Complet list of 1umq con file
Complete list of 1umq.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 298
C A 0022 LEU C 2.464 C A 0023 ALA CA
C A 0022 LEU C 3.070 C A 0023 ALA C
C A 0022 LEU C 3.054 C A 0023 ALA CB
C A 0023 ALA CA 3.794 C A 0024 LYS CA
C A 0023 ALA C 2.432 C A 0024 LYS CA
C A 0023 ALA C 3.567 C A 0024 LYS C
C A 0023 ALA C 3.365 C A 0024 LYS CB
C A 0023 ALA C 3.422 C A 0024 LYS CG
C A 0023 ALA CB 3.577 C A 0027 SER CB
C A 0024 LYS CA 3.778 C A 0025 GLY CA
C A 0024 LYS C 2.403 C A 0025 GLY CA
C A 0024 LYS C 3.090 C A 0025 GLY C
C A 0025 GLY CA 3.777 C A 0026 GLU CA
C A 0025 GLY C 2.421 C A 0026 GLU CA
C A 0025 GLY C 3.293 C A 0026 GLU C
C A 0025 GLY C 3.609 C A 0026 GLU CB
C A 0026 GLU CA 3.797 C A 0027 SER CA
C A 0026 GLU C 2.425 C A 0027 SER CA
C A 0026 GLU C 3.167 C A 0027 SER C
C A 0026 GLU C 3.671 C A 0027 SER CB
C A 0027 SER CA 3.798 C A 0028 LEU CA
C A 0027 SER C 2.425 C A 0028 LEU CA
C A 0027 SER C 3.545 C A 0028 LEU C
C A 0027 SER C 3.371 C A 0028 LEU CB
C A 0028 LEU CA 2.870 C A 0029 PRO CD
C A 0028 LEU C 2.493 C A 0029 PRO CA
C A 0028 LEU C 2.974 C A 0029 PRO C
C A 0028 LEU C 3.579 C A 0029 PRO CB
C A 0028 LEU C 3.653 C A 0029 PRO CG
C A 0028 LEU C 2.497 C A 0029 PRO CD
C A 0029 PRO CA 2.891 C A 0030 PRO CD
C A 0029 PRO C 2.462 C A 0030 PRO CA
C A 0029 PRO C 3.255 C A 0030 PRO C
C A 0029 PRO C 3.617 C A 0030 PRO CB
C A 0029 PRO C 3.533 C A 0030 PRO CG
C A 0029 PRO C 2.493 C A 0030 PRO CD
C A 0030 PRO CA 2.898 C A 0031 PRO CD
C A 0030 PRO C 2.467 C A 0031 PRO CA
C A 0030 PRO C 3.112 C A 0031 PRO C
C A 0030 PRO C 3.660 C A 0031 PRO CB
C A 0030 PRO C 3.582 C A 0031 PRO CG
C A 0030 PRO C 2.492 C A 0031 PRO CD
C A 0031 PRO CA 2.931 C A 0032 PRO CD
C A 0031 PRO C 2.475 C A 0032 PRO CA
C A 0031 PRO C 3.157 C A 0032 PRO C
C A 0031 PRO C 3.651 C A 0032 PRO CB
C A 0031 PRO C 3.647 C A 0032 PRO CG
C A 0031 PRO C 2.509 C A 0032 PRO CD
C A 0031 PRO CB 3.275 C A 0032 PRO CD
C A 0032 PRO C 2.445 C A 0033 GLU CA
C A 0032 PRO C 3.045 C A 0033 GLU C
C A 0032 PRO C 3.706 C A 0033 GLU CB
C A 0033 GLU CA 3.796 C A 0034 ASN CA
C A 0033 GLU C 2.428 C A 0034 ASN CA
C A 0033 GLU C 3.221 C A 0034 ASN C
C A 0033 GLU C 3.661 C A 0034 ASN CB
C A 0034 ASN CA 2.904 C A 0035 PRO CD
C A 0034 ASN C 2.474 C A 0035 PRO CA
C A 0034 ASN C 2.984 C A 0035 PRO C
C A 0034 ASN C 3.661 C A 0035 PRO CB
C A 0034 ASN C 3.563 C A 0035 PRO CG
C A 0034 ASN C 2.496 C A 0035 PRO CD
C A 0035 PRO CA 3.799 C A 0036 MET CA
C A 0035 PRO C 2.428 C A 0036 MET CA
C A 0035 PRO C 3.217 C A 0036 MET C
C A 0035 PRO C 3.665 C A 0036 MET CB
C A 0036 MET CA 3.794 C A 0037 SER CA
C A 0036 MET C 2.430 C A 0037 SER CA
