Complet list of 1d1r con file
Complete list of 1d1r.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 301
C A 0029 LYS C 2.423 C A 0030 GLY CA
C A 0029 LYS C 3.684 C A 0030 GLY C
C A 0030 GLY C 2.422 C A 0031 ASP CA
C A 0030 GLY C 3.010 C A 0031 ASP C
C A 0030 GLY C 2.911 C A 0031 ASP CB
C A 0031 ASP C 2.422 C A 0032 GLY CA
C A 0031 ASP C 3.628 C A 0032 GLY C
C A 0032 GLY C 2.422 E A 0033 VAL CA
C A 0032 GLY C 3.556 E A 0033 VAL C
C A 0032 GLY C 3.363 E A 0033 VAL CB
C A 0032 GLY C 3.250 E A 0033 VAL CG1
E A 0033 VAL C 2.423 E A 0034 VAL CA
E A 0033 VAL C 3.281 E A 0034 VAL C
E A 0033 VAL C 3.608 E A 0034 VAL CB
E A 0034 VAL C 2.423 E A 0035 ARG CA
E A 0034 VAL C 3.535 E A 0035 ARG C
E A 0034 VAL C 3.392 E A 0035 ARG CB
E A 0034 VAL CG2 3.471 C A 0054 VAL CG2
E A 0034 VAL CB 3.575 H A 0097 LEU CG
E A 0034 VAL CB 3.293 H A 0097 LEU CD1
E A 0034 VAL CB 3.604 H A 0097 LEU CD2
E A 0034 VAL CG1 3.774 H A 0097 LEU CG
E A 0034 VAL CG1 3.329 H A 0097 LEU CD1
E A 0035 ARG C 2.422 E A 0036 ILE CA
E A 0035 ARG C 3.393 E A 0036 ILE C
E A 0035 ARG C 3.533 E A 0036 ILE CB
E A 0035 ARG C 3.562 E A 0036 ILE CG1
E A 0035 ARG CB 3.690 C A 0105 LYS CB
E A 0036 ILE C 2.421 E A 0037 GLN CA
E A 0036 ILE C 3.480 E A 0037 GLN C
E A 0036 ILE C 3.455 E A 0037 GLN CB
E A 0036 ILE CG2 3.631 E A 0051 ILE CD1
E A 0036 ILE CG1 3.659 H A 0093 LEU CB
E A 0036 ILE CG1 3.664 H A 0093 LEU CG
E A 0036 ILE CG1 3.571 H A 0093 LEU CD1
E A 0036 ILE CG2 3.414 H A 0093 LEU CG
E A 0036 ILE CD1 3.717 H A 0093 LEU CB
E A 0036 ILE CD1 3.345 H A 0097 LEU CD1
E A 0037 GLN C 2.423 E A 0038 ARG CA
E A 0037 GLN C 3.545 E A 0038 ARG C
E A 0037 GLN C 3.378 E A 0038 ARG CB
E A 0037 GLN CG 3.451 C A 0107 ALA CB
E A 0038 ARG C 2.423 C A 0039 GLN CA
E A 0038 ARG C 3.210 C A 0039 GLN C
E A 0038 ARG C 3.643 C A 0039 GLN CB
E A 0038 ARG CG 3.680 H A 0090 ARG CZ
E A 0038 ARG CD 3.444 H A 0090 ARG CZ
E A 0038 ARG CZ 3.489 H A 0090 ARG CZ
C A 0039 GLN C 2.422 C A 0040 THR CA
C A 0039 GLN C 3.115 C A 0040 THR C
C A 0039 GLN C 3.675 C A 0040 THR CB
C A 0039 GLN CB 3.682 C A 0048 VAL CG2
C A 0040 THR C 2.422 C A 0041 SER CA
C A 0040 THR C 3.585 C A 0041 SER C
C A 0040 THR C 3.317 C A 0041 SER CB
C A 0041 SER C 2.422 C A 0042 GLY CA
C A 0041 SER C 3.663 C A 0042 GLY C
C A 0042 GLY C 2.422 C A 0043 ARG CA
C A 0042 GLY C 3.057 C A 0043 ARG C
C A 0042 GLY C 3.688 C A 0043 ARG CB
C A 0043 ARG C 2.423 C A 0044 LYS CA
C A 0043 ARG C 3.587 C A 0044 LYS C
C A 0043 ARG C 3.316 C A 0044 LYS CB
C A 0043 ARG C 3.537 C A 0044 LYS CG
C A 0044 LYS C 2.422 C A 0045 GLY CA
C A 0044 LYS C 3.694 C A 0045 GLY C
C A 0045 GLY C 2.422 C A 0046 LYS CA
C A 0045 GLY C 3.688 C A 0046 LYS C
