/usr/share/pdb2pqr/dat/AMBER.DAT is in pdb2pqr 2.1.0+dfsg-1.
This file is owned by root:root, with mode 0o644.
The actual contents of the file can be viewed below.
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2222 2223 2224 2225 2226 2227 2228 2229 2230 2231 2232 2233 2234 2235 2236 2237 2238 2239 2240 2241 2242 2243 2244 2245 2246 2247 2248 2249 2250 2251 2252 2253 2254 2255 2256 2257 2258 2259 | # Amber 99 parameters for use with PDB2PQR
#
ALA N -0.415700 1.8240 N
ALA H 0.271900 0.6000 H
ALA CA 0.033700 1.9080 CT
ALA HA 0.082300 1.3870 H1
ALA CB -0.182500 1.9080 CT
ALA HB1 0.060300 1.4870 HC
ALA HB2 0.060300 1.4870 HC
ALA HB3 0.060300 1.4870 HC
ALA C 0.597300 1.9080 C
ALA O -0.567900 1.6612 O
ARG N -0.347900 1.8240 N
ARG H 0.274700 0.6000 H
ARG CA -0.263700 1.9080 CT
ARG HA 0.156000 1.3870 H1
ARG CB -0.000700 1.9080 CT
ARG HB2 0.032700 1.4870 HC
ARG HB3 0.032700 1.4870 HC
ARG CG 0.039000 1.9080 CT
ARG HG2 0.028500 1.4870 HC
ARG HG3 0.028500 1.4870 HC
ARG CD 0.048600 1.9080 CT
ARG HD2 0.068700 1.3870 H1
ARG HD3 0.068700 1.3870 H1
ARG NE -0.529500 1.8240 N2
ARG HE 0.345600 0.6000 H
ARG CZ 0.807600 1.9080 CA
ARG NH1 -0.862700 1.8240 N2
ARG HH11 0.447800 0.6000 H
ARG HH12 0.447800 0.6000 H
ARG NH2 -0.862700 1.8240 N2
ARG HH21 0.447800 0.6000 H
ARG HH22 0.447800 0.6000 H
ARG C 0.734100 1.9080 C
ARG O -0.589400 1.6612 O
ASH N -0.415700 1.8240 N
ASH H 0.271900 0.6000 H
ASH CA 0.034100 1.9080 CT
ASH HA 0.086400 1.3870 H1
ASH CB -0.031600 1.9080 CT
ASH HB2 0.048800 1.4870 HC
ASH HB3 0.048800 1.4870 HC
ASH CG 0.646200 1.9080 C
ASH OD1 -0.555400 1.6612 O
ASH OD2 -0.637600 1.7210 OH
ASH HD2 0.474700 0.0000 HO
ASH C 0.597300 1.9080 C
ASH O -0.567900 1.6612 O
ASN N -0.415700 1.8240 N
ASN H 0.271900 0.6000 H
ASN CA 0.014300 1.9080 CT
ASN HA 0.104800 1.3870 H1
ASN CB -0.204100 1.9080 CT
ASN HB2 0.079700 1.4870 HC
ASN HB3 0.079700 1.4870 HC
ASN CG 0.713000 1.9080 C
ASN OD1 -0.593100 1.6612 O
ASN ND2 -0.919100 1.8240 N
ASN HD21 0.419600 0.6000 H
ASN HD22 0.419600 0.6000 H
ASN C 0.597300 1.9080 C
ASN O -0.567900 1.6612 O
ASP N -0.516300 1.8240 N
ASP H 0.293600 0.6000 H
ASP CA 0.038100 1.9080 CT
ASP HA 0.088000 1.3870 H1
ASP CB -0.030300 1.9080 CT
ASP HB2 -0.012200 1.4870 HC
ASP HB3 -0.012200 1.4870 HC
ASP CG 0.799400 1.9080 C
ASP OD1 -0.801400 1.6612 O2
ASP OD2 -0.801400 1.6612 O2
ASP C 0.536600 1.9080 C
ASP O -0.581900 1.6612 O
CYM N -0.415700 1.8240 N
CYM HN 0.271900 0.6000 H
CYM CA -0.035100 1.9080 CT
CYM HA 0.050800 1.3870 H1
CYM CB -0.241300 1.9080 CT
CYM HB3 0.112200 1.3870 H1
CYM HB2 0.112200 1.3870 H1
CYM SG -0.884400 2.0000 SH
CYM C 0.597300 1.9080 C
CYM O -0.567900 1.6612 O
CYS N -0.415700 1.8240 N
CYS H 0.271900 0.6000 H
CYS CA 0.021300 1.9080 CT
CYS HA 0.112400 1.3870 H1
CYS CB -0.123100 1.9080 CT
CYS HB2 0.111200 1.3870 H1
CYS HB3 0.111200 1.3870 H1
CYS SG -0.311900 2.0000 SH
CYS HG 0.193300 0.6000 HS
CYS C 0.597300 1.9080 C
CYS O -0.567900 1.6612 O
CYX N -0.415700 1.8240 N
CYX H 0.271900 0.6000 H
CYX CA 0.042900 1.9080 CT
CYX HA 0.076600 1.3870 H1
CYX CB -0.079000 1.9080 CT
CYX HB2 0.091000 1.3870 H1
CYX HB3 0.091000 1.3870 H1
CYX SG -0.108100 2.0000 S
CYX C 0.597300 1.9080 C
CYX O -0.567900 1.6612 O
GLH N -0.415700 1.8240 N
GLH H 0.271900 0.6000 H
GLH CA 0.014500 1.9080 CT
GLH HA 0.077900 1.3870 H1
GLH CB -0.007100 1.9080 CT
GLH HB2 0.025600 1.4870 HC
GLH HB3 0.025600 1.4870 HC
GLH CG -0.017400 1.9080 CT
GLH HG2 0.043000 1.4870 HC
GLH HG3 0.043000 1.4870 HC
GLH CD 0.680100 1.9080 C
GLH OE1 -0.583800 1.6612 O
GLH OE2 -0.651100 1.7210 OH
GLH HE2 0.464100 0.0000 HO
GLH C 0.597300 1.9080 C
GLH O -0.567900 1.6612 O
GLN N -0.415700 1.8240 N
GLN H 0.271900 0.6000 H
GLN CA -0.003100 1.9080 CT
GLN HA 0.085000 1.3870 H1
GLN CB -0.003600 1.9080 CT
GLN HB2 0.017100 1.4870 HC
GLN HB3 0.017100 1.4870 HC
GLN CG -0.064500 1.9080 CT
GLN HG2 0.035200 1.4870 HC
GLN HG3 0.035200 1.4870 HC
GLN CD 0.695100 1.9080 C
GLN OE1 -0.608600 1.6612 O
GLN NE2 -0.940700 1.8240 N
GLN HE21 0.425100 0.6000 H
GLN HE22 0.425100 0.6000 H
GLN C 0.597300 1.9080 C
GLN O -0.567900 1.6612 O
GLU N -0.516300 1.8240 N
GLU H 0.293600 0.6000 H
GLU CA 0.039700 1.9080 CT
GLU HA 0.110500 1.3870 H1
GLU CB 0.056000 1.9080 CT
GLU HB2 -0.017300 1.4870 HC
GLU HB3 -0.017300 1.4870 HC
GLU CG 0.013600 1.9080 CT
GLU HG2 -0.042500 1.4870 HC
GLU HG3 -0.042500 1.4870 HC
GLU CD 0.805400 1.9080 C
GLU OE1 -0.818800 1.6612 O2
GLU OE2 -0.818800 1.6612 O2
GLU C 0.536600 1.9080 C
GLU O -0.581900 1.6612 O
GLY N -0.415700 1.8240 N
GLY H 0.271900 0.6000 H
GLY CA -0.025200 1.9080 CT
GLY HA2 0.069800 1.3870 H1
GLY HA3 0.069800 1.3870 H1
GLY C 0.597300 1.9080 C
GLY O -0.567900 1.6612 O
HID N -0.415700 1.8240 N
HID H 0.271900 0.6000 H
HID CA 0.018800 1.9080 CT
HID HA 0.088100 1.3870 H1
HID CB -0.046200 1.9080 CT
HID HB2 0.040200 1.4870 HC
HID HB3 0.040200 1.4870 HC
HID CG -0.026600 1.9080 CC
HID ND1 -0.381100 1.8240 NA
HID HD1 0.364900 0.6000 H
HID CE1 0.205700 1.9080 CR
HID HE1 0.139200 1.3590 H5
HID NE2 -0.572700 1.8240 NB
HID CD2 0.129200 1.9080 CV
HID HD2 0.114700 1.4090 H4
HID C 0.597300 1.9080 C
HID O -0.567900 1.6612 O
HIE N -0.415700 1.8240 N
HIE H 0.271900 0.6000 H
HIE CA -0.058100 1.9080 CT
HIE HA 0.136000 1.3870 H1
HIE CB -0.007400 1.9080 CT
HIE HB2 0.036700 1.4870 HC
HIE HB3 0.036700 1.4870 HC
HIE CG 0.186800 1.9080 CC
HIE ND1 -0.543200 1.8240 NB
HIE CE1 0.163500 1.9080 CR
HIE HE1 0.143500 1.3590 H5
HIE NE2 -0.279500 1.8240 NA
HIE HE2 0.333900 0.6000 H
HIE CD2 -0.220700 1.9080 CW
HIE HD2 0.186200 1.4090 H4
HIE C 0.597300 1.9080 C
HIE O -0.567900 1.6612 O
HIP N -0.347900 1.8240 N
HIP H 0.274700 0.6000 H
HIP CA -0.135400 1.9080 CT
HIP HA 0.121200 1.3870 H1
HIP CB -0.041400 1.9080 CT
HIP HB2 0.081000 1.4870 HC
HIP HB3 0.081000 1.4870 HC
HIP CG -0.001200 1.9080 CC
HIP ND1 -0.151300 1.8240 NA
HIP HD1 0.386600 0.6000 H
HIP CE1 -0.017000 1.9080 CR
HIP HE1 0.268100 1.3590 H5
HIP NE2 -0.171800 1.8240 NA
HIP HE2 0.391100 0.6000 H
HIP CD2 -0.114100 1.9080 CW
HIP HD2 0.231700 1.4090 H4
HIP C 0.734100 1.9080 C
HIP O -0.589400 1.6612 O
ILE N -0.415700 1.8240 N
ILE H 0.271900 0.6000 H
ILE CA -0.059700 1.9080 CT
ILE HA 0.086900 1.3870 H1
ILE CB 0.130300 1.9080 CT
ILE HB 0.018700 1.4870 HC
ILE CG2 -0.320400 1.9080 CT
ILE HG21 0.088200 1.4870 HC
ILE HG22 0.088200 1.4870 HC
ILE HG23 0.088200 1.4870 HC
ILE CG1 -0.043000 1.9080 CT
ILE HG12 0.023600 1.4870 HC
ILE HG13 0.023600 1.4870 HC
ILE CD1 -0.066000 1.9080 CT
ILE HD11 0.018600 1.4870 HC
ILE HD12 0.018600 1.4870 HC
ILE HD13 0.018600 1.4870 HC
ILE C 0.597300 1.9080 C
ILE O -0.567900 1.6612 O
LEU N -0.415700 1.8240 N
LEU H 0.271900 0.6000 H
LEU CA -0.051800 1.9080 CT
LEU HA 0.092200 1.3870 H1
LEU CB -0.110200 1.9080 CT
LEU HB2 0.045700 1.4870 HC
LEU HB3 0.045700 1.4870 HC
LEU CG 0.353100 1.9080 CT
LEU HG -0.036100 1.4870 HC
LEU CD1 -0.412100 1.9080 CT
LEU HD11 0.100000 1.4870 HC
LEU HD12 0.100000 1.4870 HC
LEU HD13 0.100000 1.4870 HC
LEU CD2 -0.412100 1.9080 CT
LEU HD21 0.100000 1.4870 HC
LEU HD22 0.100000 1.4870 HC
LEU HD23 0.100000 1.4870 HC
LEU C 0.597300 1.9080 C
LEU O -0.567900 1.6612 O
LYN N -0.415700 1.8240 N
LYN H 0.271900 0.6000 H
LYN CA -0.072060 1.9080 CT
LYN HA 0.099400 1.3870 H1
LYN CB -0.048450 1.9080 CT
LYN HB2 0.034000 1.4870 HC
LYN HB3 0.034000 1.4870 HC
LYN CG 0.066120 1.9080 CT
LYN HG2 0.010410 1.4870 HC
LYN HG3 0.010410 1.4870 HC
LYN CD -0.037680 1.9080 CT
LYN HD2 0.011550 1.4870 HC
LYN HD3 0.011550 1.4870 HC
LYN CE 0.326040 1.9080 CT
LYN HE2 -0.033580 1.1000 HP
LYN HE3 -0.033580 1.1000 HP
LYN NZ -1.035810 1.8240 N3
LYN HZ2 0.386040 0.6000 H
LYN HZ3 0.386040 0.6000 H
LYN C 0.597300 1.9080 C
LYN O -0.567900 1.6612 O
LYS N -0.347900 1.8240 N
LYS H 0.274700 0.6000 H
LYS CA -0.240000 1.9080 CT
