Complet list of 1ls8 con file
Complete list of 1ls8.con file
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 531
C A 0001 SER C 2.520 C A 0002 GLN CA
C A 0001 SER C 3.198 C A 0002 GLN C
C A 0001 SER C 3.163 C A 0002 GLN CB
C A 0002 GLN C 2.476 H A 0003 GLU CA
C A 0002 GLN C 3.037 H A 0003 GLU C
C A 0002 GLN C 3.767 H A 0003 GLU CB
C A 0002 GLN CG 3.767 C A 0127 TRP C
C A 0002 GLN CD 3.416 C A 0127 TRP CA
C A 0002 GLN CD 3.591 C A 0127 TRP C
H A 0003 GLU C 2.464 H A 0004 VAL CA
H A 0003 GLU C 2.894 H A 0004 VAL C
H A 0003 GLU C 3.757 H A 0004 VAL CB
H A 0004 VAL C 2.444 H A 0005 MET CA
H A 0004 VAL C 3.118 H A 0005 MET C
H A 0004 VAL C 3.676 H A 0005 MET CB
H A 0004 VAL CG1 3.473 H A 0008 LEU CD1
H A 0004 VAL CG1 3.681 C A 0082 ALA CA
H A 0004 VAL CG1 3.738 C A 0082 ALA CB
H A 0005 MET C 2.447 H A 0006 LYS CA
H A 0005 MET C 2.931 H A 0006 LYS C
H A 0005 MET C 3.747 H A 0006 LYS CB
H A 0005 MET CG 3.715 H A 0090 LEU CD2
H A 0005 MET CE 3.600 H A 0090 LEU CD2
H A 0006 LYS C 2.469 H A 0007 ASN CA
H A 0006 LYS C 3.115 H A 0007 ASN C
H A 0006 LYS C 3.714 H A 0007 ASN CB
H A 0007 ASN C 2.511 H A 0008 LEU CA
H A 0007 ASN C 3.125 H A 0008 LEU C
H A 0007 ASN C 3.749 H A 0008 LEU CB
H A 0008 LEU C 2.458 C A 0009 SER CA
H A 0008 LEU C 3.164 C A 0009 SER C
H A 0008 LEU C 3.692 C A 0009 SER CB
H A 0008 LEU CD1 3.663 H A 0077 ALA CA
H A 0008 LEU CD2 3.638 H A 0079 LYS CB
C A 0009 SER C 2.468 C A 0010 LEU CA
C A 0009 SER C 3.049 C A 0010 LEU C
C A 0009 SER CA 3.426 C A 0012 PHE CB
C A 0009 SER CB 3.651 C A 0012 PHE CB
C A 0010 LEU C 2.492 C A 0011 ASN CA
C A 0010 LEU C 3.460 C A 0011 ASN C
C A 0010 LEU C 3.624 C A 0011 ASN CB
C A 0011 ASN C 2.513 C A 0012 PHE CA
C A 0011 ASN C 3.124 C A 0012 PHE C
C A 0011 ASN C 3.712 C A 0012 PHE CB
C A 0011 ASN CA 3.594 C A 0014 LYS CB
C A 0011 ASN C 3.670 C A 0014 LYS CB
C A 0012 PHE C 2.489 C A 0013 GLY CA
C A 0012 PHE C 3.601 C A 0013 GLY C
C A 0012 PHE CD1 3.636 C A 0135 VAL CG1
C A 0012 PHE CE1 3.791 C A 0135 VAL CG1
C A 0013 GLY C 2.464 C A 0014 LYS CA
C A 0013 GLY C 2.947 C A 0014 LYS C
C A 0013 GLY C 3.677 C A 0014 LYS CB
C A 0014 LYS C 2.462 C A 0015 ALA CA
C A 0014 LYS C 3.218 C A 0015 ALA C
C A 0014 LYS C 3.689 C A 0015 ALA CB
C A 0015 ALA C 2.453 H A 0016 LEU CA
C A 0015 ALA C 2.901 H A 0016 LEU C
C A 0015 ALA C 3.779 H A 0016 LEU CB
H A 0016 LEU CA 3.797 H A 0017 ASP CA
H A 0016 LEU C 2.452 H A 0017 ASP CA
H A 0016 LEU C 3.137 H A 0017 ASP C
H A 0016 LEU C 3.690 H A 0017 ASP CB
H A 0016 LEU C 3.429 H A 0020 LYS CD
H A 0016 LEU CD1 3.636 H A 0020 LYS CD
H A 0016 LEU CD1 3.455 H A 0029 ILE CD1
H A 0016 LEU CD2 3.780 C A 0033 PHE CE2
H A 0016 LEU CD2 3.648 C A 0033 PHE CZ
H A 0016 LEU CD2 3.197 H A 0055 LEU CD1
H A 0017 ASP CA 3.795 H A 0018 GLU CA
H A 0017 ASP C 2.432 H A 0018 GLU CA
H A 0017 ASP C 3.082 H A 0018 GLU C
H A 0017 ASP C 3.691 H A 0018 GLU CB
H A 0018 GLU C 2.444 H A 0019 CYS CA
H A 0018 GLU C 3.024 H A 0019 CYS C
H A 0018 GLU C 3.675 H A 0019 CYS CB
H A 0019 CYS C 2.467 H A 0020 LYS CA
H A 0019 CYS C 3.052 H A 0020 LYS C
H A 0019 CYS C 3.768 H A 0020 LYS CB
H A 0020 LYS C 2.444 H A 0021 LYS CA
H A 0020 LYS C 2.960 H A 0021 LYS C
H A 0020 LYS C 3.741 H A 0021 LYS CB
H A 0020 LYS CG 3.733 H A 0029 ILE CD1
H A 0021 LYS C 2.455 H A 0022 GLU CA
H A 0021 LYS C 3.063 H A 0022 GLU C
H A 0021 LYS C 3.736 H A 0022 GLU CB
H A 0022 GLU C 2.477 C A 0023 MET CA
H A 0022 GLU C 3.481 C A 0023 MET C
H A 0022 GLU C 3.531 C A 0023 MET CB
H A 0022 GLU C 3.600 C A 0023 MET CG
C A 0023 MET C 2.522 C A 0024 THR CA
C A 0023 MET C 2.987 C A 0024 THR C
C A 0023 MET C 3.357 C A 0024 THR CB
C A 0023 MET CB 3.775 C A 0025 LEU CG
C A 0023 MET CB 3.581 C A 0025 LEU CD2
C A 0024 THR C 2.454 C A 0025 LEU CA
C A 0024 THR C 3.148 C A 0025 LEU C
C A 0024 THR C 3.708 C A 0025 LEU CB
C A 0025 LEU CA 3.782 C A 0026 THR CA
C A 0025 LEU C 2.436 C A 0026 THR CA
C A 0025 LEU C 3.327 C A 0026 THR C
C A 0025 LEU C 3.501 C A 0026 THR CB
C A 0025 LEU C 3.600 C A 0026 THR CG2
C A 0026 THR C 2.442 C A 0027 ASP CA
C A 0026 THR C 3.437 C A 0027 ASP C
C A 0026 THR C 3.520 C A 0027 ASP CB
C A 0027 ASP C 2.520 C A 0028 ALA CA
C A 0027 ASP C 3.370 C A 0028 ALA C
C A 0027 ASP C 3.686 C A 0028 ALA CB
C A 0028 ALA C 2.444 H A 0029 ILE CA
C A 0028 ALA C 3.015 H A 0029 ILE C
C A 0028 ALA C 3.735 H A 0029 ILE CB
H A 0029 ILE C 2.438 H A 0030 ASN CA
H A 0029 ILE C 3.022 H A 0030 ASN C
H A 0029 ILE C 3.698 H A 0030 ASN CB
H A 0029 ILE CA 3.758 H A 0032 ASP CB
H A 0029 ILE CG2 3.780 H A 0048 THR CA
H A 0030 ASN C 2.459 H A 0031 GLU CA
H A 0030 ASN C 3.129 H A 0031 GLU C
H A 0030 ASN C 3.731 H A 0031 GLU CB
H A 0031 GLU C 2.465 H A 0032 ASP CA
H A 0031 GLU C 3.045 H A 0032 ASP C
H A 0031 GLU C 3.703 H A 0032 ASP CB
H A 0032 ASP C 2.460 C A 0033 PHE CA
H A 0032 ASP C 3.123 C A 0033 PHE C
H A 0032 ASP C 3.734 C A 0033 PHE CB
H A 0032 ASP CB 3.737 H A 0048 THR CG2
