1 10.35 C A 0003 ASP OD2
C A 0001 ASP OD2 9.980 C A 0003 ASP OD1
C A 0001 ASP OD2 11.32 C A 0003 ASP OD2
C A 0002 LYS NZ 5.723 C A 0005 LYS NZ
C A 0003 ASP OD1 9.425 C A 0078 GLU OE1
C A 0003 ASP OD1 10.65 C A 0078 GLU OE2
C A 0003 ASP OD2 8.530 C A 0078 GLU OE1
C A 0003 ASP OD2 10.05 C A 0078 GLU OE2
H A 0010 GLU OE1 9.315 H A 0011 GLU OE1
H A 0010 GLU OE1 8.552 H A 0011 GLU OE2
H A 0010 GLU OE2 9.745 H A 0011 GLU OE1
H A 0010 GLU OE2 9.435 H A 0011 GLU OE2
H A 0010 GLU OE1 11.81 C A 0082 ASP OD1
H A 0010 GLU OE1 9.673 C A 0082 ASP OD2
H A 0010 GLU OE2 9.809 C A 0082 ASP OD1
H A 0010 GLU OE2 7.662 C A 0082 ASP OD2
H A 0010 GLU OE1 8.652 C A 0083 ASP OD1
H A 0010 GLU OE1 9.215 C A 0083 ASP OD2
H A 0010 GLU OE2 6.627 C A 0083 ASP OD1
H A 0010 GLU OE2 7.403 C A 0083 ASP OD2
H A 0011 GLU OE1 11.99 E A 0031 ASP OD1
H A 0011 GLU OE1 9.854 E A 0031 ASP OD2
H A 0011 GLU OE2 10.82 E A 0031 ASP OD2
H A 0011 GLU OE1 11.72 C A 0083 ASP OD1
H A 0011 GLU OE1 10.36 C A 0083 ASP OD2
H A 0011 GLU OE2 11.54 C A 0083 ASP OD2
H A 0014 LYS NZ 10.04 C A 0015 HIS ND1
H A 0014 LYS NZ 8.324 C A 0015 HIS NE2
C A 0016 LYS NZ 10.77 C A 0047 ARG NH2
C A 0019 LYS NZ 11.62 C A 0034 LYS NZ
C A 0026 HIS ND1 9.101 C A 0027 HIS ND1
C A 0026 HIS ND1 10.56 C A 0027 HIS NE2
C A 0026 HIS NE2 10.81 C A 0027 HIS ND1
C A 0026 HIS ND1 8.913 C A 0028 LYS NZ
C A 0026 HIS NE2 10.25 C A 0028 LYS NZ
C A 0026 HIS ND1 7.329 C A 0084 ARG NH1
C A 0026 HIS ND1 7.989 C A 0084 ARG NH2
C A 0026 HIS NE2 8.820 C A 0084 ARG NH1
C A 0026 HIS NE2 8.987 C A 0084 ARG NH2
C A 0027 HIS ND1 6.738 C A 0028 LYS NZ
C A 0027 HIS NE2 8.916 C A 0028 LYS NZ
C A 0027 HIS ND1 11.00 C A 0080 HIS ND1
C A 0027 HIS ND1 11.70 C A 0080 HIS NE2
C A 0027 HIS NE2 9.128 C A 0080 HIS ND1
C A 0027 HIS NE2 9.965 C A 0080 HIS NE2
C A 0027 HIS ND1 5.263 C A 0084 ARG NH1
C A 0027 HIS ND1 6.732 C A 0084 ARG NH2
C A 0027 HIS NE2 5.057 C A 0084 ARG NH1
C A 0027 HIS NE2 6.348 C A 0084 ARG NH2
C A 0027 HIS NE2 11.35 C A 0086 LYS NZ
C A 0028 LYS NZ 8.946 C A 0072 LYS NZ
C A 0028 LYS NZ 10.43 C A 0084 ARG NH1
C A 0028 LYS NZ 11.78 C A 0084 ARG NH2
E A 0031 ASP OD1 9.250 C A 0038 GLU OE1
E A 0031 ASP OD1 11.12 C A 0038 GLU OE2
E A 0031 ASP OD2 11.36 C A 0038 GLU OE1
C A 0034 LYS NZ 10.14 C A 0039 HIS ND1
