Complet list of 2b1u con file
Complete list of 2b1u.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 323
C A 0076 ALA C 2.450 C A 0077 ARG CA
C A 0076 ALA C 3.697 C A 0077 ARG C
C A 0076 ALA C 3.142 C A 0077 ARG CB
C A 0076 ALA C 3.776 C A 0077 ARG CG
C A 0077 ARG CA 3.730 C A 0078 ALA CA
C A 0077 ARG C 2.429 C A 0078 ALA CA
C A 0077 ARG C 3.075 C A 0078 ALA C
C A 0077 ARG C 3.660 C A 0078 ALA CB
C A 0078 ALA CA 3.647 H A 0079 GLY CA
C A 0078 ALA CA 3.777 H A 0079 GLY C
C A 0078 ALA C 2.362 H A 0079 GLY CA
C A 0078 ALA C 2.797 H A 0079 GLY C
C A 0078 ALA CA 3.709 H A 0082 ASP CB
C A 0078 ALA CA 3.393 H A 0082 ASP CG
C A 0078 ALA CB 3.242 H A 0082 ASP CG
H A 0079 GLY CA 3.786 H A 0080 LEU CA
H A 0079 GLY C 2.415 H A 0080 LEU CA
H A 0079 GLY C 3.076 H A 0080 LEU C
H A 0079 GLY C 3.661 H A 0080 LEU CB
H A 0079 GLY C 3.679 H A 0083 LEU CG
H A 0079 GLY C 3.562 H A 0143 LEU CD2
H A 0080 LEU C 2.420 H A 0081 GLU CA
H A 0080 LEU C 2.977 H A 0081 GLU C
H A 0080 LEU C 3.692 H A 0081 GLU CB
H A 0080 LEU CA 3.610 H A 0143 LEU CD2
H A 0081 GLU C 2.468 H A 0082 ASP CA
H A 0081 GLU C 2.936 H A 0082 ASP C
H A 0081 GLU C 3.752 H A 0082 ASP CB
H A 0082 ASP CA 3.787 H A 0083 LEU CA
H A 0082 ASP C 2.450 H A 0083 LEU CA
H A 0082 ASP C 3.087 H A 0083 LEU C
H A 0082 ASP C 3.667 H A 0083 LEU CB
H A 0082 ASP C 3.701 H A 0083 LEU CD2
H A 0082 ASP CB 3.780 H A 0083 LEU CD2
H A 0082 ASP CA 3.778 H A 0110 LEU CD2
H A 0082 ASP CB 3.712 H A 0110 LEU CD2
H A 0082 ASP CG 3.739 H A 0110 LEU CD2
H A 0083 LEU C 2.426 H A 0084 GLN CA
H A 0083 LEU C 3.030 H A 0084 GLN C
H A 0083 LEU C 3.705 H A 0084 GLN CB
H A 0083 LEU CA 3.750 H A 0086 ALA CB
H A 0083 LEU C 3.760 H A 0086 ALA CB
H A 0083 LEU C 3.588 H A 0087 PHE CD2
H A 0083 LEU CB 3.527 H A 0143 LEU CD2
H A 0083 LEU CG 3.522 H A 0143 LEU CD2
H A 0084 GLN C 2.448 H A 0085 VAL CA
H A 0084 GLN C 3.056 H A 0085 VAL C
H A 0084 GLN C 3.659 H A 0085 VAL CB
H A 0085 VAL C 2.483 H A 0086 ALA CA
H A 0085 VAL C 2.956 H A 0086 ALA C
H A 0085 VAL C 3.776 H A 0086 ALA CB
H A 0086 ALA CA 3.789 H A 0087 PHE CA
H A 0086 ALA C 2.451 H A 0087 PHE CA
H A 0086 ALA C 2.939 H A 0087 PHE C
H A 0086 ALA C 3.708 H A 0087 PHE CB
H A 0086 ALA C 3.686 H A 0106 ALA CB
H A 0087 PHE C 2.462 H A 0088 ARG CA
H A 0087 PHE C 3.067 H A 0088 ARG C
H A 0087 PHE C 3.723 H A 0088 ARG CB
H A 0087 PHE CD1 3.296 E A 0098 ILE CG2
H A 0087 PHE CE1 3.652 E A 0098 ILE CG2
H A 0087 PHE CD1 3.765 H A 0103 LEU CD2
H A 0087 PHE CE1 3.325 H A 0103 LEU CG
H A 0087 PHE CE1 3.569 H A 0103 LEU CD1
H A 0087 PHE CE1 3.208 H A 0103 LEU CD2
H A 0087 PHE CZ 3.478 H A 0103 LEU CD2
H A 0087 PHE CB 3.516 C A 0136 TYR CE2
H A 0087 PHE CE1 3.759 H A 0139 PHE CD2
H A 0087 PHE CE2 3.663 H A 0139 PHE CG
H A 0087 PHE CE2 3.396 H A 0139 PHE CD1
H A 0087 PHE CZ 3.111 H A 0139 PHE CG
H A 0087 PHE CZ 3.124 H A 0139 PHE CD1
H A 0087 PHE CZ 3.404 H A 0139 PHE CD2
H A 0087 PHE CZ 3.539 H A 0139 PHE CE1
H A 0088 ARG C 2.441 C A 0089 ALA CA
H A 0088 ARG C 3.089 C A 0089 ALA C
H A 0088 ARG C 3.695 C A 0089 ALA CB
H A 0088 ARG CA 3.697 C A 0091 ASP CG
H A 0088 ARG CD 3.649 C A 0091 ASP CG