C A 0045 GLY C 3.058 C A 0046 LYS CB
C A 0046 LYS C 2.424 C A 0047 GLY CA
C A 0046 LYS C 3.460 C A 0047 GLY C
C A 0047 GLY C 2.422 C A 0048 VAL CA
C A 0047 GLY C 3.512 C A 0048 VAL C
C A 0047 GLY C 3.420 C A 0048 VAL CB
C A 0047 GLY C 3.443 C A 0048 VAL CG1
C A 0047 GLY CA 3.779 C A 0088 ASP CG
C A 0048 VAL C 2.422 E A 0049 CYS CA
C A 0048 VAL C 3.531 E A 0049 CYS C
C A 0048 VAL C 3.397 E A 0049 CYS CB
E A 0049 CYS C 2.422 E A 0050 LEU CA
E A 0049 CYS C 3.432 E A 0050 LEU C
E A 0049 CYS C 3.501 E A 0050 LEU CB
E A 0049 CYS C 3.536 E A 0050 LEU CG
E A 0050 LEU C 2.422 E A 0051 ILE CA
E A 0050 LEU C 3.372 E A 0051 ILE C
E A 0050 LEU C 3.550 E A 0051 ILE CB
E A 0050 LEU C 3.541 E A 0051 ILE CG1
E A 0050 LEU C 3.701 E A 0051 ILE CD1
E A 0051 ILE C 2.422 E A 0052 THR CA
E A 0051 ILE C 3.664 E A 0052 THR C
E A 0051 ILE C 3.145 E A 0052 THR CB
E A 0052 THR C 2.422 C A 0053 GLY CA
E A 0052 THR C 3.385 C A 0053 GLY C
E A 0052 THR CG2 3.754 C A 0081 GLY C
C A 0053 GLY C 2.422 C A 0054 VAL CA
C A 0053 GLY C 2.872 C A 0054 VAL C
C A 0053 GLY C 3.687 C A 0054 VAL CB
C A 0054 VAL C 2.423 C A 0055 ASP CA
C A 0054 VAL C 3.135 C A 0055 ASP C
C A 0054 VAL C 3.669 C A 0055 ASP CB
C A 0054 VAL CG1 3.516 C A 0056 LEU CD1
C A 0054 VAL CB 3.722 H A 0061 LEU CD2
C A 0055 ASP C 2.423 C A 0056 LEU CA
C A 0055 ASP C 3.618 C A 0056 LEU C
C A 0055 ASP C 3.259 C A 0056 LEU CB
C A 0055 ASP C 3.284 C A 0056 LEU CG
C A 0056 LEU C 2.420 H A 0057 ASP CA
C A 0056 LEU C 2.843 H A 0057 ASP C
C A 0056 LEU C 3.681 H A 0057 ASP CB
H A 0057 ASP C 2.422 H A 0058 ASP CA
H A 0057 ASP C 2.968 H A 0058 ASP C
H A 0057 ASP C 3.695 H A 0058 ASP CB
H A 0058 ASP C 2.423 H A 0059 ALA CA
H A 0058 ASP C 2.935 H A 0059 ALA C
H A 0058 ASP C 3.694 H A 0059 ALA CB
H A 0059 ALA C 2.424 H A 0060 GLU CA
H A 0059 ALA C 2.986 H A 0060 GLU C
H A 0059 ALA C 3.696 H A 0060 GLU CB
H A 0060 GLU C 2.423 H A 0061 LEU CA
H A 0060 GLU C 2.955 H A 0061 LEU C
H A 0060 GLU C 3.695 H A 0061 LEU CB
H A 0061 LEU C 2.424 H A 0062 THR CA
H A 0061 LEU C 2.978 H A 0062 THR C
H A 0061 LEU C 3.695 H A 0062 THR CB
H A 0062 THR C 2.423 H A 0063 LYS CA
H A 0062 THR C 3.063 H A 0063 LYS C
H A 0062 THR C 3.686 H A 0063 LYS CB
H A 0063 LYS C 2.424 H A 0064 LEU CA
H A 0063 LYS C 3.016 H A 0064 LEU C
H A 0063 LYS C 3.693 H A 0064 LEU CB
H A 0064 LEU C 2.423 H A 0065 ALA CA
H A 0064 LEU C 2.941 H A 0065 ALA C
H A 0064 LEU C 3.695 H A 0065 ALA CB
H A 0065 ALA C 2.422 H A 0066 ALA CA
H A 0065 ALA C 3.021 H A 0066 ALA C
H A 0065 ALA C 3.690 H A 0066 ALA CB
H A 0065 ALA CB 3.269 C A 0078 VAL CG2
H A 0065 ALA CB 3.475 E A 0083 ILE CG1
H A 0065 ALA CB 3.741 E A 0083 ILE CG2
H A 0065 ALA CB 3.555 E A 0083 ILE CD1
