Complet list of 1wwn con file
Complete list of 1wwn.con file
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 318
C A 0001 LYS C 2.440 C A 0002 LYS CA
C A 0001 LYS C 3.546 C A 0002 LYS C
C A 0001 LYS C 3.346 C A 0002 LYS CB
C A 0002 LYS C 2.469 E A 0003 ASN CA
C A 0002 LYS C 3.565 E A 0003 ASN C
C A 0002 LYS C 3.377 E A 0003 ASN CB
C A 0002 LYS CD 3.650 E A 0003 ASN C
C A 0002 LYS C 3.271 C A 0047 LEU CD1
C A 0002 LYS CD 3.735 C A 0047 LEU CD1
C A 0002 LYS CE 3.793 C A 0053 VAL CG2
E A 0003 ASN CA 3.790 E A 0004 GLY CA
E A 0003 ASN C 2.425 E A 0004 GLY CA
E A 0003 ASN C 3.713 E A 0004 GLY C
E A 0003 ASN CA 3.326 C A 0047 LEU CD1
E A 0003 ASN C 3.720 C A 0047 LEU CD1
E A 0004 GLY CA 3.798 E A 0005 TYR CA
E A 0004 GLY C 2.445 E A 0005 TYR CA
E A 0004 GLY C 3.219 E A 0005 TYR C
E A 0004 GLY C 3.679 E A 0005 TYR CB
E A 0004 GLY C 3.789 E A 0043 TYR CD1
E A 0005 TYR CA 3.800 C A 0006 ALA CA
E A 0005 TYR C 2.443 C A 0006 ALA CA
E A 0005 TYR C 3.229 C A 0006 ALA C
E A 0005 TYR C 3.632 C A 0006 ALA CB
E A 0005 TYR CE1 3.796 E A 0038 CYS CB
E A 0005 TYR CE2 3.735 C A 0040 LEU CD1
E A 0005 TYR CG 3.737 E A 0041 SER CB
E A 0005 TYR CD2 3.539 E A 0041 SER CB
E A 0005 TYR CE2 3.589 E A 0041 SER CB
E A 0005 TYR CZ 3.778 E A 0041 SER CB
E A 0005 TYR CB 3.471 C A 0054 LEU CB
E A 0005 TYR CG 3.580 C A 0056 ILE CG2
E A 0005 TYR CD1 3.223 C A 0056 ILE CG2
E A 0005 TYR CE1 3.159 C A 0056 ILE CG2
E A 0005 TYR CE2 3.766 C A 0056 ILE CG2
E A 0005 TYR CZ 3.493 C A 0056 ILE CG2
C A 0006 ALA C 2.482 C A 0007 VAL CA
C A 0006 ALA C 3.463 C A 0007 VAL C
C A 0006 ALA C 3.541 C A 0007 VAL CB
C A 0006 ALA C 3.574 C A 0007 VAL CG1
C A 0006 ALA CA 3.700 C A 0030 TYR CE2
C A 0006 ALA CB 3.431 C A 0030 TYR CE2
C A 0006 ALA CB 3.572 C A 0030 TYR CZ
C A 0007 VAL CA 3.774 C A 0008 ASP CA
C A 0007 VAL C 2.441 C A 0008 ASP CA
C A 0007 VAL C 3.142 C A 0008 ASP C
C A 0007 VAL C 3.631 C A 0008 ASP CB
C A 0007 VAL CB 3.243 C A 0011 GLY CA
C A 0007 VAL CB 3.460 C A 0011 GLY C
C A 0007 VAL CG1 3.573 C A 0011 GLY CA
C A 0007 VAL CG1 3.479 C A 0011 GLY C
C A 0007 VAL CG2 3.546 C A 0011 GLY CA
C A 0007 VAL C 3.794 C A 0030 TYR CZ
C A 0007 VAL CG2 3.774 C A 0052 ALA C
C A 0007 VAL CG1 3.452 C A 0054 LEU CD1
C A 0007 VAL CG1 3.777 C A 0054 LEU CD2
C A 0007 VAL CG2 3.637 C A 0054 LEU CD1
C A 0008 ASP C 2.457 C A 0009 SER CA
C A 0008 ASP C 3.680 C A 0009 SER C
C A 0008 ASP C 3.295 C A 0009 SER CB
C A 0009 SER C 2.454 C A 0010 SER CA
C A 0009 SER C 3.707 C A 0010 SER C
C A 0009 SER C 3.129 C A 0010 SER CB
C A 0010 SER C 2.449 C A 0011 GLY CA
