Complet list of 2ezk con file
Complete list of 2ezk.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 369
C A 0076 MET CA 3.764 C A 0077 ILE CA
C A 0076 MET C 2.368 C A 0077 ILE CA
C A 0076 MET C 2.762 C A 0077 ILE C
C A 0076 MET C 3.718 C A 0077 ILE CB
C A 0077 ILE CA 3.755 C A 0078 ALA CA
C A 0077 ILE C 2.385 C A 0078 ALA CA
C A 0077 ILE C 2.824 C A 0078 ALA C
C A 0077 ILE C 3.644 C A 0078 ALA CB
C A 0077 ILE CG2 3.733 H A 0093 TRP CZ3
C A 0077 ILE CG2 3.341 H A 0093 TRP CH2
C A 0077 ILE CD1 3.259 H A 0096 TRP CZ2
C A 0077 ILE CD1 3.551 H A 0096 TRP CZ3
C A 0077 ILE CD1 2.958 H A 0096 TRP CH2
C A 0077 ILE CG1 3.751 H A 0161 ALA CB
C A 0077 ILE CD1 3.319 H A 0161 ALA CB
C A 0078 ALA CA 3.744 C A 0079 ARG CA
C A 0078 ALA C 2.369 C A 0079 ARG CA
C A 0078 ALA C 3.391 C A 0079 ARG C
C A 0078 ALA C 3.186 C A 0079 ARG CB
C A 0078 ALA C 3.186 C A 0079 ARG CG
C A 0078 ALA CB 3.780 C A 0079 ARG CZ
C A 0079 ARG CA 3.724 C A 0080 PRO CA
C A 0079 ARG CA 2.995 C A 0080 PRO CD
C A 0079 ARG C 2.352 C A 0080 PRO CA
C A 0079 ARG C 3.337 C A 0080 PRO C
C A 0079 ARG C 3.356 C A 0080 PRO CB
C A 0079 ARG C 3.581 C A 0080 PRO CG
C A 0079 ARG C 2.501 C A 0080 PRO CD
C A 0079 ARG CB 3.781 C A 0080 PRO CD
C A 0080 PRO CA 3.629 C A 0081 THR CA
C A 0080 PRO C 2.360 C A 0081 THR CA
C A 0080 PRO C 3.016 C A 0081 THR C
C A 0080 PRO C 3.502 C A 0081 THR CB
C A 0080 PRO CG 3.650 C A 0082 LEU CD2
C A 0081 THR C 2.409 C A 0082 LEU CA
C A 0081 THR C 2.992 C A 0082 LEU C
C A 0081 THR C 3.717 C A 0082 LEU CB
C A 0081 THR CG2 3.443 C A 0083 GLU CB
C A 0082 LEU C 2.451 C A 0083 GLU CA
C A 0082 LEU C 3.581 C A 0083 GLU C
C A 0082 LEU C 3.364 C A 0083 GLU CB
C A 0082 LEU CA 3.597 C A 0085 HIS CE1
C A 0082 LEU C 2.945 C A 0085 HIS CE1
C A 0082 LEU CD2 3.473 C A 0089 ARG CD
C A 0083 GLU C 2.450 C A 0084 ALA CA
C A 0083 GLU C 3.337 C A 0084 ALA C
C A 0083 GLU C 3.630 C A 0084 ALA CB
C A 0083 GLU CA 3.289 C A 0085 HIS CE1
C A 0083 GLU C 3.093 C A 0085 HIS CE1
C A 0084 ALA C 2.414 C A 0085 HIS CA
C A 0084 ALA C 3.698 C A 0085 HIS C
C A 0084 ALA C 2.985 C A 0085 HIS CB
C A 0084 ALA C 2.810 C A 0085 HIS CG
C A 0084 ALA C 3.114 C A 0085 HIS CD2
C A 0085 HIS C 2.428 C A 0086 ASP CA
C A 0085 HIS C 3.105 C A 0086 ASP C
C A 0085 HIS C 3.664 C A 0086 ASP CB
C A 0085 HIS CB 3.629 C A 0087 TYR CD1
C A 0085 HIS CB 3.292 C A 0087 TYR CE1
C A 0085 HIS CB 3.469 C A 0089 ARG CZ
C A 0085 HIS CG 2.828 C A 0089 ARG CZ
C A 0085 HIS CD2 3.183 C A 0089 ARG CZ
C A 0085 HIS CE1 3.043 C A 0089 ARG CZ
C A 0086 ASP C 2.449 C A 0087 TYR CA
C A 0086 ASP C 3.533 C A 0087 TYR C
C A 0086 ASP C 3.434 C A 0087 TYR CB
C A 0087 TYR C 2.432 C A 0088 ASP CA
C A 0087 TYR C 3.164 C A 0088 ASP C
C A 0087 TYR C 3.668 C A 0088 ASP CB
C A 0087 TYR CE2 3.398 C A 0089 ARG CG
C A 0088 ASP CA 3.714 C A 0089 ARG CZ
C A 0088 ASP C 2.443 C A 0089 ARG CA
C A 0088 ASP C 3.201 C A 0089 ARG C
C A 0088 ASP C 3.707 C A 0089 ARG CB
C A 0089 ARG C 2.425 H A 0090 GLU CA
C A 0089 ARG C 2.745 H A 0090 GLU C
C A 0089 ARG C 3.752 H A 0090 GLU CB
C A 0089 ARG CB 3.305 H A 0093 TRP CD1
H A 0090 GLU CA 3.792 H A 0091 ALA CA
H A 0090 GLU C 2.415 H A 0091 ALA CA
H A 0090 GLU C 2.947 H A 0091 ALA C
