Complet list of 2cqi con file
Complete list of 2cqi.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 462
C A -001 SER CA 3.792 C A 0000 GLY CA
C A -001 SER C 2.418 C A 0000 GLY CA
C A -001 SER C 3.074 C A 0000 GLY C
C A -002 SER C 2.435 C A -001 SER CA
C A -002 SER C 2.951 C A -001 SER C
C A -002 SER C 3.714 C A -001 SER CB
C A -003 GLY CA 3.797 C A -002 SER CA
C A -003 GLY C 2.434 C A -002 SER CA
C A -003 GLY C 3.676 C A -002 SER C
C A -003 GLY C 3.190 C A -002 SER CB
C A -004 SER CA 3.791 C A -003 GLY CA
C A -004 SER C 2.418 C A -003 GLY CA
C A -004 SER C 3.428 C A -003 GLY C
C A -005 SER C 2.434 C A -004 SER CA
C A -005 SER C 3.687 C A -004 SER C
C A -005 SER C 3.153 C A -004 SER CB
C A -006 GLY CA 3.797 C A -005 SER CA
C A -006 GLY C 2.434 C A -005 SER CA
C A -006 GLY C 2.839 C A -005 SER C
C A -006 GLY C 3.689 C A -005 SER CB
C A 0000 GLY CA 3.797 C A 0001 MET CA
C A 0000 GLY C 2.433 C A 0001 MET CA
C A 0000 GLY C 3.573 C A 0001 MET C
C A 0000 GLY C 3.380 C A 0001 MET CB
C A 0001 MET C 2.434 C A 0002 MET CA
C A 0001 MET C 3.616 C A 0002 MET C
C A 0001 MET C 3.311 C A 0002 MET CB
C A 0002 MET C 2.434 C A 0003 GLU CA
C A 0002 MET C 3.435 C A 0003 GLU C
C A 0002 MET C 3.533 C A 0003 GLU CB
C A 0002 MET C 3.752 C A 0003 GLU CD
C A 0003 GLU C 2.433 C A 0004 ASP CA
C A 0003 GLU C 3.206 C A 0004 ASP C
C A 0003 GLU C 3.667 C A 0004 ASP CB
C A 0004 ASP C 2.433 C A 0005 ASP CA
C A 0004 ASP C 3.473 C A 0005 ASP C
C A 0004 ASP C 3.495 C A 0005 ASP CB
C A 0004 ASP C 3.593 C A 0005 ASP CG
C A 0005 ASP CA 3.792 C A 0006 GLY CA
C A 0005 ASP C 2.417 C A 0006 GLY CA
C A 0005 ASP C 3.712 C A 0006 GLY C
C A 0006 GLY CA 3.796 C A 0007 GLN CA
C A 0006 GLY C 2.434 C A 0007 GLN CA
C A 0006 GLY C 2.916 C A 0007 GLN C
C A 0006 GLY C 3.710 C A 0007 GLN CB
C A 0007 GLN CA 2.867 C A 0008 PRO CD
C A 0007 GLN C 2.463 C A 0008 PRO CA
C A 0007 GLN C 3.136 C A 0008 PRO C
C A 0007 GLN C 3.645 C A 0008 PRO CB
C A 0007 GLN C 3.635 C A 0008 PRO CG
C A 0007 GLN C 2.498 C A 0008 PRO CD
C A 0007 GLN CB 3.585 C A 0008 PRO CD
C A 0007 GLN CB 3.590 H A 0058 HIS CB
C A 0007 GLN CB 3.701 H A 0058 HIS CG
C A 0008 PRO C 2.434 C A 0009 ARG CA
C A 0008 PRO C 3.573 C A 0009 ARG C
C A 0008 PRO C 3.379 C A 0009 ARG CB
C A 0008 PRO C 3.463 C A 0009 ARG CG
C A 0008 PRO CG 3.503 H A 0058 HIS CE1
C A 0008 PRO CD 3.548 H A 0058 HIS CE1
C A 0008 PRO C 3.771 E A 0082 TRP CZ3
C A 0008 PRO CB 3.402 E A 0082 TRP CE3
C A 0008 PRO CB 3.437 E A 0082 TRP CZ3
C A 0008 PRO CG 3.472 E A 0082 TRP CE3
C A 0008 PRO CG 3.349 E A 0082 TRP CZ3
C A 0009 ARG C 2.434 E A 0010 THR CA
C A 0009 ARG C 3.528 E A 0010 THR C
C A 0009 ARG C 3.468 E A 0010 THR CB
E A 0010 THR C 2.434 E A 0011 LEU CA
E A 0010 THR C 3.545 E A 0011 LEU C
E A 0010 THR C 3.417 E A 0011 LEU CB
E A 0010 THR C 3.416 E A 0011 LEU CG
E A 0010 THR C 3.656 E A 0011 LEU CD2
E A 0011 LEU C 2.434 E A 0012 TYR CA
E A 0011 LEU C 3.351 E A 0012 TYR C
E A 0011 LEU C 3.594 E A 0012 TYR CB
E A 0011 LEU CD1 3.772 H A 0065 LEU CB
E A 0011 LEU CD2 3.788 H A 0065 LEU CB
E A 0011 LEU CD2 3.407 E A 0082 TRP CE3
E A 0011 LEU CD2 3.479 E A 0082 TRP CZ3
E A 0012 TYR C 2.434 E A 0013 VAL CA
E A 0012 TYR C 3.375 E A 0013 VAL C
E A 0012 TYR C 3.605 E A 0013 VAL CB
E A 0012 TYR C 3.700 E A 0013 VAL CG2
E A 0012 TYR CE2 3.619 E A 0050 TYR CB
E A 0012 TYR CD2 3.752 E A 0052 PHE CE1
E A 0013 VAL CA 3.791 E A 0014 GLY CA
E A 0013 VAL C 2.418 E A 0014 GLY CA
E A 0013 VAL C 3.524 E A 0014 GLY C
E A 0013 VAL CG1 3.712 C A 0016 LEU CG
E A 0013 VAL CG1 3.698 C A 0016 LEU CD1