C A 0010 SER C 3.219 C A 0011 GLY C
C A 0011 GLY CA 3.791 C A 0012 LYS CA
C A 0011 GLY C 2.424 C A 0012 LYS CA
C A 0011 GLY C 3.027 C A 0012 LYS C
C A 0011 GLY C 3.661 C A 0012 LYS CB
C A 0012 LYS C 2.453 C A 0013 VAL CA
C A 0012 LYS C 2.993 C A 0013 VAL C
C A 0012 LYS C 3.745 C A 0013 VAL CB
C A 0013 VAL C 2.475 C A 0014 SER CA
C A 0013 VAL C 3.136 C A 0014 SER C
C A 0013 VAL C 3.705 C A 0014 SER CB
C A 0013 VAL CG1 3.783 E A 0041 SER CB
C A 0014 SER C 2.483 C A 0015 GLU CA
C A 0014 SER C 2.983 C A 0015 GLU C
C A 0014 SER C 3.105 C A 0015 GLU CB
C A 0015 GLU C 2.533 C A 0016 CYS CA
C A 0015 GLU C 3.532 C A 0016 CYS C
C A 0015 GLU C 3.045 C A 0016 CYS CB
C A 0015 GLU CD 3.799 C A 0017 LEU CG
C A 0015 GLU CD 3.328 H A 0021 TYR CE1
C A 0015 GLU CD 3.661 H A 0021 TYR CZ
C A 0016 CYS CA 3.788 C A 0017 LEU CA
C A 0016 CYS C 2.432 C A 0017 LEU CA
C A 0016 CYS C 2.957 C A 0017 LEU C
C A 0016 CYS C 3.729 C A 0017 LEU CB
C A 0017 LEU C 2.455 H A 0018 LEU CA
C A 0017 LEU C 3.680 H A 0018 LEU C
C A 0017 LEU C 3.188 H A 0018 LEU CB
C A 0017 LEU C 3.736 H A 0018 LEU CG
H A 0018 LEU C 2.465 H A 0019 ASN CA
H A 0018 LEU C 3.033 H A 0019 ASN C
H A 0018 LEU C 3.720 H A 0019 ASN CB
H A 0018 LEU CD1 3.795 H A 0020 ASN CB
H A 0019 ASN C 2.448 H A 0020 ASN CA
H A 0019 ASN C 2.967 H A 0020 ASN C
H A 0019 ASN C 3.744 H A 0020 ASN CB
H A 0019 ASN CB 3.681 E A 0036 TYR CB
H A 0019 ASN CG 3.406 E A 0036 TYR CB
H A 0020 ASN C 2.461 H A 0021 TYR CA
H A 0020 ASN C 3.031 H A 0021 TYR C
H A 0020 ASN C 3.736 H A 0021 TYR CB
H A 0021 TYR C 2.457 H A 0022 CYS CA
H A 0021 TYR C 2.894 H A 0022 CYS C
H A 0021 TYR C 3.739 H A 0022 CYS CB
H A 0021 TYR CD1 3.792 H A 0025 ILE CG1
H A 0021 TYR CE1 3.662 H A 0025 ILE CG1
H A 0022 CYS CA 3.799 H A 0023 ASN CA
H A 0022 CYS C 2.456 H A 0023 ASN CA
H A 0022 CYS C 2.970 H A 0023 ASN C
H A 0022 CYS C 3.700 H A 0023 ASN CB
H A 0022 CYS CB 3.732 E A 0036 TYR CA
H A 0023 ASN C 2.456 H A 0024 ASN CA
H A 0023 ASN C 3.000 H A 0024 ASN C
H A 0023 ASN C 3.695 H A 0024 ASN CB
H A 0024 ASN C 2.470 H A 0025 ILE CA
H A 0024 ASN C 2.952 H A 0025 ILE C
H A 0024 ASN C 3.716 H A 0025 ILE CB
H A 0025 ILE CA 3.784 H A 0026 CYS CA
H A 0025 ILE C 2.417 H A 0026 CYS CA
H A 0025 ILE C 3.071 H A 0026 CYS C
H A 0025 ILE C 3.696 H A 0026 CYS CB
H A 0026 CYS C 2.413 H A 0027 THR CA
H A 0026 CYS C 2.991 H A 0027 THR C
H A 0026 CYS C 3.727 H A 0027 THR CB
H A 0026 CYS C 3.693 C A 0032 ALA CB
H A 0026 CYS CB 3.648 C A 0032 ALA CB
H A 0027 THR C 2.460 H A 0028 LYS CA
H A 0027 THR C 3.123 H A 0028 LYS C