H A 0066 ALA C 2.423 H A 0067 GLU CA
H A 0066 ALA C 3.052 H A 0067 GLU C
H A 0066 ALA C 3.688 H A 0067 GLU CB
H A 0066 ALA CA 3.312 H A 0069 LYS CG
H A 0066 ALA CA 3.501 H A 0069 LYS CD
H A 0066 ALA C 3.329 H A 0069 LYS CG
H A 0067 GLU C 2.424 H A 0068 LEU CA
H A 0067 GLU C 2.999 H A 0068 LEU C
H A 0067 GLU C 3.693 H A 0068 LEU CB
H A 0068 LEU C 2.425 H A 0069 LYS CA
H A 0068 LEU C 3.102 H A 0069 LYS C
H A 0068 LEU C 3.677 H A 0069 LYS CB
H A 0068 LEU CD2 3.288 H A 0096 LEU CD2
H A 0069 LYS C 2.422 C A 0070 LYS CA
H A 0069 LYS C 3.116 C A 0070 LYS C
H A 0069 LYS C 3.677 C A 0070 LYS CB
H A 0069 LYS CB 3.703 C A 0075 GLY CA
C A 0070 LYS C 2.422 C A 0071 LYS CA
C A 0070 LYS C 3.597 C A 0071 LYS C
C A 0070 LYS C 3.318 C A 0071 LYS CB
C A 0070 LYS C 3.358 C A 0071 LYS CG
C A 0071 LYS C 2.424 C A 0072 CYS CA
C A 0071 LYS C 3.538 C A 0072 CYS C
C A 0071 LYS C 3.404 C A 0072 CYS CB
C A 0072 CYS C 2.422 C A 0073 GLY CA
C A 0072 CYS C 3.279 C A 0073 GLY C
C A 0073 GLY C 2.475 C A 0074 CYS CA
C A 0073 GLY C 3.443 C A 0074 CYS C
C A 0073 GLY C 2.804 C A 0074 CYS CB
C A 0074 CYS C 2.423 C A 0075 GLY CA
C A 0074 CYS C 3.031 C A 0075 GLY C
C A 0075 GLY C 2.425 C A 0076 GLY CA
C A 0075 GLY C 3.169 C A 0076 GLY C
C A 0076 GLY C 2.422 C A 0077 ALA CA
C A 0076 GLY C 3.374 C A 0077 ALA C
C A 0076 GLY C 3.548 C A 0077 ALA CB
C A 0076 GLY CA 3.660 E A 0085 ILE CD1
C A 0077 ALA C 2.423 C A 0078 VAL CA
C A 0077 ALA C 3.363 C A 0078 VAL C
C A 0077 ALA C 3.555 C A 0078 VAL CB
C A 0077 ALA C 3.684 C A 0078 VAL CG2
C A 0078 VAL C 2.418 C A 0079 LYS CA
C A 0078 VAL C 3.629 C A 0079 LYS C
C A 0078 VAL C 3.224 C A 0079 LYS CB
C A 0078 VAL C 3.733 C A 0079 LYS CG
C A 0078 VAL CG1 3.758 E A 0083 ILE CG1
C A 0078 VAL CG2 3.349 E A 0083 ILE CG1
C A 0079 LYS C 2.424 C A 0080 ASP CA
C A 0079 LYS C 2.862 C A 0080 ASP C
C A 0079 LYS C 3.087 C A 0080 ASP CB
C A 0079 LYS CB 3.714 C A 0082 VAL CB
C A 0080 ASP C 2.426 C A 0081 GLY CA
C A 0080 ASP C 3.102 C A 0081 GLY C
C A 0081 GLY C 2.420 C A 0082 VAL CA
C A 0081 GLY C 3.498 C A 0082 VAL C
C A 0081 GLY C 3.432 C A 0082 VAL CB
C A 0081 GLY C 3.306 C A 0082 VAL CG2
C A 0082 VAL C 2.423 E A 0083 ILE CA
C A 0082 VAL C 3.252 E A 0083 ILE C
C A 0082 VAL C 3.622 E A 0083 ILE CB
E A 0083 ILE C 2.424 E A 0084 GLU CA
E A 0083 ILE C 3.244 E A 0084 GLU C
E A 0083 ILE C 3.628 E A 0084 GLU CB
E A 0083 ILE C 3.723 E A 0084 GLU CG
E A 0084 GLU C 2.423 E A 0085 ILE CA
E A 0084 GLU C 3.516 E A 0085 ILE C
E A 0084 GLU C 3.411 E A 0085 ILE CB
E A 0084 GLU C 3.418 E A 0085 ILE CG1
E A 0084 GLU C 3.609 E A 0085 ILE CD1
E A 0085 ILE C 2.422 C A 0086 GLN CA
E A 0085 ILE C 3.197 C A 0086 GLN C