C A 0089 ALA C 2.496 C A 0090 PHE CA
C A 0089 ALA C 3.570 C A 0090 PHE C
C A 0089 ALA C 3.443 C A 0090 PHE CB
C A 0089 ALA C 3.350 C A 0090 PHE CG
C A 0089 ALA C 3.677 C A 0090 PHE CD1
C A 0089 ALA C 3.640 C A 0090 PHE CD2
C A 0089 ALA CB 3.455 C A 0090 PHE CD2
C A 0089 ALA CB 3.421 C A 0090 PHE CE2
C A 0089 ALA CB 3.791 H A 0106 ALA CB
C A 0090 PHE C 2.447 C A 0091 ASP CA
C A 0090 PHE C 3.194 C A 0091 ASP C
C A 0090 PHE C 3.663 C A 0091 ASP CB
C A 0090 PHE CB 3.422 H A 0102 GLU CB
C A 0090 PHE CB 3.633 H A 0102 GLU CG
C A 0090 PHE CG 3.268 H A 0102 GLU CB
C A 0090 PHE CG 3.215 H A 0102 GLU CG
C A 0090 PHE CD1 3.308 H A 0102 GLU CG
C A 0090 PHE CD2 3.733 H A 0102 GLU CA
C A 0090 PHE CD2 3.434 H A 0102 GLU C
C A 0090 PHE CD2 3.457 H A 0102 GLU CB
C A 0090 PHE CD2 3.774 H A 0102 GLU CG
C A 0091 ASP CA 3.779 C A 0092 GLN CA
C A 0091 ASP C 2.422 C A 0092 GLN CA
C A 0091 ASP C 3.091 C A 0092 GLN C
C A 0091 ASP C 3.695 C A 0092 GLN CB
C A 0091 ASP CB 3.445 C A 0136 TYR CD2
C A 0091 ASP CB 3.357 C A 0136 TYR CE2
C A 0092 GLN C 2.439 C A 0093 ASP CA
C A 0092 GLN C 3.757 C A 0093 ASP C
C A 0092 GLN C 3.057 C A 0093 ASP CB
C A 0093 ASP C 2.403 C A 0094 GLY CA
C A 0093 ASP C 3.237 C A 0094 GLY C
C A 0094 GLY C 2.485 C A 0095 ASP CA
C A 0094 GLY C 2.980 C A 0095 ASP C
C A 0094 GLY C 3.251 C A 0095 ASP CB
C A 0094 GLY CA 3.378 C A 0136 TYR CD1
C A 0094 GLY CA 3.571 C A 0136 TYR CE1
C A 0095 ASP C 2.463 C A 0096 GLY CA
C A 0095 ASP C 3.243 C A 0096 GLY C
C A 0096 GLY C 2.449 E A 0097 HIS CA
C A 0096 GLY C 3.532 E A 0097 HIS C
C A 0096 GLY C 3.466 E A 0097 HIS CB
E A 0097 HIS CA 3.794 E A 0098 ILE CA
E A 0097 HIS C 2.458 E A 0098 ILE CA
E A 0097 HIS C 3.377 E A 0098 ILE C
E A 0097 HIS C 3.648 E A 0098 ILE CB
E A 0097 HIS CD2 3.662 E A 0133 ARG CB
E A 0097 HIS CD2 3.507 E A 0134 VAL C
E A 0098 ILE CA 3.770 E A 0099 THR CA
E A 0098 ILE C 2.503 E A 0099 THR CA
E A 0098 ILE C 3.360 E A 0099 THR C
E A 0098 ILE C 3.502 E A 0099 THR CB
E A 0098 ILE CD1 3.723 E A 0099 THR C
E A 0098 ILE CD1 3.668 H A 0100 VAL CA
E A 0098 ILE CD1 3.668 H A 0103 LEU CD1
E A 0098 ILE CG1 3.652 E A 0134 VAL CB
E A 0098 ILE CD1 3.563 E A 0134 VAL CG2
E A 0099 THR C 2.476 H A 0100 VAL CA
E A 0099 THR C 3.032 H A 0100 VAL C
E A 0099 THR C 3.727 H A 0100 VAL CB
E A 0099 THR CB 3.741 H A 0102 GLU CB
E A 0099 THR CG2 3.720 H A 0102 GLU CB
E A 0099 THR CG2 3.229 H A 0102 GLU CD
H A 0100 VAL C 2.430 H A 0101 ASP CA
H A 0100 VAL C 3.107 H A 0101 ASP C
H A 0100 VAL C 3.700 H A 0101 ASP CB
H A 0100 VAL C 3.578 H A 0103 LEU CB
H A 0101 ASP C 2.487 H A 0102 GLU CA
H A 0101 ASP C 2.935 H A 0102 GLU C
H A 0101 ASP C 3.690 H A 0102 GLU CB
H A 0101 ASP CG 3.627 H A 0104 ARG CZ
H A 0102 GLU C 2.464 H A 0103 LEU CA
H A 0102 GLU C 2.970 H A 0103 LEU C
H A 0102 GLU C 3.691 H A 0103 LEU CB
H A 0103 LEU C 2.468 H A 0104 ARG CA
H A 0103 LEU C 3.012 H A 0104 ARG C
H A 0103 LEU C 3.724 H A 0104 ARG CB
H A 0103 LEU CD1 3.294 H A 0139 PHE CE2
H A 0103 LEU CD1 3.714 H A 0139 PHE CZ
H A 0104 ARG C 2.445 H A 0105 ARG CA
H A 0104 ARG C 3.018 H A 0105 ARG C
H A 0104 ARG C 3.724 H A 0105 ARG CB