H A 0027 THR C 3.702 H A 0028 LYS CB
H A 0028 LYS C 2.466 H A 0029 VAL CA
H A 0028 LYS C 3.494 H A 0029 VAL C
H A 0028 LYS C 3.464 H A 0029 VAL CB
H A 0028 LYS C 3.588 H A 0029 VAL CG2
H A 0028 LYS C 3.680 C A 0031 TYR CE1
H A 0029 VAL C 2.472 C A 0030 TYR CA
H A 0029 VAL C 3.419 C A 0030 TYR C
H A 0029 VAL C 3.568 C A 0030 TYR CB
H A 0029 VAL C 3.710 C A 0030 TYR CD1
H A 0029 VAL CB 3.666 C A 0030 TYR CD1
H A 0029 VAL CG1 3.528 C A 0030 TYR CD1
H A 0029 VAL CG1 3.681 C A 0030 TYR CE1
H A 0029 VAL C 3.654 C A 0031 TYR CE2
H A 0029 VAL C 3.768 C A 0031 TYR CZ
C A 0030 TYR C 2.493 C A 0031 TYR CA
C A 0030 TYR C 3.219 C A 0031 TYR C
C A 0030 TYR C 3.108 C A 0031 TYR CB
C A 0030 TYR C 3.427 C A 0031 TYR CG
C A 0030 TYR C 3.296 C A 0031 TYR CD2
C A 0030 TYR CD2 3.663 C A 0051 LYS CG
C A 0030 TYR CD2 3.797 C A 0051 LYS CE
C A 0030 TYR CE2 3.390 C A 0051 LYS CG
C A 0031 TYR CA 3.775 C A 0032 ALA CA
C A 0031 TYR C 2.462 C A 0032 ALA CA
C A 0031 TYR C 2.998 C A 0032 ALA C
C A 0031 TYR C 3.693 C A 0032 ALA CB
C A 0031 TYR CB 3.690 C A 0048 ASP CB
C A 0032 ALA CA 3.780 C A 0033 THR CA
C A 0032 ALA C 2.458 C A 0033 THR CA
C A 0032 ALA C 3.237 C A 0033 THR C
C A 0032 ALA C 3.669 C A 0033 THR CB
C A 0032 ALA CA 3.686 C A 0046 GLY CA
C A 0032 ALA CA 3.435 C A 0046 GLY C
C A 0033 THR C 2.443 E A 0034 SER CA
C A 0033 THR C 3.717 E A 0034 SER C
C A 0033 THR C 3.149 E A 0034 SER CB
E A 0034 SER C 2.483 E A 0035 GLY CA
E A 0034 SER C 3.678 E A 0035 GLY C
E A 0035 GLY C 2.459 E A 0036 TYR CA
E A 0035 GLY C 3.706 E A 0036 TYR C
E A 0035 GLY C 3.022 E A 0036 TYR CB
E A 0035 GLY C 3.413 E A 0036 TYR CG
E A 0035 GLY CA 3.755 E A 0044 CYS CA
E A 0036 TYR C 2.442 E A 0037 CYS CA
E A 0036 TYR C 3.048 E A 0037 CYS C
E A 0036 TYR C 3.736 E A 0037 CYS CB
E A 0036 TYR CD1 3.723 E A 0037 CYS C
E A 0036 TYR CE1 3.762 E A 0043 TYR CD2
E A 0036 TYR CE2 3.579 E A 0045 PHE CE1
E A 0036 TYR CZ 3.687 E A 0045 PHE CE1
E A 0036 TYR CZ 3.768 E A 0045 PHE CZ
E A 0036 TYR CZ 3.738 C A 0067 GLN CB
E A 0036 TYR CD2 3.606 C A 0068 ILE CD1
E A 0036 TYR CE2 3.484 C A 0068 ILE CD1
E A 0037 CYS CA 3.799 E A 0038 CYS CA
E A 0037 CYS C 2.429 E A 0038 CYS CA
E A 0037 CYS C 3.049 E A 0038 CYS C
E A 0037 CYS C 3.691 E A 0038 CYS CB
E A 0038 CYS C 2.531 C A 0039 LEU CA
E A 0038 CYS C 3.009 C A 0039 LEU C
E A 0038 CYS C 3.679 C A 0039 LEU CB
C A 0039 LEU C 2.448 C A 0040 LEU CA
C A 0039 LEU C 3.690 C A 0040 LEU C
C A 0039 LEU C 3.243 C A 0040 LEU CB
C A 0040 LEU C 2.457 E A 0041 SER CA
C A 0040 LEU C 3.719 E A 0041 SER C
C A 0040 LEU C 3.196 E A 0041 SER CB
