* CHARMM 22 residue topology file created by MODELLER SVN, 31 January, 2003 * Atom type index does not correspond to original CHARMM atom type index. * Other features might also differ from the original CHARMM. * MODELLER topology.submodel = 7 MASS 1 H 1.008 H MASS 2 HC 1.008 H MASS 3 HA 1.008 H MASS 4 HT 1.008 H MASS 5 HP 1.008 H MASS 6 HB 1.008 H MASS 7 HR1 1.008 H MASS 8 HR2 1.008 H MASS 9 HR3 1.008 H MASS 10 HS 1.008 H MASS 11 C 12.011 C MASS 12 CA 12.011 C MASS 13 CT1 12.011 C MASS 14 CT2 12.011 C MASS 15 CT3 12.011 C MASS 16 CPH1 12.011 C MASS 17 CPH2 12.011 C MASS 18 CPT 12.011 C MASS 19 CY 12.011 C MASS 20 CP1 12.011 C MASS 21 CP2 12.011 C MASS 22 CP3 12.011 C MASS 23 CC 12.011 C MASS 24 CD 12.011 C MASS 25 CPA 12.011 C MASS 26 CPB 12.011 C MASS 27 CPM 12.011 C MASS 28 CM 12.011 C MASS 29 CS 12.011 C MASS 30 N 14.007 N MASS 31 NR1 14.007 N MASS 32 NR2 14.007 N MASS 33 NR3 14.007 N MASS 34 NH1 14.007 N MASS 35 NH2 14.007 N MASS 36 NH3 14.007 N MASS 37 NC2 14.007 N MASS 38 NY 14.007 N MASS 39 NP 14.007 N MASS 40 NPH 14.007 N MASS 41 NP1 14.007 N MASS 42 PA 15.000 P MASS 43 PB 15.000 P MASS 44 O 15.999 O MASS 45 OB 15.999 O MASS 46 OC 15.999 O MASS 47 OH1 15.999 O MASS 48 OS 15.999 O MASS 49 OT 15.999 O MASS 50 OM 15.999 O MASS 72 S 32.060 S MASS 73 SM 32.060 S MASS 74 SS 32.060 S MASS 75 CAL 40.080 CA MASS 76 ZN 65.370 ZN MASS 77 FE 55.847 FE MASS 78 UNDF 55.847 X MASS 82 CE1 12.011 C MASS 83 CE2 12.011 C MASS 84 CN1 12.011 C MASS 85 CN1A 12.011 C MASS 86 CN2 12.011 C MASS 87 CN3 12.011 C MASS 88 CN3A 12.011 C MASS 89 CN3B 12.011 C MASS 90 CN3C 12.011 C MASS 91 CN3D 12.011 C MASS 92 CN4 12.011 C MASS 93 CN5 12.011 C MASS 94 CN6 12.011 C MASS 95 CN6B 12.011 C MASS 96 CN6C 12.011 C MASS 97 CN7 12.011 C MASS 98 CN8 12.011 C MASS 99 CN9 12.011 C MASS 100 DUM 0.001 X MASS 101 HA1 1.008 H MASS 102 HA2 1.008 H MASS 103 HE 4.003 HE MASS 104 HN1 1.008 H MASS 105 HN2 1.008 H MASS 106 HN3 1.008 H MASS 107 HN3B 1.008 H MASS 108 HN4 1.008 H MASS 109 HN5 1.008 H MASS 110 HN6 1.008 H MASS 111 HN7 1.008 H MASS 112 MG 24.305 MG MASS 113 NE 20.180 NE MASS 114 NN1 14.007 N MASS 115 NN2 14.007 N MASS 116 NN2G 14.007 N MASS 117 NN2U 14.007 N MASS 118 NN3 14.007 N MASS 119 NN3A 14.007 N MASS 120 NN3I 14.007 N MASS 121 NN4 14.007 N MASS 122 NN5 14.007 N MASS 123 ON1 15.999 O MASS 124 ON1C 15.999 O MASS 125 ON2 15.999 O MASS 126 ON2B 15.999 O MASS 127 ON3 15.999 O MASS 128 ON4 15.999 O MASS 129 ON5 15.999 O MASS 130 ON6 15.999 O MASS 131 P 30.974 P MASS 132 P2 30.974 P MASS 133 SOD 22.990 NA DECL -CA DECL -C DECL -O DECL +N DECL +HN DECL +CA DEFA FIRS NONE LAST NONE AUTO ANGLES DIHE RESI ALA 0.00000 ATOM CA CT1 0.