Complet list of 1zae con file
Complete list of 1zae.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 261
C A 0061 HIS C 2.486 C A 0062 MET CA
C A 0061 HIS C 3.024 C A 0062 MET C
C A 0061 HIS C 3.182 C A 0062 MET CB
C A 0061 HIS CE1 3.391 C A 0063 ASP CG
C A 0062 MET C 2.486 C A 0063 ASP CA
C A 0062 MET C 3.122 C A 0063 ASP C
C A 0062 MET C 3.695 C A 0063 ASP CB
C A 0063 ASP C 2.480 C A 0064 LYS CA
C A 0063 ASP C 3.200 C A 0064 LYS C
C A 0063 ASP C 3.695 C A 0064 LYS CB
C A 0064 LYS C 2.487 C A 0065 THR CA
C A 0064 LYS C 3.199 C A 0065 THR C
C A 0064 LYS C 3.735 C A 0065 THR CB
C A 0064 LYS CE 3.196 H A 0092 GLU CD
C A 0065 THR C 2.475 C A 0066 VAL CA
C A 0065 THR C 3.302 C A 0066 VAL C
C A 0065 THR C 3.666 C A 0066 VAL CB
C A 0066 VAL C 2.483 C A 0067 ASN CA
C A 0066 VAL C 3.078 C A 0067 ASN C
C A 0066 VAL C 3.187 C A 0067 ASN CB
C A 0067 ASN C 2.469 C A 0068 LEU CA
C A 0067 ASN C 3.083 C A 0068 LEU C
C A 0067 ASN C 3.728 C A 0068 LEU CB
C A 0068 LEU C 2.464 H A 0069 SER CA
C A 0068 LEU C 3.044 H A 0069 SER C
C A 0068 LEU C 3.738 H A 0069 SER CB
C A 0068 LEU CB 3.626 H A 0073 VAL CB
C A 0068 LEU CB 3.688 H A 0073 VAL CG2
C A 0068 LEU CD2 3.587 H A 0091 ILE CG2
H A 0069 SER C 2.438 H A 0070 ALA CA
H A 0069 SER C 3.037 H A 0070 ALA C
H A 0069 SER C 3.708 H A 0070 ALA CB
H A 0069 SER CB 3.341 H A 0072 GLU CD
H A 0070 ALA C 2.435 H A 0071 CYS CA
H A 0070 ALA C 3.088 H A 0071 CYS C
H A 0070 ALA C 3.701 H A 0071 CYS CB
H A 0071 CYS C 2.454 H A 0072 GLU CA
H A 0071 CYS C 2.987 H A 0072 GLU C
H A 0071 CYS C 3.720 H A 0072 GLU CB
H A 0071 CYS CB 3.421 H A 0101 SER C
H A 0072 GLU C 2.477 H A 0073 VAL CA
H A 0072 GLU C 3.057 H A 0073 VAL C
H A 0072 GLU C 3.741 H A 0073 VAL CB
H A 0072 GLU CG 3.796 H A 0105 VAL CG1
H A 0073 VAL C 2.445 H A 0074 ALA CA
H A 0073 VAL C 3.057 H A 0074 ALA C
H A 0073 VAL C 3.714 H A 0074 ALA CB
H A 0074 ALA C 2.415 H A 0075 VAL CA
H A 0074 ALA C 3.122 H A 0075 VAL C
H A 0074 ALA C 3.680 H A 0075 VAL CB
H A 0075 VAL C 2.508 H A 0076 LEU CA
H A 0075 VAL C 3.019 H A 0076 LEU C
H A 0075 VAL C 3.738 H A 0076 LEU CB
H A 0075 VAL C 3.572 H A 0079 TYR CD2
H A 0075 VAL CG1 3.393 H A 0079 TYR CE2
H A 0075 VAL CG2 3.711 H A 0102 GLU CA
H A 0075 VAL CB 3.663 H A 0105 VAL CG2
H A 0075 VAL CG2 3.421 H A 0105 VAL CG2
H A 0075 VAL CG1 3.664 H A 0106 LEU CB
H A 0076 LEU C 2.442 H A 0077 ASP CA
H A 0076 LEU C 3.045 H A 0077 ASP C
H A 0076 LEU C 3.716 H A 0077 ASP CB
H A 0076 LEU CA 3.786 H A 0079 TYR CD2
H A 0076 LEU CD1 3.637 H A 0091 ILE CD1
H A 0077 ASP C 2.441 H A 0078 LEU CA
H A 0077 ASP C 2.961 H A 0078 LEU C
H A 0077 ASP C 3.725 H A 0078 LEU CB
H A 0078 LEU C 2.457 H A 0079 TYR CA
H A 0078 LEU C 3.046 H A 0079 TYR C
H A 0078 LEU C 3.742 H A 0079 TYR CB
H A 0079 TYR C 2.452 H A 0080 GLU CA
H A 0079 TYR C 3.039 H A 0080 GLU C
H A 0079 TYR C 3.717 H A 0080 GLU CB
H A 0079 TYR CD1 3.554 C A 0084 ILE CG2
H A 0079 TYR CE2 3.742 H A 0109 ILE CG2
H A 0079 TYR CE2 3.317 H A 0109 ILE CD1
H A 0079 TYR CZ 3.383 H A 0109 ILE CG2
H A 0080 GLU C 2.471 H A 0081 GLN CA
H A 0080 GLU C 3.106 H A 0081 GLN C
H A 0080 GLU C 3.753 H A 0081 GLN CB
H A 0080 GLU CD 3.637 C A 0085 ARG CA
H A 0081 GLN C 2.457 H A 0082 SER CA
H A 0081 GLN C 3.124 H A 0082 SER C
H A 0081 GLN C 3.741 H A 0082 SER CB
H A 0082 SER C 2.530 C A 0083 ASN CA
H A 0082 SER C 3.267 C A 0083 ASN C
H A 0082 SER C 3.124 C A 0083 ASN CB
H A 0082 SER C 3.639 C A 0084 ILE CD1
H A 0082 SER CB 3.697 C A 0084 ILE CD1
C A 0083 ASN C 2.466 C A 0084 ILE CA
C A 0083 ASN C 3.249 C A 0084 ILE C
C A 0083 ASN C 3.683 C A 0084 ILE CB
C A 0083 ASN C 3.483 C A 0084 ILE CD1
C A 0084 ILE CA 3.778 C A 0085 ARG CA
C A 0084 ILE C 2.387 C A 0085 ARG CA
C A 0084 ILE C 3.005 C A 0085 ARG C
C A 0084 ILE C 3.695 C A 0085 ARG CB
C A 0084 ILE CG1 3.744 H A 0113 ARG CZ
C A 0084 ILE CG2 3.321 H A 0113 ARG CZ
C A 0085 ARG C 2.452 C A 0086 ILE CA
C A 0085 ARG C 3.314 C A 0086 ILE C
C A 0085 ARG C 3.622 C A 0086 ILE CB
C A 0086 ILE CA 3.011 H A 0087 PRO CD
C A 0086 ILE C 2.462 H A 0087 PRO CA
C A 0086 ILE C 3.004 H A 0087 PRO C
C A 0086 ILE C 3.701 H A 0087 PRO CB
C A 0086 ILE C 3.680 H A 0087 PRO CG
C A 0086 ILE C 2.512 H A 0087 PRO CD
C A 0086 ILE CG2 3.388 H A 0091 ILE CG1
C A 0086 ILE CG2 3.759 H A 0091 ILE CD1
C A 0086 ILE CD1 3.790 H A 0109 ILE CG2
H A 0087 PRO C 2.446 H A 0088 SER CA
H A 0087 PRO C 2.967 H A 0088 SER C
H A 0087 PRO C 3.717 H A 0088 SER CB
H A 0087 PRO CG 3.749 H A 0116 TRP CD1
H A 0088 SER C 2.470 H A 0089 ASP CA
H A 0088 SER C 2.988 H A 0089 ASP C
H A 0088 SER C 3.663 H A 0089 ASP CB
H A 0089 ASP C 2.423 H A 0090 ILE CA
H A 0089 ASP C 3.151 H A 0090 ILE C
H A 0089 ASP C 3.714 H A 0090 ILE CB
H A 0089 ASP CG 3.700 H A 0116 TRP CZ2
H A 0090 ILE C 2.437 H A 0091 ILE CA
H A 0090 ILE C 3.014 H A 0091 ILE C
H A 0090 ILE C 3.739 H A 0091 ILE CB
H A 0090 ILE CG2 3.386 H A 0112 GLN CG
H A 0090 ILE CG2 3.612 H A 0116 TRP CD1
H A 0091 ILE C 2.492 H A 0092 GLU CA
H A 0091 ILE C 3.032 H A 0092 GLU C
H A 0091 ILE C 3.719 H A 0092 GLU CB
H A 0092 GLU C 2.473 H A 0093 ASP CA
H A 0092 GLU C 3.054 H A 0093 ASP C
H A 0092 GLU C 3.705 H A 0093 ASP CB
H A 0093 ASP C 2.471 H A 0094 LEU CA
H A 0093 ASP C 3.011 H A 0094 LEU C
H A 0093 ASP C 3.740 H A 0094 LEU CB
H A 0094 LEU C 2.481 H A 0095 VAL CA
H A 0094 LEU C 3.050 H A 0095 VAL C
H A 0094 LEU C 3.727 H A 0095 VAL CB
H A 0094 LEU CD1 3.304 H A 0109 ILE CG1
H A 0094 LEU CD1 3.509 H A 0109 ILE CD1
H A 0095 VAL C 2.480 H A 0096 ASN CA
H A 0095 VAL C 3.165 H A 0096 ASN C
H A 0095 VAL C 3.727 H A 0096 ASN CB
H A 0096 ASN C 2.468 H A 0097 GLN CA
H A 0096 ASN C 3.057 H A 0097 GLN C
H A 0096 ASN C 3.750 H A 0097 GLN CB
H A 0097 GLN C 2.483 H A 0098 ARG CA
H A 0097 GLN C 3.124 H A 0098 ARG C
H A 0097 GLN C 3.113 H A 0098 ARG CB
H A 0097 GLN CG 3.731 H A 0108 TYR CZ
H A 0098 ARG C 2.474 C A 0099 LEU CA
H A 0098 ARG C 3.239 C A 0099 LEU C
H A 0098 ARG C 3.689 C A 0099 LEU CB
C A 0099 LEU C 2.479 C A 0100 GLN CA
C A 0099 LEU C 3.361 C A 0100 GLN C
C A 0099 LEU C 3.672 C A 0100 GLN CB
C A 0099 LEU CD1 3.785 H A 0104 GLU C
C A 0099 LEU CD1 3.592 H A 0108 TYR CB
C A 0100 GLN C 2.471 H A 0101 SER CA
C A 0100 GLN C 3.620 H A 0101 SER C
C A 0100 GLN C 3.444 H A 0101 SER CB
C A 0100 GLN CB 3.758 H A 0104 GLU CD
H A 0101 SER C 2.515 H A 0102 GLU CA
H A 0101 SER C 3.017 H A 0102 GLU C
H A 0101 SER C 3.710 H A 0102 GLU CB
H A 0101 SER CB 3.707 H A 0104 GLU CD
H A 0102 GLU C 2.440 H A 0103 GLN CA
H A 0102 GLU C 3.073 H A 0103 GLN C
H A 0102 GLU C 3.721 H A 0103 GLN CB
H A 0102 GLU CA 3.756 H A 0105 VAL CG2
H A 0103 GLN C 2.439 H A 0104 GLU CA
H A 0103 GLN C 3.050 H A 0104 GLU C
H A 0103 GLN C 3.688 H A 0104 GLU CB
H A 0103 GLN CA 3.768 H A 0106 LEU CG