E A 0041 SER CA 3.799 E A 0042 CYS CA
E A 0041 SER C 2.455 E A 0042 CYS CA
E A 0041 SER C 2.979 E A 0042 CYS C
E A 0041 SER C 3.743 E A 0042 CYS CB
E A 0042 CYS CA 3.726 E A 0043 TYR CA
E A 0042 CYS C 2.413 E A 0043 TYR CA
E A 0042 CYS C 3.034 E A 0043 TYR C
E A 0042 CYS C 3.685 E A 0043 TYR CB
E A 0043 TYR CA 3.712 E A 0044 CYS CA
E A 0043 TYR C 2.413 E A 0044 CYS CA
E A 0043 TYR C 3.562 E A 0044 CYS C
E A 0043 TYR C 3.205 E A 0044 CYS CB
E A 0043 TYR CD2 3.439 E A 0045 PHE CE1
E A 0043 TYR CD2 3.618 E A 0045 PHE CZ
E A 0043 TYR CE2 3.630 E A 0045 PHE CE1
E A 0043 TYR CE2 3.620 E A 0045 PHE CE2
E A 0043 TYR CE2 3.357 E A 0045 PHE CZ
E A 0043 TYR CE1 3.742 C A 0056 ILE CD1
E A 0044 CYS CA 3.798 E A 0045 PHE CA
E A 0044 CYS C 2.501 E A 0045 PHE CA
E A 0044 CYS C 3.426 E A 0045 PHE C
E A 0044 CYS C 3.562 E A 0045 PHE CB
E A 0044 CYS C 3.787 E A 0045 PHE CG
E A 0044 CYS C 3.757 E A 0045 PHE CD1
E A 0044 CYS CB 3.579 C A 0047 LEU CG
E A 0044 CYS CB 3.560 C A 0047 LEU CD2
E A 0045 PHE C 2.484 C A 0046 GLY CA
E A 0045 PHE C 3.605 C A 0046 GLY C
E A 0045 PHE CZ 3.730 C A 0068 ILE CB
E A 0045 PHE CD2 3.756 C A 0069 ILE CD1
C A 0046 GLY C 2.518 C A 0047 LEU CA
C A 0046 GLY C 2.876 C A 0047 LEU C
C A 0046 GLY C 3.792 C A 0047 LEU CB
C A 0046 GLY C 3.749 C A 0047 LEU CD1
C A 0047 LEU C 2.488 C A 0048 ASP CA
C A 0047 LEU C 3.230 C A 0048 ASP C
C A 0047 LEU C 3.657 C A 0048 ASP CB
C A 0047 LEU CD2 3.521 C A 0053 VAL CG1
C A 0048 ASP CA 3.746 C A 0049 ASP CA
C A 0048 ASP C 2.440 C A 0049 ASP CA
C A 0048 ASP C 3.049 C A 0049 ASP C
C A 0048 ASP C 3.688 C A 0049 ASP CB
C A 0049 ASP C 2.467 C A 0050 ASP CA
C A 0049 ASP C 3.599 C A 0050 ASP C
C A 0049 ASP C 3.341 C A 0050 ASP CB
C A 0050 ASP CA 3.770 C A 0051 LYS CA
C A 0050 ASP C 2.460 C A 0051 LYS CA
C A 0050 ASP C 2.990 C A 0051 LYS C
C A 0050 ASP C 3.725 C A 0051 LYS CB
C A 0050 ASP CG 3.419 C A 0053 VAL CG1
C A 0050 ASP CG 3.456 C A 0053 VAL CG2
C A 0051 LYS C 2.513 C A 0052 ALA CA
C A 0051 LYS C 3.703 C A 0052 ALA C
C A 0051 LYS C 3.019 C A 0052 ALA CB
C A 0052 ALA CA 3.797 C A 0053 VAL CA
C A 0052 ALA C 2.421 C A 0053 VAL CA
C A 0052 ALA C 2.992 C A 0053 VAL C
C A 0052 ALA C 3.731 C A 0053 VAL CB
C A 0053 VAL C 2.435 C A 0054 LEU CA
C A 0053 VAL C 3.126 C A 0054 LEU C
C A 0053 VAL C 3.702 C A 0054 LEU CB
C A 0054 LEU CA 3.771 C A 0055 LYS CA
C A 0054 LEU C 2.480 C A 0055 LYS CA
C A 0054 LEU C 3.299 C A 0055 LYS C
C A 0054 LEU C 3.649 C A 0055 LYS CB
C A 0055 LYS C 2.445 C A 0056 ILE CA
C A 0055 LYS C 3.151 C A 0056 ILE C