LYS HA 0.142600 1.3870 H1
LYS CB -0.009400 1.9080 CT
LYS HB2 0.036200 1.4870 HC
LYS HB3 0.036200 1.4870 HC
LYS CG 0.018700 1.9080 CT
LYS HG2 0.010300 1.4870 HC
LYS HG3 0.010300 1.4870 HC
LYS CD -0.047900 1.9080 CT
LYS HD2 0.062100 1.4870 HC
LYS HD3 0.062100 1.4870 HC
LYS CE -0.014300 1.9080 CT
LYS HE2 0.113500 1.1000 HP
LYS HE3 0.113500 1.1000 HP
LYS NZ -0.385400 1.8240 N3
LYS HZ1 0.340000 0.6000 H
LYS HZ2 0.340000 0.6000 H
LYS HZ3 0.340000 0.6000 H
LYS C 0.734100 1.9080 C
LYS O -0.589400 1.6612 O
MET N -0.415700 1.8240 N
MET H 0.271900 0.6000 H
MET CA -0.023700 1.9080 CT
MET HA 0.088000 1.3870 H1
MET CB 0.034200 1.9080 CT
MET HB2 0.024100 1.4870 HC
MET HB3 0.024100 1.4870 HC
MET CG 0.001800 1.9080 CT
MET HG2 0.044000 1.3870 H1
MET HG3 0.044000 1.3870 H1
MET SD -0.273700 2.0000 S
MET CE -0.053600 1.9080 CT
MET HE1 0.068400 1.3870 H1
MET HE2 0.068400 1.3870 H1
MET HE3 0.068400 1.3870 H1
MET C 0.597300 1.9080 C
MET O -0.567900 1.6612 O
PHE N -0.415700 1.8240 N
PHE H 0.271900 0.6000 H
PHE CA -0.002400 1.9080 CT
PHE HA 0.097800 1.3870 H1
PHE CB -0.034300 1.9080 CT
PHE HB2 0.029500 1.4870 HC
PHE HB3 0.029500 1.4870 HC
PHE CG 0.011800 1.9080 CA
PHE CD1 -0.125600 1.9080 CA
PHE HD1 0.133000 1.4590 HA
PHE CE1 -0.170400 1.9080 CA
PHE HE1 0.143000 1.4590 HA
PHE CZ -0.107200 1.9080 CA
PHE HZ 0.129700 1.4590 HA
PHE CE2 -0.170400 1.9080 CA
PHE HE2 0.143000 1.4590 HA
PHE CD2 -0.125600 1.9080 CA
PHE HD2 0.133000 1.4590 HA
PHE C 0.597300 1.9080 C
PHE O -0.567900 1.6612 O
PRO N -0.254800 1.8240 N
PRO CD 0.019200 1.9080 CT
PRO HD2 0.039100 1.3870 H1
PRO HD3 0.039100 1.3870 H1
PRO CG 0.018900 1.9080 CT
PRO HG2 0.021300 1.4870 HC
PRO HG3 0.021300 1.4870 HC
PRO CB -0.007000 1.9080 CT
PRO HB2 0.025300 1.4870 HC
PRO HB3 0.025300 1.4870 HC
PRO CA -0.026600 1.9080 CT
PRO HA 0.064100 1.3870 H1
PRO C 0.589600 1.9080 C
PRO O -0.574800 1.6612 O
SER N -0.415700 1.8240 N
SER H 0.271900 0.6000 H
SER CA -0.024900 1.9080 CT
SER HA 0.084300 1.3870 H1
SER CB 0.211700 1.9080 CT
SER HB2 0.035200 1.3870 H1
SER HB3 0.035200 1.3870 H1
SER OG -0.654600 1.7210 OH
SER HG 0.427500 0.0000 HO
SER C 0.597300 1.9080 C
SER O -0.567900 1.6612 O
THR N -0.415700 1.8240 N
THR H 0.271900 0.6000 H
THR CA -0.038900 1.9080 CT
THR HA 0.100700 1.3870 H1
THR CB 0.365400 1.9080 CT
THR HB 0.004300 1.3870 H1
THR CG2 -0.243800 1.9080 CT
THR HG21 0.064200 1.4870 HC
THR HG22 0.064200 1.4870 HC
THR HG23 0.064200 1.4870 HC
THR OG1 -0.676100 1.7210 OH
THR HG1 0.410200 0.0000 HO
THR C 0.597300 1.9080 C
THR O -0.567900 1.6612 O
TRP N -0.415700 1.8240 N
TRP H 0.271900 0.6000 H
TRP CA -0.027500 1.9080 CT
TRP HA 0.112300 1.3870 H1
TRP CB -0.005000 1.9080 CT
TRP HB2 0.033900 1.4870 HC
TRP HB3 0.033900 1.4870 HC
TRP CG -0.141500 1.9080 C*
TRP CD1 -0.163800 1.9080 CW
TRP HD1 0.206200 1.4090 H4
TRP NE1 -0.341800 1.8240 NA
TRP HE1 0.341200 0.6000 H
TRP CE2 0.138000 1.9080 CN
TRP CZ2 -0.260100 1.9080 CA
TRP HZ2 0.157200 1.4590 HA
TRP CH2 -0.113400 1.9080 CA
TRP HH2 0.141700 1.4590 HA
TRP CZ3 -0.197200 1.9080 CA
TRP HZ3 0.144700 1.4590 HA
TRP CE3 -0.238700 1.9080 CA
TRP HE3 0.170000 1.4590 HA
TRP CD2 0.124300 1.9080 CB
TRP C 0.597300 1.9080 C
TRP O -0.567900 1.6612 O
TYR N -0.415700 1.8240 N
TYR H 0.271900 0.6000 H
TYR CA -0.001400 1.9080 CT
TYR HA 0.087600 1.3870 H1
TYR CB -0.015200 1.9080 CT
TYR HB2 0.029500 1.4870 HC
TYR HB3 0.029500 1.4870 HC
TYR CG -0.001100 1.9080 CA
TYR CD1 -0.190600 1.9080 CA
TYR HD1 0.169900 1.4590 HA
TYR CE1 -0.234100 1.9080 CA
TYR HE1 0.165600 1.4590 HA
TYR CZ 0.322600 1.9080 C
TYR OH -0.557900 1.7210 OH
TYR HH 0.399200 0.0000 HO
TYR CE2 -0.234100 1.9080 CA
TYR HE2 0.165600 1.4590 HA
TYR CD2 -0.190600 1.9080 CA
TYR HD2 0.169900 1.4590 HA
TYR C 0.597300 1.9080 C
TYR O -0.567900 1.6612 O
VAL N -0.415700 1.8240 N
VAL H 0.271900 0.6000 H
VAL CA -0.087500 1.9080 CT
VAL HA 0.096900 1.3870 H1
VAL CB 0.298500 1.9080 CT
VAL HB -0.029700 1.4870 HC
VAL CG1 -0.319200 1.9080 CT
VAL HG11 0.079100 1.4870 HC
VAL HG12 0.079100 1.4870 HC
VAL HG13 0.079100 1.4870 HC
VAL CG2 -0.319200 1.9080 CT
VAL HG21 0.079100 1.4870 HC
VAL HG22 0.079100 1.4870 HC
VAL HG23 0.079100 1.4870 HC
VAL C 0.597300 1.9080 C
VAL O -0.567900 1.6612 O
CALA N -0.382100 1.8240 N
CALA H 0.268100 0.6000 H
CALA CA -0.174700 1.9080 CT
CALA HA 0.106700 1.3870 H1
CALA CB -0.209300 1.9080 CT
CALA HB1 0.076400 1.4870 HC
CALA HB2 0.076400 1.4870 HC
CALA HB3 0.076400 1.4870 HC
CALA C 0.773100 1.9080 C
CALA O -0.805500 1.6612 O2
CALA OXT -0.805500 1.6612 O2
CARG N -0.348100 1.8240 N
CARG H 0.276400 0.6000 H
CARG CA -0.306800 1.9080 CT
CARG HA 0.144700 1.3870 H1
CARG CB -0.037400 1.9080 CT
CARG HB2 0.037100 1.4870 HC
CARG HB3 0.037100 1.4870 HC
CARG CG 0.074400 1.9080 CT
CARG HG2 0.018500 1.4870 HC
CARG HG3 0.018500 1.4870 HC
CARG CD 0.111400 1.9080 CT
CARG HD2 0.046800 1.3870 H1
CARG HD3 0.046800 1.3870 H1
CARG NE -0.556400 1.8240 N2
CARG HE 0.347900 0.6000 H
CARG CZ 0.836800 1.9080 CA
CARG NH1 -0.873700 1.8240 N2
CARG HH11 0.449300 0.6000 H
CARG HH12 0.449300 0.6000 H
CARG NH2 -0.873700 1.8240 N2
CARG HH21 0.449300 0.6000 H
CARG HH22 0.449300 0.6000 H
CARG C 0.855700 1.9080 C
CARG O -0.826600 1.6612 O2
CARG OXT -0.826600 1.6612 O2
CASN N -0.382100 1.8240 N
CASN H 0.268100 0.6000 H
CASN CA -0.208000 1.9080 CT
CASN HA 0.135800 1.3870 H1
CASN CB -0.229900 1.9080 CT
CASN HB2 0.102300 1.4870 HC
CASN HB3 0.102300 1.4870 HC
CASN CG 0.715300 1.9080 C
CASN OD1 -0.601000 1.6612 O
CASN ND2 -0.908400 1.8240 N
CASN HD21 0.415000 0.6000 H
CASN HD22 0.415000 0.6000 H
CASN C 0.805000 1.9080 C
CASN O -0.814700 1.6612 O2
CASN OXT -0.814700 1.6612 O2
CASP N -0.519200 1.8240 N
CASP H 0.305500 0.6000 H
CASP CA -0.181700 1.9080 CT
CASP HA 0.104600 1.3870 H1
CASP CB -0.067700 1.9080 CT
CASP HB2 -0.021200 1.4870 HC
CASP HB3 -0.021200 1.4870 HC
CASP CG 0.885100 1.9080 C
CASP OD1 -0.816200 1.6612 O2
CASP OD2 -0.816200 1.6612 O2
CASP C 0.725600 1.9080 C
CASP O -0.788700 1.6612 O2
CASP OXT -0.788700 1.6612 O2
CCYS N -0.382100 1.8240 N
CCYS H 0.268100 0.6000 H
CCYS CA -0.163500 1.9080 CT
CCYS HA 0.139600 1.3870 H1
CCYS CB -0.199600 1.9080 CT
CCYS HB2 0.143700 1.3870 H1
CCYS HB3 0.143700 1.3870 H1
CCYS SG -0.310200 2.0000 SH
CCYS HSG 0.206800 0.6000 HS
CCYS C 0.749700 1.9080 C
CCYS O -0.798100 1.6612 O2
CCYS OXT -0.798100 1.6612 O2
CCYX N -0.382100 1.8240 N
CCYX H 0.268100 0.6000 H
CCYX CA -0.131800 1.9080 CT
CCYX HA 0.093800 1.3870 H1
CCYX CB -0.194300 1.9080 CT
CCYX HB2 0.122800 1.3870 H1
CCYX HB3 0.122800 1.3870 H1
CCYX SG -0.052900 2.0000 S
CCYX C 0.761800 1.9080 C
CCYX O -0.804100 1.6612 O2
CCYX OXT -0.804100 1.6612 O2
CGLN N -0.382100 1.8240 N
CGLN H 0.268100 0.6000 H
CGLN CA -0.224800 1.9080 CT
CGLN HA 0.123200 1.3870 H1
CGLN CB -0.066400 1.9080 CT
CGLN HB2 0.045200 1.4870 HC
CGLN HB3 0.045200 1.4870 HC
CGLN CG -0.021000 1.9080 CT
CGLN HG2 0.020300 1.4870 HC
CGLN HG3 0.020300 1.4870 HC
CGLN CD 0.709300 1.9080 C
CGLN OE1 -0.609800 1.6612 O
CGLN NE2 -0.957400 1.8240 N
CGLN HE21 0.430400 0.6000 H
CGLN HE22 0.430400 0.6000 H
CGLN C 0.777500 1.9080 C
CGLN O -0.804200 1.6612 O2
CGLN OXT -0.804200 1.6612 O2
CGLU N -0.519200 1.8240 N
CGLU H 0.305500 0.6000 H
CGLU CA -0.205900 1.9080 CT
CGLU HA 0.139900 1.3870 H1
CGLU CB 0.007100 1.9080 CT
CGLU HB2 -0.007800 1.4870 HC
CGLU HB3 -0.007800 1.4870 HC
CGLU CG 0.067500 1.9080 CT
CGLU HG2 -0.054800 1.4870 HC
CGLU HG3 -0.054800 1.4870 HC
CGLU CD 0.818300 1.9080 C
CGLU OE1 -0.822000 1.6612 O2
CGLU OE2 -0.822000 1.6612 O2
CGLU C 0.742000 1.9080 C
CGLU O -0.793000 1.6612 O2
CGLU OXT -0.793000 1.6612 O2
CGLY N -0.382100 1.8240 N
CGLY H 0.268100 0.6000 H
CGLY CA -0.249300 1.9080 CT
CGLY HA2 0.105600 1.3870 H1
CGLY HA3 0.105600 1.3870 H1
CGLY C 0.723100 1.9080 C
CGLY O -0.785500 1.6612 O2
CGLY OXT -0.785500 1.6612 O2