H A 0090 GLU C 3.679 H A 0091 ALA CB
H A 0091 ALA C 2.434 H A 0092 LEU CA
H A 0091 ALA C 3.025 H A 0092 LEU C
H A 0091 ALA C 3.704 H A 0092 LEU CB
H A 0092 LEU C 2.435 H A 0093 TRP CA
H A 0092 LEU C 3.080 H A 0093 TRP C
H A 0092 LEU C 3.749 H A 0093 TRP CB
H A 0093 TRP C 2.431 H A 0094 SER CA
H A 0093 TRP C 2.875 H A 0094 SER C
H A 0093 TRP C 3.771 H A 0094 SER CB
H A 0093 TRP CE3 3.756 H A 0096 TRP CB
H A 0094 SER CA 3.777 H A 0095 LYS CA
H A 0094 SER C 2.414 H A 0095 LYS CA
H A 0094 SER C 2.923 H A 0095 LYS C
H A 0094 SER C 3.647 H A 0095 LYS CB
H A 0095 LYS C 2.426 H A 0096 TRP CA
H A 0095 LYS C 2.988 H A 0096 TRP C
H A 0095 LYS C 3.700 H A 0096 TRP CB
H A 0096 TRP C 2.419 H A 0097 ASP CA
H A 0096 TRP C 2.947 H A 0097 ASP C
H A 0096 TRP C 3.691 H A 0097 ASP CB
H A 0096 TRP CD1 3.665 H A 0097 ASP CA
H A 0096 TRP CD2 3.722 H A 0104 ARG CG
H A 0096 TRP CE2 3.367 H A 0104 ARG CG
H A 0096 TRP CE2 3.101 H A 0104 ARG CD
H A 0096 TRP CZ2 3.466 H A 0104 ARG CB
H A 0096 TRP CZ2 3.245 H A 0104 ARG CG
H A 0096 TRP CZ2 3.212 H A 0104 ARG CD
H A 0096 TRP CH2 3.699 H A 0104 ARG CA
H A 0096 TRP CH2 3.396 H A 0104 ARG CB
H A 0096 TRP CH2 3.480 H A 0104 ARG CG
H A 0096 TRP CE3 3.324 H A 0165 VAL CG2
H A 0096 TRP CZ3 3.611 H A 0165 VAL CG2
H A 0097 ASP C 2.426 H A 0098 ASN CA
H A 0097 ASP C 3.201 H A 0098 ASN C
H A 0097 ASP C 3.654 H A 0098 ASN CB
H A 0098 ASN C 2.423 C A 0099 ALA CA
H A 0098 ASN C 3.040 C A 0099 ALA C
H A 0098 ASN C 3.707 C A 0099 ALA CB
C A 0099 ALA C 2.430 C A 0100 SER CA
C A 0099 ALA C 3.093 C A 0100 SER C
C A 0099 ALA C 3.684 C A 0100 SER CB
C A 0100 SER C 2.430 H A 0101 ASP CA
C A 0100 SER C 2.968 H A 0101 ASP C
C A 0100 SER C 3.699 H A 0101 ASP CB
H A 0101 ASP C 2.422 H A 0102 SER CA
H A 0101 ASP C 2.987 H A 0102 SER C
H A 0101 ASP C 3.697 H A 0102 SER CB
H A 0102 SER C 2.424 H A 0103 GLN CA
H A 0102 SER C 3.061 H A 0103 GLN C
H A 0102 SER C 3.691 H A 0103 GLN CB
H A 0103 GLN C 2.422 H A 0104 ARG CA
H A 0103 GLN C 2.972 H A 0104 ARG C
H A 0103 GLN C 3.704 H A 0104 ARG CB
H A 0104 ARG C 2.433 H A 0105 ARG CA
H A 0104 ARG C 2.970 H A 0105 ARG C
H A 0104 ARG C 3.657 H A 0105 ARG CB
H A 0105 ARG C 2.435 H A 0106 LEU CA
H A 0105 ARG C 2.958 H A 0106 LEU C
H A 0105 ARG C 3.710 H A 0106 LEU CB
H A 0106 LEU C 2.423 H A 0107 ALA CA
H A 0106 LEU C 2.955 H A 0107 ALA C
H A 0106 LEU C 3.696 H A 0107 ALA CB
H A 0106 LEU CD1 3.743 H A 0110 TRP CD1
H A 0107 ALA C 2.419 H A 0108 GLU CA
H A 0107 ALA C 2.968 H A 0108 GLU C
H A 0107 ALA C 3.699 H A 0108 GLU CB
H A 0107 ALA CB 3.668 H A 0164 LEU CB
H A 0108 GLU C 2.425 H A 0109 LYS CA
H A 0108 GLU C 3.026 H A 0109 LYS C
H A 0108 GLU C 3.704 H A 0109 LYS CB
H A 0109 LYS C 2.428 H A 0110 TRP CA
H A 0109 LYS C 3.194 H A 0110 TRP C
H A 0109 LYS C 3.665 H A 0110 TRP CB
H A 0109 LYS C 3.625 H A 0112 PRO CD
H A 0110 TRP C 2.415 H A 0111 LEU CA
H A 0110 TRP C 3.119 H A 0111 LEU C
H A 0110 TRP C 3.689 H A 0111 LEU CB
H A 0110 TRP C 3.672 H A 0112 PRO CD
H A 0110 TRP CH2 3.685 C A 0140 VAL CB
H A 0110 TRP CH2 3.604 H A 0144 THR CG2
H A 0111 LEU CA 3.037 H A 0112 PRO CD
H A 0111 LEU C 2.457 H A 0112 PRO CA
H A 0111 LEU C 3.104 H A 0112 PRO C
H A 0111 LEU C 3.664 H A 0112 PRO CB
H A 0111 LEU C 3.653 H A 0112 PRO CG
