Complet list of 1x9v con file
Complete list of 1x9v.con file
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 175
C A 0052 ASP C 2.423 C A 0053 THR CA
C A 0052 ASP C 2.879 C A 0053 THR C
C A 0052 ASP C 3.627 C A 0053 THR CB
C A 0053 THR C 2.422 H A 0054 TRP CA
C A 0053 THR C 3.158 H A 0054 TRP C
C A 0053 THR C 3.600 H A 0054 TRP CB
H A 0054 TRP CA 3.796 H A 0055 THR CA
H A 0054 TRP C 2.408 H A 0055 THR CA
H A 0054 TRP C 2.863 H A 0055 THR C
H A 0054 TRP C 3.621 H A 0055 THR CB
H A 0054 TRP C 3.785 H A 0058 GLU CG
H A 0055 THR C 2.424 H A 0056 GLY CA
H A 0055 THR C 3.213 H A 0056 GLY C
H A 0055 THR CA 3.473 H A 0058 GLU CG
H A 0055 THR CA 3.353 H A 0058 GLU CD
H A 0055 THR C 3.750 H A 0058 GLU CG
H A 0056 GLY C 2.425 H A 0057 VAL CA
H A 0056 GLY C 3.307 H A 0057 VAL C
H A 0056 GLY C 3.544 H A 0057 VAL CB
H A 0056 GLY C 3.615 H A 0057 VAL CG2
H A 0056 GLY C 3.749 H A 0060 LEU CG
H A 0056 GLY C 3.740 H A 0060 LEU CD1
H A 0057 VAL C 2.421 H A 0058 GLU CA
H A 0057 VAL C 2.885 H A 0058 GLU C
H A 0057 VAL C 3.641 H A 0058 GLU CB
H A 0057 VAL CA 3.747 H A 0060 LEU CB
H A 0057 VAL C 3.755 H A 0060 LEU CB
H A 0057 VAL C 3.705 H A 0061 ILE CG1
H A 0058 GLU C 2.418 H A 0059 ALA CA
H A 0058 GLU C 3.046 H A 0059 ALA C
H A 0058 GLU C 3.633 H A 0059 ALA CB
H A 0058 GLU CA 3.794 H A 0061 ILE CD1
H A 0059 ALA C 2.419 H A 0060 LEU CA
H A 0059 ALA C 3.169 H A 0060 LEU C
H A 0059 ALA C 3.595 H A 0060 LEU CB
H A 0059 ALA CA 3.521 H A 0062 ARG CG
H A 0059 ALA CA 3.517 H A 0062 ARG CD
H A 0059 ALA C 3.482 H A 0062 ARG CG
H A 0059 ALA C 3.711 H A 0063 ILE CG1
H A 0060 LEU C 2.420 H A 0061 ILE CA
H A 0060 LEU C 3.033 H A 0061 ILE C
H A 0060 LEU C 3.634 H A 0061 ILE CB
H A 0060 LEU C 3.589 H A 0064 LEU CD1
H A 0061 ILE C 2.426 H A 0062 ARG CA
H A 0061 ILE C 3.218 H A 0062 ARG C
H A 0061 ILE C 3.599 H A 0062 ARG CB
H A 0062 ARG CA 3.792 H A 0063 ILE CA
H A 0062 ARG C 2.396 H A 0063 ILE CA
H A 0062 ARG C 2.881 H A 0063 ILE C
H A 0062 ARG C 3.624 H A 0063 ILE CB
H A 0062 ARG CA 3.512 H A 0065 GLN CG
H A 0062 ARG CA 3.791 H A 0065 GLN CD
H A 0062 ARG C 3.691 H A 0065 GLN CG
H A 0063 ILE C 2.414 H A 0064 LEU CA
H A 0063 ILE C 3.089 H A 0064 LEU C
H A 0063 ILE C 3.613 H A 0064 LEU CB
H A 0064 LEU C 2.414 H A 0065 GLN CA
H A 0064 LEU C 3.005 H A 0065 GLN C
H A 0064 LEU C 3.644 H A 0065 GLN CB
H A 0065 GLN C 2.421 H A 0066 GLN CA
H A 0065 GLN C 2.938 H A 0066 GLN C
H A 0065 GLN C 3.638 H A 0066 GLN CB
H A 0066 GLN C 2.422 H A 0067 LEU CA
H A 0066 GLN C 2.900 H A 0067 LEU C
H A 0066 GLN C 3.638 H A 0067 LEU CB
H A 0067 LEU C 2.419 H A 0068 LEU CA
H A 0067 LEU C 2.847 H A 0068 LEU C
H A 0067 LEU C 3.607 H A 0068 LEU CB
H A 0068 LEU C 2.421 H A 0069 PHE CA
H A 0068 LEU C 2.865 H A 0069 PHE C
H A 0068 LEU C 3.625 H A 0069 PHE CB
H A 0069 PHE C 2.425 H A 0070 ILE CA
H A 0069 PHE C 3.173 H A 0070 ILE C
H A 0069 PHE C 3.606 H A 0070 ILE CB
H A 0069 PHE C 3.362 H A 0070 ILE CD1
H A 0069 PHE CA 3.156 H A 0072 PHE CD2
H A 0069 PHE CA 3.205 H A 0072 PHE CE2
H A 0069 PHE C 3.086 H A 0072 PHE CD2
H A 0069 PHE C 3.230 H A 0072 PHE CE2
H A 0070 ILE C 2.424 H A 0071 HIS CA