E A 0013 VAL CG1 3.446 C A 0016 LEU CD2
E A 0014 GLY CA 3.797 C A 0015 ASN CA
E A 0014 GLY C 2.434 C A 0015 ASN CA
E A 0014 GLY C 3.032 C A 0015 ASN C
E A 0014 GLY C 2.969 C A 0015 ASN CB
E A 0014 GLY CA 3.674 E A 0079 LYS CG
E A 0014 GLY C 3.577 E A 0079 LYS CG
C A 0015 ASN C 2.434 C A 0016 LEU CA
C A 0015 ASN C 3.298 C A 0016 LEU C
C A 0015 ASN C 3.626 C A 0016 LEU CB
C A 0015 ASN CA 3.502 C A 0048 ASP CG
C A 0016 LEU C 2.434 C A 0017 SER CA
C A 0016 LEU C 3.061 C A 0017 SER C
C A 0016 LEU C 3.708 C A 0017 SER CB
C A 0016 LEU CD2 3.713 C A 0020 VAL CG1
C A 0016 LEU CD2 3.594 H A 0025 ILE CD1
C A 0016 LEU CD2 3.608 E A 0078 VAL CG1
C A 0017 SER C 2.434 C A 0018 ARG CA
C A 0017 SER C 2.968 C A 0018 ARG C
C A 0017 SER C 3.716 C A 0018 ARG CB
C A 0017 SER CA 3.502 E A 0076 LYS CD
C A 0017 SER CB 3.590 E A 0076 LYS CD
C A 0018 ARG C 2.433 C A 0019 ASP CA
C A 0018 ARG C 3.209 C A 0019 ASP C
C A 0018 ARG C 3.666 C A 0019 ASP CB
C A 0019 ASP C 2.434 C A 0020 VAL CA
C A 0019 ASP C 2.993 C A 0020 VAL C
C A 0019 ASP C 3.736 C A 0020 VAL CB
C A 0019 ASP C 3.735 C A 0074 LEU CD1
C A 0019 ASP CB 3.541 C A 0074 LEU CD1
C A 0019 ASP CG 3.667 C A 0074 LEU CD1
C A 0020 VAL C 2.433 C A 0021 THR CA
C A 0020 VAL C 3.586 C A 0021 THR C
C A 0020 VAL C 3.394 C A 0021 THR CB
C A 0020 VAL C 3.527 C A 0021 THR CG2
C A 0020 VAL CG1 3.699 H A 0025 ILE CG1
C A 0020 VAL C 3.458 E A 0040 MET CE
C A 0020 VAL CG1 3.379 E A 0040 MET CE
C A 0020 VAL CG2 3.517 C A 0074 LEU CD1
C A 0021 THR C 2.434 H A 0022 GLU CA
C A 0021 THR C 2.998 H A 0022 GLU C
C A 0021 THR C 3.716 H A 0022 GLU CB
C A 0021 THR CA 3.464 E A 0040 MET CE
C A 0021 THR C 3.561 E A 0040 MET CE
H A 0022 GLU C 2.435 H A 0023 VAL CA
H A 0022 GLU C 3.051 H A 0023 VAL C
H A 0022 GLU C 3.734 H A 0023 VAL CB
H A 0022 GLU CD 3.373 H A 0026 LEU CD1
H A 0023 VAL C 2.434 H A 0024 LEU CA
H A 0023 VAL C 2.991 H A 0024 LEU C
H A 0023 VAL C 3.715 H A 0024 LEU CB
H A 0024 LEU C 2.433 H A 0025 ILE CA
H A 0024 LEU C 2.985 H A 0025 ILE C
H A 0024 LEU C 3.736 H A 0025 ILE CB
H A 0024 LEU CD2 3.667 H A 0028 LEU CG
H A 0024 LEU CD2 3.564 H A 0028 LEU CD1
H A 0024 LEU CD1 3.662 C A 0074 LEU CD1
H A 0025 ILE C 2.435 H A 0026 LEU CA
H A 0025 ILE C 2.988 H A 0026 LEU C
H A 0025 ILE C 3.714 H A 0026 LEU CB
H A 0025 ILE CG2 3.449 H A 0029 PHE CD1
H A 0025 ILE CG2 3.583 H A 0029 PHE CE1
H A 0025 ILE CG2 3.464 E A 0053 VAL CG2
H A 0026 LEU C 2.434 H A 0027 GLN CA
H A 0026 LEU C 3.070 H A 0027 GLN C
H A 0026 LEU C 3.707 H A 0027 GLN CB
H A 0026 LEU CD2 3.161 C A 0035 CYS CB
H A 0026 LEU CG 3.599 E A 0038 CYS CB
H A 0026 LEU CD2 3.599 E A 0038 CYS CB
H A 0027 GLN C 2.435 H A 0028 LEU CA
H A 0027 GLN C 3.034 H A 0028 LEU C
H A 0027 GLN C 3.711 H A 0028 LEU CB
H A 0028 LEU C 2.434 H A 0029 PHE CA
H A 0028 LEU C 3.066 H A 0029 PHE C
H A 0028 LEU C 3.709 H A 0029 PHE CB
H A 0028 LEU CD1 3.618 C A 0073 ILE CG1
H A 0028 LEU CD1 3.411 C A 0073 ILE CD1
H A 0029 PHE C 2.434 H A 0030 SER CA
H A 0029 PHE C 3.006 H A 0030 SER C
H A 0029 PHE C 3.715 H A 0030 SER CB
H A 0029 PHE CD2 3.547 E A 0053 VAL CG1
H A 0029 PHE CD2 3.613 C A 0055 PHE CE2
H A 0029 PHE CD2 3.620 C A 0055 PHE CZ
H A 0029 PHE CE1 3.481 H A 0068 MET CG
H A 0029 PHE CE1 3.301 H A 0068 MET CE
H A 0029 PHE CE2 3.502 H A 0068 MET CG
H A 0029 PHE CZ 3.412 H A 0068 MET CB
H A 0029 PHE CZ 3.262 H A 0068 MET CG
H A 0030 SER C 2.433 H A 0031 GLN CA
H A 0030 SER C 2.959 H A 0031 GLN C
H A 0030 SER C 3.714 H A 0031 GLN CB
H A 0031 GLN C 2.434 H A 0032 ILE CA