H A 0111 LEU C 2.520 H A 0112 PRO CD
H A 0111 LEU CB 3.424 H A 0112 PRO CD
H A 0112 PRO C 2.421 H A 0113 ALA CA
H A 0112 PRO C 3.113 H A 0113 ALA C
H A 0112 PRO C 3.678 H A 0113 ALA CB
H A 0113 ALA C 2.422 H A 0114 VAL CA
H A 0113 ALA C 3.016 H A 0114 VAL C
H A 0113 ALA C 3.696 H A 0114 VAL CB
H A 0114 VAL C 2.421 H A 0115 GLN CA
H A 0114 VAL C 3.033 H A 0115 GLN C
H A 0114 VAL C 3.685 H A 0115 GLN CB
H A 0114 VAL CG2 3.619 H A 0145 LEU CD1
H A 0114 VAL CG1 3.578 H A 0149 TYR CD2
H A 0114 VAL CG1 3.426 H A 0160 TRP CZ3
H A 0115 GLN C 2.422 H A 0116 ALA CA
H A 0115 GLN C 2.985 H A 0116 ALA C
H A 0115 GLN C 3.698 H A 0116 ALA CB
H A 0116 ALA C 2.425 H A 0117 ALA CA
H A 0116 ALA C 2.973 H A 0117 ALA C
H A 0116 ALA C 3.696 H A 0117 ALA CB
H A 0117 ALA C 2.420 H A 0118 ASP CA
H A 0117 ALA C 2.959 H A 0118 ASP C
H A 0117 ALA C 3.694 H A 0118 ASP CB
H A 0118 ASP C 2.422 H A 0119 GLU CA
H A 0118 ASP C 2.982 H A 0119 GLU C
H A 0118 ASP C 3.716 H A 0119 GLU CB
H A 0119 GLU C 2.419 H A 0120 MET CA
H A 0119 GLU C 3.050 H A 0120 MET C
H A 0119 GLU C 3.692 H A 0120 MET CB
H A 0120 MET C 2.416 H A 0121 LEU CA
H A 0120 MET C 2.985 H A 0121 LEU C
H A 0120 MET C 3.699 H A 0121 LEU CB
H A 0121 LEU C 2.424 H A 0122 ASN CA
H A 0121 LEU C 2.961 H A 0122 ASN C
H A 0121 LEU C 3.689 H A 0122 ASN CB
H A 0121 LEU CD1 3.757 H A 0149 TYR CZ
H A 0122 ASN C 2.422 C A 0123 GLN CA
H A 0122 ASN C 3.102 C A 0123 GLN C
H A 0122 ASN C 3.673 C A 0123 GLN CB
C A 0123 GLN C 2.433 C A 0124 GLY CA
C A 0123 GLN C 3.109 C A 0124 GLY C
C A 0124 GLY C 2.421 C A 0125 ILE CA
C A 0124 GLY C 3.109 C A 0125 ILE C
C A 0124 GLY C 3.679 C A 0125 ILE CB
C A 0125 ILE C 2.425 C A 0126 SER CA
C A 0125 ILE C 2.894 C A 0126 SER C
C A 0125 ILE C 3.691 C A 0126 SER CB
C A 0126 SER C 2.419 H A 0127 THR CA
C A 0126 SER C 2.960 H A 0127 THR C
C A 0126 SER C 3.696 H A 0127 THR CB
H A 0127 THR C 2.414 H A 0128 LYS CA
H A 0127 THR C 2.924 H A 0128 LYS C
H A 0127 THR C 3.700 H A 0128 LYS CB
H A 0127 THR C 3.667 H A 0131 PHE CD2
H A 0128 LYS C 2.416 H A 0129 THR CA
H A 0128 LYS C 2.988 H A 0129 THR C
H A 0128 LYS C 3.677 H A 0129 THR CB
H A 0129 THR C 2.418 H A 0130 ALA CA
H A 0129 THR C 2.969 H A 0130 ALA C
H A 0129 THR C 3.691 H A 0130 ALA CB
H A 0130 ALA C 2.423 H A 0131 PHE CA
H A 0130 ALA C 3.055 H A 0131 PHE C
H A 0130 ALA C 3.703 H A 0131 PHE CB
H A 0131 PHE C 2.418 H A 0132 ALA CA
H A 0131 PHE C 2.954 H A 0132 ALA C
H A 0131 PHE C 3.697 H A 0132 ALA CB
H A 0132 ALA C 2.421 H A 0133 THR CA
H A 0132 ALA C 2.966 H A 0133 THR C
H A 0132 ALA C 3.697 H A 0133 THR CB
H A 0133 THR C 2.425 H A 0134 VAL CA
H A 0133 THR C 3.000 H A 0134 VAL C
H A 0133 THR C 3.693 H A 0134 VAL CB
H A 0133 THR CG2 3.573 H A 0137 HIS CD2
H A 0134 VAL C 2.422 H A 0135 ALA CA
H A 0134 VAL C 2.996 H A 0135 ALA C
H A 0134 VAL C 3.695 H A 0135 ALA CB
H A 0134 VAL CG1 3.497 H A 0145 LEU CD2
H A 0135 ALA C 2.414 H A 0136 GLY CA
H A 0135 ALA C 3.027 H A 0136 GLY C
H A 0136 GLY C 2.421 H A 0137 HIS CA
H A 0136 GLY C 3.058 H A 0137 HIS C
H A 0136 GLY C 3.689 H A 0137 HIS CB
H A 0137 HIS C 2.445 C A 0138 TYR CA
H A 0137 HIS C 3.341 C A 0138 TYR C
H A 0137 HIS C 3.599 C A 0138 TYR CB