H A 0070 ILE C 2.889 H A 0071 HIS C
H A 0070 ILE C 3.626 H A 0071 HIS CB
H A 0070 ILE CA 3.328 H A 0073 ARG CG
H A 0070 ILE C 3.635 H A 0073 ARG CG
H A 0071 HIS C 2.421 H A 0072 PHE CA
H A 0071 HIS C 3.108 H A 0072 PHE C
H A 0071 HIS C 3.632 H A 0072 PHE CB
H A 0072 PHE C 2.423 H A 0073 ARG CA
H A 0072 PHE C 3.198 H A 0073 ARG C
H A 0072 PHE C 3.598 H A 0073 ARG CB
H A 0072 PHE CD1 3.717 H A 0073 ARG CA
H A 0072 PHE CE1 3.772 H A 0073 ARG CB
H A 0072 PHE CE2 3.795 H A 0073 ARG CB
H A 0072 PHE CZ 3.636 H A 0073 ARG CB
H A 0072 PHE C 3.789 C A 0077 ARG CG
H A 0073 ARG C 2.426 H A 0074 ILE CA
H A 0073 ARG C 3.579 H A 0074 ILE C
H A 0073 ARG C 3.294 H A 0074 ILE CB
H A 0073 ARG C 3.344 H A 0074 ILE CG1
H A 0073 ARG CG 3.624 H A 0074 ILE CG1
H A 0073 ARG CD 3.311 H A 0074 ILE CG1
H A 0073 ARG CA 3.373 C A 0077 ARG CG
H A 0073 ARG CA 3.533 C A 0077 ARG CD
H A 0073 ARG C 3.730 C A 0077 ARG CG
H A 0074 ILE C 2.421 H A 0075 GLY CA
H A 0074 ILE C 3.478 H A 0075 GLY C
H A 0074 ILE CA 3.630 C A 0078 HIS CA
H A 0074 ILE CA 3.634 C A 0078 HIS CB
H A 0074 ILE C 3.481 C A 0078 HIS CB
H A 0075 GLY C 2.420 H A 0076 CYS CA
H A 0075 GLY C 3.351 H A 0076 CYS C
H A 0075 GLY C 3.511 H A 0076 CYS CB
H A 0076 CYS C 2.422 C A 0077 ARG CA
H A 0076 CYS C 3.696 C A 0077 ARG C
H A 0076 CYS C 2.989 C A 0077 ARG CB
H A 0076 CYS C 3.519 C A 0077 ARG CG
C A 0077 ARG C 2.422 C A 0078 HIS CA
C A 0077 ARG C 2.906 C A 0078 HIS C
C A 0077 ARG C 3.633 C A 0078 HIS CB
C A 0078 HIS C 2.422 C A 0079 SER CA
C A 0078 HIS C 3.318 C A 0079 SER C
C A 0078 HIS C 3.538 C A 0079 SER CB
C A 0079 SER C 2.424 C A 0080 ARG CA
C A 0079 SER C 3.246 C A 0080 ARG C
C A 0079 SER C 3.578 C A 0080 ARG CB
C A 0080 ARG C 2.424 C A 0081 ILE CA
C A 0080 ARG C 2.948 C A 0081 ILE C
C A 0080 ARG C 3.636 C A 0081 ILE CB
C A 0081 ILE C 2.421 C A 0082 GLY CA
C A 0081 ILE C 3.559 C A 0082 GLY C
C A 0082 GLY C 2.423 C A 0083 ILE CA
C A 0082 GLY C 3.015 C A 0083 ILE C
C A 0082 GLY C 3.637 C A 0083 ILE CB
C A 0083 ILE C 2.423 C A 0084 ILE CA
C A 0083 ILE C 2.874 C A 0084 ILE C
C A 0083 ILE C 2.982 C A 0084 ILE CB
C A 0083 ILE C 3.365 C A 0084 ILE CG1
C A 0083 ILE CG2 3.712 C A 0086 GLN C
C A 0084 ILE C 2.425 C A 0085 GLN CA
C A 0084 ILE C 2.970 C A 0085 GLN C
C A 0084 ILE C 2.871 C A 0085 GLN CB
C A 0085 GLN C 2.425 C A 0086 GLN CA
C A 0085 GLN C 3.705 C A 0086 GLN C
C A 0085 GLN C 2.910 C A 0086 GLN CB
C A 0086 GLN C 2.424 C A 0087 ARG CA
C A 0086 GLN C 2.884 C A 0087 ARG C
C A 0086 GLN C 3.628 C A 0087 ARG CB
C A 0087 ARG C 2.423 C A 0088 ARG CA
C A 0087 ARG C 3.086 C A 0088 ARG C
C A 0087 ARG C 3.630 C A 0088 ARG CB
C A 0088 ARG C 2.436 C A 0089 THR CA
C A 0088 ARG C 2.841 C A 0089 THR C
C A 0088 ARG C 3.082 C A 0089 THR CB
C A 0088 ARG C 2.957 C A 0089 THR CG2
C A 0089 THR C 2.424 C A 0090 ARG CA
C A 0089 THR C 2.958 C A 0090 ARG C
C A 0089 THR C 2.882 C A 0090 ARG CB
C A 0090 ARG C 2.423 C A 0091 ASN CA
C A 0090 ARG C 2.989 C A 0091 ASN C
C A 0090 ARG C 3.639 C A 0091 ASN CB
C A 0091 ASN C 2.422 C A 0092 GLY CA
C A 0091 ASN C 3.695 C A 0092 GLY C
C A 0092 GLY C 2.424 C A 0093 ALA CA
C A 0092 GLY C 3.318 C A 0093 ALA C