C A 0036 MET C 3.081 C A 0037 SER C
C A 0036 MET C 3.696 C A 0037 SER CB
C A 0037 SER CA 3.800 H A 0038 ALA CA
C A 0037 SER C 2.432 H A 0038 ALA CA
C A 0037 SER C 3.018 H A 0038 ALA C
C A 0037 SER C 3.702 H A 0038 ALA CB
C A 0037 SER CB 3.419 H A 0040 ARG CB
H A 0038 ALA CA 3.765 H A 0039 ASP CA
H A 0038 ALA C 2.400 H A 0039 ASP CA
H A 0038 ALA C 3.182 H A 0039 ASP C
H A 0038 ALA C 3.638 H A 0039 ASP CB
H A 0039 ASP CA 3.792 H A 0040 ARG CA
H A 0039 ASP C 2.434 H A 0040 ARG CA
H A 0039 ASP C 2.972 H A 0040 ARG C
H A 0039 ASP C 3.722 H A 0040 ARG CB
H A 0039 ASP CG 3.769 H A 0042 ARG CZ
H A 0040 ARG CA 3.796 H A 0041 VAL CA
H A 0040 ARG C 2.433 H A 0041 VAL CA
H A 0040 ARG C 2.997 H A 0041 VAL C
H A 0040 ARG C 3.742 H A 0041 VAL CB
H A 0041 VAL C 2.429 H A 0042 ARG CA
H A 0041 VAL C 3.038 H A 0042 ARG C
H A 0041 VAL C 3.722 H A 0042 ARG CB
H A 0042 ARG C 2.446 H A 0043 TRP CA
H A 0042 ARG C 2.978 H A 0043 TRP C
H A 0042 ARG C 3.735 H A 0043 TRP CB
H A 0042 ARG C 3.659 H A 0046 ILE CG1
H A 0043 TRP CA 3.793 H A 0044 GLU CA
H A 0043 TRP C 2.419 H A 0044 GLU CA
H A 0043 TRP C 3.007 H A 0044 GLU C
H A 0043 TRP C 3.707 H A 0044 GLU CB
H A 0043 TRP CA 3.605 H A 0046 ILE CG1
H A 0043 TRP CA 3.672 H A 0046 ILE CD1
H A 0043 TRP CE3 3.234 H A 0046 ILE CB
H A 0043 TRP CE3 3.625 H A 0046 ILE CG1
H A 0043 TRP CE3 3.768 H A 0046 ILE CG2
H A 0043 TRP CE3 3.354 H A 0046 ILE CD1
H A 0043 TRP CZ3 3.333 H A 0046 ILE CB
H A 0043 TRP CZ3 3.325 H A 0046 ILE CG2
H A 0043 TRP CZ3 3.780 H A 0046 ILE CD1
H A 0043 TRP CD2 3.749 H A 0074 ILE CG2
H A 0043 TRP CE2 3.418 H A 0074 ILE CG2
H A 0043 TRP CZ2 3.434 H A 0074 ILE CG2
H A 0043 TRP CH2 3.732 H A 0074 ILE CG2
H A 0043 TRP CH2 3.711 H A 0075 LEU CD2
H A 0043 TRP CZ2 3.562 C A 0078 ARG CG
H A 0044 GLU CA 3.793 H A 0045 HIS CA
H A 0044 GLU C 2.408 H A 0045 HIS CA
H A 0044 GLU C 3.100 H A 0045 HIS C
H A 0044 GLU C 3.666 H A 0045 HIS CB
H A 0045 HIS CA 3.785 H A 0046 ILE CA
H A 0045 HIS C 2.446 H A 0046 ILE CA
H A 0045 HIS C 3.000 H A 0046 ILE C
H A 0045 HIS C 3.753 H A 0046 ILE CB
H A 0045 HIS CA 3.516 H A 0048 ARG CG
H A 0045 HIS C 3.581 H A 0048 ARG CG
H A 0045 HIS C 3.561 H A 0064 LEU CD2
H A 0045 HIS CB 3.342 H A 0064 LEU CD1
H A 0045 HIS CD2 3.323 H A 0064 LEU CD2
H A 0046 ILE CA 3.780 H A 0047 GLN CA
H A 0046 ILE C 2.420 H A 0047 GLN CA
H A 0046 ILE C 3.100 H A 0047 GLN C
H A 0046 ILE C 3.685 H A 0047 GLN CB
H A 0046 ILE CA 3.656 H A 0049 ILE CG2
H A 0046 ILE C 3.557 H A 0049 ILE CG2
H A 0046 ILE CG2 3.434 H A 0060 THR CG2
H A 0046 ILE CA 3.525 H A 0064 LEU CD2
H A 0046 ILE CG1 3.588 H A 0064 LEU CG
H A 0046 ILE CG1 3.567 H A 0064 LEU CD1