E A 0085 ILE C 3.647 C A 0086 GLN CB
C A 0086 GLN C 2.424 C A 0087 GLY CA
C A 0086 GLN C 3.676 C A 0087 GLY C
C A 0087 GLY C 2.423 C A 0088 ASP CA
C A 0087 GLY C 3.285 C A 0088 ASP C
C A 0087 GLY C 3.606 C A 0088 ASP CB
C A 0088 ASP C 2.423 H A 0089 LYS CA
C A 0088 ASP C 3.409 H A 0089 LYS C
C A 0088 ASP C 3.521 H A 0089 LYS CB
C A 0088 ASP C 3.752 H A 0089 LYS CG
H A 0089 LYS C 2.421 H A 0090 ARG CA
H A 0089 LYS C 2.838 H A 0090 ARG C
H A 0089 LYS C 3.679 H A 0090 ARG CB
H A 0090 ARG C 2.422 H A 0091 ASP CA
H A 0090 ARG C 2.931 H A 0091 ASP C
H A 0090 ARG C 3.696 H A 0091 ASP CB
H A 0090 ARG C 3.776 H A 0093 LEU CB
H A 0091 ASP C 2.423 H A 0092 LEU CA
H A 0091 ASP C 3.007 H A 0092 LEU C
H A 0091 ASP C 3.693 H A 0092 LEU CB
H A 0092 LEU C 2.422 H A 0093 LEU CA
H A 0092 LEU C 2.987 H A 0093 LEU C
H A 0092 LEU C 3.694 H A 0093 LEU CB
H A 0093 LEU C 2.422 H A 0094 LYS CA
H A 0093 LEU C 2.975 H A 0094 LYS C
H A 0093 LEU C 3.695 H A 0094 LYS CB
H A 0093 LEU CA 3.609 H A 0096 LEU CG
H A 0093 LEU CA 3.429 H A 0096 LEU CD2
H A 0093 LEU C 3.583 H A 0096 LEU CG
H A 0093 LEU CD1 3.554 H A 0096 LEU CD2
H A 0094 LYS C 2.422 H A 0095 SER CA
H A 0094 LYS C 3.044 H A 0095 SER C
H A 0094 LYS C 3.688 H A 0095 SER CB
H A 0095 SER C 2.422 H A 0096 LEU CA
H A 0095 SER C 2.842 H A 0096 LEU C
H A 0095 SER C 3.680 H A 0096 LEU CB
H A 0096 LEU C 2.422 H A 0097 LEU CA
H A 0096 LEU C 2.999 H A 0097 LEU C
H A 0096 LEU C 3.694 H A 0097 LEU CB
H A 0096 LEU CD1 3.636 H A 0097 LEU CA
H A 0096 LEU C 3.728 H A 0099 ALA CB
H A 0097 LEU C 2.423 H A 0098 GLU CA
H A 0097 LEU C 3.022 H A 0098 GLU C
H A 0097 LEU C 3.693 H A 0098 GLU CB
H A 0097 LEU CB 3.582 E A 0104 VAL CG2
H A 0097 LEU CG 3.469 E A 0104 VAL CG2
H A 0097 LEU CD1 3.571 E A 0104 VAL CB
H A 0097 LEU CD1 3.019 E A 0104 VAL CG1
H A 0097 LEU CD1 3.118 E A 0104 VAL CG2
H A 0097 LEU CD2 3.185 E A 0104 VAL CG2
H A 0098 GLU C 2.423 H A 0099 ALA CA
H A 0098 GLU C 3.050 H A 0099 ALA C
H A 0098 GLU C 3.688 H A 0099 ALA CB
H A 0099 ALA C 2.423 H A 0100 LYS CA
H A 0099 ALA C 3.180 H A 0100 LYS C
H A 0099 ALA C 3.654 H A 0100 LYS CB
H A 0100 LYS C 2.423 H A 0101 GLY CA
H A 0100 LYS C 3.247 H A 0101 GLY C
H A 0100 LYS CB 3.491 C A 0102 MET CG
H A 0100 LYS CD 3.524 C A 0102 MET CE
H A 0101 GLY C 2.422 C A 0102 MET CA
H A 0101 GLY C 3.203 C A 0102 MET C
H A 0101 GLY C 3.644 C A 0102 MET CB
H A 0101 GLY C 3.765 C A 0102 MET CG
C A 0102 MET C 2.422 E A 0103 LYS CA
C A 0102 MET C 3.236 E A 0103 LYS C
C A 0102 MET C 3.630 E A 0103 LYS CB
E A 0103 LYS C 2.422 E A 0104 VAL CA
E A 0103 LYS C 3.589 E A 0104 VAL C
E A 0103 LYS C 3.312 E A 0104 VAL CB
E A 0103 LYS C 3.122 E A 0104 VAL CG2
E A 0104 VAL C 2.423 C A 0105 LYS CA