C A 0092 GLY C 3.539 C A 0093 ALA CB
C A 0093 ALA C 2.423 C A 0094 SER CA
C A 0093 ALA C 2.926 C A 0094 SER C
C A 0093 ALA C 2.918 C A 0094 SER CB
C A 0094 SER C 2.424 C A 0095 LYS CA
C A 0094 SER C 3.569 C A 0095 LYS C
C A 0094 SER C 3.299 C A 0095 LYS CB
C A 0094 SER C 3.313 C A 0095 LYS CG
C A 0095 LYS C 2.424 C A 0096 SER CA
C A 0095 LYS C 2.877 C A 0096 SER C
C A 0095 LYS C 2.979 C A 0096 SER CB
CHARGE_ATTR 2.00 12.00 4
H A 0058 GLU OE1 8.574 H A 0062 ARG NH1
H A 0058 GLU OE1 6.465 H A 0062 ARG NH2
H A 0058 GLU OE2 7.042 H A 0062 ARG NH1
H A 0058 GLU OE2 4.933 H A 0062 ARG NH2
CHARGE_REPU 2.00 12.00 36
C A 0052 ASP OD1 9.817 H A 0058 GLU OE1
C A 0052 ASP OD1 10.70 H A 0058 GLU OE2
C A 0052 ASP OD2 7.922 H A 0058 GLU OE1
C A 0052 ASP OD2 8.641 H A 0058 GLU OE2
H A 0071 HIS ND1 10.97 C A 0078 HIS ND1
H A 0071 HIS ND1 11.08 C A 0078 HIS NE2
H A 0073 ARG NH1 6.980 C A 0077 ARG NH1
H A 0073 ARG NH1 5.459 C A 0077 ARG NH2
H A 0073 ARG NH2 8.032 C A 0077 ARG NH1
H A 0073 ARG NH2 7.014 C A 0077 ARG NH2
H A 0073 ARG NH1 10.50 C A 0078 HIS ND1
H A 0073 ARG NH1 11.95 C A 0078 HIS NE2
C A 0077 ARG NH1 10.36 C A 0078 HIS ND1
C A 0077 ARG NH1 10.54 C A 0078 HIS NE2
C A 0077 ARG NH2 8.881 C A 0078 HIS ND1
C A 0077 ARG NH2 9.452 C A 0078 HIS NE2
C A 0078 HIS ND1 9.062 C A 0080 ARG NH1
C A 0078 HIS ND1 9.344 C A 0080 ARG NH2
C A 0078 HIS NE2 8.598 C A 0080 ARG NH1
C A 0078 HIS NE2 9.323 C A 0080 ARG NH2
C A 0078 HIS ND1 9.183 C A 0088 ARG NH1
C A 0078 HIS ND1 8.888 C A 0088 ARG NH2
C A 0078 HIS NE2 10.19 C A 0088 ARG NH1
C A 0078 HIS NE2 9.451 C A 0088 ARG NH2
C A 0080 ARG NH1 7.002 C A 0087 ARG NH1
C A 0080 ARG NH1 8.257 C A 0087 ARG NH2
C A 0080 ARG NH2 7.919 C A 0087 ARG NH1
C A 0080 ARG NH2 9.548 C A 0087 ARG NH2
C A 0080 ARG NH1 10.37 C A 0088 ARG NH1
C A 0080 ARG NH1 10.06 C A 0088 ARG NH2
C A 0080 ARG NH2 10.68 C A 0088 ARG NH1
C A 0080 ARG NH2 10.85 C A 0088 ARG NH2
C A 0087 ARG NH1 10.18 C A 0090 ARG NH1
C A 0087 ARG NH1 9.717 C A 0090 ARG NH2
C A 0087 ARG NH2 9.335 C A 0090 ARG NH1
C A 0087 ARG NH2 9.376 C A 0090 ARG NH2
HB_MM 2.00 3.20 75
C A 0053 THR N 2.196 C A 0052 ASP O
H A 0054 TRP N 2.196 C A 0053 THR O
H A 0055 THR N 2.188 H A 0054 TRP O
H A 0056 GLY N 2.816 C A 0052 ASP O
H A 0056 GLY N 2.623 H A 0054 TRP O
H A 0056 GLY N 2.199 H A 0055 THR O
H A 0057 VAL N 2.405 H A 0054 TRP O
H A 0057 VAL N 2.198 H A 0056 GLY O
H A 0058 GLU N 2.699 H A 0054 TRP O
H A 0058 GLU N 2.198 H A 0057 VAL O
H A 0059 ALA N 3.074 H A 0057 VAL O
H A 0059 ALA N 2.197 H A 0058 GLU O
H A 0060 LEU N 2.574 H A 0057 VAL O
H A 0060 LEU N 2.198 H A 0059 ALA O
H A 0061 ILE N 2.465 H A 0057 VAL O
H A 0061 ILE N 3.077 H A 0058 GLU O
H A 0061 ILE N 2.203 H A 0060 LEU O
H A 0062 ARG N 3.160 H A 0058 GLU O
H A 0062 ARG N 2.205 H A 0061 ILE O
H A 0063 ILE N 2.874 H A 0059 ALA O
H A 0063 ILE N 2.188 H A 0062 ARG O
H A 0064 LEU N 2.984 H A 0062 ARG O
H A 0064 LEU N 2.196 H A 0063 ILE O
H A 0065 GLN N 2.929 H A 0062 ARG O
H A 0065 GLN N 2.197 H A 0064 LEU O
H A 0066 GLN N 2.424 H A 0062 ARG O
H A 0066 GLN N 2.201 H A 0065 GLN O
H A 0067 LEU N 3.077 H A 0063 ILE O