C A 0034 LYS NZ 10.63 C A 0039 HIS NE2
H A 0037 GLU OE1 6.940 C A 0038 GLU OE1
H A 0037 GLU OE1 7.591 C A 0038 GLU OE2
H A 0037 GLU OE2 7.263 C A 0038 GLU OE1
H A 0037 GLU OE2 7.311 C A 0038 GLU OE2
C A 0039 HIS ND1 6.648 C A 0063 HIS ND1
C A 0039 HIS ND1 4.632 C A 0063 HIS NE2
C A 0039 HIS NE2 5.075 C A 0063 HIS ND1
C A 0039 HIS NE2 2.890 C A 0063 HIS NE2
C A 0043 GLU OE1 8.925 C A 0044 GLU OE1
C A 0043 GLU OE1 9.083 C A 0044 GLU OE2
C A 0043 GLU OE2 10.73 C A 0044 GLU OE1
C A 0043 GLU OE2 10.59 C A 0044 GLU OE2
C A 0043 GLU OE1 8.334 C A 0048 GLU OE1
C A 0043 GLU OE1 7.712 C A 0048 GLU OE2
C A 0043 GLU OE2 10.45 C A 0048 GLU OE1
C A 0043 GLU OE2 9.754 C A 0048 GLU OE2
C A 0044 GLU OE1 5.112 C A 0048 GLU OE1
C A 0044 GLU OE1 3.101 C A 0048 GLU OE2
C A 0044 GLU OE2 6.830 C A 0048 GLU OE1
C A 0044 GLU OE2 4.699 C A 0048 GLU OE2
C A 0044 GLU OE1 9.915 C A 0056 GLU OE1
C A 0044 GLU OE1 11.39 C A 0056 GLU OE2
C A 0044 GLU OE2 11.46 C A 0056 GLU OE1
C A 0044 GLU OE1 6.678 C A 0059 GLU OE1
C A 0044 GLU OE1 7.153 C A 0059 GLU OE2
C A 0044 GLU OE2 6.154 C A 0059 GLU OE1
C A 0044 GLU OE2 6.622 C A 0059 GLU OE2
C A 0044 GLU OE1 6.400 C A 0060 ASP OD1
C A 0044 GLU OE1 6.451 C A 0060 ASP OD2
C A 0044 GLU OE2 6.105 C A 0060 ASP OD1
C A 0044 GLU OE2 5.593 C A 0060 ASP OD2
C A 0044 GLU OE1 6.517 C A 0069 GLU OE1
C A 0044 GLU OE1 6.614 C A 0069 GLU OE2
C A 0044 GLU OE2 6.678 C A 0069 GLU OE1
C A 0044 GLU OE2 7.424 C A 0069 GLU OE2
C A 0048 GLU OE1 8.744 C A 0056 GLU OE1
C A 0048 GLU OE1 10.49 C A 0056 GLU OE2
C A 0048 GLU OE2 9.386 C A 0056 GLU OE1
C A 0048 GLU OE2 11.11 C A 0056 GLU OE2
C A 0048 GLU OE1 11.56 C A 0059 GLU OE1
C A 0048 GLU OE1 11.95 C A 0059 GLU OE2
C A 0048 GLU OE2 9.727 C A 0059 GLU OE1
C A 0048 GLU OE2 10.09 C A 0059 GLU OE2
C A 0048 GLU OE1 9.436 C A 0060 ASP OD1
C A 0048 GLU OE1 9.550 C A 0060 ASP OD2
C A 0048 GLU OE2 8.126 C A 0060 ASP OD1
C A 0048 GLU OE2 8.065 C A 0060 ASP OD2
C A 0048 GLU OE1 10.68 C A 0069 GLU OE1
C A 0048 GLU OE1 9.934 C A 0069 GLU OE2
C A 0048 GLU OE2 9.203 C A 0069 GLU OE1
C A 0048 GLU OE2 8.812 C A 0069 GLU OE2
C A 0053 ASP OD1 11.03 C A 0056 GLU OE1
C A 0053 ASP OD1 10.49 C A 0056 GLU OE2
C A 0053 ASP OD2 8.970 C A 0056 GLU OE1
C A 0053 ASP OD2 8.346 C A 0056 GLU OE2
C A 0053 ASP OD1 9.084 C A 0092 GLU OE1