H A 0104 GLU C 2.428 H A 0105 VAL CA
H A 0104 GLU C 3.023 H A 0105 VAL C
H A 0104 GLU C 3.739 H A 0105 VAL CB
H A 0105 VAL C 2.413 H A 0106 LEU CA
H A 0105 VAL C 3.039 H A 0106 LEU C
H A 0105 VAL C 3.724 H A 0106 LEU CB
H A 0105 VAL C 3.765 H A 0109 ILE CD1
H A 0106 LEU C 2.449 H A 0107 ASN CA
H A 0106 LEU C 3.051 H A 0107 ASN C
H A 0106 LEU C 3.739 H A 0107 ASN CB
H A 0107 ASN C 2.474 H A 0108 TYR CA
H A 0107 ASN C 2.989 H A 0108 TYR C
H A 0107 ASN C 3.716 H A 0108 TYR CB
H A 0108 TYR C 2.449 H A 0109 ILE CA
H A 0108 TYR C 2.967 H A 0109 ILE C
H A 0108 TYR C 3.746 H A 0109 ILE CB
H A 0109 ILE C 2.432 H A 0110 GLU CA
H A 0109 ILE C 3.057 H A 0110 GLU C
H A 0109 ILE C 3.732 H A 0110 GLU CB
H A 0110 GLU C 2.446 H A 0111 THR CA
H A 0110 GLU C 3.025 H A 0111 THR C
H A 0110 GLU C 3.741 H A 0111 THR CB
H A 0111 THR C 2.467 H A 0112 GLN CA
H A 0111 THR C 3.099 H A 0112 GLN C
H A 0111 THR C 3.704 H A 0112 GLN CB
H A 0112 GLN C 2.489 H A 0113 ARG CA
H A 0112 GLN C 3.193 H A 0113 ARG C
H A 0112 GLN C 3.682 H A 0113 ARG CB
H A 0113 ARG C 2.478 H A 0114 THR CA
H A 0113 ARG C 3.345 H A 0114 THR C
H A 0113 ARG C 3.611 H A 0114 THR CB
H A 0114 THR C 2.456 H A 0115 TYR CA
H A 0114 THR C 2.894 H A 0115 TYR C
H A 0114 THR C 3.740 H A 0115 TYR CB
H A 0115 TYR C 2.427 H A 0116 TRP CA
H A 0115 TYR C 2.981 H A 0116 TRP C
H A 0115 TYR C 3.755 H A 0116 TRP CB
H A 0115 TYR CD1 3.763 H A 0119 GLU CG
H A 0115 TYR CE1 3.475 H A 0119 GLU CG
H A 0116 TRP C 2.416 H A 0117 LYS CA
H A 0116 TRP C 2.937 H A 0117 LYS C
H A 0116 TRP C 3.720 H A 0117 LYS CB
H A 0116 TRP C 3.615 H A 0120 ASN CG
H A 0117 LYS C 2.445 H A 0118 LEU CA
H A 0117 LYS C 3.040 H A 0118 LEU C
H A 0117 LYS C 3.734 H A 0118 LEU CB
H A 0118 LEU C 2.453 H A 0119 GLU CA
H A 0118 LEU C 3.120 H A 0119 GLU C
H A 0118 LEU C 3.716 H A 0119 GLU CB
H A 0118 LEU C 3.773 H A 0122 LYS CD
H A 0119 GLU C 2.487 H A 0120 ASN CA
H A 0119 GLU C 3.310 H A 0120 ASN C
H A 0119 GLU C 3.688 H A 0120 ASN CB
H A 0119 GLU CD 3.520 H A 0122 LYS CD
H A 0120 ASN C 2.505 H A 0121 GLN CA
H A 0120 ASN C 3.441 H A 0121 GLN C
H A 0120 ASN C 3.593 H A 0121 GLN CB
H A 0121 GLN C 2.491 H A 0122 LYS CA
H A 0121 GLN C 3.104 H A 0122 LYS C
H A 0121 GLN C 3.727 H A 0122 LYS CB
H A 0122 LYS C 2.535 C A 0123 LYS CA
H A 0122 LYS C 3.108 C A 0123 LYS C
H A 0122 LYS C 3.706 C A 0123 LYS CB
C A 0123 LYS CA 3.775 C A 0124 LEU CA
C A 0123 LYS C 2.448 C A 0124 LEU CA
C A 0123 LYS C 3.368 C A 0124 LEU C
C A 0123 LYS C 3.611 C A 0124 LEU CB
C A 0124 LEU C 2.489 C A 0125 TYR CA
C A 0124 LEU C 3.246 C A 0125 TYR C
C A 0124 LEU C 3.708 C A 0125 TYR CB
C A 0125 TYR C 2.509 C A 0126 ARG CA
C A 0125 TYR C 3.203 C A 0126 ARG C
C A 0125 TYR C 3.147 C A 0126 ARG CB
C A 0125 TYR C 3.619 C A 0126 ARG CG
C A 0126 ARG C 2.459 C A 0127 GLY CA
C A 0126 ARG C 3.165 C A 0127 GLY C
C A 0127 GLY C 2.469 C A 0128 SER CA
C A 0127 GLY C 3.242 C A 0128 SER C
C A 0127 GLY C 3.681 C A 0128 SER CB
C A 0128 SER C 2.457 C A 0129 LEU CA
C A 0128 SER C 3.178 C A 0129 LEU C
C A 0128 SER C 3.721 C A 0129 LEU CB
C A 0129 LEU C 2.490 C A 0130 LYS CA
C A 0129 LEU C 3.609 C A 0130 LYS C
C A 0129 LEU C 3.425 C A 0130 LYS CB
C A 0129 LEU C 3.472 C A 0130 LYS CG
CHARGE_ATTR 2.00 12.00 63
C A 0063 ASP OD1 2.705 C A 0061 HIS ND1
C A 0063 ASP OD1 4.669 C A 0061 HIS NE2
C A 0063 ASP OD2 3.072 C A 0061 HIS ND1
C A 0063 ASP OD2 4.474 C A 0061 HIS NE2
C A 0063 ASP OD1 8.377 C A 0064 LYS NZ
C A 0063 ASP OD2 7.204 C A 0064 LYS NZ
C A 0063 ASP OD1 3.644 C A 0085 ARG NH1
C A 0063 ASP OD1 3.895 C A 0085 ARG NH2
C A 0063 ASP OD2 2.678 C A 0085 ARG NH1
C A 0063 ASP OD2 2.655 C A 0085 ARG NH2
H A 0072 GLU OE1 4.856 H A 0098 ARG NH1
H A 0072 GLU OE1 2.667 H A 0098 ARG NH2
H A 0072 GLU OE2 4.562 H A 0098 ARG NH1
H A 0072 GLU OE2 2.993 H A 0098 ARG NH2
H A 0080 GLU OE1 9.834 C A 0061 HIS ND1
H A 0080 GLU OE1 11.63 C A 0061 HIS NE2
H A 0080 GLU OE2 8.954 C A 0061 HIS ND1
H A 0080 GLU OE2 10.51 C A 0061 HIS NE2
H A 0080 GLU OE1 5.248 C A 0085 ARG NH1
H A 0080 GLU OE1 7.284 C A 0085 ARG NH2
H A 0080 GLU OE2 4.347 C A 0085 ARG NH1
H A 0080 GLU OE2 6.256 C A 0085 ARG NH2
H A 0080 GLU OE1 10.94 H A 0113 ARG NH1
H A 0080 GLU OE1 9.830 H A 0113 ARG NH2
H A 0080 GLU OE2 10.32 H A 0113 ARG NH1
H A 0080 GLU OE2 9.424 H A 0113 ARG NH2
H A 0089 ASP OD1 11.42 C A 0061 HIS ND1
H A 0089 ASP OD1 10.09 C A 0061 HIS NE2
H A 0089 ASP OD2 10.38 C A 0061 HIS ND1
H A 0089 ASP OD2 8.771 C A 0061 HIS NE2
H A 0089 ASP OD1 6.475 C A 0064 LYS NZ
H A 0089 ASP OD2 5.416 C A 0064 LYS NZ
H A 0089 ASP OD1 11.95 C A 0085 ARG NH1
H A 0089 ASP OD1 10.58 C A 0085 ARG NH2
H A 0089 ASP OD2 11.72 C A 0085 ARG NH1
H A 0089 ASP OD2 10.06 C A 0085 ARG NH2
H A 0092 GLU OE1 9.648 C A 0061 HIS ND1
H A 0092 GLU OE1 8.177 C A 0061 HIS NE2
H A 0092 GLU OE2 10.61 C A 0061 HIS ND1
H A 0092 GLU OE2 9.165 C A 0061 HIS NE2
H A 0092 GLU OE1 2.638 C A 0064 LYS NZ
H A 0092 GLU OE2 3.815 C A 0064 LYS NZ
H A 0092 GLU OE1 11.46 C A 0085 ARG NH1
H A 0092 GLU OE1 10.32 C A 0085 ARG NH2
H A 0092 GLU OE2 11.78 C A 0085 ARG NH2
H A 0093 ASP OD1 11.57 C A 0064 LYS NZ
H A 0093 ASP OD2 11.39 C A 0064 LYS NZ
H A 0093 ASP OD1 11.47 H A 0098 ARG NH1
H A 0093 ASP OD1 10.58 H A 0098 ARG NH2
H A 0093 ASP OD2 11.39 H A 0098 ARG NH2
H A 0104 GLU OE1 11.48 H A 0098 ARG NH1
H A 0104 GLU OE1 11.03 H A 0098 ARG NH2
H A 0110 GLU OE1 4.659 H A 0113 ARG NH1
H A 0110 GLU OE1 6.734 H A 0113 ARG NH2
H A 0110 GLU OE2 2.644 H A 0113 ARG NH1
H A 0110 GLU OE2 4.833 H A 0113 ARG NH2
H A 0110 GLU OE1 7.622 H A 0117 LYS NZ
H A 0110 GLU OE2 5.714 H A 0117 LYS NZ
H A 0119 GLU OE2 11.61 H A 0117 LYS NZ
H A 0119 GLU OE1 2.649 H A 0122 LYS NZ
H A 0119 GLU OE2 2.584 H A 0122 LYS NZ
H A 0119 GLU OE1 9.217 C A 0123 LYS NZ
H A 0119 GLU OE2 10.23 C A 0123 LYS NZ
CHARGE_REPU 2.00 12.00 59
C A 0061 HIS ND1 7.113 C A 0064 LYS NZ
C A 0061 HIS NE2 5.564 C A 0064 LYS NZ
C A 0061 HIS ND1 4.710 C A 0085 ARG NH1
C A 0061 HIS ND1 3.479 C A 0085 ARG NH2
C A 0061 HIS NE2 6.395 C A 0085 ARG NH1
C A 0061 HIS NE2 4.712 C A 0085 ARG NH2
C A 0063 ASP OD1 8.061 H A 0080 GLU OE1
C A 0063 ASP OD1 7.334 H A 0080 GLU OE2
C A 0063 ASP OD2 7.521 H A 0080 GLU OE1
C A 0063 ASP OD2 6.279 H A 0080 GLU OE2
C A 0063 ASP OD2 10.80 H A 0089 ASP OD1
C A 0063 ASP OD2 10.34 H A 0089 ASP OD2
C A 0063 ASP OD1 10.67 H A 0092 GLU OE1
C A 0063 ASP OD1 11.46 H A 0092 GLU OE2
C A 0063 ASP OD2 9.301 H A 0092 GLU OE1
C A 0063 ASP OD2 10.40 H A 0092 GLU OE2
C A 0064 LYS NZ 9.506 C A 0085 ARG NH1
C A 0064 LYS NZ 8.204 C A 0085 ARG NH2
H A 0072 GLU OE1 10.48 H A 0093 ASP OD1
H A 0072 GLU OE1 10.77 H A 0093 ASP OD2
H A 0072 GLU OE2 9.928 H A 0093 ASP OD1
H A 0072 GLU OE2 10.35 H A 0093 ASP OD2
H A 0072 GLU OE1 11.36 H A 0102 GLU OE1