H A 0067 LEU N 2.199 H A 0066 GLN O
H A 0068 LEU N 3.166 H A 0064 LEU O
H A 0068 LEU N 2.195 H A 0067 LEU O
H A 0069 PHE N 2.908 H A 0065 GLN O
H A 0069 PHE N 3.041 H A 0066 GLN O
H A 0069 PHE N 2.959 H A 0067 LEU O
H A 0069 PHE N 2.197 H A 0068 LEU O
H A 0070 ILE N 2.542 H A 0067 LEU O
H A 0070 ILE N 2.744 H A 0068 LEU O
H A 0070 ILE N 2.196 H A 0069 PHE O
H A 0071 HIS N 3.007 H A 0067 LEU O
H A 0071 HIS N 2.952 H A 0068 LEU O
H A 0071 HIS N 2.196 H A 0070 ILE O
H A 0072 PHE N 3.010 H A 0068 LEU O
H A 0072 PHE N 2.994 H A 0070 ILE O
H A 0072 PHE N 2.194 H A 0071 HIS O
H A 0073 ARG N 2.892 H A 0070 ILE O
H A 0073 ARG N 2.195 H A 0072 PHE O
H A 0074 ILE N 2.531 H A 0070 ILE O
H A 0074 ILE N 2.195 H A 0073 ARG O
H A 0075 GLY N 2.530 H A 0071 HIS O
H A 0075 GLY N 2.194 H A 0074 ILE O
H A 0076 CYS N 2.197 H A 0075 GLY O
C A 0077 ARG N 2.197 H A 0076 CYS O
C A 0078 HIS N 2.196 C A 0077 ARG O
C A 0079 SER N 2.195 C A 0078 HIS O
C A 0080 ARG N 2.197 C A 0079 SER O
C A 0081 ILE N 3.096 C A 0079 SER O
C A 0081 ILE N 2.196 C A 0080 ARG O
C A 0082 GLY N 2.852 C A 0080 ARG O
C A 0082 GLY N 2.197 C A 0081 ILE O
C A 0083 ILE N 2.197 C A 0082 GLY O
C A 0084 ILE N 2.196 C A 0083 ILE O
C A 0085 GLN N 2.196 C A 0084 ILE O
C A 0086 GLN N 2.197 C A 0085 GLN O
C A 0087 ARG N 2.197 C A 0086 GLN O
C A 0088 ARG N 2.195 C A 0087 ARG O
C A 0089 THR N 2.593 C A 0087 ARG O
C A 0089 THR N 2.202 C A 0088 ARG O
C A 0090 ARG N 2.640 C A 0088 ARG O
C A 0090 ARG N 2.197 C A 0089 THR O
C A 0091 ASN N 2.197 C A 0090 ARG O
C A 0092 GLY N 2.197 C A 0091 ASN O
C A 0093 ALA N 2.196 C A 0092 GLY O
C A 0094 SER N 2.197 C A 0093 ALA O
C A 0095 LYS N 2.196 C A 0094 SER O
C A 0096 SER N 2.196 C A 0095 LYS O
HB_MS 2.00 3.20 2
H A 0054 TRP N 3.046 C A 0053 THR OG1
H A 0055 THR N 3.142 H A 0058 GLU OE1
AROMATIC 0.00 8.00 2
H A 0069 PHE 5.668 H A 0072 PHE
C A 0077 ARG 6.827 H A 0072 PHE
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 50
H A 0054 TRP CE3 3.344 H B 0068 LEU CD1
H A 0054 TRP CE3 3.220 H B 0068 LEU CD2
H A 0054 TRP CZ3 2.891 H B 0068 LEU CD2
H A 0054 TRP CD1 3.449 H B 0071 HIS CD2
H A 0054 TRP CD2 3.515 H B 0071 HIS CD2
H A 0054 TRP CE2 3.169 H B 0071 HIS CG
H A 0054 TRP CE2 2.874 H B 0071 HIS CD2
H A 0054 TRP CE2 3.617 H B 0071 HIS CE1
H A 0054 TRP CZ2 3.194 H B 0071 HIS CB
H A 0054 TRP CZ2 2.955 H B 0071 HIS CG
H A 0054 TRP CZ2 3.267 H B 0071 HIS CD2
H A 0054 TRP CH2 3.460 H B 0071 HIS CB
H A 0054 TRP CH2 3.760 H B 0071 HIS CG
H A 0057 VAL CG1 3.605 H B 0064 LEU CD2
H A 0057 VAL CB 3.796 H B 0068 LEU CD2
H A 0057 VAL CG1 3.013 H B 0068 LEU CD2
H A 0061 ILE CG1 3.797 H B 0064 LEU CA
H A 0061 ILE CG1 3.286 H B 0064 LEU C
H A 0061 ILE CG1 3.139 H B 0064 LEU CB
H A 0061 ILE CD1 3.335 H B 0064 LEU C
H A 0061 ILE CG2 3.652 H B 0065 GLN CB
H A 0061 ILE CD1 3.369 H B 0065 GLN CA
H A 0061 ILE CD1 3.766 H B 0068 LEU CB
H A 0061 ILE CD1 3.319 H B 0068 LEU CG
H A 0064 LEU CD2 3.571 H B 0057 VAL CG1
H A 0064 LEU CA 3.751 H B 0061 ILE CG1
H A 0064 LEU C 3.239 H B 0061 ILE CG1
H A 0064 LEU C 3.282 H B 0061 ILE CD1
H A 0064 LEU CB 3.104 H B 0061 ILE CG1
H A 0064 LEU CD1 2.804 H B 0064 LEU CD1