CHID N -0.382100 1.8240 N
CHID H 0.268100 0.6000 H
CHID CA -0.173900 1.9080 CT
CHID HA 0.110000 1.3870 H1
CHID CB -0.104600 1.9080 CT
CHID HB2 0.056500 1.4870 HC
CHID HB3 0.056500 1.4870 HC
CHID CG 0.029300 1.9080 CC
CHID ND1 -0.389200 1.8240 NA
CHID HD1 0.375500 0.6000 H
CHID CE1 0.192500 1.9080 CR
CHID HE1 0.141800 1.3590 H5
CHID NE2 -0.562900 1.8240 NB
CHID CD2 0.100100 1.9080 CV
CHID HD2 0.124100 1.4090 H4
CHID C 0.761500 1.9080 C
CHID O -0.801600 1.6612 O2
CHID OXT -0.801600 1.6612 O2
CHIE N -0.382100 1.8240 N
CHIE H 0.268100 0.6000 H
CHIE CA -0.269900 1.9080 CT
CHIE HA 0.165000 1.3870 H1
CHIE CB -0.106800 1.9080 CT
CHIE HB2 0.062000 1.4870 HC
CHIE HB3 0.062000 1.4870 HC
CHIE CG 0.272400 1.9080 CC
CHIE ND1 -0.551700 1.8240 NB
CHIE CE1 0.155800 1.9080 CR
CHIE HE1 0.144800 1.3590 H5
CHIE NE2 -0.267000 1.8240 NA
CHIE HE2 0.331900 0.6000 H
CHIE CD2 -0.258800 1.9080 CW
CHIE HD2 0.195700 1.4090 H4
CHIE C 0.791600 1.9080 C
CHIE O -0.806500 1.6612 O2
CHIE OXT -0.806500 1.6612 O2
CHIP N -0.348100 1.8240 N
CHIP H 0.276400 0.6000 H
CHIP CA -0.144500 1.9080 CT
CHIP HA 0.111500 1.3870 H1
CHIP CB -0.080000 1.9080 CT
CHIP HB2 0.086800 1.4870 HC
CHIP HB3 0.086800 1.4870 HC
CHIP CG 0.029800 1.9080 CC
CHIP ND1 -0.150100 1.8240 NA
CHIP HD1 0.388300 0.6000 H
CHIP CE1 -0.025100 1.9080 CR
CHIP HE1 0.269400 1.3590 H5
CHIP NE2 -0.168300 1.8240 NA
CHIP HE2 0.391300 0.6000 H
CHIP CD2 -0.125600 1.9080 CW
CHIP HD2 0.233600 1.4090 H4
CHIP C 0.803200 1.9080 C
CHIP O -0.817700 1.6612 O2
CHIP OXT -0.817700 1.6612 O2
CILE N -0.382100 1.8240 N
CILE H 0.268100 0.6000 H
CILE CA -0.310000 1.9080 CT
CILE HA 0.137500 1.3870 H1
CILE CB 0.036300 1.9080 CT
CILE HB 0.076600 1.4870 HC
CILE CG2 -0.349800 1.9080 CT
CILE HG21 0.102100 1.4870 HC
CILE HG22 0.102100 1.4870 HC
CILE HG23 0.102100 1.4870 HC
CILE CG1 -0.032300 1.9080 CT
CILE HG12 0.032100 1.4870 HC
CILE HG13 0.032100 1.4870 HC
CILE CD1 -0.069900 1.9080 CT
CILE HD11 0.019600 1.4870 HC
CILE HD12 0.019600 1.4870 HC
CILE HD13 0.019600 1.4870 HC
CILE C 0.834300 1.9080 C
CILE O -0.819000 1.6612 O2
CILE OXT -0.819000 1.6612 O2
CLEU N -0.382100 1.8240 N
CLEU H 0.268100 0.6000 H
CLEU CA -0.284700 1.9080 CT
CLEU HA 0.134600 1.3870 H1
CLEU CB -0.246900 1.9080 CT
CLEU HB2 0.097400 1.4870 HC
CLEU HB3 0.097400 1.4870 HC
CLEU CG 0.370600 1.9080 CT
CLEU HG -0.037400 1.4870 HC
CLEU CD1 -0.416300 1.9080 CT
CLEU HD11 0.103800 1.4870 HC
CLEU HD12 0.103800 1.4870 HC
CLEU HD13 0.103800 1.4870 HC
CLEU CD2 -0.416300 1.9080 CT
CLEU HD21 0.103800 1.4870 HC
CLEU HD22 0.103800 1.4870 HC
CLEU HD23 0.103800 1.4870 HC
CLEU C 0.832600 1.9080 C
CLEU O -0.819900 1.6612 O2
CLEU OXT -0.819900 1.6612 O2
CLYS N -0.348100 1.8240 N
CLYS H 0.276400 0.6000 H
CLYS CA -0.290300 1.9080 CT
CLYS HA 0.143800 1.3870 H1
CLYS CB -0.053800 1.9080 CT
CLYS HB2 0.048200 1.4870 HC
CLYS HB3 0.048200 1.4870 HC
CLYS CG 0.022700 1.9080 CT
CLYS HG2 0.013400 1.4870 HC
CLYS HG3 0.013400 1.4870 HC
CLYS CD -0.039200 1.9080 CT
CLYS HD2 0.061100 1.4870 HC
CLYS HD3 0.061100 1.4870 HC
CLYS CE -0.017600 1.9080 CT
CLYS HE2 0.112100 1.1000 HP
CLYS HE3 0.112100 1.1000 HP
CLYS NZ -0.374100 1.8240 N3
CLYS HZ1 0.337400 0.6000 H
CLYS HZ2 0.337400 0.6000 H
CLYS HZ3 0.337400 0.6000 H
CLYS C 0.848800 1.9080 C
CLYS O -0.825200 1.6612 O2
CLYS OXT -0.825200 1.6612 O2
CMET N -0.382100 1.8240 N
CMET H 0.268100 0.6000 H
CMET CA -0.259700 1.9080 CT
CMET HA 0.127700 1.3870 H1
CMET CB -0.023600 1.9080 CT
CMET HB2 0.048000 1.4870 HC
CMET HB3 0.048000 1.4870 HC
CMET CG 0.049200 1.9080 CT
CMET HG2 0.031700 1.3870 H1
CMET HG3 0.031700 1.3870 H1
CMET SD -0.269200 2.0000 S
CMET CE -0.037600 1.9080 CT
CMET HE1 0.062500 1.3870 H1
CMET HE2 0.062500 1.3870 H1
CMET HE3 0.062500 1.3870 H1
CMET C 0.801300 1.9080 C
CMET O -0.810500 1.6612 O2
CMET OXT -0.810500 1.6612 O2
CPHE N -0.382100 1.8240 N
CPHE H 0.268100 0.6000 H
CPHE CA -0.182500 1.9080 CT
CPHE HA 0.109800 1.3870 H1
CPHE CB -0.095900 1.9080 CT
CPHE HB2 0.044300 1.4870 HC
CPHE HB3 0.044300 1.4870 HC
CPHE CG 0.055200 1.9080 CA
CPHE CD1 -0.130000 1.9080 CA
CPHE HD1 0.140800 1.4590 HA
CPHE CE1 -0.184700 1.9080 CA
CPHE HE1 0.146100 1.4590 HA
CPHE CZ -0.094400 1.9080 CA
CPHE HZ 0.128000 1.4590 HA
CPHE CE2 -0.184700 1.9080 CA
CPHE HE2 0.146100 1.4590 HA
CPHE CD2 -0.130000 1.9080 CA
CPHE HD2 0.140800 1.4590 HA
CPHE C 0.766000 1.9080 C
CPHE O -0.802600 1.6612 O2
CPHE OXT -0.802600 1.6612 O2
CPRO N -0.280200 1.8240 N
CPRO CD 0.043400 1.9080 CT
CPRO HD2 0.033100 1.3870 H1
CPRO HD3 0.033100 1.3870 H1
CPRO CG 0.046600 1.9080 CT
CPRO HG2 0.017200 1.4870 HC
CPRO HG3 0.017200 1.4870 HC
CPRO CB -0.054300 1.9080 CT
CPRO HB2 0.038100 1.4870 HC
CPRO HB3 0.038100 1.4870 HC
CPRO CA -0.133600 1.9080 CT
CPRO HA 0.077600 1.3870 H1
CPRO C 0.663100 1.9080 C
CPRO O -0.769700 1.6612 O2
CPRO OXT -0.769700 1.6612 O2
CSER N -0.382100 1.8240 N
CSER H 0.268100 0.6000 H
CSER CA -0.272200 1.9080 CT
CSER HA 0.130400 1.3870 H1
CSER CB 0.112300 1.9080 CT
CSER HB2 0.081300 1.3870 H1
CSER HB3 0.081300 1.3870 H1
CSER OG -0.651400 1.7210 OH
CSER HG 0.447400 0.0000 HO
CSER C 0.811300 1.9080 C
CSER O -0.813200 1.6612 O2
CSER OXT -0.813200 1.6612 O2
CTHR N -0.382100 1.8240 N
CTHR H 0.268100 0.6000 H
CTHR CA -0.242000 1.9080 CT
CTHR HA 0.120700 1.3870 H1
CTHR CB 0.302500 1.9080 CT
CTHR HB 0.007800 1.3870 H1
CTHR CG2 -0.185300 1.9080 CT
CTHR HG21 0.058600 1.4870 HC
CTHR HG22 0.058600 1.4870 HC
CTHR HG23 0.058600 1.4870 HC
CTHR OG1 -0.649600 1.7210 OH
CTHR HG1 0.411900 0.0000 HO
CTHR C 0.781000 1.9080 C
CTHR O -0.804400 1.6612 O2
CTHR OXT -0.804400 1.6612 O2
CTRP N -0.382100 1.8240 N
CTRP H 0.268100 0.6000 H
CTRP CA -0.208400 1.9080 CT
CTRP HA 0.127200 1.3870 H1
CTRP CB -0.074200 1.9080 CT
CTRP HB2 0.049700 1.4870 HC
CTRP HB3 0.049700 1.4870 HC
CTRP CG -0.079600 1.9080 C*
CTRP CD1 -0.180800 1.9080 CW
CTRP HD1 0.204300 1.4090 H4
CTRP NE1 -0.331600 1.8240 NA
CTRP HE1 0.341300 0.6000 H
CTRP CE2 0.122200 1.9080 CN
CTRP CZ2 -0.259400 1.9080 CA
CTRP HZ2 0.156700 1.4590 HA
CTRP CH2 -0.102000 1.9080 CA
CTRP HH2 0.140100 1.4590 HA
CTRP CZ3 -0.228700 1.9080 CA
CTRP HZ3 0.150700 1.4590 HA
CTRP CE3 -0.183700 1.9080 CA
CTRP HE3 0.149100 1.4590 HA
CTRP CD2 0.107800 1.9080 CB
CTRP C 0.765800 1.9080 C
CTRP O -0.801100 1.6612 O2
CTRP OXT -0.801100 1.6612 O2
CTYR N -0.382100 1.8240 N
CTYR H 0.268100 0.6000 H
CTYR CA -0.201500 1.9080 CT
CTYR HA 0.109200 1.3870 H1
CTYR CB -0.075200 1.9080 CT
CTYR HB2 0.049000 1.4870 HC
CTYR HB3 0.049000 1.4870 HC
CTYR CG 0.024300 1.9080 CA
CTYR CD1 -0.192200 1.9080 CA
CTYR HD1 0.178000 1.4590 HA
CTYR CE1 -0.245800 1.9080 CA
CTYR HE1 0.167300 1.4590 HA
CTYR CZ 0.339500 1.9080 C
CTYR OH -0.564300 1.7210 OH
CTYR HH 0.401700 0.0000 HO
CTYR CE2 -0.245800 1.9080 CA
CTYR HE2 0.167300 1.4590 HA
CTYR CD2 -0.192200 1.9080 CA
CTYR HD2 0.178000 1.4590 HA
CTYR C 0.781700 1.9080 C
CTYR O -0.807000 1.6612 O2
CTYR OXT -0.807000 1.6612 O2
CVAL N -0.382100 1.8240 N
CVAL H 0.268100 0.6000 H
CVAL CA -0.343800 1.9080 CT
CVAL HA 0.143800 1.3870 H1
CVAL CB 0.194000 1.9080 CT
CVAL HB 0.030800 1.4870 HC
CVAL CG1 -0.306400 1.9080 CT
CVAL HG11 0.083600 1.4870 HC
CVAL HG12 0.083600 1.4870 HC
CVAL HG13 0.083600 1.4870 HC
CVAL CG2 -0.306400 1.9080 CT
CVAL HG21 0.083600 1.4870 HC
CVAL HG22 0.083600 1.4870 HC
CVAL HG23 0.083600 1.4870 HC
CVAL C 0.835000 1.9080 C
CVAL O -0.817300 1.6612 O2
CVAL OXT -0.817300 1.6612 O2
NHE N -0.463000 1.8240 N
NHE HN1 0.231500 0.6000 H
NHE HN2 0.231500 0.6000 H
NME N -0.415700 1.8240 N
NME H 0.271900 0.6000 H
NME CH3 -0.149000 1.9080 CT
NME HH31 0.097600 1.3870 H1
NME HH32 0.097600 1.3870 H1
NME HH33 0.097600 1.3870 H1
ACE HH31 0.112300 1.4870 HC
ACE CH3 -0.366200 1.9080 CT
ACE HH32 0.112300 1.4870 HC
ACE HH33 0.112300 1.4870 HC