H A 0072 GLU OE2 10.51 H A 0102 GLU OE1
H A 0072 GLU OE2 11.67 H A 0102 GLU OE2
H A 0072 GLU OE1 10.29 H A 0104 GLU OE1
H A 0072 GLU OE2 8.375 H A 0104 GLU OE1
H A 0072 GLU OE2 10.50 H A 0104 GLU OE2
H A 0077 ASP OD1 9.832 H A 0080 GLU OE1
H A 0077 ASP OD1 10.26 H A 0080 GLU OE2
H A 0077 ASP OD2 9.037 H A 0080 GLU OE1
H A 0077 ASP OD2 9.554 H A 0080 GLU OE2
H A 0080 GLU OE2 11.65 H A 0110 GLU OE1
H A 0080 GLU OE2 11.40 H A 0110 GLU OE2
C A 0085 ARG NH1 11.68 H A 0113 ARG NH2
H A 0089 ASP OD1 5.512 H A 0092 GLU OE1
H A 0089 ASP OD1 7.583 H A 0092 GLU OE2
H A 0089 ASP OD2 4.986 H A 0092 GLU OE1
H A 0089 ASP OD2 7.011 H A 0092 GLU OE2
H A 0089 ASP OD1 7.527 H A 0093 ASP OD1
H A 0089 ASP OD1 6.742 H A 0093 ASP OD2
H A 0089 ASP OD2 9.474 H A 0093 ASP OD1
H A 0089 ASP OD2 8.884 H A 0093 ASP OD2
H A 0089 ASP OD1 10.94 H A 0119 GLU OE1
H A 0089 ASP OD1 11.52 H A 0119 GLU OE2
H A 0089 ASP OD2 11.32 H A 0119 GLU OE1
H A 0092 GLU OE1 9.426 H A 0093 ASP OD1
H A 0092 GLU OE1 9.606 H A 0093 ASP OD2
H A 0092 GLU OE2 10.42 H A 0093 ASP OD1
H A 0092 GLU OE2 10.98 H A 0093 ASP OD2
H A 0102 GLU OE1 7.231 H A 0104 GLU OE1
H A 0102 GLU OE1 7.240 H A 0104 GLU OE2
H A 0102 GLU OE2 9.375 H A 0104 GLU OE1
H A 0102 GLU OE2 9.385 H A 0104 GLU OE2
H A 0113 ARG NH1 5.144 H A 0117 LYS NZ
H A 0113 ARG NH2 5.807 H A 0117 LYS NZ
H A 0122 LYS NZ 7.932 C A 0123 LYS NZ
C A 0123 LYS NZ 10.65 C A 0126 ARG NH1
C A 0123 LYS NZ 8.481 C A 0126 ARG NH2
HB_MM 2.00 3.20 136
C A 0062 MET N 2.247 C A 0061 HIS O
C A 0063 ASP N 2.248 C A 0062 MET O
C A 0064 LYS N 2.246 C A 0063 ASP O
C A 0065 THR N 2.785 C A 0063 ASP O
C A 0065 THR N 2.232 C A 0064 LYS O
C A 0066 VAL N 2.758 C A 0064 LYS O
C A 0066 VAL N 2.228 C A 0065 THR O
C A 0067 ASN N 2.230 C A 0066 VAL O
C A 0068 LEU N 3.107 C A 0066 VAL O
C A 0068 LEU N 2.245 C A 0067 ASN O
H A 0069 SER N 3.169 C A 0067 ASN O
H A 0069 SER N 2.242 C A 0068 LEU O
H A 0070 ALA N 2.223 H A 0069 SER O
H A 0071 CYS N 2.226 H A 0070 ALA O
H A 0072 GLU N 3.064 H A 0069 SER O
H A 0072 GLU N 2.234 H A 0071 CYS O
H A 0073 VAL N 2.799 H A 0069 SER O
H A 0073 VAL N 2.234 H A 0072 GLU O
H A 0074 ALA N 3.103 H A 0070 ALA O
H A 0074 ALA N 2.244 H A 0073 VAL O
H A 0075 VAL N 2.963 H A 0071 CYS O
H A 0075 VAL N 2.226 H A 0074 ALA O
H A 0076 LEU N 2.844 H A 0072 GLU O
H A 0076 LEU N 2.239 H A 0075 VAL O
H A 0077 ASP N 3.196 H A 0073 VAL O
H A 0077 ASP N 3.137 H A 0075 VAL O
H A 0077 ASP N 2.243 H A 0076 LEU O
H A 0078 LEU N 2.984 H A 0075 VAL O
H A 0078 LEU N 2.244 H A 0077 ASP O
H A 0079 TYR N 2.881 H A 0075 VAL O
H A 0079 TYR N 3.090 H A 0077 ASP O
H A 0079 TYR N 2.237 H A 0078 LEU O
H A 0080 GLU N 3.124 H A 0076 LEU O
H A 0080 GLU N 3.090 H A 0077 ASP O
H A 0080 GLU N 2.248 H A 0079 TYR O
H A 0081 GLN N 2.805 H A 0077 ASP O
H A 0081 GLN N 2.229 H A 0080 GLU O
H A 0082 SER N 2.782 H A 0078 LEU O
H A 0082 SER N 2.892 H A 0079 TYR O
H A 0082 SER N 2.221 H A 0081 GLN O
C A 0083 ASN N 3.030 H A 0079 TYR O
C A 0083 ASN N 2.803 H A 0080 GLU O
C A 0083 ASN N 3.143 H A 0081 GLN O
C A 0083 ASN N 2.262 H A 0082 SER O
C A 0084 ILE N 2.814 H A 0079 TYR O
C A 0084 ILE N 2.239 C A 0083 ASN O
C A 0085 ARG N 2.248 C A 0084 ILE O
C A 0086 ILE N 2.242 C A 0085 ARG O
H A 0087 PRO N 2.242 C A 0086 ILE O
H A 0088 SER N 2.250 H A 0087 PRO O
H A 0089 ASP N 3.086 H A 0087 PRO O
H A 0089 ASP N 2.245 H A 0088 SER O
H A 0090 ILE N 3.056 H A 0087 PRO O
H A 0090 ILE N 2.229 H A 0089 ASP O
H A 0091 ILE N 2.845 H A 0088 SER O
H A 0091 ILE N 2.229 H A 0090 ILE O
H A 0092 GLU N 2.833 H A 0088 SER O
H A 0092 GLU N 3.120 H A 0089 ASP O
H A 0092 GLU N 2.254 H A 0091 ILE O
H A 0093 ASP N 3.049 H A 0089 ASP O
H A 0093 ASP N 2.248 H A 0092 GLU O
H A 0094 LEU N 2.857 H A 0090 ILE O
H A 0094 LEU N 3.181 H A 0091 ILE O
H A 0094 LEU N 2.240 H A 0093 ASP O
H A 0095 VAL N 2.899 H A 0091 ILE O
H A 0095 VAL N 2.243 H A 0094 LEU O
H A 0096 ASN N 2.790 H A 0093 ASP O
H A 0096 ASN N 2.251 H A 0095 VAL O
H A 0097 GLN N 2.902 H A 0093 ASP O
H A 0097 GLN N 3.057 H A 0094 LEU O
H A 0097 GLN N 2.244 H A 0096 ASN O
H A 0098 ARG N 2.870 H A 0094 LEU O
H A 0098 ARG N 2.247 H A 0097 GLN O
C A 0099 LEU N 2.248 H A 0098 ARG O
C A 0100 GLN N 2.240 C A 0099 LEU O
H A 0101 SER N 2.255 C A 0100 GLN O
H A 0102 GLU N 2.239 H A 0101 SER O
H A 0103 GLN N 3.189 H A 0101 SER O
H A 0103 GLN N 2.237 H A 0102 GLU O
H A 0104 GLU N 2.843 H A 0101 SER O
H A 0104 GLU N 2.226 H A 0103 GLN O
H A 0105 VAL N 2.904 H A 0101 SER O
H A 0105 VAL N 2.245 H A 0104 GLU O
H A 0106 LEU N 2.909 H A 0102 GLU O
H A 0106 LEU N 2.226 H A 0105 VAL O
H A 0107 ASN N 2.840 H A 0103 GLN O
H A 0107 ASN N 2.239 H A 0106 LEU O
H A 0108 TYR N 2.850 H A 0104 GLU O
H A 0108 TYR N 2.256 H A 0107 ASN O
H A 0109 ILE N 2.756 H A 0105 VAL O
H A 0109 ILE N 2.234 H A 0108 TYR O
H A 0110 GLU N 3.185 H A 0106 LEU O
H A 0110 GLU N 3.164 H A 0107 ASN O
H A 0110 GLU N 2.223 H A 0109 ILE O
H A 0111 THR N 3.054 H A 0107 ASN O
H A 0111 THR N 3.174 H A 0108 TYR O
H A 0111 THR N 2.247 H A 0110 GLU O
H A 0112 GLN N 2.844 H A 0108 TYR O
H A 0112 GLN N 2.236 H A 0111 THR O
H A 0113 ARG N 2.695 H A 0109 ILE O
H A 0113 ARG N 2.205 H A 0112 GLN O
H A 0114 THR N 2.949 H A 0110 GLU O
H A 0114 THR N 2.811 H A 0111 THR O
H A 0114 THR N 2.226 H A 0113 ARG O
H A 0115 TYR N 2.841 H A 0111 THR O
H A 0115 TYR N 2.248 H A 0114 THR O
H A 0116 TRP N 2.849 H A 0112 GLN O
H A 0116 TRP N 2.245 H A 0115 TYR O
H A 0117 LYS N 3.193 H A 0113 ARG O
H A 0117 LYS N 2.228 H A 0116 TRP O
H A 0118 LEU N 3.087 H A 0114 THR O
H A 0118 LEU N 2.947 H A 0115 TYR O
H A 0118 LEU N 2.235 H A 0117 LYS O
H A 0119 GLU N 2.871 H A 0115 TYR O
H A 0119 GLU N 3.184 H A 0116 TRP O
H A 0119 GLU N 2.223 H A 0118 LEU O
H A 0120 ASN N 2.685 H A 0116 TRP O
H A 0120 ASN N 3.120 H A 0118 LEU O
H A 0120 ASN N 2.215 H A 0119 GLU O
H A 0121 GLN N 2.919 H A 0117 LYS O
H A 0121 GLN N 2.821 H A 0118 LEU O
H A 0121 GLN N 2.244 H A 0120 ASN O
H A 0122 LYS N 2.848 H A 0118 LEU O
H A 0122 LYS N 2.237 H A 0121 GLN O
C A 0123 LYS N 2.264 H A 0122 LYS O
C A 0124 LEU N 2.235 C A 0123 LYS O
C A 0125 TYR N 2.233 C A 0124 LEU O
C A 0126 ARG N 2.833 C A 0124 LEU O
C A 0126 ARG N 2.232 C A 0125 TYR O
C A 0127 GLY N 2.751 C A 0125 TYR O
C A 0127 GLY N 2.230 C A 0126 ARG O
C A 0128 SER N 2.893 C A 0126 ARG O
C A 0128 SER N 2.234 C A 0127 GLY O
C A 0129 LEU N 2.850 C A 0127 GLY O
C A 0129 LEU N 2.234 C A 0128 SER O
C A 0130 LYS N 2.240 C A 0129 LEU O
HB_MS 2.00 3.20 18
C A 0061 HIS N 2.751 C A 0063 ASP OD1
C A 0067 ASN O 2.697 H A 0098 ARG NH2
H A 0069 SER N 2.757 H A 0072 GLU OE1
H A 0070 ALA N 2.935 H A 0069 SER OG
H A 0078 LEU O 2.740 H A 0082 SER OG
C A 0086 ILE N 2.870 H A 0080 GLU OE2