H A 0032 ASP CG 3.444 H A 0048 THR CG2
C A 0033 PHE C 2.487 C A 0034 TYR CA
C A 0033 PHE C 3.105 C A 0034 TYR C
C A 0033 PHE C 3.738 C A 0034 TYR CB
C A 0033 PHE CD1 3.642 H A 0048 THR CG2
C A 0033 PHE CE1 3.348 H A 0048 THR CG2
C A 0033 PHE CE2 3.662 H A 0052 ILE CG1
C A 0033 PHE CZ 3.224 H A 0052 ILE CG1
C A 0033 PHE CE2 3.736 H A 0055 LEU CD1
C A 0034 TYR C 2.504 C A 0035 ASN CA
C A 0034 TYR C 3.045 C A 0035 ASN C
C A 0034 TYR C 3.411 C A 0035 ASN CB
C A 0034 TYR C 3.512 C A 0035 ASN CG
C A 0034 TYR CD1 3.461 C A 0035 ASN CG
C A 0034 TYR CE1 3.503 C A 0035 ASN CG
C A 0035 ASN C 2.485 C A 0036 PHE CA
C A 0035 ASN C 2.974 C A 0036 PHE C
C A 0035 ASN C 3.749 C A 0036 PHE CB
C A 0036 PHE C 2.490 C A 0037 TRP CA
C A 0036 PHE C 3.032 C A 0037 TRP C
C A 0036 PHE C 3.090 C A 0037 TRP CB
C A 0036 PHE CG 3.702 H A 0119 LYS CB
C A 0036 PHE CG 3.526 H A 0119 LYS CG
C A 0036 PHE CG 3.670 H A 0119 LYS CD
C A 0036 PHE CD1 3.688 H A 0119 LYS CG
C A 0036 PHE CD1 3.611 H A 0119 LYS CD
C A 0036 PHE CD2 3.510 H A 0119 LYS CB
C A 0036 PHE CD2 3.628 H A 0119 LYS CG
C A 0037 TRP C 2.468 C A 0038 LYS CA
C A 0037 TRP C 3.052 C A 0038 LYS C
C A 0037 TRP C 3.241 C A 0038 LYS CB
C A 0037 TRP C 3.272 C A 0038 LYS CG
C A 0037 TRP C 3.671 C A 0038 LYS CD
C A 0038 LYS C 2.458 C A 0039 GLU CA
C A 0038 LYS C 3.511 C A 0039 GLU C
C A 0038 LYS C 3.437 C A 0039 GLU CB
C A 0038 LYS CB 3.784 C A 0041 TYR CB
C A 0039 GLU C 2.465 C A 0040 GLY CA
C A 0039 GLU C 3.688 C A 0040 GLY C
C A 0040 GLY C 2.472 C A 0041 TYR CA
C A 0040 GLY C 3.542 C A 0041 TYR C
C A 0040 GLY C 3.377 C A 0041 TYR CB
C A 0041 TYR CA 3.793 C A 0042 GLU CA
C A 0041 TYR C 2.422 C A 0042 GLU CA
C A 0041 TYR C 3.054 C A 0042 GLU C
C A 0041 TYR C 3.686 C A 0042 GLU CB
C A 0041 TYR CD2 3.629 C A 0043 ILE CG1
C A 0041 TYR CE2 3.766 C A 0043 ILE CG1
C A 0042 GLU CA 3.797 C A 0043 ILE CA
C A 0042 GLU C 2.446 C A 0043 ILE CA
C A 0042 GLU C 2.922 C A 0043 ILE C
C A 0042 GLU C 3.728 C A 0043 ILE CB
C A 0043 ILE C 2.462 C A 0044 LYS CA
C A 0043 ILE C 3.090 C A 0044 LYS C
C A 0043 ILE C 3.714 C A 0044 LYS CB
C A 0043 ILE CG2 3.670 C A 0045 ASN CB
C A 0044 LYS C 2.479 C A 0045 ASN CA
C A 0044 LYS C 3.037 C A 0045 ASN C
C A 0044 LYS C 3.734 C A 0045 ASN CB
C A 0045 ASN C 2.480 H A 0046 ARG CA
C A 0045 ASN C 3.571 H A 0046 ARG C
C A 0045 ASN C 3.489 H A 0046 ARG CB
C A 0045 ASN C 3.541 H A 0046 ARG CG
H A 0046 ARG C 2.451 H A 0047 GLU CA
H A 0046 ARG C 3.062 H A 0047 GLU C
H A 0046 ARG C 3.737 H A 0047 GLU CB
H A 0046 ARG CD 3.763 H A 0109 ILE CG1
H A 0046 ARG CA 3.585 H A 0112 LEU CD1
H A 0046 ARG C 3.650 H A 0112 LEU CD1
H A 0047 GLU C 2.464 H A 0048 THR CA
H A 0047 GLU C 3.016 H A 0048 THR C
H A 0047 GLU C 3.739 H A 0048 THR CB
H A 0048 THR C 2.456 H A 0049 GLY CA
H A 0048 THR C 3.033 H A 0049 GLY C
H A 0049 GLY C 2.448 H A 0050 CYS CA
H A 0049 GLY C 3.051 H A 0050 CYS C
H A 0049 GLY C 3.703 H A 0050 CYS CB
H A 0049 GLY CA 3.590 H A 0111 THR CG2
H A 0049 GLY CA 3.722 H A 0112 LEU CG
H A 0049 GLY CA 3.721 H A 0112 LEU CD1
H A 0050 CYS C 2.464 H A 0051 ALA CA
H A 0050 CYS C 3.022 H A 0051 ALA C
H A 0050 CYS C 3.734 H A 0051 ALA CB
H A 0051 ALA C 2.473 H A 0052 ILE CA
H A 0051 ALA C 2.946 H A 0052 ILE C
H A 0051 ALA C 3.771 H A 0052 ILE CB
H A 0052 ILE C 2.432 H A 0053 MET CA
H A 0052 ILE C 3.056 H A 0053 MET C
H A 0052 ILE C 3.682 H A 0053 MET CB
H A 0052 ILE CD1 3.643 H A 0115 ALA CB
H A 0053 MET C 2.488 H A 0054 CYS CA
H A 0053 MET C 3.054 H A 0054 CYS C
H A 0053 MET C 3.756 H A 0054 CYS CB
H A 0053 MET CE 3.617 C A 0062 LEU CD1
H A 0054 CYS C 2.466 H A 0055 LEU CA
H A 0054 CYS C 2.999 H A 0055 LEU C
H A 0054 CYS C 3.761 H A 0055 LEU CB
H A 0055 LEU C 2.457 H A 0056 SER CA
H A 0055 LEU C 3.030 H A 0056 SER C
H A 0055 LEU C 3.731 H A 0056 SER CB
H A 0056 SER C 2.479 H A 0057 THR CA
H A 0056 SER C 3.048 H A 0057 THR C
H A 0056 SER C 3.764 H A 0057 THR CB
H A 0056 SER CB 3.749 C A 0062 LEU CG
H A 0057 THR C 2.451 H A 0058 LYS CA
H A 0057 THR C 3.036 H A 0058 LYS C
H A 0057 THR C 3.736 H A 0058 LYS CB
H A 0058 LYS C 2.466 H A 0059 LEU CA
H A 0058 LYS C 3.250 H A 0059 LEU C
H A 0058 LYS C 3.665 H A 0059 LEU CB
H A 0059 LEU C 2.478 C A 0060 ASN CA
H A 0059 LEU C 3.027 C A 0060 ASN C
H A 0059 LEU C 3.146 C A 0060 ASN CB
H A 0059 LEU C 3.420 C A 0060 ASN CG
C A 0060 ASN C 2.482 C A 0061 MET CA
C A 0060 ASN C 3.099 C A 0061 MET C
C A 0060 ASN C 3.725 C A 0061 MET CB
C A 0061 MET C 2.454 C A 0062 LEU CA
C A 0061 MET C 3.353 C A 0062 LEU C
C A 0061 MET C 3.623 C A 0062 LEU CB
C A 0061 MET CG 3.560 C A 0068 LEU CD1
C A 0062 LEU CA 3.768 C A 0063 ASP CA
C A 0062 LEU C 2.454 C A 0063 ASP CA
C A 0062 LEU C 3.034 C A 0063 ASP C
C A 0062 LEU C 3.735 C A 0063 ASP CB
C A 0062 LEU CD2 3.627 C A 0068 LEU CA
C A 0063 ASP CA 2.981 C A 0064 PRO CD
C A 0063 ASP C 2.455 C A 0064 PRO CA
C A 0063 ASP C 3.177 C A 0064 PRO C
C A 0063 ASP C 3.633 C A 0064 PRO CB
C A 0063 ASP C 3.703 C A 0064 PRO CG