H A 0104 ARG CD 3.421 C A 0114 LEU CD1
H A 0104 ARG CA 3.741 H A 0119 LEU CG
H A 0104 ARG CA 3.710 H A 0119 LEU CD2
H A 0104 ARG CB 3.651 H A 0119 LEU CG
H A 0104 ARG CG 3.623 H A 0119 LEU CG
H A 0105 ARG C 2.473 H A 0106 ALA CA
H A 0105 ARG C 3.009 H A 0106 ALA C
H A 0105 ARG C 3.729 H A 0106 ALA CB
H A 0106 ALA C 2.457 H A 0107 MET CA
H A 0106 ALA C 3.030 H A 0107 MET C
H A 0106 ALA C 3.710 H A 0107 MET CB
H A 0107 MET C 2.454 H A 0108 ALA CA
H A 0107 MET C 3.052 H A 0108 ALA C
H A 0107 MET C 3.732 H A 0108 ALA CB
H A 0107 MET CB 3.659 H A 0115 PRO CG
H A 0107 MET CE 3.521 H A 0115 PRO CG
H A 0108 ALA C 2.450 H A 0109 GLY CA
H A 0108 ALA C 3.061 H A 0109 GLY C
H A 0108 ALA CA 3.651 C A 0113 PRO CA
H A 0108 ALA CA 3.744 C A 0113 PRO CB
H A 0108 ALA CB 3.706 C A 0113 PRO CB
H A 0109 GLY C 2.450 H A 0110 LEU CA
H A 0109 GLY C 3.204 H A 0110 LEU C
H A 0109 GLY C 3.691 H A 0110 LEU CB
H A 0110 LEU CA 3.787 C A 0111 GLY CA
H A 0110 LEU C 2.420 C A 0111 GLY CA
H A 0110 LEU C 3.730 C A 0111 GLY C
C A 0111 GLY C 2.466 C A 0112 GLN CA
C A 0111 GLY C 3.395 C A 0112 GLN C
C A 0111 GLY C 3.571 C A 0112 GLN CB
C A 0111 GLY C 3.507 C A 0113 PRO CD
C A 0112 GLN CA 3.012 C A 0113 PRO CD
C A 0112 GLN C 2.449 C A 0113 PRO CA
C A 0112 GLN C 3.091 C A 0113 PRO C
C A 0112 GLN C 3.666 C A 0113 PRO CB
C A 0112 GLN C 3.687 C A 0113 PRO CG
C A 0112 GLN C 2.514 C A 0113 PRO CD
C A 0112 GLN CD 3.457 H A 0115 PRO CB
C A 0113 PRO C 2.451 C A 0114 LEU CA
C A 0113 PRO C 2.938 C A 0114 LEU C
C A 0113 PRO C 3.180 C A 0114 LEU CB
C A 0113 PRO C 3.727 H A 0115 PRO CD
C A 0114 LEU CA 2.908 H A 0115 PRO CD
C A 0114 LEU C 2.423 H A 0115 PRO CA
C A 0114 LEU C 3.076 H A 0115 PRO C
C A 0114 LEU C 3.600 H A 0115 PRO CB
C A 0114 LEU C 3.676 H A 0115 PRO CG
C A 0114 LEU C 2.489 H A 0115 PRO CD
H A 0115 PRO CA 3.777 H A 0116 GLN CA
H A 0115 PRO C 2.415 H A 0116 GLN CA
H A 0115 PRO C 2.931 H A 0116 GLN C
H A 0115 PRO C 3.741 H A 0116 GLN CB
H A 0115 PRO CB 3.778 H A 0118 GLU CB
H A 0116 GLN C 2.460 H A 0117 GLU CA
H A 0116 GLN C 3.119 H A 0117 GLU C
H A 0116 GLN C 3.715 H A 0117 GLU CB
H A 0117 GLU CA 3.794 H A 0118 GLU CA
H A 0117 GLU C 2.432 H A 0118 GLU CA
H A 0117 GLU C 2.969 H A 0118 GLU C
H A 0117 GLU C 3.692 H A 0118 GLU CB
H A 0118 GLU CA 3.798 H A 0119 LEU CA
H A 0118 GLU C 2.427 H A 0119 LEU CA
H A 0118 GLU C 3.015 H A 0119 LEU C
H A 0118 GLU C 3.716 H A 0119 LEU CB
H A 0119 LEU C 2.504 H A 0120 ASP CA
H A 0119 LEU C 2.998 H A 0120 ASP C
H A 0119 LEU C 3.777 H A 0120 ASP CB
H A 0119 LEU CD1 3.455 H A 0123 ILE CG1
H A 0120 ASP C 2.453 H A 0121 ALA CA
H A 0120 ASP C 2.941 H A 0121 ALA C
H A 0120 ASP C 3.694 H A 0121 ALA CB
H A 0120 ASP CA 3.779 H A 0123 ILE CB
H A 0121 ALA C 2.447 H A 0122 MET CA
H A 0121 ALA C 3.124 H A 0122 MET C
H A 0121 ALA C 3.706 H A 0122 MET CB
H A 0122 MET C 2.473 H A 0123 ILE CA
H A 0122 MET C 2.932 H A 0123 ILE C
H A 0122 MET C 3.791 H A 0123 ILE CB
H A 0122 MET CG 3.779 H A 0139 PHE CZ
H A 0122 MET CE 3.631 H A 0143 LEU CD1
H A 0123 ILE C 2.431 H A 0124 ARG CA
H A 0123 ILE C 3.048 H A 0124 ARG C
H A 0123 ILE C 3.709 H A 0124 ARG CB
H A 0124 ARG C 2.457 H A 0125 GLU CA