H A 0089 ASP N 2.990 H A 0088 SER OG
H A 0093 ASP O 2.808 H A 0096 ASN ND2
C A 0100 GLN N 2.681 H A 0104 GLU OE1
H A 0101 SER N 2.832 H A 0104 GLU OE1
H A 0102 GLU N 2.895 H A 0101 SER OG
H A 0103 GLN O 2.955 H A 0107 ASN ND2
H A 0108 TYR O 2.690 H A 0111 THR OG1
H A 0110 GLU O 2.860 H A 0114 THR OG1
H A 0112 GLN N 3.058 H A 0111 THR OG1
H A 0113 ARG O 2.887 H A 0117 LYS NZ
H A 0116 TRP O 3.105 H A 0120 ASN ND2
C A 0124 LEU O 2.667 C A 0126 ARG NH2
HB_SS 2.00 3.20 10
C A 0064 LYS NZ 2.798 H A 0088 SER OG
H A 0077 ASP OD1 2.745 H A 0081 GLN NE2
H A 0093 ASP OD1 2.737 H A 0097 GLN NE2
H A 0093 ASP OD2 2.665 H A 0108 TYR OH
H A 0093 ASP OD2 2.742 H A 0112 GLN NE2
H A 0098 ARG NH1 2.743 C A 0067 ASN OD1
H A 0102 GLU OE1 2.738 H A 0101 SER OG
H A 0104 GLU OE2 2.777 C A 0100 GLN NE2
H A 0110 GLU OE1 2.801 H A 0079 TYR OH
H A 0117 LYS NZ 2.812 H A 0114 THR OG1
AROMATIC 0.00 8.00 5
C A 0064 LYS 6.713 C A 0061 HIS
C A 0085 ARG 4.333 C A 0061 HIS
H A 0122 LYS 7.535 H A 0115 TYR
C A 0123 LYS 5.000 C A 0125 TYR
H A 0113 ARG 6.179 H A 0079 TYR
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 63
C A 0061 HIS CE1 3.655 H B 0089 ASP CG
C A 0061 HIS CD2 3.615 H B 0092 GLU CB
C A 0064 LYS CD 3.775 H B 0092 GLU CD
H A 0078 LEU C 3.778 C B 0124 LEU CD1
H A 0078 LEU CB 3.739 C B 0124 LEU CD1
H A 0079 TYR CG 3.702 C B 0124 LEU CD2
H A 0079 TYR CD1 3.404 C B 0124 LEU CD2
H A 0079 TYR CE1 3.296 C B 0124 LEU CD2
H A 0079 TYR CE2 3.747 C B 0124 LEU CD2
H A 0079 TYR CZ 3.365 C B 0124 LEU CD2
C A 0084 ILE CG1 3.730 H B 0122 LYS C
C A 0084 ILE CD1 3.653 H B 0122 LYS C
C A 0084 ILE CD1 3.546 H B 0122 LYS CB
C A 0084 ILE CD1 3.485 C B 0123 LYS C
C A 0085 ARG CZ 3.559 H B 0116 TRP CH2
C A 0085 ARG CB 3.615 H B 0119 GLU CD
C A 0086 ILE C 3.679 H B 0116 TRP CH2
H A 0087 PRO CA 3.739 H B 0089 ASP CG
H A 0087 PRO CA 3.627 H B 0116 TRP CZ2
H A 0087 PRO CA 3.375 H B 0116 TRP CH2
H A 0087 PRO CG 3.646 H B 0116 TRP CE3
H A 0087 PRO CG 3.568 H B 0116 TRP CZ3
H A 0087 PRO CG 3.690 H B 0116 TRP CH2
H A 0087 PRO CD 3.553 H B 0116 TRP CZ3
H A 0087 PRO CD 3.767 H B 0116 TRP CH2
H A 0102 GLU CD 3.436 C B 0130 LYS CD
H A 0106 LEU CD1 3.590 C B 0126 ARG CG
H A 0106 LEU CD1 3.659 C B 0126 ARG CD
H A 0110 GLU CD 3.699 C B 0126 ARG CZ
H A 0113 ARG CG 3.788 H B 0120 ASN CB
H A 0113 ARG CZ 3.645 H B 0120 ASN CA
H A 0113 ARG CZ 3.565 H B 0120 ASN C
H A 0116 TRP CZ2 3.787 C B 0085 ARG CZ
H A 0116 TRP CH2 3.374 C B 0085 ARG CZ
H A 0116 TRP CH2 3.630 C B 0086 ILE C
H A 0116 TRP CE3 3.757 H B 0087 PRO CG
H A 0116 TRP CZ2 3.560 H B 0087 PRO CA
H A 0116 TRP CZ2 3.548 H B 0087 PRO CB
H A 0116 TRP CZ2 3.648 H B 0087 PRO CG
H A 0116 TRP CZ3 3.534 H B 0087 PRO CG
H A 0116 TRP CZ3 3.466 H B 0087 PRO CD
H A 0116 TRP CH2 3.361 H B 0087 PRO CA
H A 0116 TRP CH2 3.694 H B 0087 PRO CB
H A 0116 TRP CH2 3.465 H B 0087 PRO CG
H A 0116 TRP CH2 3.512 H B 0087 PRO CD
H A 0117 LYS CG 3.774 H B 0120 ASN CB
H A 0117 LYS CD 3.697 H B 0120 ASN C
H A 0120 ASN CA 3.662 H B 0113 ARG CG
H A 0120 ASN C 3.557 H B 0113 ARG CZ
H A 0120 ASN CG 3.721 H B 0116 TRP CB
H A 0120 ASN CB 3.542 H B 0117 LYS CB
H A 0122 LYS CE 3.730 C B 0083 ASN CG
H A 0122 LYS C 3.800 C B 0084 ILE CD1
H A 0122 LYS CB 3.605 C B 0084 ILE CD1
C A 0123 LYS C 3.620 C B 0084 ILE CD1
C A 0124 LEU CD1 3.637 H B 0078 LEU C
C A 0124 LEU CD2 3.380 H B 0079 TYR CD1
C A 0124 LEU CD2 3.224 H B 0079 TYR CE1
C A 0124 LEU CD2 3.757 H B 0079 TYR CZ
C A 0124 LEU CA 3.794 H B 0082 SER CB
C A 0124 LEU CD1 3.722 H B 0082 SER CB
C A 0126 ARG CZ 3.725 H B 0110 GLU CD
C A 0128 SER CB 3.603 H B 0102 GLU CB
CHARGE_ATTR 2.00 12.00 94
C A 0061 HIS ND1 5.554 H B 0089 ASP OD1
C A 0061 HIS ND1 3.815 H B 0089 ASP OD2
C A 0061 HIS NE2 4.518 H B 0089 ASP OD1
C A 0061 HIS NE2 3.577 H B 0089 ASP OD2
C A 0061 HIS ND1 4.666 H B 0092 GLU OE1
C A 0061 HIS ND1 6.840 H B 0092 GLU OE2
C A 0061 HIS NE2 2.638 H B 0092 GLU OE1
C A 0061 HIS NE2 4.848 H B 0092 GLU OE2
C A 0061 HIS ND1 8.443 H B 0093 ASP OD1
C A 0061 HIS ND1 8.406 H B 0093 ASP OD2
C A 0061 HIS NE2 8.069 H B 0093 ASP OD1
C A 0061 HIS NE2 8.015 H B 0093 ASP OD2
C A 0061 HIS ND1 11.42 H B 0119 GLU OE1
C A 0064 LYS NZ 4.498 H B 0089 ASP OD1
C A 0064 LYS NZ 5.831 H B 0089 ASP OD2
C A 0064 LYS NZ 3.474 H B 0092 GLU OE1
C A 0064 LYS NZ 2.664 H B 0092 GLU OE2
H A 0077 ASP OD1 11.72 C B 0123 LYS NZ
H A 0080 GLU OE1 7.483 H B 0122 LYS NZ
H A 0080 GLU OE2 8.537 H B 0122 LYS NZ
H A 0080 GLU OE1 11.11 C B 0123 LYS NZ
C A 0085 ARG NH1 6.715 H B 0089 ASP OD1
C A 0085 ARG NH1 4.703 H B 0089 ASP OD2
C A 0085 ARG NH2 4.949 H B 0089 ASP OD1
C A 0085 ARG NH2 2.779 H B 0089 ASP OD2
C A 0085 ARG NH1 8.428 H B 0092 GLU OE1
C A 0085 ARG NH1 10.36 H B 0092 GLU OE2
C A 0085 ARG NH2 6.785 H B 0092 GLU OE1
C A 0085 ARG NH2 8.764 H B 0092 GLU OE2
C A 0085 ARG NH1 11.75 H B 0093 ASP OD1
C A 0085 ARG NH1 11.11 H B 0093 ASP OD2
C A 0085 ARG NH2 10.06 H B 0093 ASP OD1
C A 0085 ARG NH2 9.299 H B 0093 ASP OD2
C A 0085 ARG NH1 7.933 H B 0119 GLU OE1
C A 0085 ARG NH1 8.435 H B 0119 GLU OE2
C A 0085 ARG NH2 8.313 H B 0119 GLU OE1
C A 0085 ARG NH2 9.075 H B 0119 GLU OE2
H A 0089 ASP OD1 3.155 C B 0085 ARG NH1
H A 0089 ASP OD1 2.631 C B 0085 ARG NH2
H A 0089 ASP OD2 2.708 C B 0085 ARG NH1
H A 0089 ASP OD2 3.777 C B 0085 ARG NH2
H A 0092 GLU OE1 7.228 C B 0085 ARG NH1
H A 0092 GLU OE1 7.606 C B 0085 ARG NH2
H A 0092 GLU OE2 9.045 C B 0085 ARG NH1
H A 0092 GLU OE2 9.455 C B 0085 ARG NH2
H A 0093 ASP OD1 9.510 C B 0085 ARG NH1
H A 0093 ASP OD1 7.526 C B 0085 ARG NH2
H A 0093 ASP OD2 8.930 C B 0085 ARG NH1
H A 0093 ASP OD2 6.813 C B 0085 ARG NH2
H A 0102 GLU OE1 2.586 C B 0130 LYS NZ
H A 0102 GLU OE2 2.589 C B 0130 LYS NZ
H A 0104 GLU OE1 8.722 C B 0130 LYS NZ
H A 0104 GLU OE2 8.264 C B 0130 LYS NZ
H A 0110 GLU OE2 11.49 H B 0122 LYS NZ
H A 0110 GLU OE1 10.57 C B 0123 LYS NZ
H A 0110 GLU OE2 9.884 C B 0123 LYS NZ
H A 0110 GLU OE1 2.698 C B 0126 ARG NH1
H A 0110 GLU OE1 2.628 C B 0126 ARG NH2
H A 0110 GLU OE2 4.491 C B 0126 ARG NH1
H A 0110 GLU OE2 3.734 C B 0126 ARG NH2
H A 0113 ARG NH1 9.178 H B 0119 GLU OE1
H A 0113 ARG NH1 7.171 H B 0119 GLU OE2
H A 0113 ARG NH2 7.061 H B 0119 GLU OE1
H A 0113 ARG NH2 5.131 H B 0119 GLU OE2
H A 0117 LYS NZ 11.71 H B 0119 GLU OE1
H A 0117 LYS NZ 10.30 H B 0119 GLU OE2
H A 0119 GLU OE1 9.063 C B 0085 ARG NH1
H A 0119 GLU OE1 8.918 C B 0085 ARG NH2
H A 0119 GLU OE2 10.12 C B 0085 ARG NH1
H A 0119 GLU OE2 9.495 C B 0085 ARG NH2
H A 0119 GLU OE1 7.824 H B 0113 ARG NH1
H A 0119 GLU OE1 5.724 H B 0113 ARG NH2
H A 0119 GLU OE2 9.127 H B 0113 ARG NH1
H A 0119 GLU OE2 6.916 H B 0113 ARG NH2
H A 0119 GLU OE1 11.15 H B 0117 LYS NZ
H A 0119 GLU OE2 11.73 H B 0117 LYS NZ
H A 0122 LYS NZ 6.040 H B 0080 GLU OE1