C A 0053 ASP OD1 11.09 C A 0092 GLU OE2
C A 0053 ASP OD2 10.26 C A 0092 GLU OE1
C A 0056 GLU OE1 8.678 C A 0060 ASP OD1
C A 0056 GLU OE1 10.24 C A 0060 ASP OD2
C A 0056 GLU OE2 10.00 C A 0060 ASP OD1
C A 0056 GLU OE2 11.78 C A 0060 ASP OD2
C A 0056 GLU OE1 10.23 C A 0069 GLU OE1
C A 0056 GLU OE1 8.752 C A 0069 GLU OE2
C A 0056 GLU OE2 10.72 C A 0069 GLU OE1
C A 0056 GLU OE2 9.045 C A 0069 GLU OE2
C A 0059 GLU OE1 7.542 C A 0060 ASP OD1
C A 0059 GLU OE1 8.180 C A 0060 ASP OD2
C A 0059 GLU OE2 9.382 C A 0060 ASP OD1
C A 0059 GLU OE2 9.790 C A 0060 ASP OD2
C A 0059 GLU OE1 11.02 C A 0066 ASP OD1
C A 0059 GLU OE1 3.234 C A 0069 GLU OE1
C A 0059 GLU OE1 4.932 C A 0069 GLU OE2
C A 0059 GLU OE2 5.140 C A 0069 GLU OE1
C A 0059 GLU OE2 6.422 C A 0069 GLU OE2
C A 0060 ASP OD1 9.600 C A 0066 ASP OD1
C A 0060 ASP OD1 11.65 C A 0066 ASP OD2
C A 0060 ASP OD2 9.217 C A 0066 ASP OD1
C A 0060 ASP OD2 11.35 C A 0066 ASP OD2
C A 0060 ASP OD1 5.797 C A 0069 GLU OE1
C A 0060 ASP OD1 6.527 C A 0069 GLU OE2
C A 0060 ASP OD2 7.207 C A 0069 GLU OE1
C A 0060 ASP OD2 8.206 C A 0069 GLU OE2
C A 0066 ASP OD1 11.13 C A 0069 GLU OE1
C A 0068 ARG NH1 8.974 C A 0072 LYS NZ
C A 0068 ARG NH2 9.988 C A 0072 LYS NZ
C A 0078 GLU OE1 11.95 C A 0083 ASP OD2
C A 0082 ASP OD1 5.997 C A 0083 ASP OD1
C A 0082 ASP OD1 6.578 C A 0083 ASP OD2
C A 0082 ASP OD2 4.533 C A 0083 ASP OD1
C A 0082 ASP OD2 5.294 C A 0083 ASP OD2
C A 0083 ASP OD1 10.77 C A 0092 GLU OE1
C A 0083 ASP OD1 9.471 C A 0092 GLU OE2
C A 0083 ASP OD2 11.58 C A 0092 GLU OE1
C A 0083 ASP OD2 10.62 C A 0092 GLU OE2
C A 0084 ARG NH1 10.97 C A 0086 LYS NZ
HB_MM 2.00 3.20 125
C A 0002 LYS N 2.205 C A 0001 ASP O
C A 0003 ASP N 2.205 C A 0002 LYS O
C A 0004 VAL N 2.205 C A 0003 ASP O
C A 0005 LYS N 3.182 C A 0003 ASP O
C A 0005 LYS N 2.205 C A 0004 VAL O
C A 0006 TYR N 2.202 C A 0005 LYS O
C A 0007 TYR N 2.204 C A 0006 TYR O
C A 0008 THR N 2.204 C A 0007 TYR O
H A 0009 LEU N 2.206 C A 0008 THR O
H A 0010 GLU N 2.204 H A 0009 LEU O
H A 0011 GLU N 2.205 H A 0010 GLU O
H A 0012 ILE N 2.205 H A 0011 GLU O
H A 0013 GLN N 3.051 H A 0009 LEU O
H A 0013 GLN N 2.205 H A 0012 ILE O
H A 0014 LYS N 3.048 H A 0010 GLU O
H A 0014 LYS N 2.206 H A 0013 GLN O
C A 0015 HIS N 3.085 H A 0013 GLN O