E A 0104 VAL C 3.536 C A 0105 LYS C
E A 0104 VAL C 3.391 C A 0105 LYS CB
C A 0105 LYS C 2.423 C A 0106 LEU CA
C A 0105 LYS C 2.843 C A 0106 LEU C
C A 0105 LYS C 3.680 C A 0106 LEU CB
C A 0106 LEU C 2.423 C A 0107 ALA CA
C A 0106 LEU C 3.038 C A 0107 ALA C
C A 0106 LEU C 3.690 C A 0107 ALA CB
C A 0107 ALA C 2.423 C A 0108 GLY CA
C A 0107 ALA C 3.696 C A 0108 GLY C
C A 0108 GLY C 2.423 C A 0109 GLY CA
C A 0108 GLY C 3.643 C A 0109 GLY C
C A 0109 GLY C 2.422 C A 0110 LEU CA
C A 0109 GLY C 3.398 C A 0110 LEU C
C A 0109 GLY C 3.529 C A 0110 LEU CB
C A 0110 LEU C 2.423 C A 0111 GLU CA
C A 0110 LEU C 3.592 C A 0111 GLU C
C A 0110 LEU C 3.310 C A 0111 GLU CB
CHARGE_ATTR 2.00 12.00 59
C A 0031 ASP OD1 10.23 E A 0103 LYS NZ
C A 0055 ASP OD1 11.77 E A 0035 ARG NH2
H A 0057 ASP OD1 9.749 H A 0063 LYS NZ
H A 0057 ASP OD2 7.981 H A 0063 LYS NZ
H A 0058 ASP OD1 11.51 H A 0063 LYS NZ
H A 0058 ASP OD2 11.93 H A 0063 LYS NZ
H A 0060 GLU OE1 7.712 H A 0063 LYS NZ
H A 0060 GLU OE2 7.322 H A 0063 LYS NZ
H A 0060 GLU OE1 8.381 H A 0100 LYS NZ
H A 0060 GLU OE2 9.572 H A 0100 LYS NZ
H A 0067 GLU OE1 10.55 H A 0063 LYS NZ
H A 0067 GLU OE2 9.958 H A 0063 LYS NZ
H A 0067 GLU OE1 9.015 C A 0070 LYS NZ
H A 0067 GLU OE2 7.685 C A 0070 LYS NZ
H A 0067 GLU OE1 7.859 C A 0071 LYS NZ
H A 0067 GLU OE2 7.442 C A 0071 LYS NZ
H A 0067 GLU OE1 4.490 H A 0100 LYS NZ
H A 0067 GLU OE2 6.158 H A 0100 LYS NZ
C A 0080 ASP OD1 8.697 C A 0079 LYS NZ
C A 0080 ASP OD2 10.01 C A 0079 LYS NZ
E A 0084 GLU OE1 10.68 C A 0046 LYS NZ
E A 0084 GLU OE1 5.271 C A 0079 LYS NZ
E A 0084 GLU OE2 4.260 C A 0079 LYS NZ
C A 0088 ASP OD1 7.356 E A 0038 ARG NH1
C A 0088 ASP OD1 9.390 E A 0038 ARG NH2
C A 0088 ASP OD2 6.098 E A 0038 ARG NH1
C A 0088 ASP OD2 8.226 E A 0038 ARG NH2
C A 0088 ASP OD1 10.42 C A 0044 LYS NZ
C A 0088 ASP OD2 8.716 C A 0044 LYS NZ
C A 0088 ASP OD1 10.62 C A 0046 LYS NZ
C A 0088 ASP OD2 11.12 C A 0046 LYS NZ
C A 0088 ASP OD1 10.45 H A 0089 LYS NZ
C A 0088 ASP OD2 11.37 H A 0089 LYS NZ
C A 0088 ASP OD1 9.770 H A 0090 ARG NH1
C A 0088 ASP OD1 9.787 H A 0090 ARG NH2
C A 0088 ASP OD2 9.194 H A 0090 ARG NH1
C A 0088 ASP OD2 9.402 H A 0090 ARG NH2
H A 0091 ASP OD1 9.865 E A 0038 ARG NH1
H A 0091 ASP OD1 10.20 E A 0038 ARG NH2
H A 0091 ASP OD2 9.031 E A 0038 ARG NH1
H A 0091 ASP OD2 9.594 E A 0038 ARG NH2
H A 0091 ASP OD1 10.99 H A 0089 LYS NZ
H A 0091 ASP OD2 10.53 H A 0089 LYS NZ
H A 0091 ASP OD1 8.009 H A 0090 ARG NH1
H A 0091 ASP OD1 9.895 H A 0090 ARG NH2
H A 0091 ASP OD2 7.978 H A 0090 ARG NH1
H A 0091 ASP OD2 10.07 H A 0090 ARG NH2
H A 0091 ASP OD1 7.271 H A 0094 LYS NZ
H A 0091 ASP OD2 9.038 H A 0094 LYS NZ
H A 0098 GLU OE1 6.517 H A 0094 LYS NZ