C A 0055 LYS C 3.711 C A 0056 ILE CB
C A 0056 ILE C 2.461 H A 0057 LYS CA
C A 0056 ILE C 3.068 H A 0057 LYS C
C A 0056 ILE C 3.739 H A 0057 LYS CB
C A 0056 ILE CB 3.702 H A 0060 THR CG2
C A 0056 ILE CG2 3.510 H A 0060 THR CG2
H A 0057 LYS C 2.424 H A 0058 ASP CA
H A 0057 LYS C 2.910 H A 0058 ASP C
H A 0057 LYS C 3.759 H A 0058 ASP CB
H A 0057 LYS CE 3.674 H A 0060 THR CB
H A 0058 ASP CA 3.776 H A 0059 ALA CA
H A 0058 ASP C 2.422 H A 0059 ALA CA
H A 0058 ASP C 2.943 H A 0059 ALA C
H A 0058 ASP C 3.703 H A 0059 ALA CB
H A 0058 ASP CG 3.574 H A 0061 LYS CD
H A 0059 ALA C 2.434 H A 0060 THR CA
H A 0059 ALA C 3.098 H A 0060 THR C
H A 0059 ALA C 3.697 H A 0060 THR CB
H A 0060 THR C 2.464 H A 0061 LYS CA
H A 0060 THR C 2.953 H A 0061 LYS C
H A 0060 THR C 3.724 H A 0061 LYS CB
H A 0061 LYS CA 3.795 H A 0062 SER CA
H A 0061 LYS C 2.469 H A 0062 SER CA
H A 0061 LYS C 2.972 H A 0062 SER C
H A 0061 LYS C 3.717 H A 0062 SER CB
H A 0062 SER C 2.474 H A 0063 TYR CA
H A 0062 SER C 2.957 H A 0063 TYR C
H A 0062 SER C 3.725 H A 0063 TYR CB
H A 0063 TYR C 2.461 H A 0064 CYS CA
H A 0063 TYR C 3.359 H A 0064 CYS C
H A 0063 TYR C 3.622 H A 0064 CYS CB
H A 0064 CYS C 2.442 C A 0065 ASP CA
H A 0064 CYS C 3.292 C A 0065 ASP C
H A 0064 CYS C 3.629 C A 0065 ASP CB
H A 0064 CYS CA 3.781 C A 0067 GLN CG
C A 0065 ASP C 2.498 C A 0066 VAL CA
C A 0065 ASP C 3.017 C A 0066 VAL C
C A 0065 ASP C 3.750 C A 0066 VAL CB
C A 0065 ASP C 3.706 C A 0069 ILE C
C A 0066 VAL C 2.505 C A 0067 GLN CA
C A 0066 VAL C 2.934 C A 0067 GLN C
C A 0066 VAL C 3.618 C A 0067 GLN CB
C A 0066 VAL CA 3.553 C A 0069 ILE C
C A 0067 GLN C 2.478 C A 0068 ILE CA
C A 0067 GLN C 3.496 C A 0068 ILE C
C A 0067 GLN C 3.475 C A 0068 ILE CB
C A 0067 GLN C 3.502 C A 0068 ILE CG1
C A 0068 ILE C 2.482 C A 0069 ILE CA
C A 0068 ILE C 3.408 C A 0069 ILE C
C A 0068 ILE C 3.596 C A 0069 ILE CB
C A 0068 ILE C 3.661 C A 0069 ILE CG1
CHARGE_ATTR 2.00 12.00 31
C A 0008 ASP OD1 4.505 C A 0012 LYS NZ
C A 0008 ASP OD2 2.570 C A 0012 LYS NZ
C A 0008 ASP OD1 11.30 H A 0028 LYS NZ
C A 0008 ASP OD2 11.45 H A 0028 LYS NZ
C A 0008 ASP OD1 7.773 C A 0051 LYS NZ
C A 0008 ASP OD2 9.461 C A 0051 LYS NZ
C A 0015 GLU OE1 8.027 C A 0012 LYS NZ
C A 0015 GLU OE2 7.223 C A 0012 LYS NZ
C A 0015 GLU OE2 11.77 H A 0028 LYS NZ
C A 0048 ASP OD1 4.545 C A 0001 LYS NZ
C A 0048 ASP OD2 2.628 C A 0001 LYS NZ
C A 0048 ASP OD1 9.575 C A 0051 LYS NZ
C A 0048 ASP OD2 10.33 C A 0051 LYS NZ
C A 0049 ASP OD1 10.28 C A 0001 LYS NZ
C A 0049 ASP OD2 10.43 C A 0001 LYS NZ
C A 0049 ASP OD1 11.07 C A 0002 LYS NZ