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS NTER LAST CTER RESI CYS 0.00000 ATOM CA CT1 0.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS NTER LAST CTER RESI ASP -1.00000 ATOM CA CT1 -1.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS NTER LAST CTER RESI GLU -1.00000 ATOM CA CT1 -1.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS NTER LAST CTER RESI PHE 0.00000 ATOM CA CT1 0.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS NTER LAST CTER RESI GLY 0.00000 ATOM CA CT1 0.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS GLYP LAST CTER RESI HIS 0.00000 ATOM CA CT1 0.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS NTER LAST CTER RESI ILE 0.00000 ATOM CA CT1 0.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS NTER LAST CTER RESI LYS 1.00000 ATOM CA CT1 1.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS NTER LAST CTER RESI LEU 0.00000 ATOM CA CT1 0.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS NTER LAST CTER RESI MET 0.00000 ATOM CA CT1 0.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS NTER LAST CTER RESI ASN 0.00000 ATOM CA CT1 0.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS NTER LAST CTER RESI PRO 0.00000 ATOM CA CT1 0.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS PROP LAST CTER RESI GLN 0.00000 ATOM CA CT1 0.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS NTER LAST CTER RESI ARG 1.00000 ATOM CA CT1 1.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS NTER LAST CTER RESI SER 0.00000 ATOM CA CT1 0.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS NTER LAST CTER RESI THR 0.00000 ATOM CA CT1 0.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS NTER LAST CTER RESI VAL 0.00000 ATOM CA CT1 0.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS NTER LAST CTER RESI TRP 0.00000 ATOM CA CT1 0.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS NTER LAST CTER RESI TYR 0.00000 ATOM CA CT1 0.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS NTER LAST CTER RESI ASX 0.00000 ATOM CA CT1 0.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS NTER LAST CTER RESI GLX 0.00000 ATOM CA CT1 0.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS NTER LAST CTER RESI UNK 0.00000 ATOM CA CT1 0.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS GLYP LAST CTER RESI HSE 0.00000 ATOM CA CT1 0.