H A 0124 ARG C 3.122 H A 0125 GLU C
H A 0124 ARG C 3.702 H A 0125 GLU CB
H A 0125 GLU C 2.481 H A 0126 ALA CA
H A 0125 GLU C 3.224 H A 0126 ALA C
H A 0125 GLU C 3.686 H A 0126 ALA CB
H A 0126 ALA C 2.466 C A 0127 ASP CA
H A 0126 ALA C 3.517 C A 0127 ASP C
H A 0126 ALA C 3.504 C A 0127 ASP CB
H A 0126 ALA CA 3.352 E A 0134 VAL CG2
H A 0126 ALA C 3.714 E A 0134 VAL CG2
H A 0126 ALA CB 3.106 E A 0134 VAL CG2
C A 0127 ASP C 2.478 C A 0128 VAL CA
C A 0127 ASP C 2.988 C A 0128 VAL C
C A 0127 ASP C 3.755 C A 0128 VAL CB
C A 0128 VAL C 2.428 C A 0129 ASP CA
C A 0128 VAL C 3.030 C A 0129 ASP C
C A 0128 VAL C 3.741 C A 0129 ASP CB
C A 0129 ASP C 2.506 C A 0130 GLN CA
C A 0129 ASP C 3.737 C A 0130 GLN C
C A 0129 ASP C 3.015 C A 0130 GLN CB
C A 0129 ASP C 3.219 C A 0130 GLN CG
C A 0129 ASP CG 3.469 E A 0133 ARG CB
C A 0130 GLN C 2.456 C A 0131 ASP CA
C A 0130 GLN C 3.718 C A 0131 ASP C
C A 0130 GLN C 3.031 C A 0131 ASP CB
C A 0131 ASP C 2.463 C A 0132 GLY CA
C A 0131 ASP C 3.714 C A 0132 GLY C
C A 0132 GLY C 2.466 E A 0133 ARG CA
C A 0132 GLY C 3.261 E A 0133 ARG C
C A 0132 GLY C 3.666 E A 0133 ARG CB
E A 0133 ARG C 2.465 E A 0134 VAL CA
E A 0133 ARG C 3.567 E A 0134 VAL C
E A 0133 ARG C 3.424 E A 0134 VAL CB
E A 0133 ARG C 3.273 E A 0134 VAL CG2
E A 0134 VAL CA 3.788 E A 0135 ASN CA
E A 0134 VAL C 2.426 E A 0135 ASN CA
E A 0134 VAL C 2.930 E A 0135 ASN C
E A 0134 VAL C 3.736 E A 0135 ASN CB
E A 0134 VAL CG1 3.797 H A 0139 PHE CA
E A 0134 VAL CG1 3.673 H A 0139 PHE CB
E A 0134 VAL CG1 3.494 H A 0139 PHE CD2
E A 0135 ASN C 2.486 C A 0136 TYR CA
E A 0135 ASN C 2.984 C A 0136 TYR C
E A 0135 ASN C 3.745 C A 0136 TYR CB
E A 0135 ASN CB 3.517 H A 0138 GLU CB
C A 0136 TYR C 2.446 H A 0137 GLU CA
C A 0136 TYR C 3.120 H A 0137 GLU C
C A 0136 TYR C 3.711 H A 0137 GLU CB
C A 0136 TYR CD1 3.749 H A 0137 GLU CA
H A 0137 GLU C 2.486 H A 0138 GLU CA
H A 0137 GLU C 2.973 H A 0138 GLU C
H A 0137 GLU C 3.731 H A 0138 GLU CB
H A 0138 GLU C 2.462 H A 0139 PHE CA
H A 0138 GLU C 2.907 H A 0139 PHE C
H A 0138 GLU C 3.735 H A 0139 PHE CB
H A 0139 PHE C 2.455 H A 0140 ALA CA
H A 0139 PHE C 2.964 H A 0140 ALA C
H A 0139 PHE C 3.674 H A 0140 ALA CB
H A 0140 ALA C 2.474 H A 0141 ARG CA
H A 0140 ALA C 3.040 H A 0141 ARG C
H A 0140 ALA C 3.723 H A 0141 ARG CB
H A 0141 ARG C 2.451 H A 0142 MET CA
H A 0141 ARG C 3.232 H A 0142 MET C
H A 0141 ARG C 3.701 H A 0142 MET CB
H A 0142 MET C 2.479 H A 0143 LEU CA
H A 0142 MET C 2.825 H A 0143 LEU C
H A 0142 MET C 3.734 H A 0143 LEU CB
H A 0143 LEU CA 3.791 H A 0144 ALA CA
H A 0143 LEU C 2.430 H A 0144 ALA CA
H A 0143 LEU C 3.279 H A 0144 ALA C
H A 0143 LEU C 3.570 H A 0144 ALA CB
H A 0144 ALA CA 3.783 C A 0145 GLN CA
H A 0144 ALA C 2.484 C A 0145 GLN CA
H A 0144 ALA C 3.185 C A 0145 GLN C
H A 0144 ALA C 3.738 C A 0145 GLN CB
C A 0145 GLN C 2.482 C A 0146 GLU CA
C A 0145 GLN C 3.407 C A 0146 GLU C
C A 0145 GLN C 3.601 C A 0146 GLU CB
CHARGE_ATTR 2.00 12.00 86
H A 0081 GLU OE1 9.694 C A 0077 ARG NH1
H A 0081 GLU OE1 10.91 C A 0077 ARG NH2
H A 0081 GLU OE2 11.86 C A 0077 ARG NH1
H A 0082 ASP OD1 10.07 C A 0077 ARG NH1