H A 0137 HIS C 3.787 C A 0138 TYR CG
H A 0137 HIS C 3.774 C A 0138 TYR CD1
H A 0137 HIS CB 3.791 C A 0138 TYR CD1
C A 0138 TYR C 2.424 C A 0139 GLN CA
C A 0138 TYR C 3.176 C A 0139 GLN C
C A 0138 TYR C 3.660 C A 0139 GLN CB
C A 0139 GLN C 2.439 C A 0140 VAL CA
C A 0139 GLN C 3.542 C A 0140 VAL C
C A 0139 GLN C 3.402 C A 0140 VAL CB
C A 0139 GLN C 3.330 C A 0140 VAL CG1
C A 0140 VAL C 2.418 C A 0141 SER CA
C A 0140 VAL C 3.063 C A 0141 SER C
C A 0140 VAL C 3.686 C A 0141 SER CB
C A 0141 SER C 2.416 H A 0142 ALA CA
C A 0141 SER C 2.933 H A 0142 ALA C
C A 0141 SER C 3.698 H A 0142 ALA CB
C A 0141 SER CB 3.722 H A 0144 THR CB
H A 0142 ALA C 2.428 H A 0143 SER CA
H A 0142 ALA C 3.021 H A 0143 SER C
H A 0142 ALA C 3.697 H A 0143 SER CB
H A 0143 SER C 2.417 H A 0144 THR CA
H A 0143 SER C 2.993 H A 0144 THR C
H A 0143 SER C 3.690 H A 0144 THR CB
H A 0144 THR C 2.414 H A 0145 LEU CA
H A 0144 THR C 2.974 H A 0145 LEU C
H A 0144 THR C 3.702 H A 0145 LEU CB
H A 0144 THR CG2 3.436 H A 0148 LYS CE
H A 0145 LEU C 2.404 H A 0146 ARG CA
H A 0145 LEU C 2.964 H A 0146 ARG C
H A 0145 LEU C 3.717 H A 0146 ARG CB
H A 0146 ARG C 2.423 H A 0147 ASP CA
H A 0146 ARG C 2.964 H A 0147 ASP C
H A 0146 ARG C 3.714 H A 0147 ASP CB
H A 0146 ARG CG 3.581 H A 0150 TYR CE2
H A 0147 ASP C 2.420 H A 0148 LYS CA
H A 0147 ASP C 3.070 H A 0148 LYS C
H A 0147 ASP C 3.675 H A 0148 LYS CB
H A 0148 LYS C 2.420 H A 0149 TYR CA
H A 0148 LYS C 2.962 H A 0149 TYR C
H A 0148 LYS C 3.701 H A 0149 TYR CB
H A 0149 TYR C 2.416 H A 0150 TYR CA
H A 0149 TYR C 3.042 H A 0150 TYR C
H A 0149 TYR C 3.694 H A 0150 TYR CB
H A 0150 TYR C 2.429 H A 0151 GLN CA
H A 0150 TYR C 3.042 H A 0151 GLN C
H A 0150 TYR C 3.696 H A 0151 GLN CB
H A 0151 GLN C 2.428 H A 0152 VAL CA
H A 0151 GLN C 3.150 H A 0152 VAL C
H A 0151 GLN C 3.687 H A 0152 VAL CB
H A 0152 VAL C 2.421 H A 0153 GLN CA
H A 0152 VAL C 2.969 H A 0153 GLN C
H A 0152 VAL C 3.670 H A 0153 GLN CB
H A 0152 VAL CB 3.783 H A 0160 TRP CD1
H A 0152 VAL CB 3.765 H A 0160 TRP CD2
H A 0152 VAL CB 3.492 H A 0160 TRP CE2
H A 0152 VAL CG2 3.556 H A 0160 TRP CE2
H A 0152 VAL CG2 3.526 H A 0160 TRP CZ2
H A 0153 GLN C 2.424 H A 0154 LYS CA
H A 0153 GLN C 3.135 H A 0154 LYS C
H A 0153 GLN C 3.676 H A 0154 LYS CB
H A 0154 LYS C 2.431 C A 0155 PHE CA
H A 0154 LYS C 3.334 C A 0155 PHE C
H A 0154 LYS C 3.579 C A 0155 PHE CB
H A 0154 LYS C 3.774 C A 0155 PHE CG
C A 0155 PHE C 2.414 C A 0156 ALA CA
C A 0155 PHE C 2.904 C A 0156 ALA C
C A 0155 PHE C 3.698 C A 0156 ALA CB
C A 0156 ALA C 2.414 H A 0157 LYS CA
C A 0156 ALA C 2.924 H A 0157 LYS C
C A 0156 ALA C 3.693 H A 0157 LYS CB
C A 0156 ALA C 3.349 H A 0158 PRO CD
C A 0156 ALA C 3.791 H A 0159 ASP CG
C A 0156 ALA CB 3.489 H A 0159 ASP CG
C A 0156 ALA C 3.543 H A 0160 TRP CD1
H A 0157 LYS CA 3.025 H A 0158 PRO CD
H A 0157 LYS C 2.444 H A 0158 PRO CA
H A 0157 LYS C 2.984 H A 0158 PRO C
H A 0157 LYS C 3.682 H A 0158 PRO CB
H A 0157 LYS C 3.692 H A 0158 PRO CG
H A 0157 LYS C 2.517 H A 0158 PRO CD
H A 0157 LYS CB 3.370 H A 0158 PRO CD
H A 0157 LYS CA 3.593 H A 0160 TRP CG
H A 0157 LYS CA 3.481 H A 0160 TRP CD1
H A 0157 LYS CA 3.752 H A 0160 TRP CD2
H A 0157 LYS CA 3.762 H A 0160 TRP CE2
H A 0157 LYS CG 3.770 H A 0160 TRP CE2