H A 0046 ILE CG2 3.585 H A 0071 LEU CD1
H A 0046 ILE CG2 3.408 H A 0071 LEU CD2
H A 0046 ILE CD1 3.324 H A 0074 ILE CG2
H A 0046 ILE CD1 3.588 H A 0074 ILE CD1
H A 0047 GLN CA 3.799 H A 0048 ARG CA
H A 0047 GLN C 2.434 H A 0048 ARG CA
H A 0047 GLN C 3.024 H A 0048 ARG C
H A 0047 GLN C 3.717 H A 0048 ARG CB
H A 0048 ARG C 2.415 H A 0049 ILE CA
H A 0048 ARG C 3.195 H A 0049 ILE C
H A 0048 ARG C 3.685 H A 0049 ILE CB
H A 0049 ILE C 2.442 H A 0050 TYR CA
H A 0049 ILE C 2.980 H A 0050 TYR C
H A 0049 ILE C 3.714 H A 0050 TYR CB
H A 0049 ILE CA 3.675 H A 0052 MET CG
H A 0049 ILE CD1 3.430 H A 0052 MET CG
H A 0049 ILE CD1 3.479 H A 0059 GLU CG
H A 0049 ILE CG1 3.374 H A 0060 THR CA
H A 0049 ILE CG2 3.725 H A 0060 THR CA
H A 0049 ILE CG2 3.796 H A 0060 THR CB
H A 0049 ILE CG2 3.138 H A 0060 THR CG2
H A 0049 ILE CB 3.660 H A 0063 ARG CD
H A 0049 ILE CG1 3.491 H A 0063 ARG CD
H A 0049 ILE CD1 3.236 H A 0063 ARG CD
H A 0049 ILE CG2 3.408 H A 0064 LEU CD2
H A 0050 TYR C 2.438 H A 0051 GLU CA
H A 0050 TYR C 3.116 H A 0051 GLU C
H A 0050 TYR C 3.704 H A 0051 GLU CB
H A 0050 TYR CD1 3.782 C A 0055 ARG CA
H A 0050 TYR CE1 3.511 C A 0055 ARG CA
H A 0050 TYR CE1 3.752 C A 0055 ARG C
H A 0050 TYR CE2 3.607 C A 0055 ARG CG
H A 0050 TYR CZ 3.655 C A 0055 ARG CA
H A 0050 TYR CZ 3.748 C A 0055 ARG CB
H A 0050 TYR CZ 3.734 C A 0055 ARG CG
H A 0050 TYR CE1 3.712 H A 0075 LEU CD1
H A 0051 GLU C 2.439 H A 0052 MET CA
H A 0051 GLU C 3.148 H A 0052 MET C
H A 0051 GLU C 3.716 H A 0052 MET CB
H A 0052 MET C 2.423 H A 0053 CYS CA
H A 0052 MET C 3.236 H A 0053 CYS C
H A 0052 MET C 3.642 H A 0053 CYS CB
H A 0053 CYS C 2.456 C A 0054 ASP CA
H A 0053 CYS C 3.000 C A 0054 ASP C
H A 0053 CYS C 3.105 C A 0054 ASP CB
H A 0053 CYS CB 3.582 C A 0056 ASN CB
C A 0054 ASP C 2.457 C A 0055 ARG CA
C A 0054 ASP C 3.150 C A 0055 ARG C
C A 0054 ASP C 2.974 C A 0055 ARG CB
C A 0054 ASP C 3.549 C A 0055 ARG CG
C A 0055 ARG C 2.423 C A 0056 ASN CA
C A 0055 ARG C 3.115 C A 0056 ASN C
C A 0055 ARG C 3.696 C A 0056 ASN CB
C A 0056 ASN C 2.437 H A 0057 VAL CA
C A 0056 ASN C 3.058 H A 0057 VAL C
C A 0056 ASN C 3.731 H A 0057 VAL CB
H A 0057 VAL C 2.430 H A 0058 SER CA
H A 0057 VAL C 3.065 H A 0058 SER C
H A 0057 VAL C 3.704 H A 0058 SER CB
H A 0057 VAL CG1 3.715 H A 0068 ARG CD
H A 0057 VAL CG1 3.658 H A 0071 LEU CB
H A 0058 SER C 2.437 H A 0059 GLU CA
H A 0058 SER C 2.990 H A 0059 GLU C
H A 0058 SER C 3.739 H A 0059 GLU CB
H A 0059 GLU CA 3.777 H A 0060 THR CA
H A 0059 GLU C 2.423 H A 0060 THR CA
H A 0059 GLU C 2.984 H A 0060 THR C
H A 0059 GLU C 3.717 H A 0060 THR CB
H A 0060 THR C 2.434 H A 0061 ALA CA
H A 0060 THR C 3.025 H A 0061 ALA C