C A 0049 ASP OD1 4.617 C A 0051 LYS NZ
C A 0049 ASP OD2 2.576 C A 0051 LYS NZ
C A 0050 ASP OD1 11.96 C A 0001 LYS NZ
C A 0050 ASP OD2 10.68 C A 0001 LYS NZ
C A 0050 ASP OD1 5.797 C A 0002 LYS NZ
C A 0050 ASP OD2 4.102 C A 0002 LYS NZ
C A 0050 ASP OD1 8.472 C A 0051 LYS NZ
C A 0050 ASP OD2 9.514 C A 0051 LYS NZ
H A 0058 ASP OD1 10.41 H A 0057 LYS NZ
H A 0058 ASP OD2 11.41 H A 0057 LYS NZ
H A 0058 ASP OD1 2.838 H A 0061 LYS NZ
H A 0058 ASP OD2 2.645 H A 0061 LYS NZ
C A 0065 ASP OD2 11.98 C A 0002 LYS NZ
C A 0065 ASP OD1 8.212 H A 0061 LYS NZ
C A 0065 ASP OD2 7.037 H A 0061 LYS NZ
CHARGE_REPU 2.00 12.00 27
C A 0001 LYS NZ 11.75 C A 0002 LYS NZ
C A 0001 LYS NZ 10.82 C A 0051 LYS NZ
C A 0008 ASP OD1 9.526 C A 0015 GLU OE1
C A 0008 ASP OD1 9.257 C A 0015 GLU OE2
C A 0008 ASP OD2 8.800 C A 0015 GLU OE1
C A 0008 ASP OD2 8.118 C A 0015 GLU OE2
C A 0008 ASP OD1 11.39 C A 0049 ASP OD1
C A 0008 ASP OD1 10.00 C A 0049 ASP OD2
C A 0008 ASP OD2 11.72 C A 0049 ASP OD2
C A 0008 ASP OD1 10.97 C A 0050 ASP OD1
C A 0012 LYS NZ 11.94 C A 0051 LYS NZ
C A 0048 ASP OD1 7.544 C A 0049 ASP OD1
C A 0048 ASP OD1 8.202 C A 0049 ASP OD2
C A 0048 ASP OD2 9.138 C A 0049 ASP OD1
C A 0048 ASP OD2 9.453 C A 0049 ASP OD2
C A 0048 ASP OD1 10.81 C A 0050 ASP OD1
C A 0048 ASP OD1 9.804 C A 0050 ASP OD2
C A 0048 ASP OD2 11.94 C A 0050 ASP OD1
C A 0048 ASP OD2 10.80 C A 0050 ASP OD2
C A 0049 ASP OD1 6.372 C A 0050 ASP OD1
C A 0049 ASP OD1 7.102 C A 0050 ASP OD2
C A 0049 ASP OD2 7.630 C A 0050 ASP OD1
C A 0049 ASP OD2 8.536 C A 0050 ASP OD2
H A 0058 ASP OD1 10.17 C A 0065 ASP OD1
H A 0058 ASP OD1 9.180 C A 0065 ASP OD2
H A 0058 ASP OD2 10.69 C A 0065 ASP OD1
H A 0058 ASP OD2 9.338 C A 0065 ASP OD2
HB_MM 2.00 3.20 122
C A 0002 LYS N 2.247 C A 0001 LYS O
C A 0002 LYS N 3.063 C A 0047 LEU O
E A 0003 ASN N 2.230 C A 0002 LYS O
E A 0004 GLY N 2.243 E A 0003 ASN O
E A 0004 GLY N 3.002 E A 0044 CYS O
E A 0005 TYR N 2.266 E A 0004 GLY O
C A 0006 ALA N 2.244 E A 0005 TYR O
C A 0006 ALA N 2.907 E A 0042 CYS O
C A 0007 VAL N 2.273 C A 0006 ALA O
C A 0008 ASP N 2.254 C A 0007 VAL O
C A 0008 ASP N 2.897 C A 0012 LYS O
C A 0009 SER N 2.255 C A 0008 ASP O
C A 0010 SER N 2.248 C A 0009 SER O
C A 0011 GLY N 2.237 C A 0010 SER O
C A 0012 LYS N 3.067 C A 0010 SER O
C A 0012 LYS N 2.241 C A 0011 GLY O
C A 0013 VAL N 2.263 C A 0012 LYS O
C A 0014 SER N 2.947 C A 0006 ALA O
C A 0014 SER N 2.263 C A 0013 VAL O
C A 0015 GLU N 2.747 C A 0013 VAL O
C A 0015 GLU N 2.251 C A 0014 SER O
C A 0016 CYS N 3.192 C A 0014 SER O
C A 0016 CYS N 2.266 C A 0015 GLU O