H A 0065 GLN CA 3.328 H B 0061 ILE CD1
H A 0065 GLN CB 3.628 H B 0061 ILE CG2
H A 0068 LEU CD1 3.379 H B 0054 TRP CE3
H A 0068 LEU CD2 3.182 H B 0054 TRP CE3
H A 0068 LEU CD2 2.894 H B 0054 TRP CZ3
H A 0068 LEU CD2 3.750 H B 0057 VAL CB
H A 0068 LEU CD2 2.999 H B 0057 VAL CG1
H A 0068 LEU CB 3.739 H B 0061 ILE CD1
H A 0068 LEU CG 3.301 H B 0061 ILE CD1
H A 0071 HIS CB 3.773 H B 0054 TRP CE2
H A 0071 HIS CB 3.153 H B 0054 TRP CZ2
H A 0071 HIS CB 3.460 H B 0054 TRP CH2
H A 0071 HIS CG 3.113 H B 0054 TRP CE2
H A 0071 HIS CG 2.975 H B 0054 TRP CZ2
H A 0071 HIS CD2 3.738 H B 0054 TRP CG
H A 0071 HIS CD2 3.352 H B 0054 TRP CD1
H A 0071 HIS CD2 3.483 H B 0054 TRP CD2
H A 0071 HIS CD2 2.887 H B 0054 TRP CE2
H A 0071 HIS CD2 3.347 H B 0054 TRP CZ2
H A 0071 HIS CE1 3.612 H B 0054 TRP CE2
CHARGE_ATTR 2.00 12.00 8
H A 0058 GLU OE1 9.732 H B 0071 HIS ND1
H A 0058 GLU OE1 7.874 H B 0071 HIS NE2
H A 0058 GLU OE2 11.70 H B 0071 HIS ND1
H A 0058 GLU OE2 9.816 H B 0071 HIS NE2
H A 0071 HIS ND1 9.595 H B 0058 GLU OE1
H A 0071 HIS ND1 11.56 H B 0058 GLU OE2
H A 0071 HIS NE2 7.741 H B 0058 GLU OE1
H A 0071 HIS NE2 9.678 H B 0058 GLU OE2
AROMATIC 0.00 8.00 2
H A 0054 TRP 3.864 H B 0071 HIS
H A 0071 HIS 3.877 H B 0054 TRP
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 176
C B 0052 ASP C 2.423 C B 0053 THR CA
C B 0052 ASP C 2.879 C B 0053 THR C
C B 0052 ASP C 3.628 C B 0053 THR CB
C B 0053 THR C 2.424 H B 0054 TRP CA
C B 0053 THR C 3.158 H B 0054 TRP C
C B 0053 THR C 3.600 H B 0054 TRP CB
H B 0054 TRP CA 3.795 H B 0055 THR CA
H B 0054 TRP C 2.409 H B 0055 THR CA
H B 0054 TRP C 2.864 H B 0055 THR C
H B 0054 TRP C 3.621 H B 0055 THR CB
H B 0054 TRP CE3 3.799 H B 0057 VAL CG2
H B 0054 TRP C 3.785 H B 0058 GLU CG
H B 0055 THR C 2.424 H B 0056 GLY CA
H B 0055 THR C 3.213 H B 0056 GLY C
H B 0055 THR CA 3.471 H B 0058 GLU CG
H B 0055 THR CA 3.352 H B 0058 GLU CD
H B 0055 THR C 3.750 H B 0058 GLU CG
H B 0056 GLY C 2.425 H B 0057 VAL CA
H B 0056 GLY C 3.308 H B 0057 VAL C
H B 0056 GLY C 3.545 H B 0057 VAL CB
H B 0056 GLY C 3.615 H B 0057 VAL CG2
H B 0056 GLY C 3.750 H B 0060 LEU CG
H B 0056 GLY C 3.741 H B 0060 LEU CD1
H B 0057 VAL C 2.422 H B 0058 GLU CA
H B 0057 VAL C 2.887 H B 0058 GLU C
H B 0057 VAL C 3.642 H B 0058 GLU CB
H B 0057 VAL CA 3.748 H B 0060 LEU CB
H B 0057 VAL C 3.755 H B 0060 LEU CB
H B 0057 VAL C 3.707 H B 0061 ILE CG1
H B 0058 GLU C 2.417 H B 0059 ALA CA
H B 0058 GLU C 3.045 H B 0059 ALA C
H B 0058 GLU C 3.632 H B 0059 ALA CB
H B 0058 GLU CA 3.790 H B 0061 ILE CD1
H B 0059 ALA C 2.419 H B 0060 LEU CA
H B 0059 ALA C 3.169 H B 0060 LEU C
H B 0059 ALA C 3.595 H B 0060 LEU CB
H B 0059 ALA CA 3.522 H B 0062 ARG CG
H B 0059 ALA CA 3.517 H B 0062 ARG CD
H B 0059 ALA C 3.483 H B 0062 ARG CG
H B 0059 ALA C 3.710 H B 0063 ILE CG1
H B 0060 LEU C 2.420 H B 0061 ILE CA
H B 0060 LEU C 3.033 H B 0061 ILE C
H B 0060 LEU C 3.633 H B 0061 ILE CB
H B 0060 LEU C 3.590 H B 0064 LEU CD1
H B 0061 ILE C 2.425 H B 0062 ARG CA
H B 0061 ILE C 3.218 H B 0062 ARG C
H B 0061 ILE C 3.597 H B 0062 ARG CB
H B 0062 ARG CA 3.791 H B 0063 ILE CA