H A 0060 THR C 3.696 H A 0061 ALA CB
H A 0060 THR CB 3.674 H A 0071 LEU CG
H A 0060 THR CG2 3.445 H A 0071 LEU CG
H A 0060 THR CG2 3.559 H A 0071 LEU CD1
H A 0060 THR CG2 3.221 H A 0071 LEU CD2
H A 0061 ALA CA 3.799 H A 0062 ARG CA
H A 0061 ALA C 2.423 H A 0062 ARG CA
H A 0061 ALA C 3.091 H A 0062 ARG C
H A 0061 ALA C 3.688 H A 0062 ARG CB
H A 0061 ALA CA 3.645 C A 0066 MET CG
H A 0061 ALA CB 3.533 C A 0066 MET CG
H A 0061 ALA CA 3.760 H A 0071 LEU CD2
H A 0061 ALA CB 3.627 H A 0071 LEU CB
H A 0062 ARG CA 3.790 H A 0063 ARG CA
H A 0062 ARG C 2.433 H A 0063 ARG CA
H A 0062 ARG C 3.187 H A 0063 ARG C
H A 0062 ARG C 3.639 H A 0063 ARG CB
H A 0063 ARG C 2.444 H A 0064 LEU CA
H A 0063 ARG C 3.296 H A 0064 LEU C
H A 0063 ARG C 3.636 H A 0064 LEU CB
H A 0063 ARG C 3.716 H A 0064 LEU CD2
H A 0064 LEU C 2.462 C A 0065 ASN CA
H A 0064 LEU C 3.039 C A 0065 ASN C
H A 0064 LEU C 3.047 C A 0065 ASN CB
C A 0065 ASN CA 3.798 C A 0066 MET CA
C A 0065 ASN C 2.437 C A 0066 MET CA
C A 0065 ASN C 3.677 C A 0066 MET C
C A 0065 ASN C 3.148 C A 0066 MET CB
C A 0066 MET CA 3.771 C A 0067 HIS CA
C A 0066 MET C 2.420 C A 0067 HIS CA
C A 0066 MET C 3.159 C A 0067 HIS C
C A 0066 MET C 3.628 C A 0067 HIS CB
C A 0066 MET CB 3.769 H A 0070 THR CB
C A 0066 MET CG 3.414 H A 0070 THR CB
C A 0066 MET CE 3.519 H A 0070 THR CG2
C A 0066 MET CE 3.732 H A 0071 LEU CD2
C A 0066 MET CE 3.351 H A 0074 ILE CD1
C A 0067 HIS C 2.437 H A 0068 ARG CA
C A 0067 HIS C 2.959 H A 0068 ARG C
C A 0067 HIS C 3.723 H A 0068 ARG CB
H A 0068 ARG C 2.445 H A 0069 ARG CA
H A 0068 ARG C 3.027 H A 0069 ARG C
H A 0068 ARG C 3.726 H A 0069 ARG CB
H A 0069 ARG C 2.441 H A 0070 THR CA
H A 0069 ARG C 2.998 H A 0070 THR C
H A 0069 ARG C 3.736 H A 0070 THR CB
H A 0070 THR CA 3.795 H A 0071 LEU CA
H A 0070 THR C 2.434 H A 0071 LEU CA
H A 0070 THR C 2.971 H A 0071 LEU C
H A 0070 THR C 3.703 H A 0071 LEU CB
H A 0071 LEU C 2.441 H A 0072 GLN CA
H A 0071 LEU C 3.010 H A 0072 GLN C
H A 0071 LEU C 3.718 H A 0072 GLN CB
H A 0071 LEU CD1 3.619 H A 0075 LEU CG
H A 0071 LEU CD1 3.496 H A 0075 LEU CD1
H A 0072 GLN CA 3.793 H A 0073 ARG CA
H A 0072 GLN C 2.422 H A 0073 ARG CA
H A 0072 GLN C 2.993 H A 0073 ARG C
H A 0072 GLN C 3.708 H A 0073 ARG CB
H A 0073 ARG CA 3.798 H A 0074 ILE CA
H A 0073 ARG C 2.435 H A 0074 ILE CA
H A 0073 ARG C 3.017 H A 0074 ILE C
H A 0073 ARG C 3.724 H A 0074 ILE CB
H A 0074 ILE C 2.436 H A 0075 LEU CA
H A 0074 ILE C 3.071 H A 0075 LEU C
H A 0074 ILE C 3.716 H A 0075 LEU CB
H A 0075 LEU CA 3.785 H A 0076 ALA CA
H A 0075 LEU C 2.440 H A 0076 ALA CA
H A 0075 LEU C 3.161 H A 0076 ALA C
H A 0075 LEU C 3.673 H A 0076 ALA CB