H A 0122 LYS NZ 7.434 H B 0080 GLU OE2
H A 0122 LYS NZ 10.99 H B 0110 GLU OE2
C A 0123 LYS NZ 11.50 H B 0077 ASP OD1
C A 0123 LYS NZ 8.751 H B 0080 GLU OE1
C A 0123 LYS NZ 10.94 H B 0080 GLU OE2
C A 0123 LYS NZ 10.11 H B 0110 GLU OE1
C A 0123 LYS NZ 9.502 H B 0110 GLU OE2
C A 0126 ARG NH1 11.68 H B 0104 GLU OE1
C A 0126 ARG NH1 2.716 H B 0110 GLU OE1
C A 0126 ARG NH1 4.395 H B 0110 GLU OE2
C A 0126 ARG NH2 2.615 H B 0110 GLU OE1
C A 0126 ARG NH2 3.799 H B 0110 GLU OE2
C A 0130 LYS NZ 11.96 H B 0072 GLU OE1
C A 0130 LYS NZ 4.585 H B 0102 GLU OE1
C A 0130 LYS NZ 6.567 H B 0102 GLU OE2
C A 0130 LYS NZ 2.593 H B 0104 GLU OE1
C A 0130 LYS NZ 2.628 H B 0104 GLU OE2
CHARGE_REPU 2.00 12.00 84
C A 0061 HIS NE2 11.22 C B 0085 ARG NH1
C A 0063 ASP OD1 7.135 H B 0089 ASP OD1
C A 0063 ASP OD1 5.278 H B 0089 ASP OD2
C A 0063 ASP OD2 5.430 H B 0089 ASP OD1
C A 0063 ASP OD2 3.662 H B 0089 ASP OD2
C A 0063 ASP OD1 6.699 H B 0092 GLU OE1
C A 0063 ASP OD1 8.670 H B 0092 GLU OE2
C A 0063 ASP OD2 6.176 H B 0092 GLU OE1
C A 0063 ASP OD2 8.018 H B 0092 GLU OE2
C A 0063 ASP OD1 10.64 H B 0093 ASP OD1
C A 0063 ASP OD1 10.68 H B 0093 ASP OD2
C A 0063 ASP OD2 11.30 H B 0093 ASP OD1
C A 0063 ASP OD2 10.96 H B 0093 ASP OD2
C A 0063 ASP OD1 11.23 H B 0119 GLU OE1
C A 0063 ASP OD1 11.98 H B 0119 GLU OE2
C A 0063 ASP OD2 10.43 H B 0119 GLU OE1
C A 0063 ASP OD2 10.93 H B 0119 GLU OE2
C A 0064 LYS NZ 8.026 C B 0085 ARG NH1
C A 0064 LYS NZ 8.819 C B 0085 ARG NH2
H A 0080 GLU OE1 11.34 H B 0089 ASP OD1
H A 0080 GLU OE1 9.618 H B 0089 ASP OD2
H A 0080 GLU OE2 9.665 H B 0089 ASP OD1
H A 0080 GLU OE2 8.174 H B 0089 ASP OD2
H A 0080 GLU OE1 7.025 H B 0119 GLU OE1
H A 0080 GLU OE1 6.606 H B 0119 GLU OE2
H A 0080 GLU OE2 7.589 H B 0119 GLU OE1
H A 0080 GLU OE2 7.003 H B 0119 GLU OE2
C A 0085 ARG NH1 9.842 H B 0122 LYS NZ
C A 0085 ARG NH2 10.61 H B 0122 LYS NZ
H A 0089 ASP OD1 10.39 H B 0080 GLU OE2
H A 0089 ASP OD2 11.71 H B 0080 GLU OE1
H A 0089 ASP OD2 9.995 H B 0080 GLU OE2
H A 0089 ASP OD1 5.981 H B 0089 ASP OD1
H A 0089 ASP OD1 8.091 H B 0089 ASP OD2
H A 0089 ASP OD2 5.151 H B 0089 ASP OD1
H A 0089 ASP OD2 7.360 H B 0089 ASP OD2
H A 0089 ASP OD1 8.755 H B 0092 GLU OE1
H A 0089 ASP OD1 8.137 H B 0092 GLU OE2
H A 0089 ASP OD2 7.221 H B 0092 GLU OE1
H A 0089 ASP OD2 6.482 H B 0092 GLU OE2
H A 0092 GLU OE1 6.203 H B 0089 ASP OD1
H A 0092 GLU OE1 7.898 H B 0089 ASP OD2
H A 0092 GLU OE2 8.072 H B 0089 ASP OD1
H A 0092 GLU OE2 9.528 H B 0089 ASP OD2
H A 0092 GLU OE1 6.052 H B 0092 GLU OE1
H A 0092 GLU OE1 4.712 H B 0092 GLU OE2
H A 0092 GLU OE2 6.876 H B 0092 GLU OE1
H A 0092 GLU OE2 5.245 H B 0092 GLU OE2
H A 0093 ASP OD2 11.35 H B 0089 ASP OD1
H A 0110 GLU OE1 11.01 H B 0119 GLU OE2
H A 0110 GLU OE2 11.60 H B 0119 GLU OE1
H A 0110 GLU OE2 9.553 H B 0119 GLU OE2
H A 0113 ARG NH1 9.053 H B 0122 LYS NZ
H A 0113 ARG NH2 7.020 H B 0122 LYS NZ
H A 0113 ARG NH1 8.698 C B 0123 LYS NZ
H A 0113 ARG NH2 8.361 C B 0123 LYS NZ
H A 0113 ARG NH1 6.971 C B 0126 ARG NH1
H A 0113 ARG NH1 5.669 C B 0126 ARG NH2
H A 0113 ARG NH2 9.104 C B 0126 ARG NH1
H A 0113 ARG NH2 7.640 C B 0126 ARG NH2
H A 0117 LYS NZ 9.491 C B 0126 ARG NH1
H A 0117 LYS NZ 9.143 C B 0126 ARG NH2
H A 0119 GLU OE1 5.372 H B 0080 GLU OE1
H A 0119 GLU OE1 6.226 H B 0080 GLU OE2
H A 0119 GLU OE2 7.196 H B 0080 GLU OE1
H A 0119 GLU OE2 7.968 H B 0080 GLU OE2
H A 0119 GLU OE1 11.59 H B 0110 GLU OE1
H A 0119 GLU OE1 9.840 H B 0110 GLU OE2
H A 0119 GLU OE2 11.41 H B 0110 GLU OE2
H A 0122 LYS NZ 11.45 C B 0085 ARG NH1
H A 0122 LYS NZ 11.14 C B 0085 ARG NH2
H A 0122 LYS NZ 8.875 H B 0113 ARG NH1
H A 0122 LYS NZ 6.853 H B 0113 ARG NH2
C A 0123 LYS NZ 8.682 H B 0113 ARG NH1
C A 0123 LYS NZ 8.373 H B 0113 ARG NH2
C A 0126 ARG NH1 6.389 H B 0113 ARG NH1
C A 0126 ARG NH1 8.543 H B 0113 ARG NH2
C A 0126 ARG NH2 5.138 H B 0113 ARG NH1
C A 0126 ARG NH2 7.073 H B 0113 ARG NH2
C A 0126 ARG NH1 8.314 H B 0117 LYS NZ
C A 0126 ARG NH2 8.025 H B 0117 LYS NZ
C A 0130 LYS NZ 9.839 C B 0064 LYS NZ
C A 0130 LYS NZ 11.86 H B 0098 ARG NH1
C A 0130 LYS NZ 11.32 H B 0098 ARG NH2
HB_MS 2.00 3.20 22
H A 0082 SER O 2.692 C B 0123 LYS NZ
C A 0083 ASN O 2.692 H B 0122 LYS NZ
C A 0085 ARG N 2.775 H B 0119 GLU OE2
H A 0088 SER N 2.864 H B 0089 ASP OD1
H A 0088 SER N 2.886 H B 0089 ASP OD2
H A 0089 ASP OD2 2.751 H B 0088 SER N
H A 0089 ASP N 2.927 H B 0089 ASP OD1
H A 0103 GLN OE1 3.000 C B 0130 LYS N
H A 0106 LEU O 3.182 C B 0126 ARG NH1
H A 0113 ARG NH2 2.657 H B 0119 GLU O
H A 0113 ARG NH1 2.888 H B 0122 LYS O
H A 0113 ARG NH2 2.752 H B 0122 LYS O
H A 0117 LYS NZ 2.881 H B 0120 ASN O
H A 0119 GLU OE1 3.178 C B 0085 ARG N
H A 0119 GLU O 2.638 H B 0113 ARG NH2
H A 0120 ASN OD1 3.141 H B 0117 LYS N
H A 0120 ASN O 2.781 H B 0117 LYS NZ
H A 0122 LYS NZ 2.613 C B 0083 ASN O
H A 0122 LYS O 2.966 H B 0113 ARG NH1
H A 0122 LYS O 2.757 H B 0113 ARG NH2
C A 0123 LYS NZ 2.754 H B 0082 SER O
C A 0130 LYS N 2.761 H B 0103 GLN OE1
HB_SS 2.00 3.20 8
C A 0064 LYS NZ 2.871 H B 0088 SER OG
C A 0083 ASN OD1 2.801 H B 0122 LYS NZ
H A 0088 SER OG 2.747 H B 0089 ASP OD1
H A 0089 ASP OD2 2.924 H B 0088 SER OG
H A 0122 LYS NZ 2.727 C B 0083 ASN OD1
C A 0123 LYS NZ 2.742 H B 0082 SER OG
C A 0125 TYR OH 2.809 H B 0081 GLN OE1
C A 0130 LYS NZ 2.620 H B 0101 SER OG
AROMATIC 0.00 8.00 5
C A 0085 ARG 7.407 H B 0115 TYR
H A 0115 TYR 5.603 C B 0085 ARG
H A 0079 TYR 5.659 C B 0126 ARG
C A 0085 ARG 4.671 H B 0116 TRP
C A 0126 ARG 7.405 H B 0079 TYR
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 269
C B 0061 HIS C 2.474 C B 0062 MET CA
C B 0061 HIS C 3.178 C B 0062 MET C
C B 0061 HIS C 3.700 C B 0062 MET CB
C B 0061 HIS CE1 3.703 H B 0096 ASN CA
C B 0062 MET C 2.491 C B 0063 ASP CA
C B 0062 MET C 3.591 C B 0063 ASP C
C B 0062 MET C 3.406 C B 0063 ASP CB
C B 0063 ASP C 2.466 C B 0064 LYS CA
C B 0063 ASP C 3.178 C B 0064 LYS C
C B 0063 ASP C 3.710 C B 0064 LYS CB
C B 0063 ASP CB 3.785 H B 0098 ARG CG
C B 0063 ASP CG 3.709 H B 0098 ARG CB
C B 0064 LYS C 2.512 C B 0065 THR CA
C B 0064 LYS C 3.690 C B 0065 THR C
C B 0064 LYS C 3.275 C B 0065 THR CB
C B 0064 LYS CE 3.685 C B 0100 GLN C
C B 0065 THR C 2.476 C B 0066 VAL CA
C B 0065 THR C 3.262 C B 0066 VAL C
C B 0065 THR C 3.688 C B 0066 VAL CB
C B 0065 THR CA 3.773 H B 0072 GLU CD
C B 0065 THR CG2 3.624 H B 0072 GLU CD
C B 0065 THR CG2 3.776 H B 0098 ARG CA
C B 0066 VAL C 2.481 C B 0067 ASN CA
C B 0066 VAL C 3.728 C B 0067 ASN C
C B 0066 VAL C 3.138 C B 0067 ASN CB
C B 0067 ASN C 2.489 C B 0068 LEU CA
C B 0067 ASN C 3.173 C B 0068 LEU C
C B 0067 ASN C 3.154 C B 0068 LEU CB
C B 0067 ASN CA 3.646 H B 0095 VAL CG2
C B 0068 LEU C 2.509 H B 0069 SER CA
C B 0068 LEU C 3.370 H B 0069 SER C
C B 0068 LEU C 3.666 H B 0069 SER CB