H A 0157 LYS CG 3.710 H A 0160 TRP CZ2
H A 0158 PRO C 2.438 H A 0159 ASP CA
H A 0158 PRO C 3.240 H A 0159 ASP C
H A 0158 PRO C 3.685 H A 0159 ASP CB
H A 0159 ASP C 2.423 H A 0160 TRP CA
H A 0159 ASP C 2.924 H A 0160 TRP C
H A 0159 ASP C 3.715 H A 0160 TRP CB
H A 0160 TRP C 2.401 H A 0161 ALA CA
H A 0160 TRP C 2.941 H A 0161 ALA C
H A 0160 TRP C 3.672 H A 0161 ALA CB
H A 0161 ALA C 2.424 H A 0162 ALA CA
H A 0161 ALA C 3.073 H A 0162 ALA C
H A 0161 ALA C 3.688 H A 0162 ALA CB
H A 0162 ALA C 2.429 H A 0163 ALA CA
H A 0162 ALA C 2.988 H A 0163 ALA C
H A 0162 ALA C 3.701 H A 0163 ALA CB
H A 0163 ALA C 2.423 H A 0164 LEU CA
H A 0163 ALA C 3.039 H A 0164 LEU C
H A 0163 ALA C 3.703 H A 0164 LEU CB
H A 0164 LEU C 2.424 H A 0165 VAL CA
H A 0164 LEU C 2.962 H A 0165 VAL C
H A 0164 LEU C 3.720 H A 0165 VAL CB
H A 0165 VAL CA 3.795 C A 0166 ASP CA
H A 0165 VAL C 2.408 C A 0166 ASP CA
H A 0165 VAL C 3.137 C A 0166 ASP C
H A 0165 VAL C 3.650 C A 0166 ASP CB
C A 0166 ASP C 2.433 C A 0167 GLY CA
C A 0166 ASP C 3.252 C A 0167 GLY C
C A 0167 GLY C 2.423 C A 0168 ARG CA
C A 0167 GLY C 3.198 C A 0168 ARG C
C A 0167 GLY C 3.666 C A 0168 ARG CB
CHARGE_ATTR 2.00 12.00 83
C A 0083 GLU OE1 8.189 C A 0085 HIS ND1
C A 0083 GLU OE1 6.944 C A 0085 HIS NE2
C A 0083 GLU OE2 8.976 C A 0085 HIS ND1
C A 0083 GLU OE2 8.118 C A 0085 HIS NE2
C A 0083 GLU OE1 9.578 C A 0089 ARG NH1
C A 0083 GLU OE1 10.31 C A 0089 ARG NH2
C A 0083 GLU OE2 10.55 C A 0089 ARG NH1
C A 0083 GLU OE2 11.07 C A 0089 ARG NH2
C A 0086 ASP OD1 7.626 C A 0085 HIS ND1
C A 0086 ASP OD1 9.571 C A 0085 HIS NE2
C A 0086 ASP OD2 8.192 C A 0085 HIS ND1
C A 0086 ASP OD2 9.928 C A 0085 HIS NE2
C A 0086 ASP OD1 10.21 C A 0089 ARG NH1
C A 0086 ASP OD1 8.153 C A 0089 ARG NH2
C A 0086 ASP OD2 10.71 C A 0089 ARG NH1
C A 0086 ASP OD2 8.731 C A 0089 ARG NH2
C A 0088 ASP OD1 7.907 C A 0085 HIS ND1
C A 0088 ASP OD1 9.511 C A 0085 HIS NE2
C A 0088 ASP OD2 8.973 C A 0085 HIS ND1
C A 0088 ASP OD2 10.24 C A 0085 HIS NE2
C A 0088 ASP OD1 7.225 C A 0089 ARG NH1
C A 0088 ASP OD1 5.794 C A 0089 ARG NH2
C A 0088 ASP OD2 7.583 C A 0089 ARG NH1
C A 0088 ASP OD2 6.736 C A 0089 ARG NH2
H A 0090 GLU OE1 10.20 C A 0085 HIS ND1
H A 0090 GLU OE1 10.48 C A 0085 HIS NE2
H A 0090 GLU OE2 8.395 C A 0085 HIS ND1
H A 0090 GLU OE2 8.588 C A 0085 HIS NE2
H A 0090 GLU OE1 7.785 C A 0089 ARG NH1
H A 0090 GLU OE1 8.482 C A 0089 ARG NH2
H A 0090 GLU OE2 6.092 C A 0089 ARG NH1
H A 0090 GLU OE2 6.947 C A 0089 ARG NH2
H A 0097 ASP OD1 5.284 H A 0104 ARG NH1
H A 0097 ASP OD1 6.262 H A 0104 ARG NH2
H A 0097 ASP OD2 7.368 H A 0104 ARG NH1
H A 0097 ASP OD2 8.414 H A 0104 ARG NH2
H A 0101 ASP OD1 6.829 H A 0104 ARG NH1
H A 0101 ASP OD1 4.575 H A 0104 ARG NH2
H A 0101 ASP OD2 5.265 H A 0104 ARG NH1
H A 0101 ASP OD2 3.106 H A 0104 ARG NH2
H A 0101 ASP OD1 10.31 H A 0105 ARG NH1
H A 0101 ASP OD1 9.447 H A 0105 ARG NH2
H A 0101 ASP OD2 9.592 H A 0105 ARG NH1
H A 0101 ASP OD2 8.942 H A 0105 ARG NH2
H A 0108 GLU OE1 9.224 H A 0104 ARG NH1
H A 0108 GLU OE1 9.588 H A 0104 ARG NH2
H A 0108 GLU OE2 10.60 H A 0104 ARG NH1
H A 0108 GLU OE2 11.22 H A 0104 ARG NH2
H A 0108 GLU OE1 5.762 H A 0105 ARG NH1
H A 0108 GLU OE1 7.598 H A 0105 ARG NH2