H A 0075 LEU C 3.755 C A 0078 ARG CG
H A 0076 ALA C 2.420 H A 0077 LYS CA
H A 0076 ALA C 3.191 H A 0077 LYS C
H A 0076 ALA C 3.677 H A 0077 LYS CB
H A 0077 LYS C 2.433 C A 0078 ARG CA
H A 0077 LYS C 3.449 C A 0078 ARG C
H A 0077 LYS C 3.522 C A 0078 ARG CB
C A 0078 ARG C 2.441 C A 0079 SER CA
C A 0078 ARG C 3.651 C A 0079 SER C
C A 0078 ARG C 3.248 C A 0079 SER CB
C A 0079 SER CA 2.926 C A 0080 PRO CD
C A 0079 SER C 2.471 C A 0080 PRO CA
C A 0079 SER C 3.214 C A 0080 PRO C
C A 0079 SER C 3.625 C A 0080 PRO CB
C A 0079 SER C 3.649 C A 0080 PRO CG
C A 0079 SER C 2.510 C A 0080 PRO CD
C A 0079 SER CB 3.427 C A 0080 PRO CD
C A 0080 PRO CA 3.799 C A 0081 ARG CA
C A 0080 PRO C 2.434 C A 0081 ARG CA
C A 0080 PRO C 3.428 C A 0081 ARG C
C A 0080 PRO C 3.519 C A 0081 ARG CB
CHARGE_ATTR 2.00 12.00 61
C A 0033 GLU OE2 10.87 C A 0024 LYS NZ
H A 0039 ASP OD1 10.57 H A 0040 ARG NH1
H A 0039 ASP OD1 11.72 H A 0040 ARG NH2
H A 0039 ASP OD1 4.584 H A 0042 ARG NH1
H A 0039 ASP OD1 2.929 H A 0042 ARG NH2
H A 0039 ASP OD2 5.105 H A 0042 ARG NH1
H A 0039 ASP OD2 2.998 H A 0042 ARG NH2
H A 0039 ASP OD1 11.14 H A 0045 HIS ND1
H A 0039 ASP OD1 6.675 H A 0077 LYS NZ
H A 0039 ASP OD2 6.221 H A 0077 LYS NZ
H A 0044 GLU OE1 3.694 H A 0040 ARG NH1
H A 0044 GLU OE1 5.593 H A 0040 ARG NH2
H A 0044 GLU OE2 2.665 H A 0040 ARG NH1
H A 0044 GLU OE2 3.841 H A 0040 ARG NH2
H A 0044 GLU OE1 6.797 H A 0045 HIS ND1
H A 0044 GLU OE1 8.694 H A 0045 HIS NE2
H A 0044 GLU OE2 8.708 H A 0045 HIS ND1
H A 0044 GLU OE2 10.46 H A 0045 HIS NE2
H A 0044 GLU OE1 9.810 H A 0048 ARG NH1
H A 0044 GLU OE1 9.195 H A 0048 ARG NH2
H A 0044 GLU OE2 10.69 H A 0048 ARG NH1
H A 0044 GLU OE2 10.26 H A 0048 ARG NH2
H A 0051 GLU OE1 9.858 H A 0048 ARG NH1
H A 0051 GLU OE1 11.86 H A 0048 ARG NH2
H A 0051 GLU OE2 9.919 H A 0048 ARG NH1
H A 0051 GLU OE2 11.68 H A 0048 ARG NH2
H A 0051 GLU OE1 8.152 C A 0055 ARG NH1
H A 0051 GLU OE1 9.328 C A 0055 ARG NH2
H A 0051 GLU OE2 9.536 C A 0055 ARG NH1
H A 0051 GLU OE2 10.68 C A 0055 ARG NH2
H A 0051 GLU OE1 9.713 C A 0078 ARG NH1
H A 0051 GLU OE1 8.933 C A 0078 ARG NH2
H A 0051 GLU OE2 10.76 C A 0078 ARG NH1
H A 0051 GLU OE2 9.658 C A 0078 ARG NH2
H A 0051 GLU OE1 9.446 C A 0081 ARG NH1
H A 0051 GLU OE1 9.451 C A 0081 ARG NH2
H A 0051 GLU OE2 11.38 C A 0081 ARG NH1
H A 0051 GLU OE2 11.43 C A 0081 ARG NH2
C A 0054 ASP OD1 6.096 C A 0055 ARG NH1
C A 0054 ASP OD1 5.183 C A 0055 ARG NH2
C A 0054 ASP OD2 6.391 C A 0055 ARG NH1
C A 0054 ASP OD2 4.844 C A 0055 ARG NH2
C A 0054 ASP OD1 10.38 C A 0081 ARG NH1
C A 0054 ASP OD1 11.57 C A 0081 ARG NH2
C A 0054 ASP OD2 10.41 C A 0081 ARG NH1
C A 0054 ASP OD2 11.74 C A 0081 ARG NH2