C A 0063 ASP C 2.496 C A 0064 PRO CD
C A 0063 ASP CB 3.261 C A 0064 PRO CD
C A 0064 PRO C 2.475 C A 0065 GLU CA
C A 0064 PRO C 3.238 C A 0065 GLU C
C A 0064 PRO C 3.677 C A 0065 GLU CB
C A 0065 GLU C 2.484 C A 0066 GLY CA
C A 0065 GLU C 3.636 C A 0066 GLY C
C A 0066 GLY C 2.456 C A 0067 ASN CA
C A 0066 GLY C 2.947 C A 0067 ASN C
C A 0066 GLY C 3.762 C A 0067 ASN CB
C A 0067 ASN C 2.445 C A 0068 LEU CA
C A 0067 ASN C 3.138 C A 0068 LEU C
C A 0067 ASN C 3.672 C A 0068 LEU CB
C A 0068 LEU C 2.462 C A 0069 HIS CA
C A 0068 LEU C 3.367 C A 0069 HIS C
C A 0068 LEU C 3.609 C A 0069 HIS CB
C A 0068 LEU CD2 3.771 C A 0069 HIS C
C A 0068 LEU CB 3.686 H A 0094 VAL CG1
C A 0069 HIS C 2.479 H A 0070 HIS CA
C A 0069 HIS C 2.995 H A 0070 HIS C
C A 0069 HIS C 3.744 H A 0070 HIS CB
C A 0069 HIS CB 3.786 H A 0072 ASN CB
H A 0070 HIS C 2.447 H A 0071 GLY CA
H A 0070 HIS C 3.104 H A 0071 GLY C
H A 0070 HIS CG 3.588 H A 0091 ILE CG2
H A 0070 HIS CD2 3.116 H A 0091 ILE CG2
H A 0071 GLY C 2.430 H A 0072 ASN CA
H A 0071 GLY C 3.036 H A 0072 ASN C
H A 0071 GLY C 3.722 H A 0072 ASN CB
H A 0072 ASN C 2.449 H A 0073 ALA CA
H A 0072 ASN C 3.027 H A 0073 ALA C
H A 0072 ASN C 3.723 H A 0073 ALA CB
H A 0073 ALA C 2.477 H A 0074 MET CA
H A 0073 ALA C 3.019 H A 0074 MET C
H A 0073 ALA C 3.737 H A 0074 MET CB
H A 0074 MET C 2.446 H A 0075 GLU CA
H A 0074 MET C 3.070 H A 0075 GLU C
H A 0074 MET C 3.741 H A 0075 GLU CB
H A 0075 GLU C 2.432 H A 0076 PHE CA
H A 0075 GLU C 3.007 H A 0076 PHE C
H A 0075 GLU C 3.705 H A 0076 PHE CB
H A 0076 PHE C 2.442 H A 0077 ALA CA
H A 0076 PHE C 3.080 H A 0077 ALA C
H A 0076 PHE C 3.711 H A 0077 ALA CB
H A 0077 ALA C 2.449 H A 0078 LYS CA
H A 0077 ALA C 3.088 H A 0078 LYS C
H A 0077 ALA C 3.746 H A 0078 LYS CB
H A 0077 ALA CB 3.793 H A 0087 ALA CB
H A 0078 LYS C 2.484 H A 0079 LYS CA
H A 0078 LYS C 3.070 H A 0079 LYS C
H A 0078 LYS C 3.749 H A 0079 LYS CB
H A 0079 LYS C 2.446 C A 0080 HIS CA
H A 0079 LYS C 3.344 C A 0080 HIS C
H A 0079 LYS C 3.637 C A 0080 HIS CB
C A 0080 HIS C 2.465 C A 0081 GLY CA
C A 0080 HIS C 3.193 C A 0081 GLY C
C A 0081 GLY C 2.457 C A 0082 ALA CA
C A 0081 GLY C 3.074 C A 0082 ALA C
C A 0081 GLY C 3.720 C A 0082 ALA CB
C A 0082 ALA C 2.449 C A 0083 ASP CA
C A 0082 ALA C 3.062 C A 0083 ASP C
C A 0082 ALA C 3.730 C A 0083 ASP CB
C A 0083 ASP C 2.472 H A 0084 GLU CA
C A 0083 ASP C 3.018 H A 0084 GLU C
C A 0083 ASP C 3.671 H A 0084 GLU CB
C A 0083 ASP CB 3.742 H A 0086 MET CB
H A 0084 GLU C 2.449 H A 0085 THR CA
H A 0084 GLU C 3.052 H A 0085 THR C
H A 0084 GLU C 3.685 H A 0085 THR CB
H A 0085 THR C 2.437 H A 0086 MET CA
H A 0085 THR C 2.995 H A 0086 MET C
H A 0085 THR C 3.764 H A 0086 MET CB
H A 0086 MET C 2.431 H A 0087 ALA CA
H A 0086 MET C 2.983 H A 0087 ALA C
H A 0086 MET C 3.694 H A 0087 ALA CB
H A 0086 MET CG 3.440 C A 0127 TRP CZ3
H A 0086 MET CE 3.448 C A 0127 TRP CE3
H A 0087 ALA C 2.464 H A 0088 GLN CA
H A 0087 ALA C 3.129 H A 0088 GLN C
H A 0087 ALA C 3.719 H A 0088 GLN CB
H A 0088 GLN C 2.454 H A 0089 GLN CA
H A 0088 GLN C 3.018 H A 0089 GLN C
H A 0088 GLN C 3.716 H A 0089 GLN CB
H A 0089 GLN C 2.458 H A 0090 LEU CA
H A 0089 GLN C 3.088 H A 0090 LEU C
H A 0089 GLN C 3.714 H A 0090 LEU CB
H A 0089 GLN C 3.789 H A 0093 ILE CD1
H A 0089 GLN CB 3.757 C A 0127 TRP CH2
H A 0090 LEU C 2.477 H A 0091 ILE CA
H A 0090 LEU C 3.216 H A 0091 ILE C
H A 0090 LEU C 3.680 H A 0091 ILE CB
H A 0090 LEU CG 3.729 H A 0118 PHE CE2
H A 0090 LEU CG 3.667 H A 0118 PHE CZ
H A 0090 LEU CD1 3.578 H A 0122 ILE CD1
H A 0090 LEU CD1 3.470 C A 0127 TRP CZ3
H A 0091 ILE C 2.498 H A 0092 ASP CA
H A 0091 ILE C 3.171 H A 0092 ASP C
H A 0091 ILE C 3.741 H A 0092 ASP CB
H A 0092 ASP CA 3.796 H A 0093 ILE CA
H A 0092 ASP C 2.472 H A 0093 ILE CA
H A 0092 ASP C 3.027 H A 0093 ILE C
H A 0092 ASP C 3.722 H A 0093 ILE CB
H A 0093 ILE C 2.467 H A 0094 VAL CA
H A 0093 ILE C 3.025 H A 0094 VAL C
H A 0093 ILE C 3.755 H A 0094 VAL CB
H A 0093 ILE CG2 3.780 H A 0118 PHE CA
H A 0093 ILE CG2 3.796 H A 0121 GLU CB
H A 0093 ILE CD1 3.507 H A 0122 ILE CD1
H A 0093 ILE CD1 3.675 C A 0125 LEU CD1
H A 0094 VAL C 2.512 H A 0095 HIS CA
H A 0094 VAL C 3.115 H A 0095 HIS C
H A 0094 VAL C 3.675 H A 0095 HIS CB
H A 0095 HIS C 2.474 H A 0096 GLY CA
H A 0095 HIS C 3.302 H A 0096 GLY C
H A 0096 GLY C 2.445 H A 0097 CYS CA
H A 0096 GLY C 3.052 H A 0097 CYS C
H A 0096 GLY C 3.711 H A 0097 CYS CB
H A 0097 CYS C 2.467 H A 0098 GLU CA
H A 0097 CYS C 3.090 H A 0098 GLU C
H A 0097 CYS C 3.708 H A 0098 GLU CB
H A 0097 CYS CB 3.668 H A 0117 CYS CB
H A 0098 GLU C 2.478 H A 0099 LYS CA
H A 0098 GLU C 3.089 H A 0099 LYS C
H A 0098 GLU C 3.738 H A 0099 LYS CB
H A 0099 LYS C 2.440 H A 0100 SER CA
H A 0099 LYS C 3.252 H A 0100 SER C
H A 0099 LYS C 3.630 H A 0100 SER CB
H A 0100 SER C 2.452 C A 0101 THR CA
H A 0100 SER C 3.091 C A 0101 THR C
H A 0100 SER C 3.691 C A 0101 THR CB
C A 0101 THR CA 2.988 C A 0102 PRO CD