H A 0108 GLU OE2 7.163 H A 0105 ARG NH1
H A 0108 GLU OE2 9.022 H A 0105 ARG NH2
H A 0108 GLU OE1 10.87 H A 0109 LYS NZ
H A 0108 GLU OE2 11.58 H A 0109 LYS NZ
H A 0118 ASP OD1 5.813 H A 0157 LYS NZ
H A 0118 ASP OD2 3.945 H A 0157 LYS NZ
H A 0119 GLU OE1 11.44 H A 0137 HIS NE2
H A 0119 GLU OE1 10.76 H A 0157 LYS NZ
H A 0119 GLU OE2 9.789 H A 0157 LYS NZ
H A 0147 ASP OD1 6.636 H A 0146 ARG NH1
H A 0147 ASP OD1 7.259 H A 0146 ARG NH2
H A 0147 ASP OD2 8.477 H A 0146 ARG NH1
H A 0147 ASP OD2 8.763 H A 0146 ARG NH2
H A 0147 ASP OD1 9.787 H A 0148 LYS NZ
H A 0147 ASP OD2 8.713 H A 0148 LYS NZ
H A 0159 ASP OD1 8.721 C A 0085 HIS ND1
H A 0159 ASP OD1 8.003 C A 0085 HIS NE2
H A 0159 ASP OD2 9.956 C A 0085 HIS ND1
H A 0159 ASP OD2 9.609 C A 0085 HIS NE2
H A 0159 ASP OD1 8.210 C A 0089 ARG NH1
H A 0159 ASP OD1 8.636 C A 0089 ARG NH2
H A 0159 ASP OD2 9.688 C A 0089 ARG NH1
H A 0159 ASP OD2 9.712 C A 0089 ARG NH2
H A 0159 ASP OD1 11.26 H A 0157 LYS NZ
H A 0159 ASP OD2 10.98 H A 0157 LYS NZ
C A 0166 ASP OD1 6.448 H A 0095 LYS NZ
C A 0166 ASP OD2 6.081 H A 0095 LYS NZ
C A 0166 ASP OD1 10.22 H A 0148 LYS NZ
C A 0166 ASP OD2 11.49 H A 0148 LYS NZ
C A 0166 ASP OD1 4.245 C A 0168 ARG NH1
C A 0166 ASP OD1 6.148 C A 0168 ARG NH2
C A 0166 ASP OD2 5.210 C A 0168 ARG NH1
C A 0166 ASP OD2 6.542 C A 0168 ARG NH2
CHARGE_REPU 2.00 12.00 39
C A 0079 ARG NH1 11.88 H A 0104 ARG NH1
C A 0085 HIS ND1 3.068 C A 0089 ARG NH1
C A 0085 HIS ND1 2.320 C A 0089 ARG NH2
C A 0085 HIS NE2 2.952 C A 0089 ARG NH1
C A 0085 HIS NE2 3.737 C A 0089 ARG NH2
C A 0086 ASP OD1 9.666 C A 0088 ASP OD1
C A 0086 ASP OD1 11.73 C A 0088 ASP OD2
C A 0086 ASP OD2 10.47 C A 0088 ASP OD1
C A 0086 ASP OD2 11.99 H A 0159 ASP OD1
C A 0086 ASP OD2 11.77 H A 0159 ASP OD2
C A 0088 ASP OD1 7.537 H A 0090 GLU OE1
C A 0088 ASP OD1 7.341 H A 0090 GLU OE2
C A 0088 ASP OD2 5.859 H A 0090 GLU OE1
C A 0088 ASP OD2 6.175 H A 0090 GLU OE2
H A 0090 GLU OE1 11.30 H A 0097 ASP OD2
H A 0095 LYS NZ 9.476 C A 0168 ARG NH1
H A 0095 LYS NZ 11.00 C A 0168 ARG NH2
H A 0097 ASP OD1 9.751 H A 0101 ASP OD1
H A 0097 ASP OD1 8.893 H A 0101 ASP OD2
H A 0097 ASP OD2 11.74 H A 0101 ASP OD1
H A 0097 ASP OD2 10.99 H A 0101 ASP OD2
H A 0101 ASP OD1 11.52 H A 0108 GLU OE1
H A 0101 ASP OD2 10.09 H A 0108 GLU OE1
H A 0101 ASP OD2 11.86 H A 0108 GLU OE2
H A 0104 ARG NH1 11.65 H A 0105 ARG NH1
H A 0104 ARG NH1 11.95 H A 0105 ARG NH2
H A 0104 ARG NH2 10.82 H A 0105 ARG NH1
H A 0104 ARG NH2 10.76 H A 0105 ARG NH2
H A 0105 ARG NH1 8.907 H A 0109 LYS NZ
H A 0105 ARG NH2 10.44 H A 0109 LYS NZ
H A 0109 LYS NZ 11.75 H A 0148 LYS NZ
H A 0118 ASP OD1 8.302 H A 0119 GLU OE1
H A 0118 ASP OD1 8.341 H A 0119 GLU OE2
H A 0118 ASP OD2 8.248 H A 0119 GLU OE1
H A 0118 ASP OD2 7.951 H A 0119 GLU OE2
H A 0128 LYS NZ 7.931 H A 0146 ARG NH1
H A 0128 LYS NZ 7.085 H A 0146 ARG NH2
H A 0148 LYS NZ 11.12 C A 0168 ARG NH1
H A 0159 ASP OD2 11.94 C A 0166 ASP OD2
HB_MM 2.00 3.20 167
C A 0077 ILE N 2.199 C A 0076 MET O
C A 0078 ALA N 2.365 C A 0076 MET O
C A 0078 ALA N 2.180 C A 0077 ILE O
C A 0079 ARG N 2.131 C A 0078 ALA O
C A 0080 PRO N 2.158 C A 0079 ARG O
C A 0081 THR N 2.191 C A 0080 PRO O
C A 0082 LEU N 2.984 C A 0080 PRO O