H B 0062 ARG C 2.396 H B 0063 ILE CA
H B 0062 ARG C 2.881 H B 0063 ILE C
H B 0062 ARG C 3.623 H B 0063 ILE CB
H B 0062 ARG CA 3.512 H B 0065 GLN CG
H B 0062 ARG CA 3.790 H B 0065 GLN CD
H B 0062 ARG C 3.692 H B 0065 GLN CG
H B 0063 ILE C 2.415 H B 0064 LEU CA
H B 0063 ILE C 3.091 H B 0064 LEU C
H B 0063 ILE C 3.615 H B 0064 LEU CB
H B 0064 LEU C 2.414 H B 0065 GLN CA
H B 0064 LEU C 3.005 H B 0065 GLN C
H B 0064 LEU C 3.643 H B 0065 GLN CB
H B 0065 GLN C 2.421 H B 0066 GLN CA
H B 0065 GLN C 2.938 H B 0066 GLN C
H B 0065 GLN C 3.638 H B 0066 GLN CB
H B 0066 GLN C 2.422 H B 0067 LEU CA
H B 0066 GLN C 2.902 H B 0067 LEU C
H B 0066 GLN C 3.639 H B 0067 LEU CB
H B 0067 LEU C 2.418 H B 0068 LEU CA
H B 0067 LEU C 2.844 H B 0068 LEU C
H B 0067 LEU C 3.606 H B 0068 LEU CB
H B 0068 LEU C 2.421 H B 0069 PHE CA
H B 0068 LEU C 2.866 H B 0069 PHE C
H B 0068 LEU C 3.626 H B 0069 PHE CB
H B 0069 PHE C 2.424 H B 0070 ILE CA
H B 0069 PHE C 3.172 H B 0070 ILE C
H B 0069 PHE C 3.606 H B 0070 ILE CB
H B 0069 PHE C 3.362 H B 0070 ILE CD1
H B 0069 PHE CA 3.156 H B 0072 PHE CD2
H B 0069 PHE CA 3.206 H B 0072 PHE CE2
H B 0069 PHE C 3.085 H B 0072 PHE CD2
H B 0069 PHE C 3.230 H B 0072 PHE CE2
H B 0070 ILE C 2.426 H B 0071 HIS CA
H B 0070 ILE C 2.890 H B 0071 HIS C
H B 0070 ILE C 3.627 H B 0071 HIS CB
H B 0070 ILE CA 3.326 H B 0073 ARG CG
H B 0070 ILE C 3.634 H B 0073 ARG CG
H B 0071 HIS C 2.422 H B 0072 PHE CA
H B 0071 HIS C 3.108 H B 0072 PHE C
H B 0071 HIS C 3.633 H B 0072 PHE CB
H B 0072 PHE C 2.422 H B 0073 ARG CA
H B 0072 PHE C 3.197 H B 0073 ARG C
H B 0072 PHE C 3.597 H B 0073 ARG CB
H B 0072 PHE CD1 3.716 H B 0073 ARG CA
H B 0072 PHE CE1 3.772 H B 0073 ARG CB
H B 0072 PHE CE2 3.795 H B 0073 ARG CB
H B 0072 PHE CZ 3.636 H B 0073 ARG CB
H B 0072 PHE C 3.789 C B 0077 ARG CG
H B 0073 ARG C 2.425 H B 0074 ILE CA
H B 0073 ARG C 3.579 H B 0074 ILE C
H B 0073 ARG C 3.293 H B 0074 ILE CB
H B 0073 ARG C 3.345 H B 0074 ILE CG1
H B 0073 ARG CG 3.625 H B 0074 ILE CG1
H B 0073 ARG CD 3.311 H B 0074 ILE CG1
H B 0073 ARG CA 3.371 C B 0077 ARG CG
H B 0073 ARG CA 3.534 C B 0077 ARG CD
H B 0073 ARG C 3.729 C B 0077 ARG CG
H B 0074 ILE C 2.422 H B 0075 GLY CA
H B 0074 ILE C 3.478 H B 0075 GLY C
H B 0074 ILE CA 3.629 C B 0078 HIS CA
H B 0074 ILE CA 3.633 C B 0078 HIS CB
H B 0074 ILE C 3.480 C B 0078 HIS CB
H B 0075 GLY C 2.421 H B 0076 CYS CA
H B 0075 GLY C 3.352 H B 0076 CYS C
H B 0075 GLY C 3.511 H B 0076 CYS CB
H B 0076 CYS C 2.421 C B 0077 ARG CA
H B 0076 CYS C 3.697 C B 0077 ARG C
H B 0076 CYS C 2.988 C B 0077 ARG CB
H B 0076 CYS C 3.518 C B 0077 ARG CG
C B 0077 ARG C 2.422 C B 0078 HIS CA
C B 0077 ARG C 2.906 C B 0078 HIS C
C B 0077 ARG C 3.633 C B 0078 HIS CB
C B 0078 HIS C 2.423 C B 0079 SER CA
C B 0078 HIS C 3.318 C B 0079 SER C
C B 0078 HIS C 3.537 C B 0079 SER CB
C B 0079 SER C 2.424 C B 0080 ARG CA
C B 0079 SER C 3.247 C B 0080 ARG C
C B 0079 SER C 3.580 C B 0080 ARG CB
C B 0080 ARG C 2.423 C B 0081 ILE CA
C B 0080 ARG C 2.946 C B 0081 ILE C
C B 0080 ARG C 3.635 C B 0081 ILE CB
C B 0081 ILE C 2.422 C B 0082 GLY CA
C B 0081 ILE C 3.559 C B 0082 GLY C
C B 0082 GLY C 2.422 C B 0083 ILE CA