C A 0101 THR C 2.470 C A 0102 PRO CA
C A 0101 THR C 3.153 C A 0102 PRO C
C A 0101 THR C 3.684 C A 0102 PRO CB
C A 0101 THR C 3.696 C A 0102 PRO CG
C A 0101 THR C 2.504 C A 0102 PRO CD
C A 0102 PRO C 2.508 C A 0103 ALA CA
C A 0102 PRO C 3.682 C A 0103 ALA C
C A 0102 PRO C 3.153 C A 0103 ALA CB
C A 0103 ALA C 2.444 C A 0104 ASN CA
C A 0103 ALA C 3.673 C A 0104 ASN C
C A 0103 ALA C 3.213 C A 0104 ASN CB
C A 0104 ASN C 2.492 C A 0105 ASP CA
C A 0104 ASN C 3.159 C A 0105 ASP C
C A 0104 ASN C 3.727 C A 0105 ASP CB
C A 0104 ASN CG 3.718 H A 0109 ILE CB
C A 0104 ASN CG 3.338 H A 0109 ILE CG2
C A 0105 ASP C 2.483 C A 0106 ASP CA
C A 0105 ASP C 3.545 C A 0106 ASP C
C A 0105 ASP C 3.415 C A 0106 ASP CB
C A 0106 ASP CA 3.788 H A 0107 LYS CA
C A 0106 ASP C 2.454 H A 0107 LYS CA
C A 0106 ASP C 3.071 H A 0107 LYS C
C A 0106 ASP C 3.710 H A 0107 LYS CB
H A 0107 LYS C 2.436 H A 0108 CYS CA
H A 0107 LYS C 3.000 H A 0108 CYS C
H A 0107 LYS C 3.767 H A 0108 CYS CB
H A 0107 LYS CA 3.750 H A 0110 TRP CB
H A 0108 CYS C 2.443 H A 0109 ILE CA
H A 0108 CYS C 3.026 H A 0109 ILE C
H A 0108 CYS C 3.737 H A 0109 ILE CB
H A 0109 ILE C 2.456 H A 0110 TRP CA
H A 0109 ILE C 2.954 H A 0110 TRP C
H A 0109 ILE C 3.734 H A 0110 TRP CB
H A 0110 TRP C 2.466 H A 0111 THR CA
H A 0110 TRP C 2.992 H A 0111 THR C
H A 0110 TRP C 3.725 H A 0111 THR CB
H A 0111 THR C 2.472 H A 0112 LEU CA
H A 0111 THR C 3.065 H A 0112 LEU C
H A 0111 THR C 3.728 H A 0112 LEU CB
H A 0112 LEU C 2.442 H A 0113 GLY CA
H A 0112 LEU C 2.958 H A 0113 GLY C
H A 0112 LEU CA 3.718 H A 0115 ALA CB
H A 0113 GLY C 2.486 H A 0114 VAL CA
H A 0113 GLY C 3.056 H A 0114 VAL C
H A 0113 GLY C 3.737 H A 0114 VAL CB
H A 0114 VAL C 2.499 H A 0115 ALA CA
H A 0114 VAL C 3.121 H A 0115 ALA C
H A 0114 VAL C 3.740 H A 0115 ALA CB
H A 0115 ALA C 2.451 H A 0116 THR CA
H A 0115 ALA C 3.170 H A 0116 THR C
H A 0115 ALA C 3.687 H A 0116 THR CB
H A 0116 THR C 2.472 H A 0117 CYS CA
H A 0116 THR C 3.042 H A 0117 CYS C
H A 0116 THR C 3.692 H A 0117 CYS CB
H A 0117 CYS C 2.464 H A 0118 PHE CA
H A 0117 CYS C 3.021 H A 0118 PHE C
H A 0117 CYS C 3.727 H A 0118 PHE CB
H A 0118 PHE C 2.455 H A 0119 LYS CA
H A 0118 PHE C 3.059 H A 0119 LYS C
H A 0118 PHE C 3.727 H A 0119 LYS CB
H A 0119 LYS C 2.466 H A 0120 ALA CA
H A 0119 LYS C 3.095 H A 0120 ALA C
H A 0119 LYS C 3.722 H A 0120 ALA CB
H A 0120 ALA C 2.456 H A 0121 GLU CA
H A 0120 ALA C 2.977 H A 0121 GLU C
H A 0120 ALA C 3.757 H A 0121 GLU CB
H A 0121 GLU C 2.482 H A 0122 ILE CA
H A 0121 GLU C 3.036 H A 0122 ILE C
H A 0121 GLU C 3.718 H A 0122 ILE CB
H A 0121 GLU CA 3.794 H A 0124 LYS CG
H A 0121 GLU CD 3.732 H A 0124 LYS CD
H A 0121 GLU C 3.738 C A 0125 LEU CD1
H A 0122 ILE C 2.464 H A 0123 HIS CA
H A 0122 ILE C 3.111 H A 0123 HIS C
H A 0122 ILE C 3.715 H A 0123 HIS CB
H A 0122 ILE CG2 3.743 C A 0128 ALA CB
H A 0123 HIS C 2.457 H A 0124 LYS CA
H A 0123 HIS C 3.077 H A 0124 LYS C
H A 0123 HIS C 3.749 H A 0124 LYS CB
H A 0124 LYS C 2.495 C A 0125 LEU CA
H A 0124 LYS C 3.152 C A 0125 LEU C
H A 0124 LYS C 3.750 C A 0125 LEU CB
C A 0125 LEU C 2.478 C A 0126 ASN CA
C A 0125 LEU C 3.075 C A 0126 ASN C
C A 0125 LEU C 3.164 C A 0126 ASN CB
C A 0125 LEU CB 3.797 C A 0127 TRP CD2
C A 0126 ASN C 2.470 C A 0127 TRP CA
C A 0126 ASN C 3.504 C A 0127 TRP C
C A 0126 ASN C 3.534 C A 0127 TRP CB
C A 0126 ASN C 3.792 C A 0127 TRP CG
C A 0126 ASN C 3.440 C A 0127 TRP CD1
C A 0127 TRP C 2.477 C A 0128 ALA CA
C A 0127 TRP C 3.750 C A 0128 ALA C
C A 0127 TRP C 3.108 C A 0128 ALA CB
C A 0128 ALA CA 2.985 C A 0129 PRO CD
C A 0128 ALA C 2.452 C A 0129 PRO CA
C A 0128 ALA C 3.184 C A 0129 PRO C
C A 0128 ALA C 3.638 C A 0129 PRO CB
C A 0128 ALA C 3.710 C A 0129 PRO CG
C A 0128 ALA C 2.508 C A 0129 PRO CD
C A 0129 PRO C 2.464 C A 0130 SER CA
C A 0129 PRO C 3.720 C A 0130 SER C
C A 0129 PRO C 3.169 C A 0130 SER CB
C A 0130 SER C 2.465 C A 0131 MET CA
C A 0130 SER C 3.087 C A 0131 MET C
C A 0130 SER C 3.744 C A 0131 MET CB
C A 0131 MET C 2.501 C A 0132 ASP CA
C A 0131 MET C 3.061 C A 0132 ASP C
C A 0131 MET C 3.257 C A 0132 ASP CB
C A 0131 MET CE 3.795 C A 0134 ALA CB
C A 0132 ASP C 2.525 C A 0133 VAL CA
C A 0132 ASP C 3.006 C A 0133 VAL C
C A 0132 ASP C 3.401 C A 0133 VAL CB
C A 0133 VAL C 2.482 C A 0134 ALA CA
C A 0133 VAL C 3.439 C A 0134 ALA C
C A 0133 VAL C 3.605 C A 0134 ALA CB
C A 0134 ALA C 2.509 C A 0135 VAL CA
C A 0134 ALA C 3.635 C A 0135 VAL C
C A 0134 ALA C 3.343 C A 0135 VAL CB
C A 0134 ALA C 3.295 C A 0135 VAL CG2
C A 0135 VAL C 2.442 C A 0136 GLY CA
C A 0135 VAL C 3.626 C A 0136 GLY C
C A 0136 GLY C 2.472 C A 0137 GLU CA
C A 0136 GLY C 3.666 C A 0137 GLU C
C A 0136 GLY C 3.216 C A 0137 GLU CB
C A 0137 GLU C 2.485 C A 0138 ILE CA
C A 0137 GLU C 3.434 C A 0138 ILE C
C A 0137 GLU C 3.522 C A 0138 ILE CB
C A 0137 GLU C 3.550 C A 0138 ILE CG1
C A 0138 ILE C 2.465 C A 0139 LEU CA
C A 0138 ILE C 3.615 C A 0139 LEU C