H A 0082 ASP OD1 11.93 C A 0077 ARG NH2
H A 0082 ASP OD2 10.79 C A 0077 ARG NH1
C A 0091 ASP OD1 4.200 H A 0088 ARG NH1
C A 0091 ASP OD1 5.977 H A 0088 ARG NH2
C A 0091 ASP OD2 2.635 H A 0088 ARG NH1
C A 0091 ASP OD2 4.845 H A 0088 ARG NH2
C A 0093 ASP OD1 5.510 H A 0088 ARG NH1
C A 0093 ASP OD1 6.694 H A 0088 ARG NH2
C A 0093 ASP OD2 7.706 H A 0088 ARG NH1
C A 0093 ASP OD2 8.895 H A 0088 ARG NH2
C A 0095 ASP OD1 8.694 E A 0097 HIS ND1
C A 0095 ASP OD1 8.666 E A 0097 HIS NE2
C A 0095 ASP OD2 8.276 E A 0097 HIS ND1
C A 0095 ASP OD2 8.581 E A 0097 HIS NE2
C A 0095 ASP OD1 11.08 H A 0141 ARG NH1
C A 0095 ASP OD1 10.99 H A 0141 ARG NH2
H A 0101 ASP OD1 2.600 H A 0104 ARG NH1
H A 0101 ASP OD1 2.616 H A 0104 ARG NH2
H A 0101 ASP OD2 3.293 H A 0104 ARG NH1
H A 0101 ASP OD2 4.131 H A 0104 ARG NH2
H A 0101 ASP OD2 10.36 H A 0105 ARG NH1
H A 0101 ASP OD2 10.17 H A 0105 ARG NH2
H A 0101 ASP OD1 11.90 E A 0133 ARG NH1
H A 0102 GLU OE1 8.118 H A 0104 ARG NH1
H A 0102 GLU OE1 7.851 H A 0104 ARG NH2
H A 0102 GLU OE2 10.31 H A 0104 ARG NH1
H A 0102 GLU OE2 10.05 H A 0104 ARG NH2
H A 0102 GLU OE1 10.59 H A 0105 ARG NH1
H A 0102 GLU OE1 10.49 H A 0105 ARG NH2
H A 0102 GLU OE2 11.27 H A 0105 ARG NH1
H A 0102 GLU OE2 11.04 H A 0105 ARG NH2
H A 0102 GLU OE1 11.85 E A 0133 ARG NH1
H A 0102 GLU OE1 11.90 E A 0133 ARG NH2
H A 0102 GLU OE2 11.79 E A 0133 ARG NH2
H A 0120 ASP OD1 6.142 H A 0104 ARG NH1
H A 0120 ASP OD1 5.610 H A 0104 ARG NH2
H A 0120 ASP OD2 7.864 H A 0104 ARG NH1
H A 0120 ASP OD2 7.692 H A 0104 ARG NH2
H A 0120 ASP OD1 10.87 H A 0124 ARG NH1
H A 0120 ASP OD2 10.47 H A 0124 ARG NH1
H A 0125 GLU OE1 11.29 H A 0124 ARG NH1
H A 0125 GLU OE2 10.62 H A 0124 ARG NH1
H A 0125 GLU OE2 11.56 H A 0124 ARG NH2
C A 0127 ASP OD1 10.76 E A 0097 HIS NE2
C A 0127 ASP OD1 10.25 H A 0124 ARG NH1
C A 0127 ASP OD1 9.455 H A 0124 ARG NH2
C A 0127 ASP OD2 8.869 H A 0124 ARG NH1
C A 0127 ASP OD2 7.710 H A 0124 ARG NH2
C A 0129 ASP OD1 5.725 E A 0097 HIS ND1
C A 0129 ASP OD1 4.033 E A 0097 HIS NE2
C A 0129 ASP OD2 5.960 E A 0097 HIS ND1
C A 0129 ASP OD2 4.698 E A 0097 HIS NE2
C A 0129 ASP OD1 7.170 E A 0133 ARG NH1
C A 0129 ASP OD1 7.680 E A 0133 ARG NH2
C A 0129 ASP OD2 5.035 E A 0133 ARG NH1
C A 0129 ASP OD2 5.493 E A 0133 ARG NH2
C A 0131 ASP OD1 11.85 E A 0097 HIS ND1
C A 0131 ASP OD1 10.69 E A 0097 HIS NE2
C A 0131 ASP OD2 9.662 E A 0097 HIS ND1
C A 0131 ASP OD2 8.530 E A 0097 HIS NE2
C A 0131 ASP OD1 10.58 H A 0104 ARG NH2
C A 0131 ASP OD2 10.58 H A 0104 ARG NH2
C A 0131 ASP OD1 3.794 E A 0133 ARG NH1
C A 0131 ASP OD1 5.996 E A 0133 ARG NH2
C A 0131 ASP OD2 2.636 E A 0133 ARG NH1
C A 0131 ASP OD2 4.805 E A 0133 ARG NH2
H A 0137 GLU OE1 8.239 H A 0141 ARG NH1
H A 0137 GLU OE1 7.977 H A 0141 ARG NH2
H A 0137 GLU OE2 9.812 H A 0141 ARG NH1
H A 0137 GLU OE2 9.542 H A 0141 ARG NH2
H A 0138 GLU OE1 9.098 E A 0097 HIS ND1
H A 0138 GLU OE1 7.538 E A 0097 HIS NE2
H A 0138 GLU OE2 10.63 E A 0097 HIS ND1
H A 0138 GLU OE2 9.268 E A 0097 HIS NE2
H A 0138 GLU OE1 8.919 H A 0141 ARG NH1
H A 0138 GLU OE1 10.14 H A 0141 ARG NH2
H A 0138 GLU OE2 7.485 H A 0141 ARG NH1