H A 0031 GLN C 3.232 H A 0032 ILE C
H A 0031 GLN C 3.681 H A 0032 ILE CB
H A 0032 ILE CA 3.791 C A 0033 GLY CA
H A 0032 ILE C 2.418 C A 0033 GLY CA
H A 0032 ILE C 3.673 C A 0033 GLY C
H A 0032 ILE CD1 3.496 H A 0064 ALA CA
H A 0032 ILE CD1 3.789 H A 0064 ALA CB
H A 0032 ILE CD1 3.531 H A 0067 ALA CB
C A 0033 GLY CA 2.866 C A 0034 PRO CD
C A 0033 GLY C 2.463 C A 0034 PRO CA
C A 0033 GLY C 3.135 C A 0034 PRO C
C A 0033 GLY C 3.644 C A 0034 PRO CB
C A 0033 GLY C 3.635 C A 0034 PRO CG
C A 0033 GLY C 2.497 C A 0034 PRO CD
C A 0033 GLY C 3.583 C A 0055 PHE CE1
C A 0034 PRO C 2.433 C A 0035 CYS CA
C A 0034 PRO C 3.372 C A 0035 CYS C
C A 0034 PRO C 3.578 C A 0035 CYS CB
C A 0034 PRO C 3.761 C A 0055 PHE CD1
C A 0034 PRO C 3.780 C A 0056 TYR CD1
C A 0034 PRO CB 3.492 C A 0056 TYR CD1
C A 0035 CYS C 2.434 C A 0036 LYS CA
C A 0035 CYS C 3.008 C A 0036 LYS C
C A 0035 CYS C 3.714 C A 0036 LYS CB
C A 0036 LYS C 2.435 E A 0037 SER CA
C A 0036 LYS C 3.712 E A 0037 SER C
C A 0036 LYS C 3.056 E A 0037 SER CB
C A 0036 LYS CA 3.700 C A 0056 TYR CE1
C A 0036 LYS CD 3.764 C A 0056 TYR CG
C A 0036 LYS CD 3.535 C A 0056 TYR CD2
C A 0036 LYS CD 3.708 C A 0056 TYR CE1
C A 0036 LYS CD 3.398 C A 0056 TYR CE2
C A 0036 LYS CD 3.487 C A 0056 TYR CZ
C A 0036 LYS CE 3.718 C A 0056 TYR CE2
E A 0037 SER C 2.434 E A 0038 CYS CA
E A 0037 SER C 3.549 E A 0038 CYS C
E A 0037 SER C 3.412 E A 0038 CYS CB
E A 0038 CYS C 2.434 E A 0039 LYS CA
E A 0038 CYS C 3.512 E A 0039 LYS C
E A 0038 CYS C 3.458 E A 0039 LYS CB
E A 0039 LYS C 2.433 E A 0040 MET CA
E A 0039 LYS C 3.242 E A 0040 MET C
E A 0039 LYS C 3.653 E A 0040 MET CB
E A 0040 MET C 2.432 E A 0041 ILE CA
E A 0040 MET C 3.412 E A 0041 ILE C
E A 0040 MET C 3.574 E A 0041 ILE CB
E A 0040 MET C 3.627 E A 0041 ILE CG1
E A 0040 MET CA 3.504 E A 0051 CYS CB
E A 0041 ILE C 2.434 C A 0042 THR CA
E A 0041 ILE C 3.534 C A 0042 THR C
E A 0041 ILE C 3.461 C A 0042 THR CB
E A 0041 ILE C 3.488 C A 0042 THR CG2
E A 0041 ILE CB 3.436 E A 0050 TYR CE2
E A 0041 ILE CB 3.512 E A 0050 TYR CZ
E A 0041 ILE CG2 3.509 E A 0050 TYR CZ
E A 0041 ILE CD1 3.670 E A 0050 TYR CE2
E A 0041 ILE CD1 3.597 E A 0052 PHE CE2
C A 0042 THR C 2.434 C A 0043 GLU CA
C A 0042 THR C 3.020 C A 0043 GLU C
C A 0042 THR C 3.715 C A 0043 GLU CB
C A 0042 THR CG2 3.399 C A 0049 PRO CB
C A 0043 GLU C 2.434 C A 0044 HIS CA
C A 0043 GLU C 3.201 C A 0044 HIS C
C A 0043 GLU C 3.670 C A 0044 HIS CB
C A 0044 HIS C 2.433 C A 0045 THR CA
C A 0044 HIS C 3.222 C A 0045 THR C
C A 0044 HIS C 3.686 C A 0045 THR CB
C A 0044 HIS CD2 3.501 E A 0050 TYR CE1
C A 0045 THR C 2.434 C A 0046 SER CA
C A 0045 THR C 2.864 C A 0046 SER C
C A 0045 THR C 3.699 C A 0046 SER CB
C A 0046 SER C 2.435 C A 0047 ASN CA
C A 0046 SER C 3.387 C A 0047 ASN C
C A 0046 SER C 3.570 C A 0047 ASN CB
C A 0047 ASN C 2.433 C A 0048 ASP CA
C A 0047 ASN C 2.961 C A 0048 ASP C
C A 0047 ASN C 3.713 C A 0048 ASP CB
C A 0048 ASP CA 2.867 C A 0049 PRO CD
C A 0048 ASP C 2.463 C A 0049 PRO CA
C A 0048 ASP C 3.136 C A 0049 PRO C
C A 0048 ASP C 3.645 C A 0049 PRO CB
C A 0048 ASP C 3.635 C A 0049 PRO CG
C A 0048 ASP C 2.498 C A 0049 PRO CD
C A 0048 ASP CB 3.365 C A 0049 PRO CD
C A 0049 PRO C 2.433 E A 0050 TYR CA
C A 0049 PRO C 3.670 E A 0050 TYR C
C A 0049 PRO C 3.202 E A 0050 TYR CB
E A 0050 TYR C 2.435 E A 0051 CYS CA
E A 0050 TYR C 3.595 E A 0051 CYS C
E A 0050 TYR C 3.348 E A 0051 CYS CB
E A 0051 CYS C 2.433 E A 0052 PHE CA
E A 0051 CYS C 3.394 E A 0052 PHE C
E A 0051 CYS C 3.563 E A 0052 PHE CB
E A 0051 CYS C 3.796 E A 0052 PHE CG