C A 0138 ILE C 3.253 C A 0139 LEU CB
C A 0139 LEU C 2.499 C A 0140 ALA CA
C A 0139 LEU C 3.016 C A 0140 ALA C
C A 0139 LEU C 3.206 C A 0140 ALA CB
C A 0140 ALA C 2.445 C A 0141 GLU CA
C A 0140 ALA C 2.982 C A 0141 GLU C
C A 0140 ALA C 3.731 C A 0141 GLU CB
C A 0141 GLU C 2.485 C A 0142 VAL CA
C A 0141 GLU C 3.646 C A 0142 VAL C
C A 0141 GLU C 3.325 C A 0142 VAL CB
C A 0141 GLU C 3.298 C A 0142 VAL CG1
CHARGE_ATTR 2.00 12.00 135
H A 0003 GLU OE1 6.067 H A 0006 LYS NZ
H A 0003 GLU OE2 7.296 H A 0006 LYS NZ
H A 0003 GLU OE1 8.692 C A 0080 HIS ND1
H A 0003 GLU OE1 7.794 C A 0080 HIS NE2
H A 0003 GLU OE2 8.635 C A 0080 HIS ND1
H A 0003 GLU OE2 7.303 C A 0080 HIS NE2
H A 0017 ASP OD2 10.23 C A 0014 LYS NZ
H A 0017 ASP OD1 2.778 H A 0020 LYS NZ
H A 0017 ASP OD2 4.032 H A 0020 LYS NZ
H A 0017 ASP OD1 10.64 H A 0021 LYS NZ
H A 0018 GLU OE1 9.043 C A 0014 LYS NZ
H A 0018 GLU OE2 9.984 C A 0014 LYS NZ
H A 0018 GLU OE1 11.60 H A 0020 LYS NZ
H A 0018 GLU OE2 10.60 H A 0021 LYS NZ
H A 0018 GLU OE1 5.964 H A 0058 LYS NZ
H A 0018 GLU OE2 6.299 H A 0058 LYS NZ
H A 0022 GLU OE1 10.62 H A 0021 LYS NZ
H A 0022 GLU OE2 9.489 H A 0021 LYS NZ
H A 0022 GLU OE1 4.168 H A 0058 LYS NZ
H A 0022 GLU OE2 4.451 H A 0058 LYS NZ
C A 0027 ASP OD1 2.694 H A 0020 LYS NZ
C A 0027 ASP OD2 4.380 H A 0020 LYS NZ
C A 0027 ASP OD1 11.99 H A 0021 LYS NZ
H A 0031 GLU OE1 11.95 H A 0020 LYS NZ
H A 0031 GLU OE1 6.999 C A 0038 LYS NZ
H A 0031 GLU OE2 6.049 C A 0038 LYS NZ
H A 0031 GLU OE1 11.08 C A 0044 LYS NZ
H A 0032 ASP OD2 11.64 H A 0020 LYS NZ
H A 0032 ASP OD1 8.667 C A 0038 LYS NZ
H A 0032 ASP OD2 9.334 C A 0038 LYS NZ
H A 0032 ASP OD1 11.39 C A 0044 LYS NZ
H A 0032 ASP OD2 9.423 C A 0044 LYS NZ
H A 0032 ASP OD1 8.296 H A 0046 ARG NH1
H A 0032 ASP OD1 8.537 H A 0046 ARG NH2
H A 0032 ASP OD2 7.184 H A 0046 ARG NH1
H A 0032 ASP OD2 7.863 H A 0046 ARG NH2
H A 0032 ASP OD1 7.219 H A 0119 LYS NZ
H A 0032 ASP OD2 9.314 H A 0119 LYS NZ
C A 0039 GLU OE1 10.42 C A 0038 LYS NZ
C A 0039 GLU OE2 11.79 C A 0038 LYS NZ
C A 0039 GLU OE1 8.256 H A 0123 HIS ND1
C A 0039 GLU OE1 8.719 H A 0123 HIS NE2
C A 0039 GLU OE2 8.749 H A 0123 HIS ND1
C A 0039 GLU OE2 9.694 H A 0123 HIS NE2
C A 0042 GLU OE1 10.52 C A 0044 LYS NZ
C A 0042 GLU OE1 4.027 H A 0046 ARG NH1
C A 0042 GLU OE1 2.866 H A 0046 ARG NH2
C A 0042 GLU OE2 5.706 H A 0046 ARG NH1
C A 0042 GLU OE2 3.903 H A 0046 ARG NH2
H A 0047 GLU OE1 11.55 H A 0020 LYS NZ
H A 0047 GLU OE1 6.874 C A 0044 LYS NZ
H A 0047 GLU OE2 6.364 C A 0044 LYS NZ
H A 0047 GLU OE1 9.161 H A 0046 ARG NH1
H A 0047 GLU OE1 10.48 H A 0046 ARG NH2
H A 0047 GLU OE2 8.134 H A 0046 ARG NH1
H A 0047 GLU OE2 9.355 H A 0046 ARG NH2
C A 0063 ASP OD1 4.202 C A 0069 HIS ND1
C A 0063 ASP OD1 3.998 C A 0069 HIS NE2
C A 0063 ASP OD2 5.871 C A 0069 HIS ND1
C A 0063 ASP OD2 5.601 C A 0069 HIS NE2
C A 0063 ASP OD1 7.828 H A 0070 HIS ND1
C A 0063 ASP OD1 7.671 H A 0070 HIS NE2
C A 0063 ASP OD2 7.884 H A 0070 HIS ND1
C A 0063 ASP OD2 7.512 H A 0070 HIS NE2
C A 0063 ASP OD2 11.73 H A 0095 HIS NE2
C A 0063 ASP OD1 11.46 H A 0107 LYS NZ
C A 0063 ASP OD2 10.96 H A 0107 LYS NZ
C A 0065 GLU OE1 11.40 C A 0069 HIS ND1
C A 0065 GLU OE1 10.66 C A 0069 HIS NE2
C A 0065 GLU OE2 10.98 C A 0069 HIS ND1
C A 0065 GLU OE2 9.847 C A 0069 HIS NE2
C A 0065 GLU OE1 11.74 H A 0070 HIS NE2
C A 0065 GLU OE1 9.387 H A 0107 LYS NZ
C A 0065 GLU OE2 10.23 H A 0107 LYS NZ
H A 0075 GLU OE1 8.345 C A 0069 HIS ND1
H A 0075 GLU OE1 8.809 C A 0069 HIS NE2
H A 0075 GLU OE2 10.29 C A 0069 HIS ND1
H A 0075 GLU OE2 10.86 C A 0069 HIS NE2
H A 0075 GLU OE1 8.750 H A 0078 LYS NZ
H A 0075 GLU OE2 6.656 H A 0078 LYS NZ
H A 0075 GLU OE1 5.946 H A 0079 LYS NZ
H A 0075 GLU OE2 4.756 H A 0079 LYS NZ
C A 0083 ASP OD1 11.29 C A 0080 HIS NE2
H A 0092 ASP OD1 7.736 H A 0070 HIS ND1
H A 0092 ASP OD1 6.767 H A 0070 HIS NE2
H A 0092 ASP OD2 9.447 H A 0070 HIS ND1
H A 0092 ASP OD2 8.684 H A 0070 HIS NE2
H A 0092 ASP OD1 2.839 H A 0095 HIS ND1
H A 0092 ASP OD1 4.953 H A 0095 HIS NE2
H A 0092 ASP OD2 4.870 H A 0095 HIS ND1
H A 0092 ASP OD2 6.928 H A 0095 HIS NE2
H A 0092 ASP OD1 10.30 H A 0099 LYS NZ
H A 0092 ASP OD2 10.86 H A 0099 LYS NZ
H A 0092 ASP OD1 11.38 H A 0124 LYS NZ
H A 0092 ASP OD2 10.12 H A 0124 LYS NZ
H A 0098 GLU OE1 11.52 C A 0069 HIS ND1
H A 0098 GLU OE2 11.49 C A 0069 HIS ND1
H A 0098 GLU OE1 9.104 H A 0070 HIS ND1
H A 0098 GLU OE1 7.073 H A 0070 HIS NE2
H A 0098 GLU OE2 10.08 H A 0070 HIS ND1
H A 0098 GLU OE2 8.046 H A 0070 HIS NE2
H A 0098 GLU OE1 8.124 H A 0095 HIS ND1
H A 0098 GLU OE1 7.840 H A 0095 HIS NE2
H A 0098 GLU OE2 9.807 H A 0095 HIS ND1
H A 0098 GLU OE2 9.806 H A 0095 HIS NE2
H A 0098 GLU OE1 11.94 H A 0099 LYS NZ
H A 0098 GLU OE1 11.54 H A 0107 LYS NZ
H A 0098 GLU OE2 10.08 H A 0107 LYS NZ
C A 0106 ASP OD1 9.756 H A 0046 ARG NH1
C A 0106 ASP OD1 8.887 H A 0046 ARG NH2
C A 0106 ASP OD2 11.03 H A 0046 ARG NH1
C A 0106 ASP OD2 10.47 H A 0046 ARG NH2