ACE C 0.597200 1.9080 C
ACE O -0.567900 1.6612 O
NALA N 0.141400 1.8240 N3
NALA H1 0.199700 0.6000 H
NALA H2 0.199700 0.6000 H
NALA H3 0.199700 0.6000 H
NALA CA 0.096200 1.9080 CT
NALA HA 0.088900 1.1000 HP
NALA CB -0.059700 1.9080 CT
NALA HB1 0.030000 1.4870 HC
NALA HB2 0.030000 1.4870 HC
NALA HB3 0.030000 1.4870 HC
NALA C 0.616300 1.9080 C
NALA O -0.572200 1.6612 O
NARG N 0.130500 1.8240 N3
NARG H1 0.208300 0.6000 H
NARG H2 0.208300 0.6000 H
NARG H3 0.208300 0.6000 H
NARG CA -0.022300 1.9080 CT
NARG HA 0.124200 1.1000 HP
NARG CB 0.011800 1.9080 CT
NARG HB2 0.022600 1.4870 HC
NARG HB3 0.022600 1.4870 HC
NARG CG 0.023600 1.9080 CT
NARG HG2 0.030900 1.4870 HC
NARG HG3 0.030900 1.4870 HC
NARG CD 0.093500 1.9080 CT
NARG HD2 0.052700 1.3870 H1
NARG HD3 0.052700 1.3870 H1
NARG NE -0.565000 1.8240 N2
NARG HE 0.359200 0.6000 H
NARG CZ 0.828100 1.9080 CA
NARG NH1 -0.869300 1.8240 N2
NARG HH11 0.449400 0.6000 H
NARG HH12 0.449400 0.6000 H
NARG NH2 -0.869300 1.8240 N2
NARG HH21 0.449400 0.6000 H
NARG HH22 0.449400 0.6000 H
NARG C 0.721400 1.9080 C
NARG O -0.601300 1.6612 O
NASN N 0.180100 1.8240 N3
NASN H1 0.192100 0.6000 H
NASN H2 0.192100 0.6000 H
NASN H3 0.192100 0.6000 H
NASN CA 0.036800 1.9080 CT
NASN HA 0.123100 1.1000 HP
NASN CB -0.028300 1.9080 CT
NASN HB2 0.051500 1.4870 HC
NASN HB3 0.051500 1.4870 HC
NASN CG 0.583300 1.9080 C
NASN OD1 -0.574400 1.6612 O
NASN ND2 -0.863400 1.8240 N
NASN HD21 0.409700 0.6000 H
NASN HD22 0.409700 0.6000 H
NASN C 0.616300 1.9080 C
NASN O -0.572200 1.6612 O
NASP N 0.078200 1.8240 N3
NASP H1 0.220000 0.6000 H
NASP H2 0.220000 0.6000 H
NASP H3 0.220000 0.6000 H
NASP CA 0.029200 1.9080 CT
NASP HA 0.114100 1.1000 HP
NASP CB -0.023500 1.9080 CT
NASP HB2 -0.016900 1.4870 HC
NASP HB3 -0.016900 1.4870 HC
NASP CG 0.819400 1.9080 C
NASP OD1 -0.808400 1.6612 O2
NASP OD2 -0.808400 1.6612 O2
NASP C 0.562100 1.9080 C
NASP O -0.588900 1.6612 O
NCYS N 0.132500 1.8240 N3
NCYS H1 0.202300 0.6000 H
NCYS H2 0.202300 0.6000 H
NCYS H3 0.202300 0.6000 H
NCYS CA 0.092700 1.9080 CT
NCYS HA 0.141100 1.1000 HP
NCYS CB -0.119500 1.9080 CT
NCYS HB2 0.118800 1.3870 H1
NCYS HB3 0.118800 1.3870 H1
NCYS SG -0.329800 2.0000 SH
NCYS HSG 0.197500 0.6000 HS
NCYS C 0.612300 1.9080 C
NCYS O -0.571300 1.6612 O
NCYX N 0.206900 1.8240 N3
NCYX H1 0.181500 0.6000 H
NCYX H2 0.181500 0.6000 H
NCYX H3 0.181500 0.6000 H
NCYX CA 0.105500 1.9080 CT
NCYX HA 0.092200 1.1000 HP
NCYX CB -0.027700 1.9080 CT
NCYX HB2 0.068000 1.3870 H1
NCYX HB3 0.068000 1.3870 H1
NCYX SG -0.098400 2.0000 S
NCYX C 0.612300 1.9080 C
NCYX O -0.571300 1.6612 O
NGLN N 0.149300 1.8240 N3
NGLN H1 0.199600 0.6000 H
NGLN H2 0.199600 0.6000 H
NGLN H3 0.199600 0.6000 H
NGLN CA 0.053600 1.9080 CT
NGLN HA 0.101500 1.1000 HP
NGLN CB 0.065100 1.9080 CT
NGLN HB2 0.005000 1.4870 HC
NGLN HB3 0.005000 1.4870 HC
NGLN CG -0.090300 1.9080 CT
NGLN HG2 0.033100 1.4870 HC
NGLN HG3 0.033100 1.4870 HC
NGLN CD 0.735400 1.9080 C
NGLN OE1 -0.613300 1.6612 O
NGLN NE2 -1.003100 1.8240 N
NGLN HE21 0.442900 0.6000 H
NGLN HE22 0.442900 0.6000 H
NGLN C 0.612300 1.9080 C
NGLN O -0.571300 1.6612 O
NGLU N 0.001700 1.8240 N3
NGLU H1 0.239100 0.6000 H
NGLU H2 0.239100 0.6000 H
NGLU H3 0.239100 0.6000 H
NGLU CA 0.058800 1.9080 CT
NGLU HA 0.120200 1.1000 HP
NGLU CB 0.090900 1.9080 CT
NGLU HB2 -0.023200 1.4870 HC
NGLU HB3 -0.023200 1.4870 HC
NGLU CG -0.023600 1.9080 CT
NGLU HG2 -0.031500 1.4870 HC
NGLU HG3 -0.031500 1.4870 HC
NGLU CD 0.808700 1.9080 C
NGLU OE1 -0.818900 1.6612 O2
NGLU OE2 -0.818900 1.6612 O2
NGLU C 0.562100 1.9080 C
NGLU O -0.588900 1.6612 O
NGLY N 0.294300 1.8240 N3
NGLY H1 0.164200 0.6000 H
NGLY H2 0.164200 0.6000 H
NGLY H3 0.164200 0.6000 H
NGLY CA -0.010000 1.9080 CT
NGLY HA2 0.089500 1.1000 HP
NGLY HA3 0.089500 1.1000 HP
NGLY C 0.616300 1.9080 C
NGLY O -0.572200 1.6612 O
NHID N 0.154200 1.8240 N3
NHID H1 0.196300 0.6000 H
NHID H2 0.196300 0.6000 H
NHID H3 0.196300 0.6000 H
NHID CA 0.096400 1.9080 CT
NHID HA 0.095800 1.1000 HP
NHID CB 0.025900 1.9080 CT
NHID HB2 0.020900 1.4870 HC
NHID HB3 0.020900 1.4870 HC
NHID CG -0.039900 1.9080 CC
NHID ND1 -0.381900 1.8240 NA
NHID HD1 0.363200 0.6000 H
NHID CE1 0.212700 1.9080 CR
NHID HE1 0.138500 1.3590 H5
NHID NE2 -0.571100 1.8240 NB
NHID CD2 0.104600 1.9080 CV
NHID HD2 0.129900 1.4090 H4
NHID C 0.612300 1.9080 C
NHID O -0.571300 1.6612 O
NHIE N 0.147200 1.8240 N3
NHIE H1 0.201600 0.6000 H
NHIE H2 0.201600 0.6000 H
NHIE H3 0.201600 0.6000 H
NHIE CA 0.023600 1.9080 CT
NHIE HA 0.138000 1.1000 HP
NHIE CB 0.048900 1.9080 CT
NHIE HB2 0.022300 1.4870 HC
NHIE HB3 0.022300 1.4870 HC
NHIE CG 0.174000 1.9080 CC
NHIE ND1 -0.557900 1.8240 NB
NHIE CE1 0.180400 1.9080 CR
NHIE HE1 0.139700 1.3590 H5
NHIE NE2 -0.278100 1.8240 NA
NHIE HE2 0.332400 0.6000 H
NHIE CD2 -0.234900 1.9080 CW
NHIE HD2 0.196300 1.4090 H4
NHIE C 0.612300 1.9080 C
NHIE O -0.571300 1.6612 O
NHIP N 0.256000 1.8240 N3
NHIP H1 0.170400 0.6000 H
NHIP H2 0.170400 0.6000 H
NHIP H3 0.170400 0.6000 H
NHIP CA 0.058100 1.9080 CT
NHIP HA 0.104700 1.1000 HP
NHIP CB 0.048400 1.9080 CT
NHIP HB2 0.053100 1.4870 HC
NHIP HB3 0.053100 1.4870 HC
NHIP CG -0.023600 1.9080 CC
NHIP ND1 -0.151000 1.8240 NA
NHIP HD1 0.382100 0.6000 H
NHIP CE1 -0.001100 1.9080 CR
NHIP HE1 0.264500 1.3590 H5
NHIP NE2 -0.173900 1.8240 NA
NHIP HE2 0.392100 0.6000 H
NHIP CD2 -0.143300 1.9080 CW
NHIP HD2 0.249500 1.4090 H4
NHIP C 0.721400 1.9080 C
NHIP O -0.601300 1.6612 O
NILE N 0.031100 1.8240 N3
NILE H1 0.232900 0.6000 H
NILE H2 0.232900 0.6000 H
NILE H3 0.232900 0.6000 H
NILE CA 0.025700 1.9080 CT
NILE HA 0.103100 1.1000 HP
NILE CB 0.188500 1.9080 CT
NILE HB 0.021300 1.4870 HC
NILE CG2 -0.372000 1.9080 CT
NILE HG21 0.094700 1.4870 HC
NILE HG22 0.094700 1.4870 HC
NILE HG23 0.094700 1.4870 HC
NILE CG1 -0.038700 1.9080 CT
NILE HG12 0.020100 1.4870 HC
NILE HG13 0.020100 1.4870 HC
NILE CD1 -0.090800 1.9080 CT
NILE HD11 0.022600 1.4870 HC
NILE HD12 0.022600 1.4870 HC
NILE HD13 0.022600 1.4870 HC
NILE C 0.612300 1.9080 C
NILE O -0.571300 1.6612 O
NLEU N 0.101000 1.8240 N3
NLEU H1 0.214800 0.6000 H
NLEU H2 0.214800 0.6000 H
NLEU H3 0.214800 0.6000 H
NLEU CA 0.010400 1.9080 CT
NLEU HA 0.105300 1.1000 HP
NLEU CB -0.024400 1.9080 CT
NLEU HB2 0.025600 1.4870 HC
NLEU HB3 0.025600 1.4870 HC
NLEU CG 0.342100 1.9080 CT
NLEU HG -0.038000 1.4870 HC
NLEU CD1 -0.410600 1.9080 CT
NLEU HD11 0.098000 1.4870 HC
NLEU HD12 0.098000 1.4870 HC
NLEU HD13 0.098000 1.4870 HC
NLEU CD2 -0.410400 1.9080 CT
NLEU HD21 0.098000 1.4870 HC
NLEU HD22 0.098000 1.4870 HC
NLEU HD23 0.098000 1.4870 HC
NLEU C 0.612300 1.9080 C
NLEU O -0.571300 1.6612 O
NLYS N 0.096600 1.8240 N3
NLYS H1 0.216500 0.6000 H
NLYS H2 0.216500 0.6000 H
NLYS H3 0.216500 0.6000 H
NLYS CA -0.001500 1.9080 CT
NLYS HA 0.118000 1.1000 HP
NLYS CB 0.021200 1.9080 CT
NLYS HB2 0.028300 1.4870 HC
NLYS HB3 0.028300 1.4870 HC
NLYS CG -0.004800 1.9080 CT
NLYS HG2 0.012100 1.4870 HC
NLYS HG3 0.012100 1.4870 HC
NLYS CD -0.060800 1.9080 CT
NLYS HD2 0.063300 1.4870 HC
NLYS HD3 0.063300 1.4870 HC
NLYS CE -0.018100 1.9080 CT
NLYS HE2 0.117100 1.1000 HP
NLYS HE3 0.117100 1.1000 HP
NLYS NZ -0.376400 1.8240 N3
NLYS HZ1 0.338200 0.6000 H
NLYS HZ2 0.338200 0.6000 H
NLYS HZ3 0.338200 0.6000 H
NLYS C 0.721400 1.9080 C
NLYS O -0.601300 1.6612 O
NMET N 0.159200 1.8240 N3
NMET H1 0.198400 0.6000 H
NMET H2 0.198400 0.6000 H
NMET H3 0.198400 0.6000 H
NMET CA 0.022100 1.9080 CT
NMET HA 0.111600 1.1000 HP
NMET CB 0.086500 1.9080 CT
NMET HB2 0.012500 1.4870 HC
NMET HB3 0.012500 1.4870 HC
NMET CG 0.033400 1.9080 CT
NMET HG2 0.029200 1.3870 H1
NMET HG3 0.029200 1.3870 H1
NMET SD -0.277400 2.0000 S
NMET CE -0.034100 1.9080 CT
NMET HE1 0.059700 1.3870 H1
NMET HE2 0.059700 1.3870 H1
NMET HE3 0.059700 1.3870 H1