E A 0052 PHE C 2.433 E A 0053 VAL CA
E A 0052 PHE C 3.536 E A 0053 VAL C
E A 0052 PHE C 3.458 E A 0053 VAL CB
E A 0052 PHE C 3.534 E A 0053 VAL CG2
E A 0053 VAL C 2.432 E A 0054 GLU CA
E A 0053 VAL C 3.378 E A 0054 GLU C
E A 0053 VAL C 3.575 E A 0054 GLU CB
E A 0053 VAL CG1 3.425 C A 0055 PHE CE2
E A 0054 GLU C 2.433 C A 0055 PHE CA
E A 0054 GLU C 3.368 C A 0055 PHE C
E A 0054 GLU C 3.582 C A 0055 PHE CB
C A 0055 PHE C 2.433 C A 0056 TYR CA
C A 0055 PHE C 3.112 C A 0056 TYR C
C A 0055 PHE C 3.697 C A 0056 TYR CB
C A 0055 PHE CD1 3.404 H A 0060 ASP CB
C A 0055 PHE CG 3.757 H A 0061 ALA CA
C A 0055 PHE CD2 3.430 H A 0061 ALA CA
C A 0055 PHE CE2 3.401 H A 0064 ALA CB
C A 0055 PHE CZ 3.102 H A 0064 ALA CB
C A 0056 TYR C 2.434 C A 0057 GLU CA
C A 0056 TYR C 3.524 C A 0057 GLU C
C A 0056 TYR C 3.445 C A 0057 GLU CB
C A 0056 TYR C 3.430 C A 0057 GLU CG
C A 0057 GLU C 2.435 H A 0058 HIS CA
C A 0057 GLU C 3.113 H A 0058 HIS C
C A 0057 GLU C 3.698 H A 0058 HIS CB
H A 0058 HIS C 2.433 H A 0059 ARG CA
H A 0058 HIS C 2.988 H A 0059 ARG C
H A 0058 HIS C 3.714 H A 0059 ARG CB
H A 0058 HIS CE1 3.729 E A 0082 TRP CZ2
H A 0058 HIS CE1 3.354 E A 0082 TRP CH2
H A 0059 ARG C 2.433 H A 0060 ASP CA
H A 0059 ARG C 3.087 H A 0060 ASP C
H A 0059 ARG C 3.703 H A 0060 ASP CB
H A 0059 ARG CG 3.759 H A 0060 ASP CG
H A 0060 ASP C 2.434 H A 0061 ALA CA
H A 0060 ASP C 2.982 H A 0061 ALA C
H A 0060 ASP C 3.707 H A 0061 ALA CB
H A 0061 ALA C 2.433 H A 0062 ALA CA
H A 0061 ALA C 3.059 H A 0062 ALA C
H A 0061 ALA C 3.702 H A 0062 ALA CB
H A 0062 ALA C 2.433 H A 0063 ALA CA
H A 0062 ALA C 3.035 H A 0063 ALA C
H A 0062 ALA C 3.704 H A 0063 ALA CB
H A 0062 ALA CA 3.622 E A 0082 TRP CZ2
H A 0062 ALA CA 3.790 E A 0082 TRP CH2
H A 0062 ALA CB 3.704 E A 0082 TRP CZ2
H A 0063 ALA C 2.434 H A 0064 ALA CA
H A 0063 ALA C 3.079 H A 0064 ALA C
H A 0063 ALA C 3.697 H A 0064 ALA CB
H A 0064 ALA C 2.434 H A 0065 LEU CA
H A 0064 ALA C 3.007 H A 0065 LEU C
H A 0064 ALA C 3.713 H A 0065 LEU CB
H A 0065 LEU C 2.434 H A 0066 ALA CA
H A 0065 LEU C 3.068 H A 0066 ALA C
H A 0065 LEU C 3.700 H A 0066 ALA CB
H A 0065 LEU C 3.795 C A 0069 ASN CB
H A 0065 LEU CD1 3.327 E A 0080 VAL C
H A 0065 LEU CD1 3.367 E A 0080 VAL CG1
H A 0065 LEU CD1 3.339 E A 0081 ASN CA
H A 0065 LEU CD1 3.459 E A 0081 ASN C
H A 0065 LEU CD2 3.287 E A 0082 TRP CD1
H A 0065 LEU CD2 3.740 E A 0082 TRP CD2
H A 0065 LEU CD2 3.100 E A 0082 TRP CE2
H A 0065 LEU CD2 3.611 E A 0082 TRP CZ2
H A 0066 ALA C 2.434 H A 0067 ALA CA
H A 0066 ALA C 3.045 H A 0067 ALA C
H A 0066 ALA C 3.704 H A 0067 ALA CB
H A 0066 ALA CA 3.739 C A 0069 ASN CB
H A 0066 ALA C 3.795 C A 0069 ASN CB
H A 0067 ALA C 2.434 H A 0068 MET CA
H A 0067 ALA C 3.263 H A 0068 MET C
H A 0067 ALA C 3.643 H A 0068 MET CB
H A 0068 MET C 2.435 C A 0069 ASN CA
H A 0068 MET C 2.966 C A 0069 ASN C
H A 0068 MET C 3.715 C A 0069 ASN CB
H A 0068 MET CA 3.774 C A 0071 ARG CB
H A 0068 MET C 3.782 C A 0071 ARG CB
H A 0068 MET CE 3.771 C A 0071 ARG CD
H A 0068 MET CE 3.383 C A 0073 ILE CD1
H A 0068 MET C 3.418 E A 0080 VAL CG2
H A 0068 MET CB 3.548 E A 0080 VAL CG2
C A 0069 ASN CA 3.792 C A 0070 GLY CA
C A 0069 ASN C 2.418 C A 0070 GLY CA
C A 0069 ASN C 3.087 C A 0070 GLY C
C A 0070 GLY CA 3.796 C A 0071 ARG CA
C A 0070 GLY C 2.433 C A 0071 ARG CA
C A 0070 GLY C 3.208 C A 0071 ARG C
C A 0070 GLY C 3.668 C A 0071 ARG CB
C A 0070 GLY C 3.505 E A 0077 GLU CG
C A 0071 ARG C 2.434 C A 0072 LYS CA
C A 0071 ARG C 3.262 C A 0072 LYS C
C A 0071 ARG C 3.646 C A 0072 LYS CB