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS NTER LAST CTER RESI HSP 1.00000 ATOM CA CT1 1.00000 BOND CA +CA ANGL -CA CA +CA DIHE -CA CA +CA #CA IC -CA CA +CA #CA 3.82 61.0 -165.0 61.0 3.82 PATC FIRS NTER LAST CTER RESI TIP3 0.00000 ATOM O OT 0.00000 PATC FIRS NONE LAST NONE RESI CAL 2.00000 ATOM CA CAL 2.00000 PATC FIRS NONE LAST NONE RESI ZN2 2.00000 ATOM ZN ZN 2.00000 PATC FIRS NONE LAST NONE RESI HEME -2.00000 ATOM FE FE 0.24000 ATOM NA NPH -0.18000 ATOM NB NP1 -0.18000 ATOM NC NPH -0.18000 ATOM ND NP1 -0.18000 ATOM C1A CPA 0.12000 ATOM C2A CPB -0.06000 ATOM C3A CPB -0.06000 ATOM C4A CPA 0.12000 ATOM C1B CPA 0.12000 ATOM C2B CPB -0.06000 ATOM C3B CPB -0.06000 ATOM C4B CPA 0.12000 ATOM C1C CPA 0.12000 ATOM C2C CPB -0.06000 ATOM C3C CPB -0.06000 ATOM C4C CPA 0.12000 ATOM C1D CPA 0.12000 ATOM C2D CPB -0.06000 ATOM C3D CPB -0.06000 ATOM C4D CPA 0.12000 ATOM CHA CPM 0.00000 ATOM CHB CPM 0.00000 ATOM CHC CPM 0.00000 ATOM CHD CPM 0.00000 ATOM CMA CT3 0.00000 ATOM CAA CT2 0.00000 ATOM CBA CT2 -0.10000 ATOM CGA CC 0.62000 ATOM O1A OC -0.76000 ATOM O2A OC -0.76000 ATOM CMB CT3 0.00000 ATOM CAB C 0.00000 ATOM CBB C 0.00000 ATOM CMC CT3 0.00000 ATOM CAC C 0.00000 ATOM CBC C 0.00000 ATOM CMD CT3 0.00000 ATOM CAD CT2 0.00000 ATOM CBD CT2 -0.10000 ATOM CGD CC 0.62000 ATOM O1D OC -0.76000 ATOM O2D OC -0.76000 BOND FE NA FE NB FE NC FE ND NA C1A C1A C2A BOND C2A C3A C3A C4A NA C4A C2A CAA CAA CBA CBA CGA BOND CGA O1A CGA O2A C3A CMA CHB C4A CHB C1B NB C1B BOND C1B C2B C2B C3B C3B C4B NB C4B C2B CMB C3B CAB BOND CAB CBB CHC C4B CHC C1C NC C1C C1C C2C C2C C3C BOND C3C C4C NC C4C C2C CMC C3C CAC CAC CBC CHD C4C BOND CHD C1D ND C1D C1D C2D C2D C3D C3D C4D ND C4D BOND C2D CMD C3D CAD CAD CBD CBD CGD CGD O1D CGD O2D BOND CHA C4D CHA C1A IMPR C2A C1A C3A CAA C3A C2A C4A CMA C2B C1B C3B CMB IMPR C3B C2B C4B CAB C2C C1C C3C CMC C3C C2C C4C CAC IMPR C2D C1D C3D CMD C3D C2D C4D CAD O1A CBA O2A CGA IMPR O1D CBD O2D CGD C4A NA C1A C2A C1A NA C4A C3A IMPR C4B NB C1B C2B C1B NB C4B C3B C4C NC C1C C2C IMPR C1C NC C4C C3C C4D ND C1D C2D C1D ND C4D C3D IMPR NA C1A C2A C3A NA C4A C3A C2A NB C1B C2B C3B IMPR NB C4B C3B C2B NC C1C C2C C3C NC C4C C3C C2C IMPR ND C1D C2D C3D ND C4D C3D C2D NA C1A CHA C4D IMPR NA C4A CHB C1B NB C1B CHB C4A NB C4B CHC C1C IMPR NC C1C CHC C4B NC C4C CHD C1D ND C1D CHD C4C IMPR ND C4D CHA C1A C1A C2A CHA NA C4A C3A CHB NA IMPR C1B C2B CHB NB C4B C3B CHC NB C1C C2C CHC NC IMPR C4C C3C CHD NC C1D C2D CHD ND C4D C3D CHA ND IMPR NA C1A C4A FE NB C1B C4B FE NC C1C C4C FE IMPR ND C1D C4D FE IC FE NA C4A C3A 0.0000 0.0000 180.0000 0.0000 0.0000 IC C3A C4A NA C1A 0.0000 0.0000 0.0000 0.0000 0.0000 IC FE NA C1A C2A 0.0000 0.0000 180.0000 0.0000 0.0000 IC C4A NA FE NB 0.0000 0.0000 0.0000 0.0000 0.0000 IC NA FE NB C1B 0.0000 0.0000 0.0000 0.0000 0.0000 