C A 0106 ASP OD1 9.500 H A 0107 LYS NZ
C A 0106 ASP OD2 10.27 H A 0107 LYS NZ
H A 0121 GLU OE1 10.81 H A 0095 HIS ND1
H A 0121 GLU OE2 11.56 H A 0095 HIS ND1
H A 0121 GLU OE1 11.25 H A 0099 LYS NZ
H A 0121 GLU OE2 10.31 H A 0099 LYS NZ
H A 0121 GLU OE1 10.84 H A 0123 HIS ND1
H A 0121 GLU OE2 10.29 H A 0123 HIS ND1
H A 0121 GLU OE1 3.355 H A 0124 LYS NZ
H A 0121 GLU OE2 2.760 H A 0124 LYS NZ
C A 0132 ASP OD1 11.95 H A 0006 LYS NZ
C A 0132 ASP OD1 10.26 C A 0038 LYS NZ
C A 0132 ASP OD2 11.78 C A 0038 LYS NZ
C A 0132 ASP OD1 11.08 H A 0119 LYS NZ
C A 0132 ASP OD1 11.33 H A 0123 HIS ND1
C A 0132 ASP OD1 9.333 H A 0123 HIS NE2
C A 0132 ASP OD2 10.64 H A 0123 HIS NE2
C A 0137 GLU OE1 10.13 H A 0006 LYS NZ
C A 0137 GLU OE2 10.19 H A 0006 LYS NZ
C A 0137 GLU OE1 11.26 C A 0014 LYS NZ
C A 0137 GLU OE2 10.95 C A 0014 LYS NZ
C A 0137 GLU OE1 9.853 H A 0020 LYS NZ
C A 0137 GLU OE2 7.787 H A 0020 LYS NZ
CHARGE_REPU 2.00 12.00 100
H A 0006 LYS NZ 11.16 C A 0080 HIS ND1
H A 0006 LYS NZ 11.25 C A 0080 HIS NE2
H A 0017 ASP OD1 9.673 H A 0018 GLU OE1
H A 0017 ASP OD1 10.11 H A 0018 GLU OE2
H A 0017 ASP OD2 8.965 H A 0018 GLU OE1
H A 0017 ASP OD2 9.674 H A 0018 GLU OE2
H A 0017 ASP OD1 4.233 C A 0027 ASP OD1
H A 0017 ASP OD1 5.767 C A 0027 ASP OD2
H A 0017 ASP OD2 5.935 C A 0027 ASP OD1
H A 0017 ASP OD2 7.089 C A 0027 ASP OD2
H A 0017 ASP OD1 9.535 C A 0137 GLU OE1
H A 0017 ASP OD1 7.648 C A 0137 GLU OE2
H A 0017 ASP OD2 8.085 C A 0137 GLU OE1
H A 0017 ASP OD2 6.208 C A 0137 GLU OE2
H A 0018 GLU OE1 8.100 H A 0022 GLU OE1
H A 0018 GLU OE1 7.423 H A 0022 GLU OE2
H A 0018 GLU OE2 7.811 H A 0022 GLU OE1
H A 0018 GLU OE2 6.583 H A 0022 GLU OE2
C A 0027 ASP OD1 11.49 H A 0031 GLU OE1
C A 0027 ASP OD2 10.89 H A 0031 GLU OE1
C A 0027 ASP OD2 11.94 H A 0031 GLU OE2
C A 0027 ASP OD1 11.07 H A 0047 GLU OE1
C A 0027 ASP OD1 10.65 C A 0137 GLU OE1
C A 0027 ASP OD1 8.852 C A 0137 GLU OE2
C A 0027 ASP OD2 9.962 C A 0137 GLU OE1
C A 0027 ASP OD2 8.438 C A 0137 GLU OE2
H A 0031 GLU OE1 7.558 H A 0032 ASP OD1
H A 0031 GLU OE1 6.963 H A 0032 ASP OD2
H A 0031 GLU OE2 8.684 H A 0032 ASP OD1
H A 0031 GLU OE2 8.549 H A 0032 ASP OD2
H A 0031 GLU OE1 11.12 H A 0047 GLU OE1
H A 0031 GLU OE2 11.35 C A 0132 ASP OD1
H A 0032 ASP OD1 9.550 C A 0042 GLU OE1
H A 0032 ASP OD1 9.737 C A 0042 GLU OE2
H A 0032 ASP OD2 9.330 C A 0042 GLU OE1
H A 0032 ASP OD2 9.910 C A 0042 GLU OE2
H A 0032 ASP OD1 10.32 H A 0047 GLU OE1
H A 0032 ASP OD1 10.96 H A 0047 GLU OE2
H A 0032 ASP OD2 8.204 H A 0047 GLU OE1
H A 0032 ASP OD2 8.895 H A 0047 GLU OE2
C A 0038 LYS NZ 11.85 H A 0119 LYS NZ
C A 0038 LYS NZ 11.58 H A 0123 HIS ND1
C A 0038 LYS NZ 11.04 H A 0123 HIS NE2
C A 0042 GLU OE1 12.00 H A 0047 GLU OE2
C A 0042 GLU OE1 11.32 C A 0106 ASP OD1
C A 0042 GLU OE2 11.37 C A 0106 ASP OD1
C A 0044 LYS NZ 6.844 H A 0046 ARG NH1
C A 0044 LYS NZ 9.042 H A 0046 ARG NH2
H A 0047 GLU OE1 10.53 C A 0106 ASP OD1
H A 0047 GLU OE1 10.76 C A 0106 ASP OD2
H A 0047 GLU OE2 8.859 C A 0106 ASP OD1
H A 0047 GLU OE2 8.952 C A 0106 ASP OD2
C A 0063 ASP OD1 7.557 C A 0065 GLU OE1
C A 0063 ASP OD1 7.348 C A 0065 GLU OE2
C A 0063 ASP OD2 5.639 C A 0065 GLU OE1
C A 0063 ASP OD2 5.729 C A 0065 GLU OE2
C A 0063 ASP OD1 11.65 H A 0075 GLU OE1
C A 0063 ASP OD1 9.104 H A 0098 GLU OE1
C A 0063 ASP OD1 8.885 H A 0098 GLU OE2
C A 0063 ASP OD2 7.985 H A 0098 GLU OE1
C A 0063 ASP OD2 8.108 H A 0098 GLU OE2
C A 0065 GLU OE1 9.208 H A 0098 GLU OE1
C A 0065 GLU OE1 9.571 H A 0098 GLU OE2
C A 0065 GLU OE2 11.00 H A 0098 GLU OE1
C A 0065 GLU OE2 11.27 H A 0098 GLU OE2
C A 0069 HIS ND1 6.405 H A 0070 HIS ND1
C A 0069 HIS ND1 7.214 H A 0070 HIS NE2
C A 0069 HIS NE2 8.038 H A 0070 HIS ND1
C A 0069 HIS NE2 8.885 H A 0070 HIS NE2
H A 0070 HIS ND1 7.314 H A 0095 HIS ND1
H A 0070 HIS ND1 7.318 H A 0095 HIS NE2
H A 0070 HIS NE2 6.106 H A 0095 HIS ND1
H A 0070 HIS NE2 6.280 H A 0095 HIS NE2
H A 0078 LYS NZ 5.819 H A 0079 LYS NZ
H A 0078 LYS NZ 10.84 C A 0080 HIS ND1
H A 0079 LYS NZ 10.61 C A 0080 HIS ND1
C A 0083 ASP OD1 9.093 H A 0084 GLU OE1
C A 0083 ASP OD1 9.645 H A 0084 GLU OE2
C A 0083 ASP OD2 9.899 H A 0084 GLU OE1
C A 0083 ASP OD2 10.70 H A 0084 GLU OE2
H A 0092 ASP OD1 9.880 H A 0098 GLU OE1
H A 0092 ASP OD1 11.17 H A 0098 GLU OE2
H A 0092 ASP OD2 11.88 H A 0098 GLU OE1
H A 0092 ASP OD1 9.131 H A 0121 GLU OE1
H A 0092 ASP OD1 10.32 H A 0121 GLU OE2
H A 0092 ASP OD2 8.099 H A 0121 GLU OE1
H A 0092 ASP OD2 9.522 H A 0121 GLU OE2
H A 0095 HIS ND1 9.009 H A 0099 LYS NZ
H A 0095 HIS NE2 9.150 H A 0099 LYS NZ
H A 0099 LYS NZ 11.25 H A 0124 LYS NZ
C A 0105 ASP OD1 9.531 C A 0106 ASP OD1
C A 0105 ASP OD1 8.958 C A 0106 ASP OD2
C A 0105 ASP OD2 9.206 C A 0106 ASP OD1
C A 0105 ASP OD2 8.169 C A 0106 ASP OD2
H A 0119 LYS NZ 11.51 H A 0123 HIS ND1
H A 0119 LYS NZ 11.28 H A 0123 HIS NE2
H A 0123 HIS ND1 10.50 H A 0124 LYS NZ
C A 0132 ASP OD2 11.33 C A 0141 GLU OE1
C A 0132 ASP OD2 11.03 C A 0141 GLU OE2