C A 0082 LEU N 2.199 C A 0081 THR O
C A 0083 GLU N 2.542 C A 0081 THR O
C A 0083 GLU N 2.216 C A 0082 LEU O
C A 0084 ALA N 2.204 C A 0083 GLU O
C A 0085 HIS N 2.190 C A 0084 ALA O
C A 0086 ASP N 2.198 C A 0085 HIS O
C A 0087 TYR N 3.177 C A 0085 HIS O
C A 0087 TYR N 2.204 C A 0086 ASP O
C A 0088 ASP N 2.198 C A 0087 TYR O
C A 0089 ARG N 2.204 C A 0088 ASP O
H A 0090 GLU N 2.209 C A 0089 ARG O
H A 0091 ALA N 2.747 C A 0089 ARG O
H A 0091 ALA N 2.190 H A 0090 GLU O
H A 0092 LEU N 2.418 C A 0089 ARG O
H A 0092 LEU N 2.201 H A 0091 ALA O
H A 0093 TRP N 2.441 C A 0089 ARG O
H A 0093 TRP N 2.202 H A 0092 LEU O
H A 0094 SER N 2.459 H A 0090 GLU O
H A 0094 SER N 2.200 H A 0093 TRP O
H A 0095 LYS N 3.142 H A 0091 ALA O
H A 0095 LYS N 3.084 H A 0093 TRP O
H A 0095 LYS N 2.200 H A 0094 SER O
H A 0096 TRP N 2.857 H A 0093 TRP O
H A 0096 TRP N 2.201 H A 0095 LYS O
H A 0097 ASP N 2.784 H A 0093 TRP O
H A 0097 ASP N 3.132 H A 0094 SER O
H A 0097 ASP N 2.187 H A 0096 TRP O
H A 0098 ASN N 2.836 H A 0094 SER O
H A 0098 ASN N 3.198 H A 0096 TRP O
H A 0098 ASN N 2.196 H A 0097 ASP O
C A 0099 ALA N 2.845 H A 0095 LYS O
C A 0099 ALA N 2.923 H A 0096 TRP O
C A 0099 ALA N 2.194 H A 0098 ASN O
C A 0100 SER N 2.199 C A 0099 ALA O
H A 0101 ASP N 2.199 C A 0100 SER O
H A 0102 SER N 2.197 H A 0101 ASP O
H A 0103 GLN N 3.145 C A 0100 SER O
H A 0103 GLN N 2.195 H A 0102 SER O
H A 0104 ARG N 2.193 H A 0103 GLN O
H A 0105 ARG N 2.939 H A 0101 ASP O
H A 0105 ARG N 2.202 H A 0104 ARG O
H A 0106 LEU N 2.929 H A 0102 SER O
H A 0106 LEU N 2.203 H A 0105 ARG O
H A 0107 ALA N 3.065 H A 0103 GLN O
H A 0107 ALA N 3.171 H A 0104 ARG O
H A 0107 ALA N 2.197 H A 0106 LEU O
H A 0108 GLU N 2.845 H A 0104 ARG O
H A 0108 GLU N 3.131 H A 0105 ARG O
H A 0108 GLU N 2.196 H A 0107 ALA O
H A 0109 LYS N 2.974 H A 0105 ARG O
H A 0109 LYS N 3.075 H A 0106 LEU O
H A 0109 LYS N 2.191 H A 0108 GLU O
H A 0110 TRP N 3.161 H A 0106 LEU O
H A 0110 TRP N 2.193 H A 0109 LYS O
H A 0111 LEU N 3.020 H A 0107 ALA O
H A 0111 LEU N 2.187 H A 0110 TRP O
H A 0112 PRO N 2.198 H A 0111 LEU O
H A 0113 ALA N 2.195 H A 0112 PRO O
H A 0114 VAL N 2.195 H A 0113 ALA O
H A 0115 GLN N 3.058 H A 0111 LEU O
H A 0115 GLN N 2.198 H A 0114 VAL O
H A 0116 ALA N 3.026 H A 0112 PRO O
H A 0116 ALA N 2.196 H A 0115 GLN O
H A 0117 ALA N 3.082 H A 0113 ALA O
H A 0117 ALA N 2.197 H A 0116 ALA O
H A 0118 ASP N 3.194 H A 0114 VAL O
H A 0118 ASP N 3.186 H A 0115 GLN O
H A 0118 ASP N 2.195 H A 0117 ALA O
H A 0119 GLU N 3.126 H A 0116 ALA O
H A 0119 GLU N 2.196 H A 0118 ASP O
H A 0120 MET N 3.073 H A 0117 ALA O
H A 0120 MET N 2.196 H A 0119 GLU O
H A 0121 LEU N 2.995 H A 0117 ALA O
H A 0121 LEU N 2.192 H A 0120 MET O
H A 0122 ASN N 3.000 H A 0118 ASP O
H A 0122 ASN N 2.197 H A 0121 LEU O
C A 0123 GLN N 3.163 H A 0120 MET O
C A 0123 GLN N 2.195 H A 0122 ASN O
C A 0124 GLY N 2.828 H A 0121 LEU O
C A 0124 GLY N 3.035 H A 0122 ASN O
C A 0124 GLY N 2.198 C A 0123 GLN O
C A 0125 ILE N 2.192 C A 0124 GLY O
C A 0126 SER N 2.199 C A 0125 ILE O
H A 0127 THR N 2.197 C A 0126 SER O
H A 0128 LYS N 2.191 H A 0127 THR O
H A 0129 THR N 2.198 H A 0128 LYS O
H A 0130 ALA N 2.737 C A 0126 SER O
H A 0130 ALA N 3.197 H A 0127 THR O