H A 0138 GLU OE2 8.496 H A 0141 ARG NH2
C A 0146 GLU OE1 10.11 C A 0077 ARG NH1
C A 0146 GLU OE1 8.869 C A 0077 ARG NH2
C A 0146 GLU OE2 9.325 C A 0077 ARG NH1
C A 0146 GLU OE2 8.525 C A 0077 ARG NH2
CHARGE_REPU 2.00 12.00 98
H A 0081 GLU OE1 5.859 H A 0082 ASP OD1
H A 0081 GLU OE1 8.066 H A 0082 ASP OD2
H A 0081 GLU OE2 6.580 H A 0082 ASP OD1
H A 0081 GLU OE2 8.772 H A 0082 ASP OD2
H A 0082 ASP OD1 9.587 H A 0118 GLU OE1
H A 0082 ASP OD1 10.93 H A 0118 GLU OE2
H A 0082 ASP OD2 7.789 H A 0118 GLU OE1
H A 0082 ASP OD2 9.332 H A 0118 GLU OE2
C A 0091 ASP OD1 7.580 C A 0093 ASP OD1
C A 0091 ASP OD1 9.406 C A 0093 ASP OD2
C A 0091 ASP OD2 6.057 C A 0093 ASP OD1
C A 0091 ASP OD2 7.978 C A 0093 ASP OD2
C A 0091 ASP OD1 11.72 H A 0102 GLU OE1
C A 0091 ASP OD1 10.87 H A 0102 GLU OE2
C A 0091 ASP OD2 11.20 H A 0137 GLU OE2
C A 0093 ASP OD1 11.59 C A 0095 ASP OD1
C A 0093 ASP OD1 11.44 C A 0095 ASP OD2
C A 0093 ASP OD2 10.96 C A 0095 ASP OD1
C A 0093 ASP OD2 10.41 C A 0095 ASP OD2
C A 0095 ASP OD1 11.41 C A 0129 ASP OD1
C A 0095 ASP OD2 11.18 C A 0129 ASP OD1
C A 0095 ASP OD1 5.849 H A 0137 GLU OE1
C A 0095 ASP OD1 7.405 H A 0137 GLU OE2
C A 0095 ASP OD2 7.951 H A 0137 GLU OE1
C A 0095 ASP OD2 9.465 H A 0137 GLU OE2
C A 0095 ASP OD1 6.380 H A 0138 GLU OE1
C A 0095 ASP OD1 6.255 H A 0138 GLU OE2
C A 0095 ASP OD2 7.557 H A 0138 GLU OE1
C A 0095 ASP OD2 7.329 H A 0138 GLU OE2
E A 0097 HIS ND1 9.035 E A 0133 ARG NH1
E A 0097 HIS ND1 8.410 E A 0133 ARG NH2
E A 0097 HIS NE2 8.356 E A 0133 ARG NH1
E A 0097 HIS NE2 8.295 E A 0133 ARG NH2
H A 0101 ASP OD1 6.271 H A 0102 GLU OE1
H A 0101 ASP OD1 8.391 H A 0102 GLU OE2
H A 0101 ASP OD2 5.155 H A 0102 GLU OE1
H A 0101 ASP OD2 7.250 H A 0102 GLU OE2
H A 0101 ASP OD1 7.811 H A 0120 ASP OD1
H A 0101 ASP OD1 9.744 H A 0120 ASP OD2
H A 0101 ASP OD2 9.301 H A 0120 ASP OD1
H A 0101 ASP OD2 11.13 H A 0120 ASP OD2
H A 0101 ASP OD1 10.14 C A 0131 ASP OD1
H A 0101 ASP OD1 10.23 C A 0131 ASP OD2
H A 0101 ASP OD2 11.90 C A 0131 ASP OD1
H A 0101 ASP OD2 11.81 C A 0131 ASP OD2
H A 0102 GLU OE1 11.22 C A 0131 ASP OD2
H A 0102 GLU OE2 12.00 C A 0131 ASP OD2
H A 0104 ARG NH1 11.79 H A 0105 ARG NH1
H A 0104 ARG NH1 11.90 H A 0105 ARG NH2
H A 0117 GLU OE1 10.27 H A 0118 GLU OE1
H A 0117 GLU OE1 9.623 H A 0118 GLU OE2
H A 0117 GLU OE2 10.49 H A 0118 GLU OE1
H A 0117 GLU OE2 10.31 H A 0118 GLU OE2
H A 0117 GLU OE1 9.097 H A 0120 ASP OD1
H A 0117 GLU OE1 7.451 H A 0120 ASP OD2
H A 0117 GLU OE2 9.413 H A 0120 ASP OD1
H A 0117 GLU OE2 7.856 H A 0120 ASP OD2
H A 0118 GLU OE1 11.13 H A 0120 ASP OD1
H A 0118 GLU OE1 11.61 H A 0120 ASP OD2
H A 0118 GLU OE2 10.99 H A 0120 ASP OD1
H A 0118 GLU OE2 11.29 H A 0120 ASP OD2
H A 0118 GLU OE1 8.941 H A 0125 GLU OE1
H A 0118 GLU OE1 10.40 H A 0125 GLU OE2
H A 0118 GLU OE2 7.434 H A 0125 GLU OE1
H A 0118 GLU OE2 8.591 H A 0125 GLU OE2
H A 0118 GLU OE2 11.20 C A 0146 GLU OE2
H A 0120 ASP OD1 11.43 H A 0125 GLU OE1
H A 0125 GLU OE1 8.503 C A 0127 ASP OD1
H A 0125 GLU OE1 9.803 C A 0127 ASP OD2
H A 0125 GLU OE2 8.611 C A 0127 ASP OD1
H A 0125 GLU OE2 9.656 C A 0127 ASP OD2
H A 0125 GLU OE1 11.50 H A 0138 GLU OE1