C A 0137 GLU OE1 11.35 C A 0141 GLU OE1
HB_MM 2.00 3.20 241
C A 0002 GLN N 2.244 C A 0001 SER O
H A 0003 GLU N 2.813 C A 0001 SER O
H A 0003 GLU N 2.252 C A 0002 GLN O
H A 0004 VAL N 2.257 H A 0003 GLU O
H A 0005 MET N 2.960 H A 0003 GLU O
H A 0005 MET N 2.230 H A 0004 VAL O
H A 0006 LYS N 3.171 C A 0002 GLN O
H A 0006 LYS N 2.952 H A 0003 GLU O
H A 0006 LYS N 2.243 H A 0005 MET O
H A 0007 ASN N 2.734 H A 0003 GLU O
H A 0007 ASN N 3.089 H A 0004 VAL O
H A 0007 ASN N 2.238 H A 0006 LYS O
H A 0008 LEU N 2.791 H A 0004 VAL O
H A 0008 LEU N 2.251 H A 0007 ASN O
C A 0009 SER N 3.026 H A 0006 LYS O
C A 0009 SER N 2.907 H A 0007 ASN O
C A 0009 SER N 2.241 H A 0008 LEU O
C A 0010 LEU N 2.831 H A 0008 LEU O
C A 0010 LEU N 2.248 C A 0009 SER O
C A 0011 ASN N 2.258 C A 0010 LEU O
C A 0012 PHE N 2.250 C A 0011 ASN O
C A 0013 GLY N 3.092 C A 0011 ASN O
C A 0013 GLY N 2.254 C A 0012 PHE O
C A 0014 LYS N 3.188 C A 0011 ASN O
C A 0014 LYS N 2.235 C A 0013 GLY O
C A 0015 ALA N 2.903 C A 0011 ASN O
C A 0015 ALA N 2.240 C A 0014 LYS O
H A 0016 LEU N 2.250 C A 0015 ALA O
H A 0017 ASP N 2.250 H A 0016 LEU O
H A 0018 GLU N 3.181 C A 0015 ALA O
H A 0018 GLU N 2.256 H A 0017 ASP O
H A 0019 CYS N 2.232 H A 0018 GLU O
H A 0020 LYS N 2.746 H A 0016 LEU O
H A 0020 LYS N 2.240 H A 0019 CYS O
H A 0021 LYS N 2.888 H A 0017 ASP O
H A 0021 LYS N 3.081 H A 0018 GLU O
H A 0021 LYS N 2.248 H A 0020 LYS O
H A 0022 GLU N 2.735 H A 0018 GLU O
H A 0022 GLU N 2.238 H A 0021 LYS O
C A 0023 MET N 2.915 H A 0019 CYS O
C A 0023 MET N 3.101 H A 0021 LYS O
C A 0023 MET N 2.238 H A 0022 GLU O
C A 0024 THR N 3.072 H A 0020 LYS O
C A 0024 THR N 3.090 H A 0021 LYS O
C A 0024 THR N 2.256 C A 0023 MET O
C A 0025 LEU N 2.988 H A 0020 LYS O
C A 0025 LEU N 2.242 C A 0024 THR O
C A 0026 THR N 2.240 C A 0025 LEU O
C A 0027 ASP N 2.237 C A 0026 THR O
C A 0028 ALA N 2.253 C A 0027 ASP O
H A 0029 ILE N 2.231 C A 0028 ALA O
H A 0030 ASN N 2.238 H A 0029 ILE O
H A 0031 GLU N 3.006 C A 0028 ALA O
H A 0031 GLU N 2.258 H A 0030 ASN O
H A 0032 ASP N 3.033 H A 0029 ILE O
H A 0032 ASP N 2.230 H A 0031 GLU O
C A 0033 PHE N 3.033 H A 0029 ILE O
C A 0033 PHE N 2.240 H A 0032 ASP O
C A 0034 TYR N 2.970 H A 0031 GLU O
C A 0034 TYR N 2.268 C A 0033 PHE O
C A 0035 ASN N 2.985 C A 0033 PHE O
C A 0035 ASN N 2.255 C A 0034 TYR O
C A 0036 PHE N 2.262 C A 0035 ASN O
C A 0037 TRP N 3.063 C A 0035 ASN O
C A 0037 TRP N 2.266 C A 0036 PHE O
C A 0038 LYS N 2.249 C A 0037 TRP O
C A 0039 GLU N 2.240 C A 0038 LYS O
C A 0040 GLY N 2.251 C A 0039 GLU O
C A 0041 TYR N 2.242 C A 0040 GLY O
C A 0042 GLU N 2.243 C A 0041 TYR O
C A 0043 ILE N 3.193 C A 0041 TYR O
C A 0043 ILE N 2.259 C A 0042 GLU O
C A 0044 LYS N 2.255 C A 0043 ILE O
C A 0045 ASN N 2.254 C A 0044 LYS O
H A 0046 ARG N 2.246 C A 0045 ASN O
H A 0047 GLU N 2.248 H A 0046 ARG O
H A 0048 THR N 3.067 H A 0046 ARG O
H A 0048 THR N 2.235 H A 0047 GLU O
H A 0049 GLY N 2.242 H A 0048 THR O
H A 0050 CYS N 3.146 H A 0047 GLU O
H A 0050 CYS N 3.096 H A 0048 THR O
H A 0050 CYS N 2.242 H A 0049 GLY O
H A 0051 ALA N 3.113 H A 0047 GLU O
H A 0051 ALA N 2.996 H A 0048 THR O
H A 0051 ALA N 2.261 H A 0050 CYS O
H A 0052 ILE N 2.830 H A 0048 THR O
H A 0052 ILE N 2.251 H A 0051 ALA O
H A 0053 MET N 2.883 H A 0049 GLY O
H A 0053 MET N 2.239 H A 0052 ILE O
H A 0054 CYS N 2.909 H A 0050 CYS O
H A 0054 CYS N 2.247 H A 0053 MET O
H A 0055 LEU N 2.938 H A 0051 ALA O
H A 0055 LEU N 3.030 H A 0052 ILE O
H A 0055 LEU N 2.246 H A 0054 CYS O
H A 0056 SER N 2.874 H A 0052 ILE O
H A 0056 SER N 2.247 H A 0055 LEU O
H A 0057 THR N 2.834 H A 0053 MET O
H A 0057 THR N 2.248 H A 0056 SER O
H A 0058 LYS N 2.958 H A 0054 CYS O
H A 0058 LYS N 3.006 H A 0055 LEU O
H A 0058 LYS N 2.254 H A 0057 THR O
H A 0059 LEU N 2.823 H A 0055 LEU O
H A 0059 LEU N 2.246 H A 0058 LYS O
C A 0060 ASN N 3.151 H A 0056 SER O
C A 0060 ASN N 3.044 H A 0057 THR O
C A 0060 ASN N 2.255 H A 0059 LEU O
C A 0061 MET N 2.911 H A 0056 SER O
C A 0061 MET N 2.997 H A 0059 LEU O
C A 0061 MET N 2.248 C A 0060 ASN O
C A 0062 LEU N 2.256 C A 0061 MET O
C A 0063 ASP N 2.255 C A 0062 LEU O
C A 0063 ASP N 2.850 C A 0067 ASN O
C A 0064 PRO N 2.232 C A 0063 ASP O
C A 0065 GLU N 3.094 C A 0063 ASP O
C A 0065 GLU N 2.242 C A 0064 PRO O
C A 0066 GLY N 3.198 C A 0063 ASP O
C A 0066 GLY N 2.260 C A 0065 GLU O
C A 0067 ASN N 2.255 C A 0066 GLY O
C A 0068 LEU N 2.245 C A 0067 ASN O
C A 0069 HIS N 2.879 C A 0061 MET O
C A 0069 HIS N 2.251 C A 0068 LEU O
H A 0070 HIS N 2.253 C A 0069 HIS O
H A 0071 GLY N 2.248 H A 0070 HIS O
H A 0072 ASN N 2.231 H A 0071 GLY O
H A 0073 ALA N 2.905 C A 0069 HIS O
H A 0073 ALA N 2.248 H A 0072 ASN O
H A 0074 MET N 2.921 H A 0070 HIS O
H A 0074 MET N 3.196 H A 0071 GLY O
H A 0074 MET N 2.256 H A 0073 ALA O
H A 0075 GLU N 3.004 H A 0071 GLY O
H A 0075 GLU N 2.241 H A 0074 MET O
H A 0076 PHE N 2.964 H A 0073 ALA O
H A 0076 PHE N 2.247 H A 0075 GLU O