H A 0059 GLU OE1 10.43 H A 0045 HIS NE2
H A 0059 GLU OE2 10.82 H A 0045 HIS ND1
H A 0059 GLU OE2 8.696 H A 0045 HIS NE2
H A 0059 GLU OE1 10.19 H A 0048 ARG NH1
H A 0059 GLU OE1 11.55 H A 0048 ARG NH2
H A 0059 GLU OE2 9.576 H A 0048 ARG NH1
H A 0059 GLU OE2 10.77 H A 0048 ARG NH2
H A 0059 GLU OE1 10.91 H A 0062 ARG NH1
H A 0059 GLU OE1 11.04 H A 0062 ARG NH2
H A 0059 GLU OE2 9.168 H A 0062 ARG NH1
H A 0059 GLU OE2 9.113 H A 0062 ARG NH2
H A 0059 GLU OE1 6.424 H A 0063 ARG NH1
H A 0059 GLU OE1 8.259 H A 0063 ARG NH2
H A 0059 GLU OE2 5.356 H A 0063 ARG NH1
H A 0059 GLU OE2 7.387 H A 0063 ARG NH2
CHARGE_REPU 2.00 12.00 75
H A 0039 ASP OD1 11.27 H A 0044 GLU OE1
H A 0040 ARG NH1 9.928 H A 0045 HIS ND1
H A 0040 ARG NH1 11.82 H A 0045 HIS NE2
H A 0040 ARG NH2 11.86 H A 0045 HIS ND1
H A 0042 ARG NH1 11.22 H A 0045 HIS ND1
H A 0042 ARG NH1 11.82 H A 0045 HIS NE2
H A 0042 ARG NH1 11.29 C A 0067 HIS ND1
H A 0042 ARG NH1 9.660 H A 0077 LYS NZ
H A 0042 ARG NH2 7.533 H A 0077 LYS NZ
H A 0045 HIS ND1 6.871 H A 0048 ARG NH1
H A 0045 HIS ND1 6.555 H A 0048 ARG NH2
H A 0045 HIS NE2 6.031 H A 0048 ARG NH1
H A 0045 HIS NE2 6.084 H A 0048 ARG NH2
H A 0045 HIS ND1 11.86 H A 0062 ARG NH2
H A 0045 HIS NE2 11.81 H A 0062 ARG NH1
H A 0045 HIS NE2 10.57 H A 0062 ARG NH2
H A 0045 HIS ND1 7.775 H A 0063 ARG NH1
H A 0045 HIS ND1 7.071 H A 0063 ARG NH2
H A 0045 HIS NE2 5.846 H A 0063 ARG NH1
H A 0045 HIS NE2 5.525 H A 0063 ARG NH2
H A 0048 ARG NH1 5.977 H A 0063 ARG NH1
H A 0048 ARG NH1 4.217 H A 0063 ARG NH2
H A 0048 ARG NH2 6.239 H A 0063 ARG NH1
H A 0048 ARG NH2 4.038 H A 0063 ARG NH2
H A 0051 GLU OE1 7.157 C A 0054 ASP OD1
H A 0051 GLU OE1 8.945 C A 0054 ASP OD2
H A 0051 GLU OE2 8.150 C A 0054 ASP OD1
H A 0051 GLU OE2 10.17 C A 0054 ASP OD2
C A 0055 ARG NH1 10.62 C A 0078 ARG NH1
C A 0055 ARG NH1 11.56 C A 0078 ARG NH2
C A 0055 ARG NH1 6.038 C A 0081 ARG NH1
C A 0055 ARG NH1 7.972 C A 0081 ARG NH2
C A 0055 ARG NH2 7.542 C A 0081 ARG NH1
C A 0055 ARG NH2 9.503 C A 0081 ARG NH2
H A 0062 ARG NH1 11.88 H A 0063 ARG NH1
H A 0062 ARG NH2 10.78 H A 0063 ARG NH1
H A 0062 ARG NH1 7.708 C A 0067 HIS ND1
H A 0062 ARG NH1 8.898 C A 0067 HIS NE2
H A 0062 ARG NH2 9.527 C A 0067 HIS ND1
H A 0062 ARG NH2 10.94 C A 0067 HIS NE2
C A 0067 HIS ND1 11.39 H A 0068 ARG NH1
C A 0067 HIS ND1 10.62 H A 0068 ARG NH2
C A 0067 HIS NE2 10.54 H A 0068 ARG NH1
C A 0067 HIS NE2 9.415 H A 0068 ARG NH2
C A 0067 HIS ND1 10.63 H A 0069 ARG NH1
C A 0067 HIS ND1 10.20 H A 0069 ARG NH2
C A 0067 HIS NE2 9.364 H A 0069 ARG NH1
C A 0067 HIS NE2 8.572 H A 0069 ARG NH2
H A 0068 ARG NH1 5.560 H A 0069 ARG NH1
