Complet list of 2b1u con fileClick here to see the 3D structure 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