NMET C 0.612300 1.9080 C
NMET O -0.571300 1.6612 O
NPHE N 0.173700 1.8240 N3
NPHE H1 0.192100 0.6000 H
NPHE H2 0.192100 0.6000 H
NPHE H3 0.192100 0.6000 H
NPHE CA 0.073300 1.9080 CT
NPHE HA 0.104100 1.1000 HP
NPHE CB 0.033000 1.9080 CT
NPHE HB2 0.010400 1.4870 HC
NPHE HB3 0.010400 1.4870 HC
NPHE CG 0.003100 1.9080 CA
NPHE CD1 -0.139200 1.9080 CA
NPHE HD1 0.137400 1.4590 HA
NPHE CE1 -0.160200 1.9080 CA
NPHE HE1 0.143300 1.4590 HA
NPHE CZ -0.120800 1.9080 CA
NPHE HZ 0.132900 1.4590 HA
NPHE CE2 -0.160300 1.9080 CA
NPHE HE2 0.143300 1.4590 HA
NPHE CD2 -0.139100 1.9080 CA
NPHE HD2 0.137400 1.4590 HA
NPHE C 0.612300 1.9080 C
NPHE O -0.571300 1.6612 O
NPRO N -0.202000 1.8240 N3
NPRO H2 0.312000 0.6000 H
NPRO H3 0.312000 0.6000 H
NPRO CD -0.012000 1.9080 CT
NPRO HD2 0.100000 1.1000 HP
NPRO HD3 0.100000 1.1000 HP
NPRO CG -0.121000 1.9080 CT
NPRO HG2 0.100000 1.4870 HC
NPRO HG3 0.100000 1.4870 HC
NPRO CB -0.115000 1.9080 CT
NPRO HB2 0.100000 1.4870 HC
NPRO HB3 0.100000 1.4870 HC
NPRO CA 0.100000 1.9080 CT
NPRO HA 0.100000 1.1000 HP
NPRO C 0.526000 1.9080 C
NPRO O -0.500000 1.6612 O
NSER N 0.184900 1.8240 N3
NSER H1 0.189800 0.6000 H
NSER H2 0.189800 0.6000 H
NSER H3 0.189800 0.6000 H
NSER CA 0.056700 1.9080 CT
NSER HA 0.078200 1.1000 HP
NSER CB 0.259600 1.9080 CT
NSER HB2 0.027300 1.3870 H1
NSER HB3 0.027300 1.3870 H1
NSER OG -0.671400 1.7210 OH
NSER HG 0.423900 0.0000 HO
NSER C 0.616300 1.9080 C
NSER O -0.572200 1.6612 O
NTHR N 0.181200 1.8240 N3
NTHR H1 0.193400 0.6000 H
NTHR H2 0.193400 0.6000 H
NTHR H3 0.193400 0.6000 H
NTHR CA 0.003400 1.9080 CT
NTHR HA 0.108700 1.1000 HP
NTHR CB 0.451400 1.9080 CT
NTHR HB -0.032300 1.3870 H1
NTHR CG2 -0.255400 1.9080 CT
NTHR HG21 0.062700 1.4870 HC
NTHR HG22 0.062700 1.4870 HC
NTHR HG23 0.062700 1.4870 HC
NTHR OG1 -0.676400 1.7210 OH
NTHR HG1 0.407000 0.0000 HO
NTHR C 0.616300 1.9080 C
NTHR O -0.572200 1.6612 O
NTRP N 0.191300 1.8240 N3
NTRP H1 0.188800 0.6000 H
NTRP H2 0.188800 0.6000 H
NTRP H3 0.188800 0.6000 H
NTRP CA 0.042100 1.9080 CT
NTRP HA 0.116200 1.1000 HP
NTRP CB 0.054300 1.9080 CT
NTRP HB2 0.022200 1.4870 HC
NTRP HB3 0.022200 1.4870 HC
NTRP CG -0.165400 1.9080 C*
NTRP CD1 -0.178800 1.9080 CW
NTRP HD1 0.219500 1.4090 H4
NTRP NE1 -0.344400 1.8240 NA
NTRP HE1 0.341200 0.6000 H
NTRP CE2 0.157500 1.9080 CN
NTRP CZ2 -0.271000 1.9080 CA
NTRP HZ2 0.158900 1.4590 HA
NTRP CH2 -0.108000 1.9080 CA
NTRP HH2 0.141100 1.4590 HA
NTRP CZ3 -0.203400 1.9080 CA
NTRP HZ3 0.145800 1.4590 HA
NTRP CE3 -0.226500 1.9080 CA
NTRP HE3 0.164600 1.4590 HA
NTRP CD2 0.113200 1.9080 CB
NTRP C 0.612300 1.9080 C
NTRP O -0.571300 1.6612 O
NTYR N 0.194000 1.8240 N3
NTYR H1 0.187300 0.6000 H
NTYR H2 0.187300 0.6000 H
NTYR H3 0.187300 0.6000 H
NTYR CA 0.057000 1.9080 CT
NTYR HA 0.098300 1.1000 HP
NTYR CB 0.065900 1.9080 CT
NTYR HB2 0.010200 1.4870 HC
NTYR HB3 0.010200 1.4870 HC
NTYR CG -0.020500 1.9080 CA
NTYR CD1 -0.200200 1.9080 CA
NTYR HD1 0.172000 1.4590 HA
NTYR CE1 -0.223900 1.9080 CA
NTYR HE1 0.165000 1.4590 HA
NTYR CZ 0.313900 1.9080 C
NTYR OH -0.557800 1.7210 OH
NTYR HH 0.400100 0.0000 HO
NTYR CE2 -0.223900 1.9080 CA
NTYR HE2 0.165000 1.4590 HA
NTYR CD2 -0.200200 1.9080 CA
NTYR HD2 0.172000 1.4590 HA
NTYR C 0.612300 1.9080 C
NTYR O -0.571300 1.6612 O
NVAL N 0.057700 1.8240 N3
NVAL H1 0.227200 0.6000 H
NVAL H2 0.227200 0.6000 H
NVAL H3 0.227200 0.6000 H
NVAL CA -0.005400 1.9080 CT
NVAL HA 0.109300 1.1000 HP
NVAL CB 0.319600 1.9080 CT
NVAL HB -0.022100 1.4870 HC
NVAL CG1 -0.312900 1.9080 CT
NVAL HG11 0.073500 1.4870 HC
NVAL HG12 0.073500 1.4870 HC
NVAL HG13 0.073500 1.4870 HC
NVAL CG2 -0.312900 1.9080 CT
NVAL HG21 0.073500 1.4870 HC
NVAL HG22 0.073500 1.4870 HC
NVAL HG23 0.073500 1.4870 HC
NVAL C 0.616300 1.9080 C
NVAL O -0.572200 1.6612 O
DA P 1.165900 2.1000 P
DA O1P -0.776100 1.6612 O2
DA O2P -0.776100 1.6612 O2
DA O5' -0.495400 1.6837 OS
DA C5' -0.006900 1.9080 CT
DA H5'1 0.075400 1.3870 H1
DA H5'2 0.075400 1.3870 H1
DA C4' 0.162900 1.9080 CT
DA H4' 0.117600 1.3870 H1
DA O4' -0.369100 1.6837 OS
DA C1' 0.043100 1.9080 CT
DA H1' 0.183800 1.2870 H2
DA N9 -0.026800 1.8240 N*
DA C8 0.160700 1.9080 CK
DA H8 0.187700 1.3590 H5
DA N7 -0.617500 1.8240 NB
DA C5 0.072500 1.9080 CB
DA C6 0.689700 1.9080 CA
DA N6 -0.912300 1.8240 N2
DA H61 0.416700 0.6000 H
DA H62 0.416700 0.6000 H
DA N1 -0.762400 1.8240 NC
DA C2 0.571600 1.9080 CQ
DA H2 0.059800 1.3590 H5
DA N3 -0.741700 1.8240 NC
DA C4 0.380000 1.9080 CB
DA C3' 0.071300 1.9080 CT
DA H3' 0.098500 1.3870 H1
DA C2' -0.085400 1.9080 CT
DA H2'1 0.071800 1.4870 HC
DA H2'2 0.071800 1.4870 HC
DA O3' -0.523200 1.6837 OS
DA3 P 1.165900 2.1000 P
DA3 O1P -0.776100 1.6612 O2
DA3 O2P -0.776100 1.6612 O2
DA3 O5' -0.495400 1.6837 OS
DA3 C5' -0.006900 1.9080 CT
DA3 H5'1 0.075400 1.3870 H1
DA3 H5'2 0.075400 1.3870 H1
DA3 C4' 0.162900 1.9080 CT
DA3 H4' 0.117600 1.3870 H1
DA3 O4' -0.369100 1.6837 OS
DA3 C1' 0.043100 1.9080 CT
DA3 H1' 0.183800 1.2870 H2
DA3 N9 -0.026800 1.8240 N*
DA3 C8 0.160700 1.9080 CK
DA3 H8 0.187700 1.3590 H5
DA3 N7 -0.617500 1.8240 NB
DA3 C5 0.072500 1.9080 CB
DA3 C6 0.689700 1.9080 CA
DA3 N6 -0.912300 1.8240 N2
DA3 H61 0.416700 0.6000 H
DA3 H62 0.416700 0.6000 H
DA3 N1 -0.762400 1.8240 NC
DA3 C2 0.571600 1.9080 CQ
DA3 H2 0.059800 1.3590 H5
DA3 N3 -0.741700 1.8240 NC
DA3 C4 0.380000 1.9080 CB
DA3 C3' 0.071300 1.9080 CT
DA3 H3' 0.098500 1.3870 H1
DA3 C2' -0.085400 1.9080 CT
DA3 H2'1 0.071800 1.4870 HC
DA3 H2'2 0.071800 1.4870 HC
DA3 O3' -0.654900 1.7210 OH
DA3 H3T 0.439600 0.0000 HO
DA5 H5T 0.442200 0.0000 HO
DA5 O5' -0.631800 1.7210 OH
DA5 C5' -0.006900 1.9080 CT
DA5 H5'1 0.075400 1.3870 H1
DA5 H5'2 0.075400 1.3870 H1
DA5 C4' 0.162900 1.9080 CT
DA5 H4' 0.117600 1.3870 H1
DA5 O4' -0.369100 1.6837 OS
DA5 C1' 0.043100 1.9080 CT
DA5 H1' 0.183800 1.2870 H2
DA5 N9 -0.026800 1.8240 N*
DA5 C8 0.160700 1.9080 CK
DA5 H8 0.187700 1.3590 H5
DA5 N7 -0.617500 1.8240 NB
DA5 C5 0.072500 1.9080 CB
DA5 C6 0.689700 1.9080 CA
DA5 N6 -0.912300 1.8240 N2
DA5 H61 0.416700 0.6000 H
DA5 H62 0.416700 0.6000 H
DA5 N1 -0.762400 1.8240 NC
DA5 C2 0.571600 1.9080 CQ
DA5 H2 0.059800 1.3590 H5
DA5 N3 -0.741700 1.8240 NC
DA5 C4 0.380000 1.9080 CB
DA5 C3' 0.071300 1.9080 CT
DA5 H3' 0.098500 1.3870 H1
DA5 C2' -0.085400 1.9080 CT
DA5 H2'1 0.071800 1.4870 HC
DA5 H2'2 0.071800 1.4870 HC
DA5 O3' -0.523200 1.6837 OS
DAN H5T 0.442200 0.0000 HO
DAN O5' -0.631800 1.7210 OH
DAN C5' -0.006900 1.9080 CT
DAN H5'1 0.075400 1.3870 H1
DAN H5'2 0.075400 1.3870 H1
DAN C4' 0.162900 1.9080 CT
DAN H4' 0.117600 1.3870 H1
DAN O4' -0.369100 1.6837 OS
DAN C1' 0.043100 1.9080 CT
DAN H1' 0.183800 1.2870 H2
DAN N9 -0.026800 1.8240 N*
DAN C8 0.160700 1.9080 CK
DAN H8 0.187700 1.3590 H5
DAN N7 -0.617500 1.8240 NB
DAN C5 0.072500 1.9080 CB
DAN C6 0.689700 1.9080 CA
DAN N6 -0.912300 1.8240 N2
DAN H61 0.416700 0.6000 H
DAN H62 0.416700 0.6000 H
DAN N1 -0.762400 1.8240 NC
DAN C2 0.571600 1.9080 CQ
DAN H2 0.059800 1.3590 H5
DAN N3 -0.741700 1.8240 NC
DAN C4 0.380000 1.9080 CB
DAN C3' 0.071300 1.9080 CT
DAN H3' 0.098500 1.3870 H1
DAN C2' -0.085400 1.9080 CT
DAN H2'1 0.071800 1.4870 HC
DAN H2'2 0.071800 1.4870 HC
DAN O3' -0.654900 1.7210 OH
DAN H3T 0.439600 0.0000 HO
DC P 1.165900 2.1000 P
DC O1P -0.776100 1.6612 O2
DC O2P -0.776100 1.6612 O2
DC O5' -0.495400 1.6837 OS
DC C5' -0.006900 1.9080 CT
DC H5'1 0.075400 1.3870 H1
DC H5'2 0.075400 1.3870 H1
DC C4' 0.162900 1.9080 CT
DC H4' 0.117600 1.3870 H1
DC O4' -0.369100 1.6837 OS
DC C1' -0.011600 1.9080 CT
DC H1' 0.196300 1.2870 H2
DC N1 -0.033900 1.8240 N*
DC C6 -0.018300 1.9080 CM
DC H6 0.229300 1.4090 H4
DC C5 -0.522200 1.9080 CM
DC H5 0.186300 1.4590 HA
DC C4 0.843900 1.9080 CA
DC N4 -0.977300 1.8240 N2
DC H41 0.431400 0.6000 H
DC H42 0.431400 0.6000 H
DC N3 -0.774800 1.8240 NC