C B 0068 LEU CA 3.699 H B 0072 GLU CG
C B 0068 LEU CA 3.765 H B 0073 VAL CG2
C B 0068 LEU C 3.338 H B 0073 VAL CG2
C B 0068 LEU CB 3.661 H B 0073 VAL CG2
C B 0068 LEU CD1 3.442 H B 0091 ILE CG2
H B 0069 SER C 2.495 H B 0070 ALA CA
H B 0069 SER C 3.001 H B 0070 ALA C
H B 0069 SER C 3.703 H B 0070 ALA CB
H B 0069 SER CA 3.750 H B 0072 GLU CD
H B 0069 SER CB 3.592 H B 0072 GLU CD
H B 0070 ALA C 2.458 H B 0071 CYS CA
H B 0070 ALA C 3.091 H B 0071 CYS C
H B 0070 ALA C 3.742 H B 0071 CYS CB
H B 0071 CYS C 2.426 H B 0072 GLU CA
H B 0071 CYS C 3.051 H B 0072 GLU C
H B 0071 CYS C 3.708 H B 0072 GLU CB
H B 0072 GLU C 2.465 H B 0073 VAL CA
H B 0072 GLU C 3.081 H B 0073 VAL C
H B 0072 GLU C 3.742 H B 0073 VAL CB
H B 0073 VAL C 2.460 H B 0074 ALA CA
H B 0073 VAL C 3.004 H B 0074 ALA C
H B 0073 VAL C 3.717 H B 0074 ALA CB
H B 0074 ALA C 2.447 H B 0075 VAL CA
H B 0074 ALA C 3.164 H B 0075 VAL C
H B 0074 ALA C 3.663 H B 0075 VAL CB
H B 0075 VAL C 2.461 H B 0076 LEU CA
H B 0075 VAL C 3.099 H B 0076 LEU C
H B 0075 VAL C 3.729 H B 0076 LEU CB
H B 0075 VAL CG1 3.451 H B 0079 TYR CE2
H B 0075 VAL CG1 3.730 H B 0079 TYR CZ
H B 0075 VAL CG2 3.742 H B 0105 VAL CG2
H B 0075 VAL CG1 3.551 H B 0106 LEU CB
H B 0076 LEU C 2.438 H B 0077 ASP CA
H B 0076 LEU C 3.039 H B 0077 ASP C
H B 0076 LEU C 3.692 H B 0077 ASP CB
H B 0076 LEU CA 3.767 H B 0079 TYR CD2
H B 0076 LEU CD2 3.713 C B 0086 ILE CG1
H B 0077 ASP C 2.453 H B 0078 LEU CA
H B 0077 ASP C 2.960 H B 0078 LEU C
H B 0077 ASP C 3.725 H B 0078 LEU CB
H B 0078 LEU C 2.458 H B 0079 TYR CA
H B 0078 LEU C 2.966 H B 0079 TYR C
H B 0078 LEU C 3.751 H B 0079 TYR CB
H B 0079 TYR C 2.449 H B 0080 GLU CA
H B 0079 TYR C 3.283 H B 0080 GLU C
H B 0079 TYR C 3.641 H B 0080 GLU CB
H B 0079 TYR CD1 3.527 C B 0084 ILE CG2
H B 0079 TYR CD2 3.458 C B 0086 ILE CG1
H B 0079 TYR CD2 3.644 C B 0086 ILE CD1
H B 0079 TYR CE2 3.592 H B 0109 ILE CG2
H B 0079 TYR CE2 3.707 H B 0109 ILE CD1
H B 0079 TYR CZ 3.503 H B 0109 ILE CG2
H B 0080 GLU C 2.451 H B 0081 GLN CA
H B 0080 GLU C 2.900 H B 0081 GLN C
H B 0080 GLU C 3.746 H B 0081 GLN CB
H B 0080 GLU CD 3.500 C B 0084 ILE C
H B 0081 GLN C 2.451 H B 0082 SER CA
H B 0081 GLN C 3.233 H B 0082 SER C
H B 0081 GLN C 3.690 H B 0082 SER CB
H B 0082 SER C 2.573 C B 0083 ASN CA
H B 0082 SER C 3.321 C B 0083 ASN C
H B 0082 SER C 3.340 C B 0083 ASN CB
H B 0082 SER C 3.778 C B 0084 ILE CD1
C B 0083 ASN C 2.493 C B 0084 ILE CA
C B 0083 ASN C 3.494 C B 0084 ILE C
C B 0083 ASN C 3.583 C B 0084 ILE CB
C B 0083 ASN C 3.296 C B 0084 ILE CD1
C B 0084 ILE C 2.418 C B 0085 ARG CA
C B 0084 ILE C 3.064 C B 0085 ARG C
C B 0084 ILE C 3.702 C B 0085 ARG CB
C B 0084 ILE CG1 3.760 H B 0113 ARG CZ
C B 0084 ILE CG2 3.676 H B 0113 ARG CZ
C B 0085 ARG C 2.478 C B 0086 ILE CA
C B 0085 ARG C 3.360 C B 0086 ILE C
C B 0085 ARG C 3.629 C B 0086 ILE CB
C B 0086 ILE CA 2.993 H B 0087 PRO CD
C B 0086 ILE C 2.466 H B 0087 PRO CA
C B 0086 ILE C 3.055 H B 0087 PRO C
C B 0086 ILE C 3.701 H B 0087 PRO CB
C B 0086 ILE C 3.692 H B 0087 PRO CG
C B 0086 ILE C 2.505 H B 0087 PRO CD
C B 0086 ILE CG2 3.706 H B 0090 ILE CB
C B 0086 ILE CG2 3.730 H B 0091 ILE CG1
C B 0086 ILE CG2 3.623 H B 0091 ILE CD1
C B 0086 ILE CD1 3.773 H B 0109 ILE CG2
H B 0087 PRO C 2.470 H B 0088 SER CA
H B 0087 PRO C 2.931 H B 0088 SER C
H B 0087 PRO C 3.730 H B 0088 SER CB
H B 0088 SER C 2.476 H B 0089 ASP CA
H B 0088 SER C 3.005 H B 0089 ASP C
H B 0088 SER C 3.702 H B 0089 ASP CB
H B 0088 SER C 3.718 H B 0092 GLU CG
H B 0088 SER C 3.758 H B 0092 GLU CD
H B 0089 ASP C 2.460 H B 0090 ILE CA
H B 0089 ASP C 2.956 H B 0090 ILE C
H B 0089 ASP C 3.748 H B 0090 ILE CB
H B 0089 ASP CB 3.701 H B 0116 TRP CZ2
H B 0090 ILE C 2.459 H B 0091 ILE CA
H B 0090 ILE C 3.108 H B 0091 ILE C
H B 0090 ILE C 3.681 H B 0091 ILE CB
H B 0090 ILE CD1 3.502 H B 0112 GLN C
H B 0090 ILE CD1 3.371 H B 0112 GLN CB
H B 0090 ILE CD1 3.703 H B 0116 TRP CD1
H B 0091 ILE C 2.512 H B 0092 GLU CA
H B 0091 ILE C 3.130 H B 0092 GLU C
H B 0091 ILE C 3.705 H B 0092 GLU CB
H B 0092 GLU C 2.467 H B 0093 ASP CA
H B 0092 GLU C 3.250 H B 0093 ASP C
H B 0092 GLU C 3.641 H B 0093 ASP CB
H B 0093 ASP C 2.512 H B 0094 LEU CA
H B 0093 ASP C 3.030 H B 0094 LEU C
H B 0093 ASP C 3.718 H B 0094 LEU CB
H B 0094 LEU C 2.443 H B 0095 VAL CA
H B 0094 LEU C 3.085 H B 0095 VAL C
H B 0094 LEU C 3.705 H B 0095 VAL CB
H B 0094 LEU CD2 3.455 H B 0108 TYR CD1
H B 0095 VAL C 2.467 H B 0096 ASN CA
H B 0095 VAL C 3.205 H B 0096 ASN C
H B 0095 VAL C 3.725 H B 0096 ASN CB
H B 0096 ASN C 2.476 H B 0097 GLN CA
H B 0096 ASN C 3.101 H B 0097 GLN C
H B 0096 ASN C 3.748 H B 0097 GLN CB
H B 0097 GLN C 2.505 H B 0098 ARG CA
H B 0097 GLN C 3.169 H B 0098 ARG C
H B 0097 GLN C 3.285 H B 0098 ARG CB
H B 0097 GLN C 3.361 H B 0098 ARG CG
H B 0098 ARG C 2.463 C B 0099 LEU CA
H B 0098 ARG C 3.454 C B 0099 LEU C
H B 0098 ARG C 3.532 C B 0099 LEU CB
H B 0098 ARG C 3.571 C B 0099 LEU CG
C B 0099 LEU CA 3.798 C B 0100 GLN CA
C B 0099 LEU C 2.461 C B 0100 GLN CA
C B 0099 LEU C 3.200 C B 0100 GLN C
C B 0099 LEU C 3.699 C B 0100 GLN CB
C B 0099 LEU CD1 3.276 H B 0108 TYR CB
C B 0099 LEU CD1 3.640 H B 0108 TYR CG
C B 0100 GLN C 2.475 H B 0101 SER CA
C B 0100 GLN C 3.732 H B 0101 SER C
C B 0100 GLN C 3.007 H B 0101 SER CB
H B 0101 SER C 2.469 H B 0102 GLU CA
H B 0101 SER C 3.115 H B 0102 GLU C
H B 0101 SER C 3.706 H B 0102 GLU CB
H B 0101 SER CB 3.712 H B 0104 GLU CD
H B 0102 GLU C 2.415 H B 0103 GLN CA
H B 0102 GLU C 2.982 H B 0103 GLN C
H B 0102 GLU C 3.747 H B 0103 GLN CB
H B 0103 GLN C 2.452 H B 0104 GLU CA
H B 0103 GLN C 3.140 H B 0104 GLU C
H B 0103 GLN C 3.667 H B 0104 GLU CB
H B 0103 GLN CA 3.792 H B 0106 LEU CG
H B 0103 GLN C 3.786 H B 0107 ASN CG
H B 0104 GLU C 2.424 H B 0105 VAL CA
H B 0104 GLU C 3.038 H B 0105 VAL C
H B 0104 GLU C 3.763 H B 0105 VAL CB
H B 0105 VAL C 2.419 H B 0106 LEU CA
H B 0105 VAL C 3.035 H B 0106 LEU C
H B 0105 VAL C 3.737 H B 0106 LEU CB
H B 0106 LEU C 2.476 H B 0107 ASN CA
H B 0106 LEU C 3.000 H B 0107 ASN C
H B 0106 LEU C 3.761 H B 0107 ASN CB
H B 0107 ASN C 2.459 H B 0108 TYR CA
H B 0107 ASN C 3.046 H B 0108 TYR C
H B 0107 ASN C 3.704 H B 0108 TYR CB
H B 0108 TYR C 2.460 H B 0109 ILE CA
H B 0108 TYR C 2.975 H B 0109 ILE C
H B 0108 TYR C 3.735 H B 0109 ILE CB
H B 0108 TYR CD1 3.765 H B 0112 GLN CG
H B 0108 TYR CE1 3.524 H B 0112 GLN CG
H B 0109 ILE C 2.456 H B 0110 GLU CA
H B 0109 ILE C 3.034 H B 0110 GLU C
H B 0109 ILE C 3.707 H B 0110 GLU CB
H B 0110 GLU C 2.467 H B 0111 THR CA
H B 0110 GLU C 3.100 H B 0111 THR C
H B 0110 GLU C 3.750 H B 0111 THR CB
H B 0111 THR C 2.468 H B 0112 GLN CA
H B 0111 THR C 3.074 H B 0112 GLN C
H B 0111 THR C 3.722 H B 0112 GLN CB
H B 0112 GLN C 2.491 H B 0113 ARG CA