H A 0068 ARG NH1 6.457 H A 0069 ARG NH2
H A 0068 ARG NH2 3.920 H A 0069 ARG NH1
H A 0068 ARG NH2 4.289 H A 0069 ARG NH2
H A 0068 ARG NH1 9.396 H A 0073 ARG NH1
H A 0068 ARG NH1 8.556 H A 0073 ARG NH2
H A 0068 ARG NH2 9.686 H A 0073 ARG NH1
H A 0068 ARG NH2 8.360 H A 0073 ARG NH2
H A 0068 ARG NH1 9.786 C A 0081 ARG NH1
H A 0068 ARG NH1 9.115 C A 0081 ARG NH2
H A 0068 ARG NH2 11.94 C A 0081 ARG NH1
H A 0068 ARG NH2 11.29 C A 0081 ARG NH2
H A 0069 ARG NH1 7.716 H A 0073 ARG NH1
H A 0069 ARG NH1 5.798 H A 0073 ARG NH2
H A 0069 ARG NH2 9.978 H A 0073 ARG NH1
H A 0069 ARG NH2 7.973 H A 0073 ARG NH2
H A 0073 ARG NH1 10.01 H A 0077 LYS NZ
H A 0073 ARG NH2 11.36 H A 0077 LYS NZ
H A 0073 ARG NH1 10.67 C A 0081 ARG NH2
H A 0073 ARG NH2 11.82 C A 0081 ARG NH2
H A 0077 LYS NZ 10.35 C A 0078 ARG NH1
H A 0077 LYS NZ 10.27 C A 0078 ARG NH2
H A 0077 LYS NZ 11.65 C A 0081 ARG NH2
C A 0078 ARG NH1 7.362 C A 0081 ARG NH1
C A 0078 ARG NH1 6.502 C A 0081 ARG NH2
C A 0078 ARG NH2 8.931 C A 0081 ARG NH1
C A 0078 ARG NH2 7.934 C A 0081 ARG NH2
HB_MM 2.00 3.20 103
C A 0023 ALA N 2.267 C A 0022 LEU O
C A 0024 LYS N 2.246 C A 0023 ALA O
C A 0025 GLY N 2.246 C A 0024 LYS O
C A 0026 GLU N 3.091 C A 0024 LYS O
C A 0026 GLU N 2.246 C A 0025 GLY O
C A 0027 SER N 2.244 C A 0026 GLU O
C A 0028 LEU N 2.246 C A 0027 SER O
C A 0029 PRO N 2.270 C A 0028 LEU O
C A 0030 PRO N 2.256 C A 0029 PRO O
C A 0031 PRO N 2.248 C A 0030 PRO O
C A 0032 PRO N 2.252 C A 0031 PRO O
C A 0033 GLU N 2.667 C A 0031 PRO O
C A 0033 GLU N 2.248 C A 0032 PRO O
C A 0034 ASN N 2.242 C A 0033 GLU O
C A 0035 PRO N 2.260 C A 0034 ASN O
C A 0036 MET N 2.247 C A 0035 PRO O
C A 0037 SER N 3.039 C A 0035 PRO O
C A 0037 SER N 2.250 C A 0036 MET O
H A 0038 ALA N 2.252 C A 0037 SER O
H A 0039 ASP N 2.242 H A 0038 ALA O
H A 0040 ARG N 3.180 C A 0037 SER O
H A 0040 ARG N 2.253 H A 0039 ASP O
H A 0041 VAL N 2.917 C A 0037 SER O
H A 0041 VAL N 2.254 H A 0040 ARG O
H A 0042 ARG N 2.984 H A 0039 ASP O
H A 0042 ARG N 2.257 H A 0041 VAL O
H A 0043 TRP N 2.968 H A 0039 ASP O
H A 0043 TRP N 2.250 H A 0042 ARG O
H A 0044 GLU N 3.078 H A 0040 ARG O
H A 0044 GLU N 3.191 H A 0042 ARG O
H A 0044 GLU N 2.238 H A 0043 TRP O
H A 0045 HIS N 3.188 H A 0041 VAL O
H A 0045 HIS N 2.802 H A 0042 ARG O
H A 0045 HIS N 2.248 H A 0044 GLU O
H A 0046 ILE N 2.915 H A 0042 ARG O
H A 0046 ILE N 3.177 H A 0043 TRP O
H A 0046 ILE N 2.259 H A 0045 HIS O
H A 0047 GLN N 3.159 H A 0043 TRP O
H A 0047 GLN N 2.236 H A 0046 ILE O
H A 0048 ARG N 2.247 H A 0047 GLN O
H A 0049 ILE N 3.147 H A 0047 GLN O
H A 0049 ILE N 2.237 H A 0048 ARG O
H A 0050 TYR N 2.858 H A 0046 ILE O
H A 0050 TYR N 3.141 H A 0047 GLN O