H A 0125 GLU OE1 10.63 C A 0146 GLU OE2
H A 0125 GLU OE2 11.24 C A 0146 GLU OE1
H A 0125 GLU OE2 9.934 C A 0146 GLU OE2
C A 0127 ASP OD1 9.321 C A 0129 ASP OD1
C A 0127 ASP OD1 10.34 C A 0129 ASP OD2
C A 0127 ASP OD2 10.20 C A 0129 ASP OD1
C A 0127 ASP OD2 11.01 C A 0129 ASP OD2
C A 0127 ASP OD1 11.31 C A 0131 ASP OD1
C A 0127 ASP OD1 10.57 C A 0131 ASP OD2
C A 0127 ASP OD2 11.12 C A 0131 ASP OD1
C A 0127 ASP OD2 10.80 C A 0131 ASP OD2
C A 0127 ASP OD1 8.124 H A 0138 GLU OE1
C A 0127 ASP OD1 9.574 H A 0138 GLU OE2
C A 0127 ASP OD2 10.12 H A 0138 GLU OE1
C A 0127 ASP OD2 11.44 H A 0138 GLU OE2
C A 0129 ASP OD1 9.106 C A 0131 ASP OD1
C A 0129 ASP OD1 7.373 C A 0131 ASP OD2
C A 0129 ASP OD2 7.417 C A 0131 ASP OD1
C A 0129 ASP OD2 5.680 C A 0131 ASP OD2
C A 0129 ASP OD1 8.398 H A 0138 GLU OE1
C A 0129 ASP OD1 9.960 H A 0138 GLU OE2
C A 0129 ASP OD2 10.31 H A 0138 GLU OE1
H A 0137 GLU OE1 8.155 H A 0138 GLU OE1
H A 0137 GLU OE1 7.860 H A 0138 GLU OE2
H A 0137 GLU OE2 9.869 H A 0138 GLU OE1
H A 0137 GLU OE2 9.868 H A 0138 GLU OE2
HB_MM 2.00 3.20 131
C A 0077 ARG N 2.245 C A 0076 ALA O
C A 0078 ALA N 2.269 C A 0077 ARG O
H A 0079 GLY N 2.243 C A 0078 ALA O
H A 0080 LEU N 2.924 C A 0078 ALA O
H A 0080 LEU N 2.210 H A 0079 GLY O
H A 0081 GLU N 2.778 C A 0077 ARG O
H A 0081 GLU N 2.242 H A 0080 LEU O
H A 0082 ASP N 2.263 H A 0081 GLU O
H A 0083 LEU N 2.736 H A 0079 GLY O
H A 0083 LEU N 2.232 H A 0082 ASP O
H A 0084 GLN N 2.906 H A 0080 LEU O
H A 0084 GLN N 3.161 H A 0081 GLU O
H A 0084 GLN N 2.221 H A 0083 LEU O
H A 0085 VAL N 2.832 H A 0081 GLU O
H A 0085 VAL N 2.238 H A 0084 GLN O
H A 0086 ALA N 2.664 H A 0082 ASP O
H A 0086 ALA N 3.115 H A 0083 LEU O
H A 0086 ALA N 2.247 H A 0085 VAL O
H A 0087 PHE N 2.795 H A 0083 LEU O
H A 0087 PHE N 2.252 H A 0086 ALA O
H A 0088 ARG N 3.044 H A 0084 GLN O
H A 0088 ARG N 3.067 H A 0086 ALA O
H A 0088 ARG N 2.257 H A 0087 PHE O
C A 0089 ALA N 2.897 H A 0086 ALA O
C A 0089 ALA N 2.794 H A 0087 PHE O
C A 0089 ALA N 2.229 H A 0088 ARG O
C A 0090 PHE N 2.877 H A 0087 PHE O
C A 0090 PHE N 2.250 C A 0089 ALA O
C A 0091 ASP N 2.868 H A 0087 PHE O
C A 0091 ASP N 2.248 C A 0090 PHE O
C A 0092 GLN N 2.252 C A 0091 ASP O
C A 0093 ASP N 2.260 C A 0092 GLN O
C A 0094 GLY N 2.236 C A 0093 ASP O
C A 0095 ASP N 2.260 C A 0094 GLY O
C A 0096 GLY N 2.928 C A 0094 GLY O
C A 0096 GLY N 2.250 C A 0095 ASP O
E A 0097 HIS N 2.239 C A 0096 GLY O
E A 0098 ILE N 2.265 E A 0097 HIS O
E A 0098 ILE N 3.059 E A 0134 VAL O
E A 0099 THR N 2.271 E A 0098 ILE O
H A 0100 VAL N 2.252 E A 0099 THR O
H A 0101 ASP N 3.106 E A 0099 THR O
H A 0101 ASP N 2.248 H A 0100 VAL O
H A 0102 GLU N 2.244 H A 0101 ASP O
H A 0103 LEU N 2.847 E A 0099 THR O
H A 0103 LEU N 3.132 H A 0101 ASP O
H A 0103 LEU N 2.234 H A 0102 GLU O
H A 0104 ARG N 2.719 H A 0101 ASP O
H A 0104 ARG N 2.241 H A 0103 LEU O
H A 0105 ARG N 2.986 H A 0101 ASP O
H A 0105 ARG N 2.897 H A 0102 GLU O
H A 0105 ARG N 2.253 H A 0104 ARG O
H A 0106 ALA N 2.713 H A 0102 GLU O
H A 0106 ALA N 3.023 H A 0103 LEU O
H A 0106 ALA N 2.250 H A 0105 ARG O
H A 0107 MET N 3.111 H A 0103 LEU O