C A 0017 LEU N 2.223 C A 0016 CYS O
H A 0018 LEU N 2.250 C A 0017 LEU O
H A 0019 ASN N 2.249 H A 0018 LEU O
H A 0020 ASN N 2.249 H A 0019 ASN O
H A 0021 TYR N 3.091 H A 0018 LEU O
H A 0021 TYR N 3.146 H A 0019 ASN O
H A 0021 TYR N 2.263 H A 0020 ASN O
H A 0022 CYS N 3.037 H A 0019 ASN O
H A 0022 CYS N 2.257 H A 0021 TYR O
H A 0023 ASN N 2.933 H A 0019 ASN O
H A 0023 ASN N 2.256 H A 0022 CYS O
H A 0024 ASN N 2.841 H A 0020 ASN O
H A 0024 ASN N 3.061 H A 0021 TYR O
H A 0024 ASN N 2.245 H A 0023 ASN O
H A 0025 ILE N 2.929 H A 0021 TYR O
H A 0025 ILE N 2.259 H A 0024 ASN O
H A 0026 CYS N 2.923 H A 0022 CYS O
H A 0026 CYS N 3.083 H A 0023 ASN O
H A 0026 CYS N 2.246 H A 0025 ILE O
H A 0027 THR N 2.920 H A 0023 ASN O
H A 0027 THR N 3.101 H A 0024 ASN O
H A 0027 THR N 2.242 H A 0026 CYS O
H A 0028 LYS N 2.915 H A 0024 ASN O
H A 0028 LYS N 3.006 H A 0025 ILE O
H A 0028 LYS N 2.242 H A 0027 THR O
H A 0029 VAL N 2.905 H A 0025 ILE O
H A 0029 VAL N 2.251 H A 0028 LYS O
C A 0030 TYR N 2.997 H A 0026 CYS O
C A 0030 TYR N 2.248 H A 0029 VAL O
C A 0031 TYR N 2.711 H A 0026 CYS O
C A 0031 TYR N 2.254 C A 0030 TYR O
C A 0032 ALA N 3.158 H A 0026 CYS O
C A 0032 ALA N 2.259 C A 0031 TYR O
C A 0033 THR N 2.256 C A 0032 ALA O
C A 0033 THR N 2.767 E A 0045 PHE O
E A 0034 SER N 2.246 C A 0033 THR O
E A 0034 SER N 2.974 E A 0045 PHE O
E A 0035 GLY N 2.241 E A 0034 SER O
E A 0036 TYR N 2.253 E A 0035 GLY O
E A 0036 TYR N 3.094 E A 0043 TYR O
E A 0037 CYS N 2.255 E A 0036 TYR O
E A 0038 CYS N 2.917 E A 0036 TYR O
E A 0038 CYS N 2.240 E A 0037 CYS O
E A 0038 CYS N 2.836 E A 0041 SER O
C A 0039 LEU N 2.262 E A 0038 CYS O
C A 0040 LEU N 2.682 E A 0038 CYS O
C A 0040 LEU N 2.249 C A 0039 LEU O
E A 0041 SER N 2.934 E A 0038 CYS O
E A 0041 SER N 2.237 C A 0040 LEU O
E A 0042 CYS N 2.254 E A 0041 SER O
E A 0043 TYR N 2.920 E A 0036 TYR O
E A 0043 TYR N 3.053 E A 0041 SER O
E A 0043 TYR N 2.253 E A 0042 CYS O
E A 0044 CYS N 2.908 E A 0004 GLY O
E A 0044 CYS N 2.262 E A 0043 TYR O
E A 0045 PHE N 2.878 E A 0034 SER O
E A 0045 PHE N 2.277 E A 0044 CYS O
C A 0046 GLY N 2.688 C A 0002 LYS O
C A 0046 GLY N 2.252 E A 0045 PHE O
C A 0047 LEU N 2.268 C A 0046 GLY O
C A 0048 ASP N 2.824 C A 0030 TYR O
C A 0048 ASP N 2.914 C A 0046 GLY O
C A 0048 ASP N 2.273 C A 0047 LEU O
C A 0049 ASP N 2.263 C A 0048 ASP O
C A 0050 ASP N 2.255 C A 0049 ASP O
C A 0051 LYS N 2.243 C A 0050 ASP O
C A 0052 ALA N 2.269 C A 0051 LYS O
C A 0053 VAL N 2.244 C A 0052 ALA O
C A 0054 LEU N 2.851 E A 0005 TYR O
C A 0054 LEU N 2.243 C A 0053 VAL O