H A 0098 GLU OE2 5.331 H A 0094 LYS NZ
H A 0098 GLU OE1 10.79 H A 0100 LYS NZ
H A 0098 GLU OE2 11.78 H A 0100 LYS NZ
C A 0111 GLU OE1 11.33 E A 0038 ARG NH1
C A 0111 GLU OE1 10.33 E A 0038 ARG NH2
C A 0111 GLU OE1 11.90 C A 0043 ARG NH1
C A 0111 GLU OE1 11.19 C A 0043 ARG NH2
C A 0111 GLU OE2 11.92 C A 0043 ARG NH2
C A 0111 GLU OE1 11.00 H A 0090 ARG NH2
CHARGE_REPU 2.00 12.00 68
C A 0031 ASP OD1 7.605 C A 0055 ASP OD1
C A 0031 ASP OD1 5.491 C A 0055 ASP OD2
C A 0031 ASP OD2 7.381 C A 0055 ASP OD1
C A 0031 ASP OD2 5.513 C A 0055 ASP OD2
C A 0031 ASP OD1 10.96 H A 0057 ASP OD1
C A 0031 ASP OD2 9.026 H A 0057 ASP OD1
C A 0031 ASP OD2 10.51 H A 0057 ASP OD2
C A 0031 ASP OD1 11.82 H A 0060 GLU OE1
C A 0031 ASP OD1 11.26 H A 0060 GLU OE2
C A 0031 ASP OD2 10.67 H A 0060 GLU OE1
C A 0031 ASP OD2 9.889 H A 0060 GLU OE2
E A 0035 ARG NH1 10.65 H A 0090 ARG NH2
E A 0035 ARG NH1 5.519 C A 0105 LYS NZ
E A 0035 ARG NH2 6.807 C A 0105 LYS NZ
E A 0038 ARG NH1 11.57 C A 0043 ARG NH1
E A 0038 ARG NH2 11.66 C A 0043 ARG NH1
E A 0038 ARG NH1 9.836 C A 0044 LYS NZ
E A 0038 ARG NH2 11.55 C A 0044 LYS NZ
E A 0038 ARG NH1 3.947 H A 0090 ARG NH1
E A 0038 ARG NH1 4.767 H A 0090 ARG NH2
E A 0038 ARG NH2 3.065 H A 0090 ARG NH1
E A 0038 ARG NH2 3.708 H A 0090 ARG NH2
C A 0043 ARG NH1 10.88 C A 0044 LYS NZ
C A 0055 ASP OD1 8.797 H A 0057 ASP OD1
C A 0055 ASP OD1 10.74 H A 0057 ASP OD2
C A 0055 ASP OD2 9.150 H A 0057 ASP OD1
C A 0055 ASP OD2 11.08 H A 0057 ASP OD2
C A 0055 ASP OD1 9.405 H A 0058 ASP OD1
C A 0055 ASP OD1 10.93 H A 0058 ASP OD2
C A 0055 ASP OD2 11.18 H A 0058 ASP OD1
C A 0055 ASP OD1 10.14 H A 0060 GLU OE1
C A 0055 ASP OD1 10.77 H A 0060 GLU OE2
C A 0055 ASP OD2 10.37 H A 0060 GLU OE1
C A 0055 ASP OD2 10.67 H A 0060 GLU OE2
H A 0057 ASP OD1 7.819 H A 0058 ASP OD1
H A 0057 ASP OD1 8.208 H A 0058 ASP OD2
H A 0057 ASP OD2 8.471 H A 0058 ASP OD1
H A 0057 ASP OD2 8.666 H A 0058 ASP OD2
H A 0057 ASP OD1 8.074 H A 0060 GLU OE1
H A 0057 ASP OD1 7.448 H A 0060 GLU OE2
H A 0057 ASP OD2 7.934 H A 0060 GLU OE1
H A 0057 ASP OD2 7.073 H A 0060 GLU OE2
H A 0058 ASP OD1 9.880 H A 0060 GLU OE1
H A 0058 ASP OD1 10.95 H A 0060 GLU OE2
H A 0058 ASP OD2 11.48 H A 0060 GLU OE1
H A 0058 ASP OD1 7.606 C A 0080 ASP OD1
H A 0058 ASP OD1 7.352 C A 0080 ASP OD2
H A 0058 ASP OD2 7.364 C A 0080 ASP OD1
H A 0058 ASP OD2 7.056 C A 0080 ASP OD2
H A 0060 GLU OE1 8.754 H A 0067 GLU OE1
H A 0060 GLU OE1 9.618 H A 0067 GLU OE2
H A 0060 GLU OE2 9.908 H A 0067 GLU OE1
H A 0060 GLU OE2 10.41 H A 0067 GLU OE2
H A 0069 LYS NZ 11.05 C A 0070 LYS NZ
C A 0070 LYS NZ 6.625 C A 0071 LYS NZ
C A 0071 LYS NZ 11.85 H A 0089 LYS NZ
C A 0071 LYS NZ 10.03 H A 0100 LYS NZ