C A 0072 LYS C 2.433 C A 0073 ILE CA
C A 0072 LYS C 3.582 C A 0073 ILE C
C A 0072 LYS C 3.397 C A 0073 ILE CB
C A 0072 LYS C 3.335 C A 0073 ILE CG1
C A 0072 LYS CE 3.637 C A 0075 GLY C
C A 0072 LYS CE 3.633 E A 0076 LYS CA
C A 0072 LYS CE 3.143 E A 0076 LYS C
C A 0072 LYS CE 3.347 E A 0077 GLU CA
C A 0072 LYS CE 3.567 E A 0077 GLU CB
C A 0073 ILE C 2.434 C A 0074 LEU CA
C A 0073 ILE C 3.001 C A 0074 LEU C
C A 0073 ILE C 3.000 C A 0074 LEU CB
C A 0073 ILE C 3.710 C A 0074 LEU CG
C A 0073 ILE CD1 3.599 E A 0078 VAL CG1
C A 0073 ILE CD1 3.752 E A 0078 VAL CG2
C A 0074 LEU CA 3.792 C A 0075 GLY CA
C A 0074 LEU C 2.419 C A 0075 GLY CA
C A 0074 LEU C 3.165 C A 0075 GLY C
C A 0075 GLY CA 3.796 E A 0076 LYS CA
C A 0075 GLY C 2.434 E A 0076 LYS CA
C A 0075 GLY C 3.508 E A 0076 LYS C
C A 0075 GLY C 3.460 E A 0076 LYS CB
E A 0076 LYS C 2.434 E A 0077 GLU CA
E A 0076 LYS C 3.129 E A 0077 GLU C
E A 0076 LYS C 3.696 E A 0077 GLU CB
E A 0077 GLU C 2.434 E A 0078 VAL CA
E A 0077 GLU C 3.319 E A 0078 VAL C
E A 0077 GLU C 3.639 E A 0078 VAL CB
E A 0077 GLU C 3.733 E A 0078 VAL CG1
E A 0078 VAL C 2.435 E A 0079 LYS CA
E A 0078 VAL C 3.333 E A 0079 LYS C
E A 0078 VAL C 3.607 E A 0079 LYS CB
E A 0079 LYS C 2.435 E A 0080 VAL CA
E A 0079 LYS C 3.529 E A 0080 VAL C
E A 0079 LYS C 3.466 E A 0080 VAL CB
E A 0079 LYS C 3.386 E A 0080 VAL CG2
E A 0080 VAL C 2.433 E A 0081 ASN CA
E A 0080 VAL C 3.613 E A 0081 ASN C
E A 0080 VAL C 3.321 E A 0081 ASN CB
E A 0081 ASN C 2.434 E A 0082 TRP CA
E A 0081 ASN C 3.036 E A 0082 TRP C
E A 0081 ASN C 3.710 E A 0082 TRP CB
E A 0082 TRP C 2.433 C A 0083 ALA CA
E A 0082 TRP C 3.127 C A 0083 ALA C
E A 0082 TRP C 3.687 C A 0083 ALA CB
C A 0083 ALA C 2.435 C A 0084 THR CA
C A 0083 ALA C 3.109 C A 0084 THR C
C A 0083 ALA C 3.722 C A 0084 THR CB
C A 0084 THR C 2.434 C A 0085 THR CA
C A 0084 THR C 3.616 C A 0085 THR C
C A 0084 THR C 3.346 C A 0085 THR CB
C A 0084 THR C 3.390 C A 0085 THR CG2
C A 0085 THR CA 2.866 C A 0086 PRO CD
C A 0085 THR C 2.463 C A 0086 PRO CA
C A 0085 THR C 3.135 C A 0086 PRO C
C A 0085 THR C 3.645 C A 0086 PRO CB
C A 0085 THR C 3.634 C A 0086 PRO CG
C A 0085 THR C 2.498 C A 0086 PRO CD
C A 0085 THR CB 3.438 C A 0086 PRO CD
C A 0086 PRO C 2.434 C A 0087 SER CA
C A 0086 PRO C 2.835 C A 0087 SER C
C A 0086 PRO C 3.687 C A 0087 SER CB
C A 0087 SER C 2.433 C A 0088 SER CA
C A 0087 SER C 2.950 C A 0088 SER C
C A 0087 SER C 3.713 C A 0088 SER CB
C A 0088 SER C 2.434 C A 0089 GLN CA
C A 0088 SER C 3.313 C A 0089 GLN C
C A 0088 SER C 3.617 C A 0089 GLN CB
C A 0089 GLN C 2.434 C A 0090 LYS CA
C A 0089 GLN C 3.053 C A 0090 LYS C
C A 0089 GLN C 3.711 C A 0090 LYS CB
C A 0090 LYS C 2.434 C A 0091 SER CA
C A 0090 LYS C 3.561 C A 0091 SER C
C A 0090 LYS C 3.398 C A 0091 SER CB
C A 0091 SER CA 3.791 C A 0092 GLY CA
C A 0091 SER C 2.417 C A 0092 GLY CA
C A 0091 SER C 3.694 C A 0092 GLY C
C A 0092 GLY CA 2.866 C A 0093 PRO CD
C A 0092 GLY C 2.465 C A 0093 PRO CA
C A 0092 GLY C 3.137 C A 0093 PRO C
C A 0092 GLY C 3.645 C A 0093 PRO CB
C A 0092 GLY C 3.635 C A 0093 PRO CG
C A 0092 GLY C 2.497 C A 0093 PRO CD
C A 0093 PRO C 2.434 C A 0094 SER CA
C A 0093 PRO C 3.431 C A 0094 SER C
C A 0093 PRO C 3.534 C A 0094 SER CB
C A 0094 SER C 2.434 C A 0095 SER CA
C A 0094 SER C 3.553 C A 0095 SER C
C A 0094 SER C 3.407 C A 0095 SER CB
C A 0095 SER CA 3.792 C A 0096 GLY CA
C A 0095 SER C 2.418 C A 0096 GLY CA
C A 0095 SER C 3.585 C A 0096 GLY C
CHARGE_ATTR 2.00 12.00 78
C A 0003 GLU OE1 8.663 C A 0090 LYS NZ