C A 0055 LYS N 2.268 C A 0054 LEU O
C A 0056 ILE N 2.248 C A 0055 LYS O
H A 0057 LYS N 2.254 C A 0056 ILE O
H A 0058 ASP N 2.251 H A 0057 LYS O
H A 0059 ALA N 2.238 H A 0058 ASP O
H A 0060 THR N 2.974 H A 0057 LYS O
H A 0060 THR N 2.983 H A 0058 ASP O
H A 0060 THR N 2.244 H A 0059 ALA O
H A 0061 LYS N 2.809 H A 0057 LYS O
H A 0061 LYS N 2.786 H A 0058 ASP O
H A 0061 LYS N 2.245 H A 0060 THR O
H A 0062 SER N 2.752 H A 0058 ASP O
H A 0062 SER N 2.250 H A 0061 LYS O
H A 0063 TYR N 2.906 H A 0059 ALA O
H A 0063 TYR N 2.255 H A 0062 SER O
H A 0064 CYS N 2.842 H A 0060 THR O
H A 0064 CYS N 2.918 H A 0061 LYS O
H A 0064 CYS N 2.256 H A 0063 TYR O
C A 0065 ASP N 2.784 H A 0061 LYS O
C A 0065 ASP N 3.155 H A 0062 SER O
C A 0065 ASP N 2.238 H A 0064 CYS O
C A 0066 VAL N 2.273 C A 0065 ASP O
C A 0067 GLN N 2.920 C A 0065 ASP O
C A 0067 GLN N 2.263 C A 0066 VAL O
C A 0068 ILE N 2.940 C A 0065 ASP O
C A 0068 ILE N 3.095 C A 0066 VAL O
C A 0068 ILE N 2.256 C A 0067 GLN O
C A 0069 ILE N 2.753 C A 0065 ASP O
C A 0069 ILE N 2.253 C A 0068 ILE O
HB_MS 2.00 3.20 23
E A 0003 ASN O 2.698 C A 0002 LYS NZ
C A 0007 VAL N 3.141 C A 0030 TYR OH
C A 0007 VAL O 3.064 C A 0030 TYR OH
C A 0008 ASP N 3.111 C A 0030 TYR OH
C A 0013 VAL O 2.680 C A 0012 LYS NZ
C A 0016 CYS N 2.718 C A 0015 GLU OE1
C A 0017 LEU N 2.666 C A 0015 GLU OE1
H A 0020 ASN O 2.860 H A 0023 ASN ND2
H A 0024 ASN O 2.766 H A 0027 THR OG1
H A 0028 LYS N 3.050 H A 0027 THR OG1
H A 0028 LYS O 2.703 C A 0031 TYR OH
H A 0029 VAL O 2.706 C A 0051 LYS NZ
C A 0031 TYR O 2.666 C A 0001 LYS NZ
E A 0035 GLY N 2.820 E A 0034 SER OG
E A 0037 CYS N 2.872 H A 0019 ASN OD1
C A 0040 LEU O 2.666 E A 0041 SER OG
C A 0046 GLY O 2.637 C A 0001 LYS NZ
C A 0050 ASP N 2.634 C A 0049 ASP OD1
C A 0053 VAL N 2.738 C A 0050 ASP OD1
H A 0058 ASP O 3.188 H A 0062 SER OG
H A 0063 TYR O 2.835 C A 0067 GLN NE2
H A 0064 CYS O 2.594 E A 0036 TYR OH
C A 0066 VAL N 3.037 C A 0065 ASP OD1
HB_SS 2.00 3.20 7
E A 0003 ASN ND2 2.694 E A 0043 TYR OH
C A 0008 ASP OD1 2.609 C A 0030 TYR OH
C A 0015 GLU OE2 2.621 H A 0021 TYR OH
E A 0034 SER OG 2.829 H A 0023 ASN OD1
H A 0057 LYS NZ 2.704 H A 0060 THR OG1
H A 0058 ASP OD1 2.605 H A 0062 SER OG
H A 0061 LYS NZ 2.735 H A 0062 SER OG
AROMATIC 0.00 8.00 4
C A 0001 LYS 7.271 C A 0031 TYR
C A 0051 LYS 6.226 C A 0031 TYR
E A 0036 TYR 5.292 E A 0045 PHE
H A 0057 LYS 6.408 E A 0005 TYR
SS_BOND 1.50 2.80 4
C A 0016 CYS SG 2.089 E A 0037 CYS SG
H A 0022 CYS SG 2.072 E A 0042 CYS SG
H A 0026 CYS SG 2.045 E A 0044 CYS SG
E A 0038 CYS SG 2.076 H A 0064 CYS SG