DC C2 0.795900 1.9080 C
DC O2 -0.654800 1.6612 O
DC C3' 0.071300 1.9080 CT
DC H3' 0.098500 1.3870 H1
DC C2' -0.085400 1.9080 CT
DC H2'1 0.071800 1.4870 HC
DC H2'2 0.071800 1.4870 HC
DC O3' -0.523200 1.6837 OS
DC3 P 1.165900 2.1000 P
DC3 O1P -0.776100 1.6612 O2
DC3 O2P -0.776100 1.6612 O2
DC3 O5' -0.495400 1.6837 OS
DC3 C5' -0.006900 1.9080 CT
DC3 H5'1 0.075400 1.3870 H1
DC3 H5'2 0.075400 1.3870 H1
DC3 C4' 0.162900 1.9080 CT
DC3 H4' 0.117600 1.3870 H1
DC3 O4' -0.369100 1.6837 OS
DC3 C1' -0.011600 1.9080 CT
DC3 H1' 0.196300 1.2870 H2
DC3 N1 -0.033900 1.8240 N*
DC3 C6 -0.018300 1.9080 CM
DC3 H6 0.229300 1.4090 H4
DC3 C5 -0.522200 1.9080 CM
DC3 H5 0.186300 1.4590 HA
DC3 C4 0.843900 1.9080 CA
DC3 N4 -0.977300 1.8240 N2
DC3 H41 0.431400 0.6000 H
DC3 H42 0.431400 0.6000 H
DC3 N3 -0.774800 1.8240 NC
DC3 C2 0.795900 1.9080 C
DC3 O2 -0.654800 1.6612 O
DC3 C3' 0.071300 1.9080 CT
DC3 H3' 0.098500 1.3870 H1
DC3 C2' -0.085400 1.9080 CT
DC3 H2'1 0.071800 1.4870 HC
DC3 H2'2 0.071800 1.4870 HC
DC3 O3' -0.654900 1.7210 OH
DC3 H3T 0.439600 0.0000 HO
DC5 H5T 0.442200 0.0000 HO
DC5 O5' -0.631800 1.7210 OH
DC5 C5' -0.006900 1.9080 CT
DC5 H5'1 0.075400 1.3870 H1
DC5 H5'2 0.075400 1.3870 H1
DC5 C4' 0.162900 1.9080 CT
DC5 H4' 0.117600 1.3870 H1
DC5 O4' -0.369100 1.6837 OS
DC5 C1' -0.011600 1.9080 CT
DC5 H1' 0.196300 1.2870 H2
DC5 N1 -0.033900 1.8240 N*
DC5 C6 -0.018300 1.9080 CM
DC5 H6 0.229300 1.4090 H4
DC5 C5 -0.522200 1.9080 CM
DC5 H5 0.186300 1.4590 HA
DC5 C4 0.843900 1.9080 CA
DC5 N4 -0.977300 1.8240 N2
DC5 H41 0.431400 0.6000 H
DC5 H42 0.431400 0.6000 H
DC5 N3 -0.774800 1.8240 NC
DC5 C2 0.795900 1.9080 C
DC5 O2 -0.654800 1.6612 O
DC5 C3' 0.071300 1.9080 CT
DC5 H3' 0.098500 1.3870 H1
DC5 C2' -0.085400 1.9080 CT
DC5 H2'1 0.071800 1.4870 HC
DC5 H2'2 0.071800 1.4870 HC
DC5 O3' -0.523200 1.6837 OS
DCN H5T 0.442200 0.0000 HO
DCN O5' -0.631800 1.7210 OH
DCN C5' -0.006900 1.9080 CT
DCN H5'1 0.075400 1.3870 H1
DCN H5'2 0.075400 1.3870 H1
DCN C4' 0.162900 1.9080 CT
DCN H4' 0.117600 1.3870 H1
DCN O4' -0.369100 1.6837 OS
DCN C1' -0.011600 1.9080 CT
DCN H1' 0.196300 1.2870 H2
DCN N1 -0.033900 1.8240 N*
DCN C6 -0.018300 1.9080 CM
DCN H6 0.229300 1.4090 H4
DCN C5 -0.522200 1.9080 CM
DCN H5 0.186300 1.4590 HA
DCN C4 0.843900 1.9080 CA
DCN N4 -0.977300 1.8240 N2
DCN H41 0.431400 0.6000 H
DCN H42 0.431400 0.6000 H
DCN N3 -0.774800 1.8240 NC
DCN C2 0.795900 1.9080 C
DCN O2 -0.654800 1.6612 O
DCN C3' 0.071300 1.9080 CT
DCN H3' 0.098500 1.3870 H1
DCN C2' -0.085400 1.9080 CT
DCN H2'1 0.071800 1.4870 HC
DCN H2'2 0.071800 1.4870 HC
DCN O3' -0.654900 1.7210 OH
DCN H3T 0.439600 0.0000 HO
DG P 1.165900 2.1000 P
DG O1P -0.776100 1.6612 O2
DG O2P -0.776100 1.6612 O2
DG O5' -0.495400 1.6837 OS
DG C5' -0.006900 1.9080 CT
DG H5'1 0.075400 1.3870 H1
DG H5'2 0.075400 1.3870 H1
DG C4' 0.162900 1.9080 CT
DG H4' 0.117600 1.3870 H1
DG O4' -0.369100 1.6837 OS
DG C1' 0.035800 1.9080 CT
DG H1' 0.174600 1.2870 H2
DG N9 0.057700 1.8240 N*
DG C8 0.073600 1.9080 CK
DG H8 0.199700 1.3590 H5
DG N7 -0.572500 1.8240 NB
DG C5 0.199100 1.9080 CB
DG C6 0.491800 1.9080 C
DG O6 -0.569900 1.6612 O
DG N1 -0.505300 1.8240 NA
DG H1 0.352000 0.6000 H
DG C2 0.743200 1.9080 CA
DG N2 -0.923000 1.8240 N2
DG H21 0.423500 0.6000 H
DG H22 0.423500 0.6000 H
DG N3 -0.663600 1.8240 NC
DG C4 0.181400 1.9080 CB
DG C3' 0.071300 1.9080 CT
DG H3' 0.098500 1.3870 H1
DG C2' -0.085400 1.9080 CT
DG H2'1 0.071800 1.4870 HC
DG H2'2 0.071800 1.4870 HC
DG O3' -0.523200 1.6837 OS
DG3 P 1.165900 2.1000 P
DG3 O1P -0.776100 1.6612 O2
DG3 O2P -0.776100 1.6612 O2
DG3 O5' -0.495400 1.6837 OS
DG3 C5' -0.006900 1.9080 CT
DG3 H5'1 0.075400 1.3870 H1
DG3 H5'2 0.075400 1.3870 H1
DG3 C4' 0.162900 1.9080 CT
DG3 H4' 0.117600 1.3870 H1
DG3 O4' -0.369100 1.6837 OS
DG3 C1' 0.035800 1.9080 CT
DG3 H1' 0.174600 1.2870 H2
DG3 N9 0.057700 1.8240 N*
DG3 C8 0.073600 1.9080 CK
DG3 H8 0.199700 1.3590 H5
DG3 N7 -0.572500 1.8240 NB
DG3 C5 0.199100 1.9080 CB
DG3 C6 0.491800 1.9080 C
DG3 O6 -0.569900 1.6612 O
DG3 N1 -0.505300 1.8240 NA
DG3 H1 0.352000 0.6000 H
DG3 C2 0.743200 1.9080 CA
DG3 N2 -0.923000 1.8240 N2
DG3 H21 0.423500 0.6000 H
DG3 H22 0.423500 0.6000 H
DG3 N3 -0.663600 1.8240 NC
DG3 C4 0.181400 1.9080 CB
DG3 C3' 0.071300 1.9080 CT
DG3 H3' 0.098500 1.3870 H1
DG3 C2' -0.085400 1.9080 CT
DG3 H2'1 0.071800 1.4870 HC
DG3 H2'2 0.071800 1.4870 HC
DG3 O3' -0.654900 1.7210 OH
DG3 H3T 0.439600 0.0000 HO
DG5 H5T 0.442200 0.0000 HO
DG5 O5' -0.631800 1.7210 OH
DG5 C5' -0.006900 1.9080 CT
DG5 H5'1 0.075400 1.3870 H1
DG5 H5'2 0.075400 1.3870 H1
DG5 C4' 0.162900 1.9080 CT
DG5 H4' 0.117600 1.3870 H1
DG5 O4' -0.369100 1.6837 OS
DG5 C1' 0.035800 1.9080 CT
DG5 H1' 0.174600 1.2870 H2
DG5 N9 0.057700 1.8240 N*
DG5 C8 0.073600 1.9080 CK
DG5 H8 0.199700 1.3590 H5
DG5 N7 -0.572500 1.8240 NB
DG5 C5 0.199100 1.9080 CB
DG5 C6 0.491800 1.9080 C
DG5 O6 -0.569900 1.6612 O
DG5 N1 -0.505300 1.8240 NA
DG5 H1 0.352000 0.6000 H
DG5 C2 0.743200 1.9080 CA
DG5 N2 -0.923000 1.8240 N2
DG5 H21 0.423500 0.6000 H
DG5 H22 0.423500 0.6000 H
DG5 N3 -0.663600 1.8240 NC
DG5 C4 0.181400 1.9080 CB
DG5 C3' 0.071300 1.9080 CT
DG5 H3' 0.098500 1.3870 H1
DG5 C2' -0.085400 1.9080 CT
DG5 H2'1 0.071800 1.4870 HC
DG5 H2'2 0.071800 1.4870 HC
DG5 O3' -0.523200 1.6837 OS
DGN H5T 0.442200 0.0000 HO
DGN O5' -0.631800 1.7210 OH
DGN C5' -0.006900 1.9080 CT
DGN H5'1 0.075400 1.3870 H1
DGN H5'2 0.075400 1.3870 H1
DGN C4' 0.162900 1.9080 CT
DGN H4' 0.117600 1.3870 H1
DGN O4' -0.369100 1.6837 OS
DGN C1' 0.035800 1.9080 CT
DGN H1' 0.174600 1.2870 H2
DGN N9 0.057700 1.8240 N*
DGN C8 0.073600 1.9080 CK
DGN H8 0.199700 1.3590 H5
DGN N7 -0.572500 1.8240 NB
DGN C5 0.199100 1.9080 CB
DGN C6 0.491800 1.9080 C
DGN O6 -0.569900 1.6612 O
DGN N1 -0.505300 1.8240 NA
DGN H1 0.352000 0.6000 H
DGN C2 0.743200 1.9080 CA
DGN N2 -0.923000 1.8240 N2
DGN H21 0.423500 0.6000 H
DGN H22 0.423500 0.6000 H
DGN N3 -0.663600 1.8240 NC
DGN C4 0.181400 1.9080 CB
DGN C3' 0.071300 1.9080 CT
DGN H3' 0.098500 1.3870 H1
DGN C2' -0.085400 1.9080 CT
DGN H2'1 0.071800 1.4870 HC
DGN H2'2 0.071800 1.4870 HC
DGN O3' -0.654900 1.7210 OH
DGN H3T 0.439600 0.0000 HO
DT P 1.165900 2.1000 P
DT O1P -0.776100 1.6612 O2
DT O2P -0.776100 1.6612 O2
DT O5' -0.495400 1.6837 OS
DT C5' -0.006900 1.9080 CT
DT H5'1 0.075400 1.3870 H1
DT H5'2 0.075400 1.3870 H1
DT C4' 0.162900 1.9080 CT
DT H4' 0.117600 1.3870 H1
DT O4' -0.369100 1.6837 OS
DT C1' 0.068000 1.9080 CT
DT H1' 0.180400 1.2870 H2
DT N1 -0.023900 1.8240 N*
DT C6 -0.220900 1.9080 CM
DT H6 0.260700 1.4090 H4
DT C5 0.002500 1.9080 CM
DT C7 -0.226900 1.9080 CT
DT H71 0.077000 1.4870 HC
DT H72 0.077000 1.4870 HC
DT H73 0.077000 1.4870 HC
DT C4 0.519400 1.9080 C
DT O4 -0.556300 1.6612 O
DT N3 -0.434000 1.8240 NA
DT H3 0.342000 0.6000 H
DT C2 0.567700 1.9080 C
DT O2 -0.588100 1.6612 O
DT C3' 0.071300 1.9080 CT
DT H3' 0.098500 1.3870 H1
DT C2' -0.085400 1.9080 CT
DT H2'1 0.071800 1.4870 HC
DT H2'2 0.071800 1.4870 HC
DT O3' -0.523200 1.6837 OS
DT3 P 1.165900 2.1000 P
DT3 O1P -0.776100 1.6612 O2
DT3 O2P -0.776100 1.6612 O2
DT3 O5' -0.495400 1.6837 OS
DT3 C5' -0.006900 1.9080 CT
DT3 H5'1 0.075400 1.3870 H1
DT3 H5'2 0.075400 1.3870 H1
DT3 C4' 0.162900 1.9080 CT
DT3 H4' 0.117600 1.3870 H1
DT3 O4' -0.369100 1.6837 OS
DT3 C1' 0.068000 1.9080 CT
DT3 H1' 0.180400 1.2870 H2
DT3 N1 -0.023900 1.8240 N*
DT3 C6 -0.220900 1.9080 CM
DT3 H6 0.260700 1.4090 H4
DT3 C5 0.002500 1.9080 CM
DT3 C7 -0.226900 1.9080 CT
DT3 H71 0.077000 1.4870 HC
DT3 H72 0.077000 1.4870 HC
DT3 H73 0.077000 1.4870 HC
DT3 C4 0.519400 1.9080 C
DT3 O4 -0.556300 1.6612 O
DT3 N3 -0.434000 1.8240 NA
DT3 H3 0.342000 0.6000 H
DT3 C2 0.567700 1.9080 C
DT3 O2 -0.588100 1.6612 O
DT3 C3' 0.071300 1.9080 CT
DT3 H3' 0.098500 1.3870 H1