C A 0003 GLU OE2 8.183 C A 0090 LYS NZ
C A 0004 ASP OD1 11.99 C A 0009 ARG NH2
C A 0004 ASP OD2 10.92 C A 0009 ARG NH2
C A 0004 ASP OD1 9.471 C A 0090 LYS NZ
C A 0004 ASP OD2 9.154 C A 0090 LYS NZ
C A 0005 ASP OD1 11.55 C A 0009 ARG NH2
C A 0005 ASP OD2 11.75 C A 0009 ARG NH1
C A 0005 ASP OD2 11.42 C A 0009 ARG NH2
C A 0005 ASP OD2 11.67 H A 0058 HIS ND1
C A 0005 ASP OD1 2.931 C A 0090 LYS NZ
C A 0005 ASP OD2 4.257 C A 0090 LYS NZ
C A 0019 ASP OD1 11.22 C A 0018 ARG NH1
C A 0019 ASP OD2 11.47 C A 0018 ARG NH1
C A 0019 ASP OD2 11.95 E A 0076 LYS NZ
H A 0022 GLU OE1 11.01 E A 0039 LYS NZ
H A 0022 GLU OE2 9.655 E A 0039 LYS NZ
C A 0043 GLU OE1 9.683 E A 0039 LYS NZ
C A 0043 GLU OE2 8.885 E A 0039 LYS NZ
C A 0043 GLU OE1 5.114 C A 0044 HIS ND1
C A 0043 GLU OE1 4.999 C A 0044 HIS NE2
C A 0043 GLU OE2 6.906 C A 0044 HIS ND1
C A 0043 GLU OE2 7.122 C A 0044 HIS NE2
C A 0048 ASP OD1 8.550 C A 0018 ARG NH1
C A 0048 ASP OD1 9.097 C A 0018 ARG NH2
C A 0048 ASP OD2 7.824 C A 0018 ARG NH1
C A 0048 ASP OD2 8.699 C A 0018 ARG NH2
C A 0048 ASP OD1 9.988 C A 0044 HIS ND1
C A 0048 ASP OD1 9.695 C A 0044 HIS NE2
C A 0048 ASP OD2 11.85 C A 0044 HIS ND1
C A 0048 ASP OD2 11.74 C A 0044 HIS NE2
C A 0048 ASP OD2 10.86 C A 0072 LYS NZ
C A 0048 ASP OD1 5.389 E A 0076 LYS NZ
C A 0048 ASP OD2 3.722 E A 0076 LYS NZ
C A 0048 ASP OD1 6.767 E A 0079 LYS NZ
C A 0048 ASP OD2 6.603 E A 0079 LYS NZ
E A 0054 GLU OE1 7.939 C A 0009 ARG NH1
E A 0054 GLU OE1 9.895 C A 0009 ARG NH2
E A 0054 GLU OE2 6.963 C A 0009 ARG NH1
E A 0054 GLU OE2 8.601 C A 0009 ARG NH2
E A 0054 GLU OE1 7.968 C A 0036 LYS NZ
E A 0054 GLU OE2 5.807 C A 0036 LYS NZ
E A 0054 GLU OE1 11.05 E A 0039 LYS NZ
E A 0054 GLU OE2 11.86 H A 0058 HIS ND1
C A 0057 GLU OE1 10.40 C A 0009 ARG NH1
C A 0057 GLU OE1 9.357 C A 0009 ARG NH2
C A 0057 GLU OE2 9.405 C A 0009 ARG NH1
C A 0057 GLU OE2 8.101 C A 0009 ARG NH2
C A 0057 GLU OE1 9.984 C A 0036 LYS NZ
C A 0057 GLU OE2 8.704 C A 0036 LYS NZ
C A 0057 GLU OE1 10.03 H A 0058 HIS ND1
C A 0057 GLU OE1 10.51 H A 0058 HIS NE2
C A 0057 GLU OE2 10.43 H A 0058 HIS ND1
C A 0057 GLU OE2 11.21 H A 0058 HIS NE2
C A 0057 GLU OE1 4.199 H A 0059 ARG NH1
C A 0057 GLU OE1 6.074 H A 0059 ARG NH2
C A 0057 GLU OE2 6.334 H A 0059 ARG NH1
C A 0057 GLU OE2 8.255 H A 0059 ARG NH2
H A 0060 ASP OD1 11.91 C A 0009 ARG NH1
H A 0060 ASP OD1 11.79 C A 0009 ARG NH2
H A 0060 ASP OD2 9.929 C A 0009 ARG NH1
H A 0060 ASP OD2 9.846 C A 0009 ARG NH2
H A 0060 ASP OD1 11.23 C A 0036 LYS NZ
H A 0060 ASP OD2 9.202 C A 0036 LYS NZ
H A 0060 ASP OD1 9.958 H A 0058 HIS ND1
H A 0060 ASP OD1 10.24 H A 0058 HIS NE2
H A 0060 ASP OD2 9.037 H A 0058 HIS ND1
H A 0060 ASP OD2 9.748 H A 0058 HIS NE2
H A 0060 ASP OD1 2.610 H A 0059 ARG NH1
H A 0060 ASP OD1 4.269 H A 0059 ARG NH2
H A 0060 ASP OD2 4.048 H A 0059 ARG NH1
H A 0060 ASP OD2 6.099 H A 0059 ARG NH2
E A 0077 GLU OE1 6.390 C A 0072 LYS NZ
E A 0077 GLU OE2 6.123 C A 0072 LYS NZ
E A 0077 GLU OE1 9.072 E A 0076 LYS NZ
E A 0077 GLU OE2 10.68 E A 0076 LYS NZ
E A 0077 GLU OE1 5.930 E A 0079 LYS NZ
E A 0077 GLU OE2 8.072 E A 0079 LYS NZ
CHARGE_REPU 2.00 12.00 35
C A 0003 GLU OE1 6.767 C A 0004 ASP OD1
C A 0003 GLU OE1 8.484 C A 0004 ASP OD2
C A 0003 GLU OE2 7.447 C A 0004 ASP OD1
C A 0003 GLU OE2 8.877 C A 0004 ASP OD2
C A 0003 GLU OE1 7.203 C A 0005 ASP OD1
C A 0003 GLU OE1 6.473 C A 0005 ASP OD2
C A 0003 GLU OE2 7.296 C A 0005 ASP OD1
C A 0003 GLU OE2 7.127 C A 0005 ASP OD2
C A 0004 ASP OD1 6.854 C A 0005 ASP OD1
C A 0004 ASP OD1 7.172 C A 0005 ASP OD2