H A 0107 MET N 2.254 H A 0106 ALA O
H A 0108 ALA N 2.914 H A 0105 ARG O
H A 0108 ALA N 2.975 H A 0106 ALA O
H A 0108 ALA N 2.238 H A 0107 MET O
H A 0109 GLY N 2.738 H A 0106 ALA O
H A 0109 GLY N 2.245 H A 0108 ALA O
H A 0110 LEU N 2.945 H A 0107 MET O
H A 0110 LEU N 2.251 H A 0109 GLY O
C A 0111 GLY N 2.242 H A 0110 LEU O
C A 0112 GLN N 2.252 C A 0111 GLY O
C A 0113 PRO N 2.235 C A 0112 GLN O
C A 0114 LEU N 2.252 C A 0113 PRO O
H A 0115 PRO N 2.239 C A 0114 LEU O
H A 0116 GLN N 2.788 C A 0114 LEU O
H A 0116 GLN N 2.247 H A 0115 PRO O
H A 0117 GLU N 3.063 H A 0115 PRO O
H A 0117 GLU N 2.250 H A 0116 GLN O
H A 0118 GLU N 3.072 H A 0115 PRO O
H A 0118 GLU N 2.241 H A 0117 GLU O
H A 0119 LEU N 2.775 H A 0115 PRO O
H A 0119 LEU N 2.239 H A 0118 GLU O
H A 0120 ASP N 2.771 H A 0116 GLN O
H A 0120 ASP N 2.229 H A 0119 LEU O
H A 0121 ALA N 2.772 H A 0117 GLU O
H A 0121 ALA N 3.120 H A 0119 LEU O
H A 0121 ALA N 2.243 H A 0120 ASP O
H A 0122 MET N 3.134 H A 0118 GLU O
H A 0122 MET N 2.772 H A 0119 LEU O
H A 0122 MET N 2.248 H A 0121 ALA O
H A 0123 ILE N 2.587 H A 0119 LEU O
H A 0123 ILE N 2.991 H A 0120 ASP O
H A 0123 ILE N 2.232 H A 0122 MET O
H A 0124 ARG N 2.250 H A 0123 ILE O
H A 0125 GLU N 2.941 H A 0122 MET O
H A 0125 GLU N 2.246 H A 0124 ARG O
H A 0126 ALA N 2.721 H A 0122 MET O
H A 0126 ALA N 3.102 H A 0123 ILE O
H A 0126 ALA N 2.238 H A 0125 GLU O
C A 0127 ASP N 2.904 H A 0125 GLU O
C A 0127 ASP N 2.247 H A 0126 ALA O
C A 0128 VAL N 2.252 C A 0127 ASP O
C A 0129 ASP N 2.257 C A 0128 VAL O
C A 0130 GLN N 2.260 C A 0129 ASP O
C A 0131 ASP N 2.245 C A 0130 GLN O
C A 0132 GLY N 2.243 C A 0131 ASP O
E A 0133 ARG N 2.256 C A 0132 GLY O
E A 0134 VAL N 2.264 E A 0133 ARG O
E A 0135 ASN N 2.267 E A 0134 VAL O
C A 0136 TYR N 2.791 C A 0096 GLY O
C A 0136 TYR N 3.133 E A 0134 VAL O
C A 0136 TYR N 2.255 E A 0135 ASN O
H A 0137 GLU N 3.080 E A 0135 ASN O
H A 0137 GLU N 2.251 C A 0136 TYR O
H A 0138 GLU N 2.263 H A 0137 GLU O
H A 0139 PHE N 2.838 E A 0135 ASN O
H A 0139 PHE N 2.877 H A 0137 GLU O
H A 0139 PHE N 2.254 H A 0138 GLU O
H A 0140 ALA N 2.752 H A 0137 GLU O
H A 0140 ALA N 3.174 H A 0138 GLU O
H A 0140 ALA N 2.242 H A 0139 PHE O
H A 0141 ARG N 2.883 H A 0138 GLU O
H A 0141 ARG N 3.094 H A 0139 PHE O
H A 0141 ARG N 2.260 H A 0140 ALA O
H A 0142 MET N 2.726 H A 0139 PHE O
H A 0142 MET N 2.249 H A 0141 ARG O
H A 0143 LEU N 2.790 H A 0139 PHE O
H A 0143 LEU N 2.253 H A 0142 MET O
H A 0144 ALA N 3.052 H A 0140 ALA O
H A 0144 ALA N 3.156 H A 0142 MET O
H A 0144 ALA N 2.249 H A 0143 LEU O
C A 0145 GLN N 3.108 H A 0142 MET O
C A 0145 GLN N 3.155 H A 0143 LEU O
C A 0145 GLN N 2.262 H A 0144 ALA O
C A 0146 GLU N 2.757 H A 0144 ALA O
C A 0146 GLU N 2.243 C A 0145 GLN O
HB_MS 2.00 3.20 3
C A 0076 ALA N 2.576 H A 0081 GLU OE1
E A 0097 HIS N 2.775 C A 0092 GLN OE1
C A 0132 GLY N 2.697 C A 0131 ASP OD2
HB_SS 2.00 3.20 5
C A 0095 ASP OD1 2.636 E A 0135 ASN ND2
C A 0095 ASP OD2 2.963 E A 0135 ASN ND2
H A 0118 GLU OE1 2.683 C A 0112 GLN NE2
H A 0120 ASP OD1 2.617 H A 0116 GLN NE2
H A 0125 GLU OE2 2.672 C A 0145 GLN NE2
AROMATIC 0.00 8.00 1
H A 0087 PHE 5.806 C A 0136 TYR