DT3 C2' -0.085400 1.9080 CT
DT3 H2'1 0.071800 1.4870 HC
DT3 H2'2 0.071800 1.4870 HC
DT3 O3' -0.654900 1.7210 OH
DT3 H3T 0.439600 0.0000 HO
DT5 H5T 0.442200 0.0000 HO
DT5 O5' -0.631800 1.7210 OH
DT5 C5' -0.006900 1.9080 CT
DT5 H5'1 0.075400 1.3870 H1
DT5 H5'2 0.075400 1.3870 H1
DT5 C4' 0.162900 1.9080 CT
DT5 H4' 0.117600 1.3870 H1
DT5 O4' -0.369100 1.6837 OS
DT5 C1' 0.068000 1.9080 CT
DT5 H1' 0.180400 1.2870 H2
DT5 N1 -0.023900 1.8240 N*
DT5 C6 -0.220900 1.9080 CM
DT5 H6 0.260700 1.4090 H4
DT5 C5 0.002500 1.9080 CM
DT5 C7 -0.226900 1.9080 CT
DT5 H71 0.077000 1.4870 HC
DT5 H72 0.077000 1.4870 HC
DT5 H73 0.077000 1.4870 HC
DT5 C4 0.519400 1.9080 C
DT5 O4 -0.556300 1.6612 O
DT5 N3 -0.434000 1.8240 NA
DT5 H3 0.342000 0.6000 H
DT5 C2 0.567700 1.9080 C
DT5 O2 -0.588100 1.6612 O
DT5 C3' 0.071300 1.9080 CT
DT5 H3' 0.098500 1.3870 H1
DT5 C2' -0.085400 1.9080 CT
DT5 H2'1 0.071800 1.4870 HC
DT5 H2'2 0.071800 1.4870 HC
DT5 O3' -0.523200 1.6837 OS
DTN H5T 0.442200 0.0000 HO
DTN O5' -0.631800 1.7210 OH
DTN C5' -0.006900 1.9080 CT
DTN H5'1 0.075400 1.3870 H1
DTN H5'2 0.075400 1.3870 H1
DTN C4' 0.162900 1.9080 CT
DTN H4' 0.117600 1.3870 H1
DTN O4' -0.369100 1.6837 OS
DTN C1' 0.068000 1.9080 CT
DTN H1' 0.180400 1.2870 H2
DTN N1 -0.023900 1.8240 N*
DTN C6 -0.220900 1.9080 CM
DTN H6 0.260700 1.4090 H4
DTN C5 0.002500 1.9080 CM
DTN C7 -0.226900 1.9080 CT
DTN H71 0.077000 1.4870 HC
DTN H72 0.077000 1.4870 HC
DTN H73 0.077000 1.4870 HC
DTN C4 0.519400 1.9080 C
DTN O4 -0.556300 1.6612 O
DTN N3 -0.434000 1.8240 NA
DTN H3 0.342000 0.6000 H
DTN C2 0.567700 1.9080 C
DTN O2 -0.588100 1.6612 O
DTN C3' 0.071300 1.9080 CT
DTN H3' 0.098500 1.3870 H1
DTN C2' -0.085400 1.9080 CT
DTN H2'1 0.071800 1.4870 HC
DTN H2'2 0.071800 1.4870 HC
DTN O3' -0.654900 1.7210 OH
DTN H3T 0.439600 0.0000 HO
RA P 1.166200 2.1000 P
RA O1P -0.776000 1.6612 O2
RA O2P -0.776000 1.6612 O2
RA O5' -0.498900 1.6837 OS
RA C5' 0.055800 1.9080 CT
RA H5'1 0.067900 1.3870 H1
RA H5'2 0.067900 1.3870 H1
RA C4' 0.106500 1.9080 CT
RA H4' 0.117400 1.3870 H1
RA O4' -0.354800 1.6837 OS
RA C1' 0.039400 1.9080 CT
RA H1' 0.200700 1.2870 H2
RA N9 -0.025100 1.8240 N*
RA C8 0.200600 1.9080 CK
RA H8 0.155300 1.3590 H5
RA N7 -0.607300 1.8240 NB
RA C5 0.051500 1.9080 CB
RA C6 0.700900 1.9080 CA
RA N6 -0.901900 1.8240 N2
RA H61 0.411500 0.6000 H
RA H62 0.411500 0.6000 H
RA N1 -0.761500 1.8240 NC
RA C2 0.587500 1.9080 CQ
RA H2 0.047300 1.3590 H5
RA N3 -0.699700 1.8240 NC
RA C4 0.305300 1.9080 CB
RA C3' 0.202200 1.9080 CT
RA H3' 0.061500 1.3870 H1
RA C2' 0.067000 1.9080 CT
RA H2'1 0.097200 1.3870 H1
RA O2' -0.613900 1.7210 OH
RA HO'2 0.418600 0.0000 HO
RA O3' -0.524600 1.6837 OS
RA3 P 1.166200 2.1000 P
RA3 O1P -0.776000 1.6612 O2
RA3 O2P -0.776000 1.6612 O2
RA3 O5' -0.498900 1.6837 OS
RA3 C5' 0.055800 1.9080 CT
RA3 H5'1 0.067900 1.3870 H1
RA3 H5'2 0.067900 1.3870 H1
RA3 C4' 0.106500 1.9080 CT
RA3 H4' 0.117400 1.3870 H1
RA3 O4' -0.354800 1.6837 OS
RA3 C1' 0.039400 1.9080 CT
RA3 H1' 0.200700 1.2870 H2
RA3 N9 -0.025100 1.8240 N*
RA3 C8 0.200600 1.9080 CK
RA3 H8 0.155300 1.3590 H5
RA3 N7 -0.607300 1.8240 NB
RA3 C5 0.051500 1.9080 CB
RA3 C6 0.700900 1.9080 CA
RA3 N6 -0.901900 1.8240 N2
RA3 H61 0.411500 0.6000 H
RA3 H62 0.411500 0.6000 H
RA3 N1 -0.761500 1.8240 NC
RA3 C2 0.587500 1.9080 CQ
RA3 H2 0.047300 1.3590 H5
RA3 N3 -0.699700 1.8240 NC
RA3 C4 0.305300 1.9080 CB
RA3 C3' 0.202200 1.9080 CT
RA3 H3' 0.061500 1.3870 H1
RA3 C2' 0.067000 1.9080 CT
RA3 H2'1 0.097200 1.3870 H1
RA3 O2' -0.613900 1.7210 OH
RA3 HO'2 0.418600 0.0000 HO
RA3 O3' -0.654100 1.7210 OH
RA3 H3T 0.437600 0.0000 HO
RA5 H5T 0.429500 0.0000 HO
RA5 O5' -0.622300 1.7210 OH
RA5 C5' 0.055800 1.9080 CT
RA5 H5'1 0.067900 1.3870 H1
RA5 H5'2 0.067900 1.3870 H1
RA5 C4' 0.106500 1.9080 CT
RA5 H4' 0.117400 1.3870 H1
RA5 O4' -0.354800 1.6837 OS
RA5 C1' 0.039400 1.9080 CT
RA5 H1' 0.200700 1.2870 H2
RA5 N9 -0.025100 1.8240 N*
RA5 C8 0.200600 1.9080 CK
RA5 H8 0.155300 1.3590 H5
RA5 N7 -0.607300 1.8240 NB
RA5 C5 0.051500 1.9080 CB
RA5 C6 0.700900 1.9080 CA
RA5 N6 -0.901900 1.8240 N2
RA5 H61 0.411500 0.6000 H
RA5 H62 0.411500 0.6000 H
RA5 N1 -0.761500 1.8240 NC
RA5 C2 0.587500 1.9080 CQ
RA5 H2 0.047300 1.3590 H5
RA5 N3 -0.699700 1.8240 NC
RA5 C4 0.305300 1.9080 CB
RA5 C3' 0.202200 1.9080 CT
RA5 H3' 0.061500 1.3870 H1
RA5 C2' 0.067000 1.9080 CT
RA5 H2'1 0.097200 1.3870 H1
RA5 O2' -0.613900 1.7210 OH
RA5 HO'2 0.418600 0.0000 HO
RA5 O3' -0.524600 1.6837 OS
RAN H5T 0.429500 0.0000 HO
RAN O5' -0.622300 1.7210 OH
RAN C5' 0.055800 1.9080 CT
RAN H5'1 0.067900 1.3870 H1
RAN H5'2 0.067900 1.3870 H1
RAN C4' 0.106500 1.9080 CT
RAN H4' 0.117400 1.3870 H1
RAN O4' -0.354800 1.6837 OS
RAN C1' 0.039400 1.9080 CT
RAN H1' 0.200700 1.2870 H2
RAN N9 -0.025100 1.8240 N*
RAN C8 0.200600 1.9080 CK
RAN H8 0.155300 1.3590 H5
RAN N7 -0.607300 1.8240 NB
RAN C5 0.051500 1.9080 CB
RAN C6 0.700900 1.9080 CA
RAN N6 -0.901900 1.8240 N2
RAN H61 0.411500 0.6000 H
RAN H62 0.411500 0.6000 H
RAN N1 -0.761500 1.8240 NC
RAN C2 0.587500 1.9080 CQ
RAN H2 0.047300 1.3590 H5
RAN N3 -0.699700 1.8240 NC
RAN C4 0.305300 1.9080 CB
RAN C3' 0.202200 1.9080 CT
RAN H3' 0.061500 1.3870 H1
RAN C2' 0.067000 1.9080 CT
RAN H2'1 0.097200 1.3870 H1
RAN O2' -0.613900 1.7210 OH
RAN HO'2 0.418600 0.0000 HO
RAN O3' -0.654100 1.7210 OH
RAN H3T 0.437600 0.0000 HO
RC P 1.166200 2.1000 P
RC O1P -0.776000 1.6612 O2
RC O2P -0.776000 1.6612 O2
RC O5' -0.498900 1.6837 OS
RC C5' 0.055800 1.9080 CT
RC H5'1 0.067900 1.3870 H1
RC H5'2 0.067900 1.3870 H1
RC C4' 0.106500 1.9080 CT
RC H4' 0.117400 1.3870 H1
RC O4' -0.354800 1.6837 OS
RC C1' 0.006600 1.9080 CT
RC H1' 0.202900 1.2870 H2
RC N1 -0.048400 1.8240 N*
RC C6 0.005300 1.9080 CM
RC H6 0.195800 1.4090 H4
RC C5 -0.521500 1.9080 CM
RC H5 0.192800 1.4590 HA
RC C4 0.818500 1.9080 CA
RC N4 -0.953000 1.8240 N2
RC H41 0.423400 0.6000 H
RC H42 0.423400 0.6000 H
RC N3 -0.758400 1.8240 NC
RC C2 0.753800 1.9080 C
RC O2 -0.625200 1.6612 O
RC C3' 0.202200 1.9080 CT
RC H3' 0.061500 1.3870 H1
RC C2' 0.067000 1.9080 CT
RC H2'1 0.097200 1.3870 H1
RC O2' -0.613900 1.7210 OH
RC HO'2 0.418600 0.0000 HO
RC O3' -0.524600 1.6837 OS
RC3 P 1.166200 2.1000 P
RC3 O1P -0.776000 1.6612 O2
RC3 O2P -0.776000 1.6612 O2
RC3 O5' -0.498900 1.6837 OS
RC3 C5' 0.055800 1.9080 CT
RC3 H5'1 0.067900 1.3870 H1
RC3 H5'2 0.067900 1.3870 H1
RC3 C4' 0.106500 1.9080 CT
RC3 H4' 0.117400 1.3870 H1
RC3 O4' -0.354800 1.6837 OS
RC3 C1' 0.006600 1.9080 CT
RC3 H1' 0.202900 1.2870 H2
RC3 N1 -0.048400 1.8240 N*
RC3 C6 0.005300 1.9080 CM
RC3 H6 0.195800 1.4090 H4
RC3 C5 -0.521500 1.9080 CM
RC3 H5 0.192800 1.4590 HA
RC3 C4 0.818500 1.9080 CA
RC3 N4 -0.953000 1.8240 N2
RC3 H41 0.423400 0.6000 H
RC3 H42 0.423400 0.6000 H
RC3 N3 -0.758400 1.8240 NC
RC3 C2 0.753800 1.9080 C
RC3 O2 -0.625200 1.6612 O
RC3 C3' 0.202200 1.9080 CT
RC3 H3' 0.061500 1.3870 H1
RC3 C2' 0.067000 1.9080 CT
RC3 H2'1 0.097200 1.3870 H1
RC3 O2' -0.613900 1.7210 OH
RC3 HO'2 0.418600 0.0000 HO
RC3 O3' -0.654100 1.7210 OH
RC3 H3T 0.437600 0.0000 HO
RC5 H5T 0.429500 0.0000 HO
RC5 O5' -0.622300 1.7210 OH
RC5 C5' 0.055800 1.9080 CT
RC5 H5'1 0.067900 1.3870 H1
RC5 H5'2 0.067900 1.3870 H1
RC5 C4' 0.106500 1.9080 CT
RC5 H4' 0.117400 1.3870 H1
RC5 O4' -0.354800 1.6837 OS
RC5 C1' 0.006600 1.9080 CT
RC5 H1' 0.202900 1.2870 H2
RC5 N1 -0.048400 1.8240 N*
RC5 C6 0.005300 1.9080 CM
RC5 H6 0.195800 1.4090 H4
RC5 C5 -0.521500 1.9080 CM
RC5 H5 0.192800 1.4590 HA
RC5 C4 0.818500 1.9080 CA
RC5 N4 -0.953000 1.8240 N2
RC5 H41 0.423400 0.6000 H
RC5 H42 0.423400 0.6000 H
RC5 N3 -0.758400 1.8240 NC
RC5 C2 0.753800 1.9080 C
RC5 O2 -0.625200 1.6612 O
RC5 C3' 0.202200 1.9080 CT
RC5 H3' 0.061500 1.3870 H1
RC5 C2' 0.067000 1.9080 CT
RC5 H2'1 0.097200 1.3870 H1
RC5 O2' -0.613900 1.7210 OH