C B 0082 GLY C 3.016 C B 0083 ILE C
C B 0082 GLY C 3.637 C B 0083 ILE CB
C B 0083 ILE C 2.423 C B 0084 ILE CA
C B 0083 ILE C 2.875 C B 0084 ILE C
C B 0083 ILE C 2.982 C B 0084 ILE CB
C B 0083 ILE C 3.365 C B 0084 ILE CG1
C B 0083 ILE CG2 3.712 C B 0086 GLN C
C B 0084 ILE C 2.423 C B 0085 GLN CA
C B 0084 ILE C 2.970 C B 0085 GLN C
C B 0084 ILE C 2.869 C B 0085 GLN CB
C B 0085 GLN C 2.424 C B 0086 GLN CA
C B 0085 GLN C 3.704 C B 0086 GLN C
C B 0085 GLN C 2.910 C B 0086 GLN CB
C B 0086 GLN C 2.424 C B 0087 ARG CA
C B 0086 GLN C 2.883 C B 0087 ARG C
C B 0086 GLN C 3.628 C B 0087 ARG CB
C B 0087 ARG C 2.424 C B 0088 ARG CA
C B 0087 ARG C 3.086 C B 0088 ARG C
C B 0087 ARG C 3.631 C B 0088 ARG CB
C B 0088 ARG C 2.436 C B 0089 THR CA
C B 0088 ARG C 2.841 C B 0089 THR C
C B 0088 ARG C 3.082 C B 0089 THR CB
C B 0088 ARG C 2.957 C B 0089 THR CG2
C B 0089 THR C 2.423 C B 0090 ARG CA
C B 0089 THR C 2.957 C B 0090 ARG C
C B 0089 THR C 2.882 C B 0090 ARG CB
C B 0090 ARG C 2.423 C B 0091 ASN CA
C B 0090 ARG C 2.989 C B 0091 ASN C
C B 0090 ARG C 3.640 C B 0091 ASN CB
C B 0091 ASN C 2.422 C B 0092 GLY CA
C B 0091 ASN C 3.696 C B 0092 GLY C
C B 0092 GLY C 2.423 C B 0093 ALA CA
C B 0092 GLY C 3.319 C B 0093 ALA C
C B 0092 GLY C 3.538 C B 0093 ALA CB
C B 0093 ALA C 2.422 C B 0094 SER CA
C B 0093 ALA C 2.926 C B 0094 SER C
C B 0093 ALA C 2.917 C B 0094 SER CB
C B 0094 SER C 2.423 C B 0095 LYS CA
C B 0094 SER C 3.568 C B 0095 LYS C
C B 0094 SER C 3.299 C B 0095 LYS CB
C B 0094 SER C 3.313 C B 0095 LYS CG
C B 0095 LYS C 2.424 C B 0096 SER CA
C B 0095 LYS C 2.877 C B 0096 SER C
C B 0095 LYS C 2.979 C B 0096 SER CB
CHARGE_ATTR 2.00 12.00 4
H B 0058 GLU OE1 8.574 H B 0062 ARG NH1
H B 0058 GLU OE1 6.465 H B 0062 ARG NH2
H B 0058 GLU OE2 7.043 H B 0062 ARG NH1
H B 0058 GLU OE2 4.934 H B 0062 ARG NH2
CHARGE_REPU 2.00 12.00 36
C B 0052 ASP OD1 9.817 H B 0058 GLU OE1
C B 0052 ASP OD1 10.70 H B 0058 GLU OE2
C B 0052 ASP OD2 7.922 H B 0058 GLU OE1
C B 0052 ASP OD2 8.640 H B 0058 GLU OE2
H B 0071 HIS ND1 10.97 C B 0078 HIS ND1
H B 0071 HIS ND1 11.09 C B 0078 HIS NE2
H B 0073 ARG NH1 6.981 C B 0077 ARG NH1
H B 0073 ARG NH1 5.459 C B 0077 ARG NH2
H B 0073 ARG NH2 8.033 C B 0077 ARG NH1
H B 0073 ARG NH2 7.013 C B 0077 ARG NH2
H B 0073 ARG NH1 10.50 C B 0078 HIS ND1
H B 0073 ARG NH1 11.96 C B 0078 HIS NE2
C B 0077 ARG NH1 10.36 C B 0078 HIS ND1
C B 0077 ARG NH1 10.54 C B 0078 HIS NE2
C B 0077 ARG NH2 8.881 C B 0078 HIS ND1
C B 0077 ARG NH2 9.452 C B 0078 HIS NE2
C B 0078 HIS ND1 9.062 C B 0080 ARG NH1
C B 0078 HIS ND1 9.346 C B 0080 ARG NH2
C B 0078 HIS NE2 8.597 C B 0080 ARG NH1
C B 0078 HIS NE2 9.323 C B 0080 ARG NH2
C B 0078 HIS ND1 9.184 C B 0088 ARG NH1
C B 0078 HIS ND1 8.888 C B 0088 ARG NH2
C B 0078 HIS NE2 10.19 C B 0088 ARG NH1
C B 0078 HIS NE2 9.450 C B 0088 ARG NH2
C B 0080 ARG NH1 7.002 C B 0087 ARG NH1
C B 0080 ARG NH1 8.259 C B 0087 ARG NH2
C B 0080 ARG NH2 7.918 C B 0087 ARG NH1
C B 0080 ARG NH2 9.548 C B 0087 ARG NH2
C B 0080 ARG NH1 10.37 C B 0088 ARG NH1
C B 0080 ARG NH1 10.06 C B 0088 ARG NH2
C B 0080 ARG NH2 10.69 C B 0088 ARG NH1