H A 0077 ALA N 2.999 H A 0074 MET O
H A 0077 ALA N 2.234 H A 0076 PHE O
H A 0078 LYS N 2.852 H A 0074 MET O
H A 0078 LYS N 2.248 H A 0077 ALA O
H A 0079 LYS N 3.161 H A 0077 ALA O
H A 0079 LYS N 2.250 H A 0078 LYS O
C A 0080 HIS N 2.253 H A 0079 LYS O
C A 0081 GLY N 2.992 H A 0078 LYS O
C A 0081 GLY N 2.239 C A 0080 HIS O
C A 0082 ALA N 2.253 C A 0081 GLY O
C A 0083 ASP N 2.257 C A 0082 ALA O
H A 0084 GLU N 2.252 C A 0083 ASP O
H A 0085 THR N 2.249 H A 0084 GLU O
H A 0086 MET N 2.237 H A 0085 THR O
H A 0087 ALA N 2.894 C A 0083 ASP O
H A 0087 ALA N 2.247 H A 0086 MET O
H A 0088 GLN N 2.944 H A 0084 GLU O
H A 0088 GLN N 2.261 H A 0087 ALA O
H A 0089 GLN N 2.848 H A 0085 THR O
H A 0089 GLN N 2.238 H A 0088 GLN O
H A 0090 LEU N 3.018 H A 0086 MET O
H A 0090 LEU N 2.226 H A 0089 GLN O
H A 0091 ILE N 3.068 H A 0089 GLN O
H A 0091 ILE N 2.256 H A 0090 LEU O
H A 0092 ASP N 2.914 H A 0088 GLN O
H A 0092 ASP N 2.898 H A 0089 GLN O
H A 0092 ASP N 2.223 H A 0091 ILE O
H A 0093 ILE N 2.808 H A 0089 GLN O
H A 0093 ILE N 2.244 H A 0092 ASP O
H A 0094 VAL N 2.921 H A 0091 ILE O
H A 0094 VAL N 2.226 H A 0093 ILE O
H A 0095 HIS N 2.258 H A 0094 VAL O
H A 0096 GLY N 2.906 H A 0092 ASP O
H A 0096 GLY N 3.073 H A 0094 VAL O
H A 0096 GLY N 2.242 H A 0095 HIS O
H A 0097 CYS N 2.881 H A 0093 ILE O
H A 0097 CYS N 3.077 H A 0094 VAL O
H A 0097 CYS N 2.235 H A 0096 GLY O
H A 0098 GLU N 2.826 H A 0094 VAL O
H A 0098 GLU N 2.241 H A 0097 CYS O
H A 0099 LYS N 2.241 H A 0098 GLU O
H A 0100 SER N 3.154 H A 0097 CYS O
H A 0100 SER N 2.241 H A 0099 LYS O
C A 0101 THR N 2.777 H A 0097 CYS O
C A 0101 THR N 2.250 H A 0100 SER O
C A 0102 PRO N 2.249 C A 0101 THR O
C A 0103 ALA N 2.252 C A 0102 PRO O
C A 0104 ASN N 2.244 C A 0103 ALA O
C A 0105 ASP N 2.256 C A 0104 ASN O
C A 0106 ASP N 2.230 C A 0105 ASP O
H A 0107 LYS N 2.236 C A 0106 ASP O
H A 0108 CYS N 2.236 H A 0107 LYS O
H A 0109 ILE N 2.959 C A 0106 ASP O
H A 0109 ILE N 2.260 H A 0108 CYS O
H A 0110 TRP N 2.863 C A 0106 ASP O
H A 0110 TRP N 2.250 H A 0109 ILE O
H A 0111 THR N 2.898 H A 0107 LYS O
H A 0111 THR N 2.267 H A 0110 TRP O
H A 0112 LEU N 2.851 H A 0108 CYS O
H A 0112 LEU N 2.229 H A 0111 THR O
H A 0113 GLY N 3.149 H A 0111 THR O
H A 0113 GLY N 2.249 H A 0112 LEU O
H A 0114 VAL N 2.955 H A 0111 THR O
H A 0114 VAL N 2.260 H A 0113 GLY O
H A 0115 ALA N 2.708 H A 0111 THR O
H A 0115 ALA N 2.245 H A 0114 VAL O
H A 0116 THR N 2.896 H A 0112 LEU O
H A 0116 THR N 2.256 H A 0115 ALA O
H A 0117 CYS N 2.909 H A 0113 GLY O
H A 0117 CYS N 2.248 H A 0116 THR O
H A 0118 PHE N 2.872 H A 0114 VAL O
H A 0118 PHE N 2.234 H A 0117 CYS O
H A 0119 LYS N 3.063 H A 0116 THR O
H A 0119 LYS N 2.239 H A 0118 PHE O
H A 0120 ALA N 2.891 H A 0116 THR O
H A 0120 ALA N 2.249 H A 0119 LYS O
H A 0121 GLU N 2.857 H A 0117 CYS O
H A 0121 GLU N 2.249 H A 0120 ALA O
H A 0122 ILE N 3.076 H A 0118 PHE O
H A 0122 ILE N 2.235 H A 0121 GLU O
H A 0123 HIS N 2.949 H A 0120 ALA O
H A 0123 HIS N 3.102 H A 0121 GLU O
H A 0123 HIS N 2.240 H A 0122 ILE O
H A 0124 LYS N 2.996 H A 0120 ALA O
H A 0124 LYS N 2.248 H A 0123 HIS O
C A 0125 LEU N 2.785 H A 0121 GLU O
C A 0125 LEU N 2.246 H A 0124 LYS O
C A 0126 ASN N 2.888 H A 0123 HIS O
C A 0126 ASN N 3.073 H A 0124 LYS O
C A 0126 ASN N 2.235 C A 0125 LEU O
C A 0127 TRP N 2.858 H A 0122 ILE O
C A 0127 TRP N 2.248 C A 0126 ASN O
C A 0128 ALA N 2.239 C A 0127 TRP O
C A 0129 PRO N 2.260 C A 0128 ALA O
C A 0130 SER N 2.251 C A 0129 PRO O
C A 0131 MET N 2.248 C A 0130 SER O
C A 0132 ASP N 2.254 C A 0131 MET O
C A 0133 VAL N 2.244 C A 0132 ASP O
C A 0134 ALA N 2.254 C A 0133 VAL O
C A 0135 VAL N 2.255 C A 0134 ALA O
C A 0136 GLY N 2.236 C A 0135 VAL O
C A 0137 GLU N 2.255 C A 0136 GLY O
C A 0138 ILE N 2.254 C A 0137 GLU O
C A 0139 LEU N 2.251 C A 0138 ILE O
C A 0140 ALA N 2.264 C A 0139 LEU O
C A 0141 GLU N 2.242 C A 0140 ALA O
C A 0142 VAL N 3.181 C A 0140 ALA O
C A 0142 VAL N 2.246 C A 0141 GLU O
HB_MS 2.00 3.20 14
C A 0001 SER N 2.724 C A 0083 ASP OD2
H A 0006 LYS O 2.737 C A 0009 SER OG
C A 0034 TYR O 2.978 C A 0035 ASN ND2
C A 0043 ILE O 2.952 H A 0046 ARG NH1
C A 0044 LYS O 2.816 H A 0046 ARG NH1
C A 0045 ASN O 3.037 H A 0046 ARG NH1
H A 0052 ILE O 3.099 H A 0056 SER OG
C A 0060 ASN O 2.835 H A 0072 ASN ND2
C A 0083 ASP N 3.009 C A 0001 SER OG
H A 0097 CYS O 2.678 C A 0101 THR OG1
C A 0105 ASP N 2.909 C A 0104 ASN OD1
C A 0106 ASP N 2.855 C A 0104 ASN OD1
H A 0108 CYS N 2.740 C A 0106 ASP OD1
H A 0112 LEU O 2.639 H A 0116 THR OG1
HB_SS 2.00 3.20 1
H A 0032 ASP OD2 2.563 H A 0048 THR OG1
AROMATIC 0.00 8.00 6
H A 0119 LYS 7.441 C A 0012 PHE
H A 0119 LYS 6.700 C A 0033 PHE
H A 0079 LYS 7.654 H A 0076 PHE
H A 0119 LYS 3.774 C A 0036 PHE
C A 0038 LYS 5.149 C A 0037 TRP
H A 0119 LYS 6.909 H A 0118 PHE
SS_BOND 1.50 2.80 3
H A 0019 CYS SG 2.045 H A 0054 CYS SG
H A 0050 CYS SG 2.030 H A 0108 CYS SG
H A 0097 CYS SG 2.023 H A 0117 CYS SG