C A 0004 ASP OD2 6.643 C A 0005 ASP OD1
C A 0004 ASP OD2 7.468 C A 0005 ASP OD2
C A 0009 ARG NH1 8.570 C A 0036 LYS NZ
C A 0009 ARG NH2 8.762 C A 0036 LYS NZ
C A 0009 ARG NH1 7.080 H A 0058 HIS ND1
C A 0009 ARG NH1 9.121 H A 0058 HIS NE2
C A 0009 ARG NH2 7.497 H A 0058 HIS ND1
C A 0009 ARG NH2 9.282 H A 0058 HIS NE2
C A 0018 ARG NH1 6.683 E A 0076 LYS NZ
C A 0018 ARG NH2 8.418 E A 0076 LYS NZ
H A 0022 GLU OE2 11.99 E A 0054 GLU OE1
C A 0048 ASP OD1 10.87 E A 0077 GLU OE1
C A 0048 ASP OD2 9.804 E A 0077 GLU OE1
C A 0048 ASP OD2 11.82 E A 0077 GLU OE2
E A 0054 GLU OE2 10.67 H A 0060 ASP OD2
C A 0057 GLU OE1 5.015 H A 0060 ASP OD1
C A 0057 GLU OE1 4.279 H A 0060 ASP OD2
C A 0057 GLU OE2 6.834 H A 0060 ASP OD1
C A 0057 GLU OE2 5.556 H A 0060 ASP OD2
H A 0058 HIS ND1 11.13 H A 0059 ARG NH1
H A 0058 HIS NE2 11.13 H A 0059 ARG NH1
H A 0058 HIS NE2 11.64 H A 0059 ARG NH2
C A 0072 LYS NZ 8.004 E A 0076 LYS NZ
C A 0072 LYS NZ 10.79 E A 0079 LYS NZ
E A 0076 LYS NZ 8.266 E A 0079 LYS NZ
HB_MM 2.00 3.20 153
C A -001 SER N 2.250 C A -002 SER O
C A -002 SER N 2.251 C A -003 GLY O
C A -003 GLY N 2.249 C A -004 SER O
C A -004 SER N 2.250 C A -005 SER O
C A -004 SER N 2.858 C A -006 GLY O
C A -005 SER N 2.251 C A -006 GLY O
C A 0000 GLY N 2.250 C A -001 SER O
C A 0001 MET N 2.250 C A 0000 GLY O
C A 0002 MET N 2.250 C A 0001 MET O
C A 0003 GLU N 2.250 C A 0002 MET O
C A 0004 ASP N 2.250 C A 0003 GLU O
C A 0005 ASP N 2.250 C A 0004 ASP O
C A 0006 GLY N 2.250 C A 0005 ASP O
C A 0007 GLN N 2.249 C A 0006 GLY O
C A 0008 PRO N 2.253 C A 0007 GLN O
C A 0009 ARG N 2.251 C A 0008 PRO O
E A 0010 THR N 2.251 C A 0009 ARG O
E A 0011 LEU N 2.250 E A 0010 THR O
E A 0011 LEU N 2.933 E A 0053 VAL O
E A 0012 TYR N 2.250 E A 0011 LEU O
E A 0012 TYR N 2.770 E A 0081 ASN O
E A 0013 VAL N 2.250 E A 0012 TYR O
E A 0013 VAL N 2.731 E A 0051 CYS O
E A 0014 GLY N 2.250 E A 0013 VAL O
E A 0014 GLY N 2.785 E A 0079 LYS O
C A 0015 ASN N 2.250 E A 0014 GLY O
C A 0016 LEU N 2.250 C A 0015 ASN O
C A 0017 SER N 2.251 C A 0016 LEU O
C A 0018 ARG N 2.251 C A 0017 SER O
C A 0019 ASP N 2.792 C A 0017 SER O
C A 0019 ASP N 2.250 C A 0018 ARG O
C A 0020 VAL N 2.725 C A 0017 SER O
C A 0020 VAL N 2.250 C A 0019 ASP O
C A 0021 THR N 2.251 C A 0020 VAL O
H A 0022 GLU N 2.250 C A 0021 THR O
H A 0023 VAL N 2.251 H A 0022 GLU O
H A 0024 LEU N 2.249 H A 0023 VAL O
H A 0025 ILE N 3.078 C A 0021 THR O
H A 0025 ILE N 2.251 H A 0024 LEU O
H A 0026 LEU N 3.140 H A 0022 GLU O
H A 0026 LEU N 2.250 H A 0025 ILE O
H A 0027 GLN N 2.980 H A 0023 VAL O
H A 0027 GLN N 3.023 H A 0024 LEU O
H A 0027 GLN N 3.133 H A 0025 ILE O
H A 0027 GLN N 2.251 H A 0026 LEU O
H A 0028 LEU N 3.113 H A 0024 LEU O
H A 0028 LEU N 3.188 H A 0025 ILE O
H A 0028 LEU N 2.249 H A 0027 GLN O
H A 0029 PHE N 2.863 H A 0025 ILE O
H A 0029 PHE N 2.249 H A 0028 LEU O
H A 0030 SER N 2.725 H A 0026 LEU O
H A 0030 SER N 2.250 H A 0029 PHE O
H A 0031 GLN N 2.249 H A 0030 SER O
H A 0032 ILE N 3.049 H A 0029 PHE O
H A 0032 ILE N 3.042 H A 0030 SER O
H A 0032 ILE N 2.250 H A 0031 GLN O
C A 0033 GLY N 3.036 H A 0029 PHE O
C A 0033 GLY N 2.250 H A 0032 ILE O
C A 0034 PRO N 2.254 C A 0033 GLY O
C A 0035 CYS N 2.251 C A 0034 PRO O
C A 0036 LYS N 2.250 C A 0035 CYS O
C A 0036 LYS N 2.616 E A 0054 GLU O
E A 0037 SER N 2.251 C A 0036 LYS O
E A 0038 CYS N 2.250 E A 0037 SER O
E A 0039 LYS N 2.249 E A 0038 CYS O
E A 0039 LYS N 3.082 E A 0052 PHE O
E A 0040 MET N 2.250 E A 0039 LYS O
E A 0041 ILE N 2.251 E A 0040 MET O
E A 0041 ILE N 2.678 E A 0050 TYR O