C B 0080 ARG NH2 10.85 C B 0088 ARG NH2
C B 0087 ARG NH1 10.18 C B 0090 ARG NH1
C B 0087 ARG NH1 9.717 C B 0090 ARG NH2
C B 0087 ARG NH2 9.334 C B 0090 ARG NH1
C B 0087 ARG NH2 9.376 C B 0090 ARG NH2
HB_MM 2.00 3.20 75
C B 0053 THR N 2.197 C B 0052 ASP O
H B 0054 TRP N 2.197 C B 0053 THR O
H B 0055 THR N 2.187 H B 0054 TRP O
H B 0056 GLY N 2.817 C B 0052 ASP O
H B 0056 GLY N 2.621 H B 0054 TRP O
H B 0056 GLY N 2.198 H B 0055 THR O
H B 0057 VAL N 2.406 H B 0054 TRP O
H B 0057 VAL N 2.197 H B 0056 GLY O
H B 0058 GLU N 2.699 H B 0054 TRP O
H B 0058 GLU N 2.197 H B 0057 VAL O
H B 0059 ALA N 3.073 H B 0057 VAL O
H B 0059 ALA N 2.196 H B 0058 GLU O
H B 0060 LEU N 2.574 H B 0057 VAL O
H B 0060 LEU N 2.199 H B 0059 ALA O
H B 0061 ILE N 2.467 H B 0057 VAL O
H B 0061 ILE N 3.078 H B 0058 GLU O
H B 0061 ILE N 2.202 H B 0060 LEU O
H B 0062 ARG N 3.162 H B 0058 GLU O
H B 0062 ARG N 2.202 H B 0061 ILE O
H B 0063 ILE N 2.873 H B 0059 ALA O
H B 0063 ILE N 2.189 H B 0062 ARG O
H B 0064 LEU N 2.985 H B 0062 ARG O
H B 0064 LEU N 2.196 H B 0063 ILE O
H B 0065 GLN N 2.929 H B 0062 ARG O
H B 0065 GLN N 2.197 H B 0064 LEU O
H B 0066 GLN N 2.424 H B 0062 ARG O
H B 0066 GLN N 2.201 H B 0065 GLN O
H B 0067 LEU N 3.076 H B 0063 ILE O
H B 0067 LEU N 2.198 H B 0066 GLN O
H B 0068 LEU N 3.164 H B 0064 LEU O
H B 0068 LEU N 2.197 H B 0067 LEU O
H B 0069 PHE N 2.908 H B 0065 GLN O
H B 0069 PHE N 3.041 H B 0066 GLN O
H B 0069 PHE N 2.960 H B 0067 LEU O
H B 0069 PHE N 2.198 H B 0068 LEU O
H B 0070 ILE N 2.542 H B 0067 LEU O
H B 0070 ILE N 2.744 H B 0068 LEU O
H B 0070 ILE N 2.197 H B 0069 PHE O
H B 0071 HIS N 3.006 H B 0067 LEU O
H B 0071 HIS N 2.951 H B 0068 LEU O
H B 0071 HIS N 2.196 H B 0070 ILE O
H B 0072 PHE N 3.009 H B 0068 LEU O
H B 0072 PHE N 2.994 H B 0070 ILE O
H B 0072 PHE N 2.195 H B 0071 HIS O
H B 0073 ARG N 2.891 H B 0070 ILE O
H B 0073 ARG N 2.196 H B 0072 PHE O
H B 0074 ILE N 2.530 H B 0070 ILE O
H B 0074 ILE N 2.195 H B 0073 ARG O
H B 0075 GLY N 2.530 H B 0071 HIS O
H B 0075 GLY N 2.195 H B 0074 ILE O
H B 0076 CYS N 2.197 H B 0075 GLY O
C B 0077 ARG N 2.197 H B 0076 CYS O
C B 0078 HIS N 2.196 C B 0077 ARG O
C B 0079 SER N 2.195 C B 0078 HIS O
C B 0080 ARG N 2.197 C B 0079 SER O
C B 0081 ILE N 3.096 C B 0079 SER O
C B 0081 ILE N 2.196 C B 0080 ARG O
C B 0082 GLY N 2.852 C B 0080 ARG O
C B 0082 GLY N 2.196 C B 0081 ILE O
C B 0083 ILE N 2.197 C B 0082 GLY O
C B 0084 ILE N 2.197 C B 0083 ILE O
C B 0085 GLN N 2.197 C B 0084 ILE O
C B 0086 GLN N 2.197 C B 0085 GLN O
C B 0087 ARG N 2.196 C B 0086 GLN O
C B 0088 ARG N 2.197 C B 0087 ARG O
C B 0089 THR N 2.594 C B 0087 ARG O
C B 0089 THR N 2.203 C B 0088 ARG O
C B 0090 ARG N 2.639 C B 0088 ARG O
C B 0090 ARG N 2.196 C B 0089 THR O
C B 0091 ASN N 2.197 C B 0090 ARG O
C B 0092 GLY N 2.197 C B 0091 ASN O
C B 0093 ALA N 2.197 C B 0092 GLY O
C B 0094 SER N 2.196 C B 0093 ALA O
C B 0095 LYS N 2.196 C B 0094 SER O
C B 0096 SER N 2.195 C B 0095 LYS O
HB_MS 2.00 3.20 2
H B 0054 TRP N 3.046 C B 0053 THR OG1
H B 0055 THR N 3.143 H B 0058 GLU OE1
AROMATIC 0.00 8.00 2
H B 0069 PHE 5.667 H B 0072 PHE
C B 0077 ARG 6.827 H B 0072 PHE