C A 0080 ASP OD1 11.92 E A 0084 GLU OE1
C A 0080 ASP OD1 10.25 E A 0084 GLU OE2
C A 0080 ASP OD2 11.83 E A 0084 GLU OE2
C A 0088 ASP OD2 11.91 H A 0091 ASP OD2
H A 0090 ARG NH1 9.649 H A 0094 LYS NZ
H A 0090 ARG NH2 10.62 H A 0094 LYS NZ
H A 0091 ASP OD1 9.355 H A 0098 GLU OE1
H A 0091 ASP OD1 9.919 H A 0098 GLU OE2
H A 0091 ASP OD2 11.40 H A 0098 GLU OE1
H A 0091 ASP OD2 11.98 H A 0098 GLU OE2
E A 0103 LYS NZ 11.06 C A 0105 LYS NZ
HB_MM 2.00 3.20 131
C A 0030 GLY N 2.196 C A 0029 LYS O
C A 0031 ASP N 2.196 C A 0030 GLY O
C A 0032 GLY N 2.196 C A 0031 ASP O
E A 0033 VAL N 2.196 C A 0032 GLY O
E A 0034 VAL N 2.197 E A 0033 VAL O
E A 0035 ARG N 2.196 E A 0034 VAL O
E A 0036 ILE N 2.197 E A 0035 ARG O
E A 0037 GLN N 2.195 E A 0036 ILE O
E A 0038 ARG N 2.197 E A 0037 GLN O
C A 0039 GLN N 2.196 E A 0038 ARG O
C A 0040 THR N 3.086 E A 0038 ARG O
C A 0040 THR N 2.197 C A 0039 GLN O
C A 0041 SER N 2.196 C A 0040 THR O
C A 0042 GLY N 2.197 C A 0041 SER O
C A 0043 ARG N 2.197 C A 0042 GLY O
C A 0044 LYS N 2.197 C A 0043 ARG O
C A 0045 GLY N 2.196 C A 0044 LYS O
C A 0046 LYS N 2.196 C A 0045 GLY O
C A 0047 GLY N 2.196 C A 0046 LYS O
C A 0048 VAL N 2.197 C A 0047 GLY O
E A 0049 CYS N 2.197 C A 0048 VAL O
E A 0049 CYS N 3.098 E A 0085 ILE O
E A 0050 LEU N 2.195 E A 0049 CYS O
E A 0051 ILE N 2.196 E A 0050 LEU O
E A 0051 ILE N 3.089 E A 0083 ILE O
E A 0052 THR N 2.196 E A 0051 ILE O
C A 0053 GLY N 2.196 E A 0052 THR O
C A 0054 VAL N 2.196 C A 0053 GLY O
C A 0055 ASP N 2.462 C A 0053 GLY O
C A 0055 ASP N 2.197 C A 0054 VAL O
C A 0056 LEU N 2.920 C A 0054 VAL O
C A 0056 LEU N 2.197 C A 0055 ASP O
H A 0057 ASP N 2.196 C A 0056 LEU O
H A 0058 ASP N 2.195 H A 0057 ASP O
H A 0059 ALA N 2.196 H A 0058 ASP O
H A 0060 GLU N 3.197 H A 0057 ASP O
H A 0060 GLU N 3.123 H A 0058 ASP O
H A 0060 GLU N 2.196 H A 0059 ALA O
H A 0061 LEU N 3.035 H A 0057 ASP O
H A 0061 LEU N 2.949 H A 0058 ASP O
H A 0061 LEU N 2.195 H A 0060 GLU O
H A 0062 THR N 3.193 H A 0059 ALA O
H A 0062 THR N 2.197 H A 0061 LEU O
H A 0063 LYS N 2.990 H A 0060 GLU O
H A 0063 LYS N 3.178 H A 0061 LEU O
H A 0063 LYS N 2.195 H A 0062 THR O
H A 0064 LEU N 3.071 H A 0060 GLU O
H A 0064 LEU N 3.065 H A 0061 LEU O
H A 0064 LEU N 2.196 H A 0063 LYS O
H A 0065 ALA N 3.166 H A 0061 LEU O
H A 0065 ALA N 2.197 H A 0064 LEU O
H A 0066 ALA N 3.048 H A 0062 THR O
H A 0066 ALA N 3.064 H A 0064 LEU O
H A 0066 ALA N 2.196 H A 0065 ALA O
H A 0067 GLU N 3.018 H A 0063 LYS O
H A 0067 GLU N 2.886 H A 0064 LEU O
H A 0067 GLU N 2.196 H A 0066 ALA O
H A 0068 LEU N 3.183 H A 0064 LEU O
H A 0068 LEU N 2.197 H A 0067 GLU O
H A 0069 LYS N 3.048 H A 0065 ALA O
H A 0069 LYS N 2.196 H A 0068 LEU O