C A 0015 HIS N 2.205 H A 0014 LYS O
C A 0016 LYS N 2.965 H A 0014 LYS O
C A 0016 LYS N 2.205 C A 0015 HIS O
C A 0017 ASP N 2.205 C A 0016 LYS O
C A 0018 SER N 2.206 C A 0017 ASP O
C A 0019 LYS N 2.205 C A 0018 SER O
C A 0020 SER N 2.203 C A 0019 LYS O
C A 0021 THR N 2.723 C A 0019 LYS O
C A 0021 THR N 2.206 C A 0020 SER O
E A 0022 TRP N 2.208 C A 0021 THR O
E A 0023 VAL N 2.205 E A 0022 TRP O
E A 0023 VAL N 3.070 E A 0030 TYR O
E A 0024 ILE N 2.203 E A 0023 VAL O
C A 0025 LEU N 2.206 E A 0024 ILE O
C A 0026 HIS N 2.206 C A 0025 LEU O
C A 0027 HIS N 2.205 C A 0026 HIS O
C A 0028 LYS N 2.204 C A 0027 HIS O
E A 0029 VAL N 2.205 C A 0028 LYS O
E A 0029 VAL N 3.190 C A 0077 GLY O
E A 0030 TYR N 2.928 E A 0023 VAL O
E A 0030 TYR N 2.203 E A 0029 VAL O
E A 0031 ASP N 2.203 E A 0030 TYR O
E A 0031 ASP N 2.989 C A 0074 TYR O
C A 0032 LEU N 2.739 E A 0030 TYR O
C A 0032 LEU N 2.206 E A 0031 ASP O
C A 0033 THR N 2.205 C A 0032 LEU O
C A 0034 LYS N 2.205 C A 0033 THR O
H A 0035 PHE N 3.149 C A 0032 LEU O
H A 0035 PHE N 2.205 C A 0034 LYS O
H A 0036 LEU N 3.090 C A 0034 LYS O
H A 0036 LEU N 2.205 H A 0035 PHE O
H A 0037 GLU N 3.028 C A 0034 LYS O
H A 0037 GLU N 3.184 H A 0035 PHE O
H A 0037 GLU N 2.205 H A 0036 LEU O
C A 0038 GLU N 3.052 C A 0034 LYS O
C A 0038 GLU N 3.193 H A 0035 PHE O
C A 0038 GLU N 2.205 H A 0037 GLU O
C A 0039 HIS N 2.205 C A 0038 GLU O
C A 0040 PRO N 2.231 C A 0039 HIS O
C A 0041 GLY N 2.205 C A 0040 PRO O
C A 0042 GLY N 2.205 C A 0041 GLY O
C A 0043 GLU N 2.205 C A 0042 GLY O
C A 0044 GLU N 2.204 C A 0043 GLU O
C A 0045 VAL N 2.956 C A 0043 GLU O
C A 0045 VAL N 2.202 C A 0044 GLU O
C A 0046 LEU N 3.097 C A 0044 GLU O
C A 0046 LEU N 2.206 C A 0045 VAL O
C A 0047 ARG N 3.113 C A 0044 GLU O
C A 0047 ARG N 3.159 C A 0045 VAL O
C A 0047 ARG N 2.205 C A 0046 LEU O
C A 0048 GLU N 2.205 C A 0047 ARG O
C A 0049 GLN N 2.734 C A 0047 ARG O
C A 0049 GLN N 2.205 C A 0048 GLU O
C A 0050 ALA N 2.205 C A 0049 GLN O
C A 0051 GLY N 2.205 C A 0050 ALA O
C A 0052 GLY N 2.205 C A 0051 GLY O
C A 0053 ASP N 2.205 C A 0052 GLY O
C A 0054 ALA N 2.205 C A 0053 ASP O
C A 0055 THR N 2.205 C A 0054 ALA O
C A 0056 GLU N 2.811 C A 0054 ALA O
C A 0056 GLU N 2.204 C A 0055 THR O
C A 0057 ASN N 2.205 C A 0056 GLU O
C A 0058 PHE N 2.205 C A 0057 ASN O