H A 0050 TYR N 2.250 H A 0049 ILE O
H A 0051 GLU N 2.943 H A 0047 GLN O
H A 0051 GLU N 3.065 H A 0049 ILE O
H A 0051 GLU N 2.252 H A 0050 TYR O
H A 0052 MET N 2.974 H A 0049 ILE O
H A 0052 MET N 2.251 H A 0051 GLU O
H A 0053 CYS N 2.846 H A 0049 ILE O
H A 0053 CYS N 2.239 H A 0052 MET O
C A 0054 ASP N 2.257 H A 0053 CYS O
C A 0055 ARG N 2.805 H A 0050 TYR O
C A 0055 ARG N 2.259 C A 0054 ASP O
C A 0056 ASN N 2.240 C A 0055 ARG O
H A 0057 VAL N 3.098 C A 0055 ARG O
H A 0057 VAL N 2.250 C A 0056 ASN O
H A 0058 SER N 2.248 H A 0057 VAL O
H A 0059 GLU N 2.253 H A 0058 SER O
H A 0060 THR N 3.073 C A 0056 ASN O
H A 0060 THR N 2.247 H A 0059 GLU O
H A 0061 ALA N 2.919 H A 0057 VAL O
H A 0061 ALA N 2.238 H A 0060 THR O
H A 0062 ARG N 3.053 H A 0058 SER O
H A 0062 ARG N 2.238 H A 0061 ALA O
H A 0063 ARG N 2.782 H A 0059 GLU O
H A 0063 ARG N 3.061 H A 0060 THR O
H A 0063 ARG N 2.244 H A 0062 ARG O
H A 0064 LEU N 2.753 H A 0060 THR O
H A 0064 LEU N 2.251 H A 0063 ARG O
C A 0065 ASN N 2.864 H A 0061 ALA O
C A 0065 ASN N 2.266 H A 0064 LEU O
C A 0066 MET N 2.748 H A 0061 ALA O
C A 0066 MET N 2.252 C A 0065 ASN O
C A 0067 HIS N 2.247 C A 0066 MET O
H A 0068 ARG N 2.250 C A 0067 HIS O
H A 0069 ARG N 3.153 C A 0067 HIS O
H A 0069 ARG N 2.255 H A 0068 ARG O
H A 0070 THR N 2.834 C A 0067 HIS O
H A 0070 THR N 2.252 H A 0069 ARG O
H A 0071 LEU N 2.250 H A 0070 THR O
H A 0072 GLN N 2.927 H A 0068 ARG O
H A 0072 GLN N 2.254 H A 0071 LEU O
H A 0073 ARG N 2.739 H A 0069 ARG O
H A 0073 ARG N 2.239 H A 0072 GLN O
H A 0074 ILE N 3.033 H A 0070 THR O
H A 0074 ILE N 2.248 H A 0073 ARG O
H A 0075 LEU N 2.952 H A 0071 LEU O
H A 0075 LEU N 3.065 H A 0072 GLN O
H A 0075 LEU N 2.247 H A 0074 ILE O
H A 0076 ALA N 2.635 H A 0072 GLN O
H A 0076 ALA N 3.168 H A 0073 ARG O
H A 0076 ALA N 2.249 H A 0075 LEU O
H A 0077 LYS N 2.849 H A 0073 ARG O
H A 0077 LYS N 2.235 H A 0076 ALA O
C A 0078 ARG N 3.122 H A 0075 LEU O
C A 0078 ARG N 2.244 H A 0077 LYS O
C A 0079 SER N 3.117 H A 0075 LEU O
C A 0079 SER N 2.248 C A 0078 ARG O
C A 0080 PRO N 2.243 C A 0079 SER O
C A 0081 ARG N 2.897 C A 0079 SER O
C A 0081 ARG N 2.250 C A 0080 PRO O
HB_MS 2.00 3.20 6
H A 0038 ALA N 2.955 C A 0037 SER OG
C A 0056 ASN O 2.683 H A 0060 THR OG1
H A 0058 SER N 2.857 C A 0056 ASN OD1
H A 0059 GLU N 2.959 C A 0056 ASN OD1
H A 0063 ARG O 3.081 H A 0045 HIS NE2
C A 0078 ARG O 2.958 C A 0079 SER OG
HB_SS 2.00 3.20 3
C A 0078 ARG NH1 2.773 C A 0079 SER OG
C A 0081 ARG NH1 3.108 H A 0050 TYR OH
C A 0081 ARG NH2 3.075 H A 0050 TYR OH
AROMATIC 0.00 8.00 3
C A 0081 ARG 4.982 H A 0050 TYR
H A 0077 LYS 6.547 H A 0043 TRP
H A 0063 ARG 6.542 H A 0045 HIS