C A 0070 LYS N 3.196 H A 0066 ALA O
C A 0070 LYS N 2.982 H A 0067 GLU O
C A 0070 LYS N 3.088 H A 0068 LEU O
C A 0070 LYS N 2.195 H A 0069 LYS O
C A 0071 LYS N 2.194 C A 0070 LYS O
C A 0072 CYS N 2.197 C A 0071 LYS O
C A 0073 GLY N 2.195 C A 0072 CYS O
C A 0074 CYS N 2.220 C A 0073 GLY O
C A 0075 GLY N 2.196 C A 0074 CYS O
C A 0076 GLY N 3.021 C A 0074 CYS O
C A 0076 GLY N 2.198 C A 0075 GLY O
C A 0077 ALA N 2.196 C A 0076 GLY O
C A 0078 VAL N 2.198 C A 0077 ALA O
C A 0079 LYS N 2.195 C A 0078 VAL O
C A 0079 LYS N 2.533 C A 0082 VAL O
C A 0080 ASP N 2.198 C A 0079 LYS O
C A 0081 GLY N 2.198 C A 0080 ASP O
C A 0082 VAL N 2.806 C A 0079 LYS O
C A 0082 VAL N 3.181 C A 0080 ASP O
C A 0082 VAL N 2.194 C A 0081 GLY O
E A 0083 ILE N 3.097 E A 0051 ILE O
E A 0083 ILE N 2.196 C A 0082 VAL O
E A 0084 GLU N 3.007 C A 0077 ALA O
E A 0084 GLU N 2.197 E A 0083 ILE O
E A 0085 ILE N 3.048 E A 0049 CYS O
E A 0085 ILE N 2.196 E A 0084 GLU O
C A 0086 GLN N 2.196 E A 0085 ILE O
C A 0087 GLY N 2.196 C A 0086 GLN O
C A 0088 ASP N 2.196 C A 0087 GLY O
H A 0089 LYS N 2.197 C A 0088 ASP O
H A 0090 ARG N 2.196 H A 0089 LYS O
H A 0091 ASP N 2.712 H A 0089 LYS O
H A 0091 ASP N 2.197 H A 0090 ARG O
H A 0092 LEU N 2.720 H A 0089 LYS O
H A 0092 LEU N 2.196 H A 0091 ASP O
H A 0093 LEU N 3.039 H A 0089 LYS O
H A 0093 LEU N 2.942 H A 0090 ARG O
H A 0093 LEU N 3.180 H A 0091 ASP O
H A 0093 LEU N 2.197 H A 0092 LEU O
H A 0094 LYS N 3.080 H A 0090 ARG O
H A 0094 LYS N 2.196 H A 0093 LEU O
H A 0095 SER N 3.114 H A 0092 LEU O
H A 0095 SER N 3.124 H A 0093 LEU O
H A 0095 SER N 2.196 H A 0094 LYS O
H A 0096 LEU N 3.112 H A 0092 LEU O
H A 0096 LEU N 2.196 H A 0095 SER O
H A 0097 LEU N 3.061 H A 0093 LEU O
H A 0097 LEU N 2.721 H A 0095 SER O
H A 0097 LEU N 2.197 H A 0096 LEU O
H A 0098 GLU N 3.069 H A 0094 LYS O
H A 0098 GLU N 2.674 H A 0095 SER O
H A 0098 GLU N 2.197 H A 0097 LEU O
H A 0099 ALA N 3.028 H A 0095 SER O
H A 0099 ALA N 3.035 H A 0096 LEU O
H A 0099 ALA N 2.946 H A 0097 LEU O
H A 0099 ALA N 2.196 H A 0098 GLU O
H A 0100 LYS N 3.169 H A 0097 LEU O
H A 0100 LYS N 2.197 H A 0099 ALA O
H A 0101 GLY N 2.196 H A 0100 LYS O
C A 0102 MET N 2.197 H A 0101 GLY O
E A 0103 LYS N 2.197 C A 0102 MET O
E A 0104 VAL N 2.197 E A 0103 LYS O
C A 0105 LYS N 2.196 E A 0104 VAL O
C A 0106 LEU N 2.197 C A 0105 LYS O
C A 0107 ALA N 2.496 C A 0105 LYS O
C A 0107 ALA N 2.197 C A 0106 LEU O
C A 0108 GLY N 2.196 C A 0107 ALA O
C A 0109 GLY N 2.196 C A 0108 GLY O
C A 0110 LEU N 2.197 C A 0109 GLY O
C A 0111 GLU N 2.197 C A 0110 LEU O
HB_MS 2.00 3.20 3
E A 0051 ILE O 2.658 E A 0052 THR OG1
H A 0096 LEU O 3.051 H A 0100 LYS NZ
C A 0107 ALA O 2.894 H A 0090 ARG NH2