H A 0130 ALA N 2.196 H A 0129 THR O
H A 0131 PHE N 2.757 H A 0127 THR O
H A 0131 PHE N 2.197 H A 0130 ALA O
H A 0132 ALA N 2.689 H A 0128 LYS O
H A 0132 ALA N 2.195 H A 0131 PHE O
H A 0133 THR N 2.815 H A 0129 THR O
H A 0133 THR N 2.196 H A 0132 ALA O
H A 0134 VAL N 3.130 H A 0130 ALA O
H A 0134 VAL N 2.197 H A 0133 THR O
H A 0135 ALA N 2.716 H A 0131 PHE O
H A 0135 ALA N 2.194 H A 0134 VAL O
H A 0136 GLY N 2.752 H A 0132 ALA O
H A 0136 GLY N 3.145 H A 0133 THR O
H A 0136 GLY N 2.193 H A 0135 ALA O
H A 0137 HIS N 2.891 H A 0133 THR O
H A 0137 HIS N 2.198 H A 0136 GLY O
C A 0138 TYR N 2.581 H A 0134 VAL O
C A 0138 TYR N 2.204 H A 0137 HIS O
C A 0139 GLN N 2.195 C A 0138 TYR O
C A 0140 VAL N 2.885 C A 0138 TYR O
C A 0140 VAL N 2.203 C A 0139 GLN O
C A 0141 SER N 2.195 C A 0140 VAL O
H A 0142 ALA N 2.195 C A 0141 SER O
H A 0143 SER N 2.200 H A 0142 ALA O
H A 0144 THR N 3.093 C A 0141 SER O
H A 0144 THR N 2.193 H A 0143 SER O
H A 0145 LEU N 3.029 C A 0141 SER O
H A 0145 LEU N 2.191 H A 0144 THR O
H A 0146 ARG N 3.035 H A 0142 ALA O
H A 0146 ARG N 2.189 H A 0145 LEU O
H A 0147 ASP N 2.192 H A 0146 ARG O
H A 0148 LYS N 3.189 H A 0144 THR O
H A 0148 LYS N 2.192 H A 0147 ASP O
H A 0149 TYR N 2.846 H A 0145 LEU O
H A 0149 TYR N 3.181 H A 0146 ARG O
H A 0149 TYR N 2.195 H A 0148 LYS O
H A 0150 TYR N 2.189 H A 0149 TYR O
H A 0151 GLN N 3.190 H A 0147 ASP O
H A 0151 GLN N 3.148 H A 0148 LYS O
H A 0151 GLN N 2.193 H A 0150 TYR O
H A 0152 VAL N 2.993 H A 0148 LYS O
H A 0152 VAL N 2.192 H A 0151 GLN O
H A 0153 GLN N 3.143 H A 0150 TYR O
H A 0153 GLN N 2.193 H A 0152 VAL O
H A 0154 LYS N 2.194 H A 0153 GLN O
C A 0155 PHE N 2.917 H A 0152 VAL O
C A 0155 PHE N 2.196 H A 0154 LYS O
C A 0156 ALA N 2.197 C A 0155 PHE O
H A 0157 LYS N 2.194 C A 0156 ALA O
H A 0158 PRO N 3.180 C A 0156 ALA O
H A 0158 PRO N 2.195 H A 0157 LYS O
H A 0159 ASP N 2.956 C A 0156 ALA O
H A 0159 ASP N 2.985 H A 0157 LYS O
H A 0159 ASP N 2.196 H A 0158 PRO O
H A 0160 TRP N 2.738 H A 0157 LYS O
H A 0160 TRP N 2.194 H A 0159 ASP O
H A 0161 ALA N 3.139 H A 0159 ASP O
H A 0161 ALA N 2.186 H A 0160 TRP O
H A 0162 ALA N 2.935 H A 0159 ASP O
H A 0162 ALA N 2.196 H A 0161 ALA O
H A 0163 ALA N 2.829 H A 0159 ASP O
H A 0163 ALA N 3.138 H A 0160 TRP O
H A 0163 ALA N 2.195 H A 0162 ALA O
H A 0164 LEU N 3.031 H A 0160 TRP O
H A 0164 LEU N 2.195 H A 0163 ALA O
H A 0165 VAL N 3.010 H A 0162 ALA O
H A 0165 VAL N 2.195 H A 0164 LEU O
C A 0166 ASP N 3.196 H A 0163 ALA O
C A 0166 ASP N 2.195 H A 0165 VAL O
C A 0167 GLY N 2.958 H A 0165 VAL O
C A 0167 GLY N 2.202 C A 0166 ASP O
C A 0168 ARG N 2.191 C A 0167 GLY O
HB_MS 2.00 3.20 9
C A 0087 TYR O 2.387 C A 0089 ARG NH2
H A 0094 SER O 2.982 H A 0098 ASN ND2
H A 0101 ASP N 3.111 C A 0100 SER OG
H A 0103 GLN N 2.867 H A 0102 SER OG
H A 0128 LYS N 3.139 H A 0127 THR OG1
H A 0129 THR O 2.676 H A 0133 THR OG1
H A 0152 VAL O 2.632 H A 0160 TRP NE1
C A 0155 PHE O 2.527 H A 0160 TRP NE1
C A 0156 ALA N 2.685 H A 0159 ASP OD2
HB_SS 2.00 3.20 1
H A 0118 ASP OD1 3.127 H A 0149 TYR OH
AROMATIC 0.00 8.00 4
H A 0146 ARG 7.002 H A 0150 TYR
C A 0089 ARG 2.942 C A 0085 HIS
H A 0104 ARG 5.723 H A 0096 TRP
C A 0085 HIS 5.915 C A 0087 TYR