H B 0112 GLN C 3.119 H B 0113 ARG C
H B 0112 GLN C 3.700 H B 0113 ARG CB
H B 0113 ARG C 2.469 H B 0114 THR CA
H B 0113 ARG C 3.164 H B 0114 THR C
H B 0113 ARG C 3.719 H B 0114 THR CB
H B 0114 THR C 2.437 H B 0115 TYR CA
H B 0114 THR C 2.907 H B 0115 TYR C
H B 0114 THR C 3.737 H B 0115 TYR CB
H B 0114 THR CA 3.670 H B 0117 LYS CG
H B 0115 TYR C 2.423 H B 0116 TRP CA
H B 0115 TYR C 3.023 H B 0116 TRP C
H B 0115 TYR C 3.732 H B 0116 TRP CB
H B 0115 TYR CE2 3.679 H B 0116 TRP CD2
H B 0115 TYR CE2 3.580 H B 0116 TRP CE3
H B 0115 TYR CE2 3.748 H B 0116 TRP CZ3
H B 0115 TYR CZ 3.798 H B 0119 GLU CG
H B 0116 TRP C 2.411 H B 0117 LYS CA
H B 0116 TRP C 3.037 H B 0117 LYS C
H B 0116 TRP C 3.770 H B 0117 LYS CB
H B 0117 LYS C 2.434 H B 0118 LEU CA
H B 0117 LYS C 3.075 H B 0118 LEU C
H B 0117 LYS C 3.727 H B 0118 LEU CB
H B 0118 LEU C 2.478 H B 0119 GLU CA
H B 0118 LEU C 3.098 H B 0119 GLU C
H B 0118 LEU C 3.700 H B 0119 GLU CB
H B 0119 GLU C 2.473 H B 0120 ASN CA
H B 0119 GLU C 3.214 H B 0120 ASN C
H B 0119 GLU C 3.710 H B 0120 ASN CB
H B 0119 GLU CD 3.527 H B 0122 LYS CE
H B 0120 ASN C 2.504 H B 0121 GLN CA
H B 0120 ASN C 3.264 H B 0121 GLN C
H B 0120 ASN C 3.693 H B 0121 GLN CB
H B 0121 GLN C 2.467 H B 0122 LYS CA
H B 0121 GLN C 3.102 H B 0122 LYS C
H B 0121 GLN C 3.731 H B 0122 LYS CB
H B 0122 LYS C 2.505 C B 0123 LYS CA
H B 0122 LYS C 3.402 C B 0123 LYS C
H B 0122 LYS C 3.691 C B 0123 LYS CB
C B 0123 LYS C 2.447 C B 0124 LEU CA
C B 0123 LYS C 3.214 C B 0124 LEU C
C B 0123 LYS C 3.687 C B 0124 LEU CB
C B 0124 LEU C 2.500 C B 0125 TYR CA
C B 0124 LEU C 3.254 C B 0125 TYR C
C B 0124 LEU C 3.711 C B 0125 TYR CB
C B 0125 TYR C 2.494 C B 0126 ARG CA
C B 0125 TYR C 3.212 C B 0126 ARG C
C B 0125 TYR C 3.094 C B 0126 ARG CB
C B 0126 ARG C 2.476 C B 0127 GLY CA
C B 0126 ARG C 3.209 C B 0127 GLY C
C B 0127 GLY C 2.473 C B 0128 SER CA
C B 0127 GLY C 3.231 C B 0128 SER C
C B 0127 GLY C 3.707 C B 0128 SER CB
C B 0127 GLY C 3.701 C B 0129 LEU CD1
C B 0128 SER C 2.476 C B 0129 LEU CA
C B 0128 SER C 3.181 C B 0129 LEU C
C B 0128 SER C 3.720 C B 0129 LEU CB
C B 0129 LEU C 2.479 C B 0130 LYS CA
C B 0129 LEU C 3.195 C B 0130 LYS C
C B 0129 LEU C 3.686 C B 0130 LYS CB
CHARGE_ATTR 2.00 12.00 60
C B 0063 ASP OD1 8.491 C B 0061 HIS ND1
C B 0063 ASP OD1 6.781 C B 0061 HIS NE2
C B 0063 ASP OD2 9.248 C B 0061 HIS ND1
C B 0063 ASP OD2 7.890 C B 0061 HIS NE2
C B 0063 ASP OD1 2.688 C B 0064 LYS NZ
C B 0063 ASP OD2 4.290 C B 0064 LYS NZ
C B 0063 ASP OD1 5.498 H B 0098 ARG NH1
C B 0063 ASP OD1 4.164 H B 0098 ARG NH2
C B 0063 ASP OD2 4.366 H B 0098 ARG NH1
C B 0063 ASP OD2 2.625 H B 0098 ARG NH2
H B 0072 GLU OE1 10.08 C B 0061 HIS ND1
H B 0072 GLU OE1 7.937 C B 0061 HIS NE2
H B 0072 GLU OE2 8.656 C B 0061 HIS ND1
H B 0072 GLU OE2 6.636 C B 0061 HIS NE2
H B 0072 GLU OE1 4.843 C B 0064 LYS NZ
H B 0072 GLU OE2 6.262 C B 0064 LYS NZ
H B 0072 GLU OE1 10.20 H B 0098 ARG NH1
H B 0072 GLU OE1 9.608 H B 0098 ARG NH2
H B 0072 GLU OE2 11.11 H B 0098 ARG NH1
H B 0072 GLU OE2 10.59 H B 0098 ARG NH2
H B 0080 GLU OE1 9.159 C B 0085 ARG NH1
H B 0080 GLU OE1 9.833 C B 0085 ARG NH2
H B 0080 GLU OE2 7.414 C B 0085 ARG NH1
H B 0080 GLU OE2 8.206 C B 0085 ARG NH2
H B 0080 GLU OE1 9.860 H B 0113 ARG NH1
H B 0080 GLU OE1 8.573 H B 0113 ARG NH2
H B 0080 GLU OE2 11.04 H B 0113 ARG NH1
H B 0080 GLU OE2 9.741 H B 0113 ARG NH2
H B 0089 ASP OD1 7.559 C B 0085 ARG NH1
H B 0089 ASP OD1 8.300 C B 0085 ARG NH2
H B 0089 ASP OD2 9.705 C B 0085 ARG NH1
H B 0089 ASP OD2 10.40 C B 0085 ARG NH2
H B 0092 GLU OE1 9.698 C B 0085 ARG NH1
H B 0092 GLU OE1 10.97 C B 0085 ARG NH2
H B 0092 GLU OE2 8.829 C B 0085 ARG NH1
H B 0092 GLU OE2 10.17 C B 0085 ARG NH2
H B 0093 ASP OD1 10.60 C B 0061 HIS ND1
H B 0093 ASP OD1 10.01 C B 0061 HIS NE2
H B 0093 ASP OD2 11.60 C B 0061 HIS NE2
H B 0102 GLU OE1 8.180 C B 0064 LYS NZ
H B 0102 GLU OE2 7.032 C B 0064 LYS NZ
H B 0102 GLU OE1 11.63 H B 0098 ARG NH2
H B 0102 GLU OE2 11.21 H B 0098 ARG NH2
H B 0104 GLU OE1 8.760 C B 0064 LYS NZ
H B 0104 GLU OE2 9.198 C B 0064 LYS NZ
H B 0104 GLU OE1 10.39 H B 0098 ARG NH1
H B 0104 GLU OE1 10.23 H B 0098 ARG NH2
H B 0104 GLU OE2 9.852 H B 0098 ARG NH1
H B 0104 GLU OE2 9.644 H B 0098 ARG NH2
H B 0110 GLU OE1 3.879 H B 0113 ARG NH1
H B 0110 GLU OE1 6.096 H B 0113 ARG NH2
H B 0110 GLU OE2 2.633 H B 0113 ARG NH1
H B 0110 GLU OE2 4.690 H B 0113 ARG NH2
H B 0110 GLU OE1 5.925 H B 0117 LYS NZ
H B 0110 GLU OE2 6.212 H B 0117 LYS NZ
H B 0119 GLU OE1 2.674 H B 0122 LYS NZ
H B 0119 GLU OE2 2.632 H B 0122 LYS NZ
H B 0119 GLU OE1 10.53 C B 0123 LYS NZ
H B 0119 GLU OE2 8.826 C B 0123 LYS NZ
H B 0119 GLU OE2 11.75 C B 0126 ARG NH2
CHARGE_REPU 2.00 12.00 57
C B 0061 HIS ND1 10.43 C B 0064 LYS NZ
C B 0061 HIS NE2 8.450 C B 0064 LYS NZ
C B 0061 HIS ND1 10.66 H B 0098 ARG NH1
C B 0061 HIS ND1 10.82 H B 0098 ARG NH2
C B 0061 HIS NE2 9.415 H B 0098 ARG NH1
C B 0061 HIS NE2 9.475 H B 0098 ARG NH2
C B 0063 ASP OD1 6.268 H B 0072 GLU OE1
C B 0063 ASP OD1 6.890 H B 0072 GLU OE2
C B 0063 ASP OD2 8.424 H B 0072 GLU OE1
C B 0063 ASP OD2 9.067 H B 0072 GLU OE2
C B 0063 ASP OD1 10.80 H B 0102 GLU OE1
C B 0063 ASP OD1 9.636 H B 0102 GLU OE2
C B 0063 ASP OD2 11.81 H B 0102 GLU OE1
C B 0063 ASP OD2 10.91 H B 0102 GLU OE2
C B 0063 ASP OD1 10.99 H B 0104 GLU OE1
C B 0063 ASP OD1 11.14 H B 0104 GLU OE2
C B 0063 ASP OD2 11.50 H B 0104 GLU OE1
C B 0063 ASP OD2 11.22 H B 0104 GLU OE2
C B 0064 LYS NZ 6.474 H B 0098 ARG NH1
C B 0064 LYS NZ 5.239 H B 0098 ARG NH2
H B 0072 GLU OE1 9.127 H B 0102 GLU OE1
H B 0072 GLU OE1 7.521 H B 0102 GLU OE2
H B 0072 GLU OE2 11.29 H B 0102 GLU OE1
H B 0072 GLU OE2 9.581 H B 0102 GLU OE2
H B 0072 GLU OE1 10.54 H B 0104 GLU OE1
H B 0072 GLU OE1 11.83 H B 0104 GLU OE2
H B 0077 ASP OD1 9.755 H B 0080 GLU OE1
H B 0077 ASP OD1 10.39 H B 0080 GLU OE2
H B 0077 ASP OD2 9.645 H B 0080 GLU OE1
H B 0077 ASP OD2 9.855 H B 0080 GLU OE2
H B 0080 GLU OE1 10.75 H B 0110 GLU OE2
H B 0080 GLU OE2 11.82 H B 0110 GLU OE2
C B 0085 ARG NH1 11.81 H B 0113 ARG NH2
H B 0089 ASP OD1 4.435 H B 0092 GLU OE1
H B 0089 ASP OD1 5.457 H B 0092 GLU OE2
H B 0089 ASP OD2 4.771 H B 0092 GLU OE1
H B 0089 ASP OD2 6.470 H B 0092 GLU OE2
H B 0089 ASP OD1 10.97 H B 0093 ASP OD1
H B 0089 ASP OD1 10.08 H B 0093 ASP OD2
H B 0089 ASP OD2 10.01 H B 0093 ASP OD1
H B 0089 ASP OD2 9.185 H B 0093 ASP OD2
H B 0089 ASP OD1 11.72 H B 0119 GLU OE1
H B 0089 ASP OD2 10.21 H B 0119 GLU OE1
H B 0089 ASP OD2 10.82 H B 0119 GLU OE2
H B 0092 GLU OE1 9.499 H B 0093 ASP OD1
H B 0092 GLU OE1 9.504 H B 0093 ASP OD2
H B 0092 GLU OE2 11.02 H B 0093 ASP OD1
H B 0092 GLU OE2 11.06 H B 0093 ASP OD2
H B 0102 GLU OE1 5.223 H B 0104 GLU OE1
H B 0102 GLU OE1 6.400 H B 0104 GLU OE2