C A 0042 THR N 2.252 E A 0041 ILE O
C A 0043 GLU N 2.250 C A 0042 THR O
C A 0044 HIS N 2.251 C A 0043 GLU O
C A 0045 THR N 2.251 C A 0044 HIS O
C A 0046 SER N 2.250 C A 0045 THR O
C A 0047 ASN N 3.028 C A 0045 THR O
C A 0047 ASN N 2.250 C A 0046 SER O
C A 0048 ASP N 2.249 C A 0047 ASN O
C A 0049 PRO N 2.254 C A 0048 ASP O
E A 0050 TYR N 3.094 E A 0041 ILE O
E A 0050 TYR N 2.250 C A 0049 PRO O
E A 0051 CYS N 2.806 E A 0013 VAL O
E A 0051 CYS N 2.250 E A 0050 TYR O
E A 0052 PHE N 2.857 E A 0039 LYS O
E A 0052 PHE N 2.250 E A 0051 CYS O
E A 0053 VAL N 3.009 E A 0011 LEU O
E A 0053 VAL N 2.250 E A 0052 PHE O
E A 0054 GLU N 3.131 E A 0037 SER O
E A 0054 GLU N 2.250 E A 0053 VAL O
C A 0055 PHE N 2.737 C A 0009 ARG O
C A 0055 PHE N 2.250 E A 0054 GLU O
C A 0056 TYR N 2.250 C A 0055 PHE O
C A 0057 GLU N 2.251 C A 0056 TYR O
H A 0058 HIS N 2.250 C A 0057 GLU O
H A 0059 ARG N 2.251 H A 0058 HIS O
H A 0060 ASP N 2.250 H A 0059 ARG O
H A 0061 ALA N 2.250 H A 0060 ASP O
H A 0062 ALA N 2.891 H A 0058 HIS O
H A 0062 ALA N 2.249 H A 0061 ALA O
H A 0063 ALA N 3.052 H A 0059 ARG O
H A 0063 ALA N 3.192 H A 0060 ASP O
H A 0063 ALA N 2.250 H A 0062 ALA O
H A 0064 ALA N 2.778 H A 0060 ASP O
H A 0064 ALA N 2.249 H A 0063 ALA O
H A 0065 LEU N 2.759 H A 0061 ALA O
H A 0065 LEU N 2.250 H A 0064 ALA O
H A 0066 ALA N 3.094 H A 0062 ALA O
H A 0066 ALA N 2.250 H A 0065 LEU O
H A 0067 ALA N 3.013 H A 0063 ALA O
H A 0067 ALA N 2.251 H A 0066 ALA O
H A 0068 MET N 2.679 H A 0064 ALA O
H A 0068 MET N 2.250 H A 0067 ALA O
C A 0069 ASN N 2.521 H A 0065 LEU O
C A 0069 ASN N 2.249 H A 0068 MET O
C A 0070 GLY N 2.768 H A 0068 MET O
C A 0070 GLY N 2.249 C A 0069 ASN O
C A 0070 GLY N 2.755 E A 0078 VAL O
C A 0071 ARG N 2.906 H A 0068 MET O
C A 0071 ARG N 2.250 C A 0070 GLY O
C A 0071 ARG N 3.083 E A 0078 VAL O
C A 0072 LYS N 2.250 C A 0071 ARG O
C A 0073 ILE N 2.250 C A 0072 LYS O
C A 0073 ILE N 2.854 E A 0076 LYS O
C A 0074 LEU N 2.251 C A 0073 ILE O
C A 0075 GLY N 3.193 C A 0073 ILE O
C A 0075 GLY N 2.251 C A 0074 LEU O
E A 0076 LYS N 2.876 C A 0073 ILE O
E A 0076 LYS N 2.250 C A 0075 GLY O
E A 0077 GLU N 2.250 E A 0076 LYS O
E A 0078 VAL N 2.730 C A 0071 ARG O
E A 0078 VAL N 2.250 E A 0077 GLU O
E A 0079 LYS N 2.884 E A 0014 GLY O
E A 0079 LYS N 2.250 E A 0078 VAL O
E A 0080 VAL N 2.250 E A 0079 LYS O
E A 0081 ASN N 3.140 E A 0012 TYR O
E A 0081 ASN N 2.250 E A 0080 VAL O
E A 0082 TRP N 2.249 E A 0081 ASN O
C A 0083 ALA N 2.250 E A 0082 TRP O
C A 0084 THR N 2.972 E A 0082 TRP O
C A 0084 THR N 2.250 C A 0083 ALA O
C A 0085 THR N 2.249 C A 0084 THR O
C A 0086 PRO N 2.252 C A 0085 THR O
C A 0087 SER N 2.250 C A 0086 PRO O
C A 0088 SER N 2.957 C A 0086 PRO O
C A 0088 SER N 2.250 C A 0087 SER O
C A 0089 GLN N 2.251 C A 0088 SER O
C A 0090 LYS N 2.248 C A 0089 GLN O
C A 0091 SER N 3.198 C A 0089 GLN O
C A 0091 SER N 2.250 C A 0090 LYS O
C A 0092 GLY N 2.251 C A 0091 SER O
C A 0093 PRO N 2.253 C A 0092 GLY O
C A 0094 SER N 2.250 C A 0093 PRO O
C A 0095 SER N 2.250 C A 0094 SER O
C A 0096 GLY N 2.250 C A 0095 SER O
HB_MS 2.00 3.20 9
C A -001 SER N 3.033 C A -002 SER OG
C A -005 SER O 2.641 C A -004 SER OG
C A -006 GLY O 2.664 C A -004 SER OG
C A 0007 GLN O 2.879 C A 0009 ARG NH1
C A 0008 PRO O 2.993 H A 0058 HIS ND1
H A 0023 VAL N 2.501 H A 0022 GLU OE1
E A 0038 CYS N 2.938 E A 0037 SER OG
C A 0075 GLY O 2.847 C A 0072 LYS NZ
E A 0077 GLU O 2.479 C A 0015 ASN ND2
AROMATIC 0.00 8.00 3
H A 0058 HIS 5.136 E A 0082 TRP
C A 0036 LYS 3.981 C A 0056 TYR
C A 0009 ARG 7.985 H A 0058 HIS