C A 0059 GLU N 2.206 C A 0058 PHE O
C A 0060 ASP N 2.205 C A 0059 GLU O
C A 0061 VAL N 2.205 C A 0060 ASP O
C A 0062 GLY N 2.204 C A 0061 VAL O
C A 0063 HIS N 2.205 C A 0062 GLY O
C A 0064 SER N 2.205 C A 0063 HIS O
C A 0065 THR N 2.695 C A 0063 HIS O
C A 0065 THR N 2.205 C A 0064 SER O
C A 0066 ASP N 2.205 C A 0065 THR O
C A 0067 ALA N 2.205 C A 0066 ASP O
C A 0068 ARG N 2.206 C A 0067 ALA O
C A 0069 GLU N 2.205 C A 0068 ARG O
C A 0070 LEU N 2.205 C A 0069 GLU O
C A 0071 SER N 3.040 C A 0069 GLU O
C A 0071 SER N 2.206 C A 0070 LEU O
C A 0072 LYS N 2.568 C A 0070 LEU O
C A 0072 LYS N 2.206 C A 0071 SER O
C A 0073 THR N 2.206 C A 0072 LYS O
C A 0074 TYR N 2.205 C A 0073 THR O
C A 0075 ILE N 2.206 C A 0074 TYR O
C A 0076 ILE N 2.204 C A 0075 ILE O
C A 0077 GLY N 2.203 C A 0076 ILE O
C A 0078 GLU N 2.206 C A 0077 GLY O
C A 0079 LEU N 2.205 C A 0078 GLU O
C A 0080 HIS N 2.205 C A 0079 LEU O
C A 0081 PRO N 2.224 C A 0080 HIS O
C A 0082 ASP N 2.204 C A 0081 PRO O
C A 0083 ASP N 3.101 C A 0081 PRO O
C A 0083 ASP N 2.207 C A 0082 ASP O
C A 0084 ARG N 3.168 C A 0081 PRO O
C A 0084 ARG N 2.205 C A 0083 ASP O
C A 0085 SER N 3.057 C A 0083 ASP O
C A 0085 SER N 2.205 C A 0084 ARG O
C A 0086 LYS N 2.662 C A 0084 ARG O
C A 0086 LYS N 2.205 C A 0085 SER O
C A 0087 ILE N 2.206 C A 0086 LYS O
C A 0088 ALA N 2.205 C A 0087 ILE O
C A 0089 LYS N 2.205 C A 0088 ALA O
C A 0090 PRO N 2.232 C A 0089 LYS O
C A 0091 SER N 2.206 C A 0090 PRO O
C A 0092 GLU N 2.559 C A 0090 PRO O
C A 0092 GLU N 2.205 C A 0091 SER O
C A 0093 THR N 3.110 C A 0090 PRO O
C A 0093 THR N 2.205 C A 0092 GLU O
C A 0094 LEU N 2.205 C A 0093 THR O
HB_MS 2.00 3.20 11
H A 0009 LEU O 3.067 H A 0013 GLN NE2
C A 0015 HIS O 2.653 C A 0021 THR OG1
E A 0022 TRP N 2.848 C A 0021 THR OG1
C A 0034 LYS N 2.933 C A 0033 THR OG1
C A 0060 ASP N 3.066 C A 0044 GLU OE2
C A 0066 ASP N 2.715 C A 0065 THR OG1
C A 0070 LEU N 3.189 C A 0059 GLU OE1
C A 0076 ILE O 2.630 C A 0007 TYR OH
C A 0090 PRO O 2.506 C A 0085 SER OG
C A 0090 PRO O 2.616 C A 0091 SER OG
C A 0094 LEU N 2.725 C A 0093 THR OG1
HB_SS 2.00 3.20 1
E A 0031 ASP OD2 2.731 E A 0022 TRP NE1
AROMATIC 0.00 8.00 4
H A 0035 PHE 5.262 C A 0074 TYR
C A 0084 ARG 7.872 C A 0026 HIS
C A 0005 LYS 7.219 C A 0007 TYR
C A 0028 LYS 7.949 C A 0027 HIS