H B 0102 GLU OE2 6.789 H B 0104 GLU OE1
H B 0102 GLU OE2 7.976 H B 0104 GLU OE2
H B 0113 ARG NH1 5.165 H B 0117 LYS NZ
H B 0113 ARG NH2 6.024 H B 0117 LYS NZ
H B 0122 LYS NZ 8.313 C B 0123 LYS NZ
C B 0123 LYS NZ 11.43 C B 0126 ARG NH1
C B 0123 LYS NZ 9.185 C B 0126 ARG NH2
HB_MM 2.00 3.20 132
C B 0062 MET N 2.236 C B 0061 HIS O
C B 0063 ASP N 2.824 C B 0061 HIS O
C B 0063 ASP N 2.244 C B 0062 MET O
C B 0064 LYS N 2.237 C B 0063 ASP O
C B 0065 THR N 2.810 C B 0063 ASP O
C B 0065 THR N 2.233 C B 0064 LYS O
C B 0066 VAL N 2.236 C B 0065 THR O
C B 0067 ASN N 2.251 C B 0066 VAL O
C B 0068 LEU N 2.245 C B 0067 ASN O
H B 0069 SER N 2.244 C B 0068 LEU O
H B 0070 ALA N 2.249 H B 0069 SER O
H B 0071 CYS N 3.190 H B 0069 SER O
H B 0071 CYS N 2.239 H B 0070 ALA O
H B 0072 GLU N 2.232 H B 0071 CYS O
H B 0073 VAL N 2.878 H B 0069 SER O
H B 0073 VAL N 2.237 H B 0072 GLU O
H B 0074 ALA N 2.809 H B 0070 ALA O
H B 0074 ALA N 2.237 H B 0073 VAL O
H B 0075 VAL N 2.985 H B 0071 CYS O
H B 0075 VAL N 3.200 H B 0073 VAL O
H B 0075 VAL N 2.233 H B 0074 ALA O
H B 0076 LEU N 2.856 H B 0072 GLU O
H B 0076 LEU N 2.997 H B 0073 VAL O
H B 0076 LEU N 2.236 H B 0075 VAL O
H B 0077 ASP N 2.765 H B 0073 VAL O
H B 0077 ASP N 2.231 H B 0076 LEU O
H B 0078 LEU N 2.935 H B 0074 ALA O
H B 0078 LEU N 2.235 H B 0077 ASP O
H B 0079 TYR N 2.911 H B 0075 VAL O
H B 0079 TYR N 2.241 H B 0078 LEU O
H B 0080 GLU N 2.976 H B 0077 ASP O
H B 0080 GLU N 2.250 H B 0079 TYR O
H B 0081 GLN N 2.800 H B 0077 ASP O
H B 0081 GLN N 2.229 H B 0080 GLU O
H B 0082 SER N 2.907 H B 0078 LEU O
H B 0082 SER N 2.955 H B 0079 TYR O
H B 0082 SER N 2.236 H B 0081 GLN O
C B 0083 ASN N 2.754 H B 0079 TYR O
C B 0083 ASN N 2.902 H B 0080 GLU O
C B 0083 ASN N 2.277 H B 0082 SER O
C B 0084 ILE N 2.838 H B 0079 TYR O
C B 0084 ILE N 2.232 C B 0083 ASN O
C B 0085 ARG N 2.231 C B 0084 ILE O
C B 0086 ILE N 2.233 C B 0085 ARG O
H B 0087 PRO N 2.252 C B 0086 ILE O
H B 0088 SER N 2.246 H B 0087 PRO O
H B 0089 ASP N 3.164 H B 0087 PRO O
H B 0089 ASP N 2.232 H B 0088 SER O
H B 0090 ILE N 2.947 H B 0087 PRO O
H B 0090 ILE N 3.029 H B 0088 SER O
H B 0090 ILE N 2.243 H B 0089 ASP O
H B 0091 ILE N 2.716 H B 0088 SER O
H B 0091 ILE N 2.241 H B 0090 ILE O
H B 0092 GLU N 2.795 H B 0088 SER O
H B 0092 GLU N 2.252 H B 0091 ILE O
H B 0093 ASP N 3.094 H B 0089 ASP O
H B 0093 ASP N 3.172 H B 0091 ILE O
H B 0093 ASP N 2.246 H B 0092 GLU O
H B 0094 LEU N 2.800 H B 0090 ILE O
H B 0094 LEU N 2.256 H B 0093 ASP O
H B 0095 VAL N 2.896 H B 0091 ILE O
H B 0095 VAL N 3.120 H B 0093 ASP O
H B 0095 VAL N 2.244 H B 0094 LEU O
H B 0096 ASN N 2.948 H B 0093 ASP O
H B 0096 ASN N 2.975 H B 0094 LEU O
H B 0096 ASN N 2.235 H B 0095 VAL O
H B 0097 GLN N 2.952 H B 0094 LEU O
H B 0097 GLN N 2.263 H B 0096 ASN O
H B 0098 ARG N 3.125 H B 0096 ASN O
H B 0098 ARG N 2.254 H B 0097 GLN O
C B 0099 LEU N 2.225 H B 0098 ARG O
C B 0100 GLN N 2.242 C B 0099 LEU O
H B 0101 SER N 2.249 C B 0100 GLN O
H B 0102 GLU N 2.244 H B 0101 SER O
H B 0103 GLN N 2.234 H B 0102 GLU O
H B 0104 GLU N 3.064 H B 0101 SER O
H B 0104 GLU N 3.156 H B 0102 GLU O
H B 0104 GLU N 2.216 H B 0103 GLN O
H B 0105 VAL N 2.995 H B 0101 SER O
H B 0105 VAL N 2.246 H B 0104 GLU O
H B 0106 LEU N 2.953 H B 0102 GLU O
H B 0106 LEU N 2.237 H B 0105 VAL O
H B 0107 ASN N 2.741 H B 0103 GLN O
H B 0107 ASN N 2.235 H B 0106 LEU O
H B 0108 TYR N 3.138 H B 0105 VAL O
H B 0108 TYR N 2.248 H B 0107 ASN O
H B 0109 ILE N 2.822 H B 0105 VAL O
H B 0109 ILE N 2.239 H B 0108 TYR O
H B 0110 GLU N 2.824 H B 0106 LEU O
H B 0110 GLU N 2.224 H B 0109 ILE O
H B 0111 THR N 2.918 H B 0107 ASN O
H B 0111 THR N 2.965 H B 0108 TYR O
H B 0111 THR N 2.245 H B 0110 GLU O
H B 0112 GLN N 2.852 H B 0108 TYR O
H B 0112 GLN N 2.233 H B 0111 THR O
H B 0113 ARG N 2.739 H B 0109 ILE O
H B 0113 ARG N 2.218 H B 0112 GLN O
H B 0114 THR N 2.889 H B 0110 GLU O
H B 0114 THR N 2.806 H B 0111 THR O
H B 0114 THR N 2.234 H B 0113 ARG O
H B 0115 TYR N 2.881 H B 0111 THR O
H B 0115 TYR N 2.254 H B 0114 THR O
H B 0116 TRP N 2.860 H B 0112 GLN O
H B 0116 TRP N 2.232 H B 0115 TYR O
H B 0117 LYS N 2.947 H B 0113 ARG O
H B 0117 LYS N 2.224 H B 0116 TRP O
H B 0118 LEU N 3.062 H B 0114 THR O
H B 0118 LEU N 3.094 H B 0115 TYR O
H B 0118 LEU N 2.243 H B 0117 LYS O
H B 0119 GLU N 2.814 H B 0115 TYR O
H B 0119 GLU N 2.240 H B 0118 LEU O
H B 0120 ASN N 2.830 H B 0116 TRP O
H B 0120 ASN N 3.113 H B 0117 LYS O
H B 0120 ASN N 2.226 H B 0119 GLU O
H B 0121 GLN N 2.926 H B 0117 LYS O
H B 0121 GLN N 3.064 H B 0119 GLU O
H B 0121 GLN N 2.257 H B 0120 ASN O
H B 0122 LYS N 2.893 H B 0119 GLU O
H B 0122 LYS N 2.228 H B 0121 GLN O
C B 0123 LYS N 2.260 H B 0122 LYS O
C B 0124 LEU N 2.226 C B 0123 LYS O
C B 0125 TYR N 2.241 C B 0124 LEU O
C B 0126 ARG N 2.815 C B 0124 LEU O
C B 0126 ARG N 2.226 C B 0125 TYR O
C B 0127 GLY N 2.763 C B 0125 TYR O
C B 0127 GLY N 2.237 C B 0126 ARG O
C B 0128 SER N 2.757 C B 0126 ARG O
C B 0128 SER N 2.235 C B 0127 GLY O
C B 0129 LEU N 2.793 C B 0127 GLY O
C B 0129 LEU N 2.233 C B 0128 SER O
C B 0130 LYS N 2.803 C B 0128 SER O
C B 0130 LYS N 2.233 C B 0129 LEU O
HB_MS 2.00 3.20 23
C B 0064 LYS N 2.876 C B 0063 ASP OD1
C B 0064 LYS O 2.781 C B 0065 THR OG1
C B 0065 THR O 2.703 C B 0061 HIS NE2
C B 0065 THR N 3.097 C B 0063 ASP OD1
C B 0066 VAL O 3.122 C B 0061 HIS NE2
C B 0066 VAL N 2.776 H B 0069 SER OG
H B 0069 SER N 2.717 H B 0072 GLU OE2
H B 0082 SER O 2.736 C B 0083 ASN ND2
C B 0084 ILE N 2.883 H B 0080 GLU OE1
C B 0086 ILE O 2.833 C B 0085 ARG NH1
H B 0089 ASP N 3.169 H B 0088 SER OG
H B 0092 GLU O 2.630 H B 0096 ASN ND2
H B 0093 ASP O 2.871 H B 0096 ASN ND2
H B 0095 VAL O 2.630 C B 0061 HIS NE2
C B 0099 LEU O 2.763 C B 0064 LYS NZ
H B 0102 GLU N 2.826 H B 0101 SER OG
H B 0103 GLN N 3.119 H B 0104 GLU OE1
H B 0103 GLN O 3.061 H B 0107 ASN ND2
H B 0107 ASN O 2.839 H B 0111 THR OG1
H B 0110 GLU O 2.778 H B 0114 THR OG1
H B 0116 TRP O 2.777 H B 0120 ASN ND2
H B 0118 LEU O 2.886 H B 0121 GLN NE2
C B 0124 LEU O 2.738 C B 0126 ARG NH2
HB_SS 2.00 3.20 14
C B 0064 LYS NZ 2.660 C B 0065 THR OG1
H B 0072 GLU OE1 2.765 C B 0065 THR OG1
H B 0072 GLU OE2 2.733 H B 0069 SER OG
H B 0077 ASP OD1 2.692 H B 0081 GLN NE2
H B 0093 ASP OD1 2.724 H B 0097 GLN NE2
H B 0093 ASP OD1 3.001 H B 0108 TYR OH
H B 0093 ASP OD2 2.710 H B 0108 TYR OH
H B 0093 ASP OD2 2.761 H B 0112 GLN NE2
H B 0098 ARG NH1 2.758 C B 0100 GLN OE1
H B 0098 ARG NH2 2.744 C B 0100 GLN OE1
H B 0102 GLU OE1 2.604 H B 0101 SER OG
H B 0103 GLN NE2 2.923 H B 0107 ASN OD1
H B 0117 LYS NZ 2.694 H B 0114 THR OG1
H B 0119 GLU OE1 2.783 H B 0115 TYR OH
AROMATIC 0.00 8.00 3
H B 0122 LYS 6.635 H B 0115 TYR
C B 0123 LYS 5.613 C B 0125 TYR
H B 0113 ARG 6.276 H B 0079 TYR