RC5 HO'2 0.418600 0.0000 HO
RC5 O3' -0.524600 1.6837 OS
RCN H5T 0.429500 0.0000 HO
RCN O5' -0.622300 1.7210 OH
RCN C5' 0.055800 1.9080 CT
RCN H5'1 0.067900 1.3870 H1
RCN H5'2 0.067900 1.3870 H1
RCN C4' 0.106500 1.9080 CT
RCN H4' 0.117400 1.3870 H1
RCN O4' -0.354800 1.6837 OS
RCN C1' 0.006600 1.9080 CT
RCN H1' 0.202900 1.2870 H2
RCN N1 -0.048400 1.8240 N*
RCN C6 0.005300 1.9080 CM
RCN H6 0.195800 1.4090 H4
RCN C5 -0.521500 1.9080 CM
RCN H5 0.192800 1.4590 HA
RCN C4 0.818500 1.9080 CA
RCN N4 -0.953000 1.8240 N2
RCN H41 0.423400 0.6000 H
RCN H42 0.423400 0.6000 H
RCN N3 -0.758400 1.8240 NC
RCN C2 0.753800 1.9080 C
RCN O2 -0.625200 1.6612 O
RCN C3' 0.202200 1.9080 CT
RCN H3' 0.061500 1.3870 H1
RCN C2' 0.067000 1.9080 CT
RCN H2'1 0.097200 1.3870 H1
RCN O2' -0.613900 1.7210 OH
RCN HO'2 0.418600 0.0000 HO
RCN O3' -0.654100 1.7210 OH
RCN H3T 0.437600 0.0000 HO
RG P 1.166200 2.1000 P
RG O1P -0.776000 1.6612 O2
RG O2P -0.776000 1.6612 O2
RG O5' -0.498900 1.6837 OS
RG C5' 0.055800 1.9080 CT
RG H5'1 0.067900 1.3870 H1
RG H5'2 0.067900 1.3870 H1
RG C4' 0.106500 1.9080 CT
RG H4' 0.117400 1.3870 H1
RG O4' -0.354800 1.6837 OS
RG C1' 0.019100 1.9080 CT
RG H1' 0.200600 1.2870 H2
RG N9 0.049200 1.8240 N*
RG C8 0.137400 1.9080 CK
RG H8 0.164000 1.3590 H5
RG N7 -0.570900 1.8240 NB
RG C5 0.174400 1.9080 CB
RG C6 0.477000 1.9080 C
RG O6 -0.559700 1.6612 O
RG N1 -0.478700 1.8240 NA
RG H1 0.342400 0.6000 H
RG C2 0.765700 1.9080 CA
RG N2 -0.967200 1.8240 N2
RG H21 0.436400 0.6000 H
RG H22 0.436400 0.6000 H
RG N3 -0.632300 1.8240 NC
RG C4 0.122200 1.9080 CB
RG C3' 0.202200 1.9080 CT
RG H3' 0.061500 1.3870 H1
RG C2' 0.067000 1.9080 CT
RG H2'1 0.097200 1.3870 H1
RG O2' -0.613900 1.7210 OH
RG HO'2 0.418600 0.0000 HO
RG O3' -0.524600 1.6837 OS
RG3 P 1.166200 2.1000 P
RG3 O1P -0.776000 1.6612 O2
RG3 O2P -0.776000 1.6612 O2
RG3 O5' -0.498900 1.6837 OS
RG3 C5' 0.055800 1.9080 CT
RG3 H5'1 0.067900 1.3870 H1
RG3 H5'2 0.067900 1.3870 H1
RG3 C4' 0.106500 1.9080 CT
RG3 H4' 0.117400 1.3870 H1
RG3 O4' -0.354800 1.6837 OS
RG3 C1' 0.019100 1.9080 CT
RG3 H1' 0.200600 1.2870 H2
RG3 N9 0.049200 1.8240 N*
RG3 C8 0.137400 1.9080 CK
RG3 H8 0.164000 1.3590 H5
RG3 N7 -0.570900 1.8240 NB
RG3 C5 0.174400 1.9080 CB
RG3 C6 0.477000 1.9080 C
RG3 O6 -0.559700 1.6612 O
RG3 N1 -0.478700 1.8240 NA
RG3 H1 0.342400 0.6000 H
RG3 C2 0.765700 1.9080 CA
RG3 N2 -0.967200 1.8240 N2
RG3 H21 0.436400 0.6000 H
RG3 H22 0.436400 0.6000 H
RG3 N3 -0.632300 1.8240 NC
RG3 C4 0.122200 1.9080 CB
RG3 C3' 0.202200 1.9080 CT
RG3 H3' 0.061500 1.3870 H1
RG3 C2' 0.067000 1.9080 CT
RG3 H2'1 0.097200 1.3870 H1
RG3 O2' -0.613900 1.7210 OH
RG3 HO'2 0.418600 0.0000 HO
RG3 O3' -0.654100 1.7210 OH
RG3 H3T 0.437600 0.0000 HO
RG5 H5T 0.429500 0.0000 HO
RG5 O5' -0.622300 1.7210 OH
RG5 C5' 0.055800 1.9080 CT
RG5 H5'1 0.067900 1.3870 H1
RG5 H5'2 0.067900 1.3870 H1
RG5 C4' 0.106500 1.9080 CT
RG5 H4' 0.117400 1.3870 H1
RG5 O4' -0.354800 1.6837 OS
RG5 C1' 0.019100 1.9080 CT
RG5 H1' 0.200600 1.2870 H2
RG5 N9 0.049200 1.8240 N*
RG5 C8 0.137400 1.9080 CK
RG5 H8 0.164000 1.3590 H5
RG5 N7 -0.570900 1.8240 NB
RG5 C5 0.174400 1.9080 CB
RG5 C6 0.477000 1.9080 C
RG5 O6 -0.559700 1.6612 O
RG5 N1 -0.478700 1.8240 NA
RG5 H1 0.342400 0.6000 H
RG5 C2 0.765700 1.9080 CA
RG5 N2 -0.967200 1.8240 N2
RG5 H21 0.436400 0.6000 H
RG5 H22 0.436400 0.6000 H
RG5 N3 -0.632300 1.8240 NC
RG5 C4 0.122200 1.9080 CB
RG5 C3' 0.202200 1.9080 CT
RG5 H3' 0.061500 1.3870 H1
RG5 C2' 0.067000 1.9080 CT
RG5 H2'1 0.097200 1.3870 H1
RG5 O2' -0.613900 1.7210 OH
RG5 HO'2 0.418600 0.0000 HO
RG5 O3' -0.524600 1.6837 OS
RGN H5T 0.429500 0.0000 HO
RGN O5' -0.622300 1.7210 OH
RGN C5' 0.055800 1.9080 CT
RGN H5'1 0.067900 1.3870 H1
RGN H5'2 0.067900 1.3870 H1
RGN C4' 0.106500 1.9080 CT
RGN H4' 0.117400 1.3870 H1
RGN O4' -0.354800 1.6837 OS
RGN C1' 0.019100 1.9080 CT
RGN H1' 0.200600 1.2870 H2
RGN N9 0.049200 1.8240 N*
RGN C8 0.137400 1.9080 CK
RGN H8 0.164000 1.3590 H5
RGN N7 -0.570900 1.8240 NB
RGN C5 0.174400 1.9080 CB
RGN C6 0.477000 1.9080 C
RGN O6 -0.559700 1.6612 O
RGN N1 -0.478700 1.8240 NA
RGN H1 0.342400 0.6000 H
RGN C2 0.765700 1.9080 CA
RGN N2 -0.967200 1.8240 N2
RGN H21 0.436400 0.6000 H
RGN H22 0.436400 0.6000 H
RGN N3 -0.632300 1.8240 NC
RGN C4 0.122200 1.9080 CB
RGN C3' 0.202200 1.9080 CT
RGN H3' 0.061500 1.3870 H1
RGN C2' 0.067000 1.9080 CT
RGN H2'1 0.097200 1.3870 H1
RGN O2' -0.613900 1.7210 OH
RGN HO'2 0.418600 0.0000 HO
RGN O3' -0.654100 1.7210 OH
RGN H3T 0.437600 0.0000 HO
RU P 1.166200 2.1000 P
RU O1P -0.776000 1.6612 O2
RU O2P -0.776000 1.6612 O2
RU O5' -0.498900 1.6837 OS
RU C5' 0.055800 1.9080 CT
RU H5'1 0.067900 1.3870 H1
RU H5'2 0.067900 1.3870 H1
RU C4' 0.106500 1.9080 CT
RU H4' 0.117400 1.3870 H1
RU O4' -0.354800 1.6837 OS
RU C1' 0.067400 1.9080 CT
RU H1' 0.182400 1.2870 H2
RU N1 0.041800 1.8240 N*
RU C6 -0.112600 1.9080 CM
RU H6 0.218800 1.4090 H4
RU C5 -0.363500 1.9080 CM
RU H5 0.181100 1.4590 HA
RU C4 0.595200 1.9080 C
RU O4 -0.576100 1.6612 O
RU N3 -0.354900 1.8240 NA
RU H3 0.315400 0.6000 H
RU C2 0.468700 1.9080 C
RU O2 -0.547700 1.6612 O
RU C3' 0.202200 1.9080 CT
RU H3' 0.061500 1.3870 H1
RU C2' 0.067000 1.9080 CT
RU H2'1 0.097200 1.3870 H1
RU O2' -0.613900 1.7210 OH
RU HO'2 0.418600 0.0000 HO
RU O3' -0.524600 1.6837 OS
RU3 P 1.166200 2.1000 P
RU3 O1P -0.776000 1.6612 O2
RU3 O2P -0.776000 1.6612 O2
RU3 O5' -0.498900 1.6837 OS
RU3 C5' 0.055800 1.9080 CT
RU3 H5'1 0.067900 1.3870 H1
RU3 H5'2 0.067900 1.3870 H1
RU3 C4' 0.106500 1.9080 CT
RU3 H4' 0.117400 1.3870 H1
RU3 O4' -0.354800 1.6837 OS
RU3 C1' 0.067400 1.9080 CT
RU3 H1' 0.182400 1.2870 H2
RU3 N1 0.041800 1.8240 N*
RU3 C6 -0.112600 1.9080 CM
RU3 H6 0.218800 1.4090 H4
RU3 C5 -0.363500 1.9080 CM
RU3 H5 0.181100 1.4590 HA
RU3 C4 0.595200 1.9080 C
RU3 O4 -0.576100 1.6612 O
RU3 N3 -0.354900 1.8240 NA
RU3 H3 0.315400 0.6000 H
RU3 C2 0.468700 1.9080 C
RU3 O2 -0.547700 1.6612 O
RU3 C3' 0.202200 1.9080 CT
RU3 H3' 0.061500 1.3870 H1
RU3 C2' 0.067000 1.9080 CT
RU3 H2'1 0.097200 1.3870 H1
RU3 O2' -0.613900 1.7210 OH
RU3 HO'2 0.418600 0.0000 HO
RU3 O3' -0.654100 1.7210 OH
RU3 H3T 0.437600 0.0000 HO
RU5 H5T 0.429500 0.0000 HO
RU5 O5' -0.622300 1.7210 OH
RU5 C5' 0.055800 1.9080 CT
RU5 H5'1 0.067900 1.3870 H1
RU5 H5'2 0.067900 1.3870 H1
RU5 C4' 0.106500 1.9080 CT
RU5 H4' 0.117400 1.3870 H1
RU5 O4' -0.354800 1.6837 OS
RU5 C1' 0.067400 1.9080 CT
RU5 H1' 0.182400 1.2870 H2
RU5 N1 0.041800 1.8240 N*
RU5 C6 -0.112600 1.9080 CM
RU5 H6 0.218800 1.4090 H4
RU5 C5 -0.363500 1.9080 CM
RU5 H5 0.181100 1.4590 HA
RU5 C4 0.595200 1.9080 C
RU5 O4 -0.576100 1.6612 O
RU5 N3 -0.354900 1.8240 NA
RU5 H3 0.315400 0.6000 H
RU5 C2 0.468700 1.9080 C
RU5 O2 -0.547700 1.6612 O
RU5 C3' 0.202200 1.9080 CT
RU5 H3' 0.061500 1.3870 H1
RU5 C2' 0.067000 1.9080 CT
RU5 H2'1 0.097200 1.3870 H1
RU5 O2' -0.613900 1.7210 OH
RU5 HO'2 0.418600 0.0000 HO
RU5 O3' -0.524600 1.6837 OS
RUN H5T 0.429500 0.0000 HO
RUN O5' -0.622300 1.7210 OH
RUN C5' 0.055800 1.9080 CT
RUN H5'1 0.067900 1.3870 H1
RUN H5'2 0.067900 1.3870 H1
RUN C4' 0.106500 1.9080 CT
RUN H4' 0.117400 1.3870 H1
RUN O4' -0.354800 1.6837 OS
RUN C1' 0.067400 1.9080 CT
RUN H1' 0.182400 1.2870 H2
RUN N1 0.041800 1.8240 N*
RUN C6 -0.112600 1.9080 CM
RUN H6 0.218800 1.4090 H4
RUN C5 -0.363500 1.9080 CM
RUN H5 0.181100 1.4590 HA
RUN C4 0.595200 1.9080 C
RUN O4 -0.576100 1.6612 O
RUN N3 -0.354900 1.8240 NA
RUN H3 0.315400 0.6000 H
RUN C2 0.468700 1.9080 C
RUN O2 -0.547700 1.6612 O
RUN C3' 0.202200 1.9080 CT
RUN H3' 0.061500 1.3870 H1
RUN C2' 0.067000 1.9080 CT
RUN H2'1 0.097200 1.3870 H1
RUN O2' -0.613900 1.7210 OH
RUN HO'2 0.418600 0.0000 HO
RUN O3' -0.654100 1.7210 OH
RUN H3T 0.437600 0.0000 HO
WAT HW 0.417000 0.0000 HW
WAT OW -0.834000 1.6612 OW
|