IC FE NB C1B C2B 0.0000 0.0000 180.0000 0.0000 0.0000 IC C2B C1B NB C4B 0.0000 0.0000 0.0000 0.0000 0.0000 IC FE NB C4B C3B 0.0000 0.0000 180.0000 0.0000 0.0000 IC C4B NB FE NC 0.0000 0.0000 0.0000 0.0000 0.0000 IC NB FE NC C1C 0.0000 0.0000 0.0000 0.0000 0.0000 IC FE NC C1C C2C 0.0000 0.0000 180.0000 0.0000 0.0000 IC C2C C1C NC C4C 0.0000 0.0000 0.0000 0.0000 0.0000 IC FE NC C4C C3C 0.0000 0.0000 180.0000 0.0000 0.0000 IC C4C NC FE ND 0.0000 0.0000 0.0000 0.0000 0.0000 IC NC FE ND C1D 0.0000 0.0000 0.0000 0.0000 0.0000 IC FE ND C1D C2D 0.0000 0.0000 180.0000 0.0000 0.0000 IC C2D C1D ND C4D 0.0000 0.0000 0.0000 0.0000 0.0000 IC FE ND C4D C3D 0.0000 0.0000 180.0000 0.0000 0.0000 IC C4A NA FE CHB 0.0000 0.0000 0.0000 0.0000 0.0000 IC C4B NB FE CHC 0.0000 0.0000 0.0000 0.0000 0.0000 IC C4C NC FE CHD 0.0000 0.0000 0.0000 0.0000 0.0000 IC C4D ND FE CHA 0.0000 0.0000 0.0000 0.0000 0.0000 IC C3B C1B *C2B CMB 0.0000 0.0000 180.0000 0.0000 0.0000 IC C4B C2B *C3B CAB 0.0000 0.0000 180.0000 0.0000 0.0000 IC C2B C3B CAB CBB 0.0000 0.0000 -45.0000 0.0000 0.0000 IC CHC C1C C2C CMC 0.0000 0.0000 0.0000 0.0000 0.0000 IC C4C C2C *C3C CAC 0.0000 0.0000 180.0000 0.0000 0.0000 IC C2C C3C CAC CBC 0.0000 0.0000 -45.0000 0.0000 0.0000 IC C4D C2D *C3D CAD 0.0000 0.0000 180.0000 0.0000 0.0000 IC C3D C1D *C2D CMD 0.0000 0.0000 180.0000 0.0000 0.0000 IC C2D C3D CAD CBD 0.0000 0.0000 -120.0000 0.0000 0.0000 IC C3D CAD CBD CGD 0.0000 0.0000 180.0000 0.0000 0.0000 IC CAD CBD CGD O1D 0.0000 0.0000 0.0000 0.0000 0.0000 IC CAD CBD CGD O2D 0.0000 0.0000 180.0000 0.0000 0.0000 IC C4A C2A *C3A CMA 0.0000 0.0000 180.0000 0.0000 0.0000 IC C3A C1A *C2A CAA 0.0000 0.0000 180.0000 0.0000 0.0000 IC C1A C2A CAA CBA 0.0000 0.0000 120.0000 0.0000 0.0000 IC C2A CAA CBA CGA 0.0000 0.0000 180.0000 0.0000 0.0000 IC CAA CBA CGA O1A 0.0000 0.0000 0.0000 0.0000 0.0000 IC CAA CBA CGA O2A 0.0000 0.0000 180.0000 0.0000 0.0000 IC C3C C1C *C2C CMC 0.0000 0.0000 180.0000 0.0000 0.0000 IC CBA O1A *CGA O2A 0.0000 0.0000 180.0000 0.0000 0.0000 IC CBD O1D *CGD O2D 0.0000 0.0000 180.0000 0.0000 0.0000 PATC FIRS NONE LAST NONE RESI O2 0.00000 ATOM O1 OM 0.02100 ATOM O2 OM -0.02100 BOND O1 O2 PATC FIRS NONE LAST NONE RESI CO 0.00000 ATOM C CM 0.02100 ATOM O OM -0.02100 BOND C O PATC FIRS NONE LAST NONE RESI CSS 0.00000 ATOM CA CT1 0.00000 PATC FIRS NTER LAST CTER RESI GDP -2.00000 ATOM PB PB 0.00000 ATOM O1B OT -0.46339 ATOM O2B OT -0.17823 ATOM O3B OT -0.17823 ATOM PA PA 0.00000 ATOM O1A OT -0.46339 ATOM O2A OT -0.17823 ATOM O3A OS -0.47765 ATOM O5' OS -0.47765 ATOM C5' CT1 -0.00642 ATOM C4' CT1 0.12099 ATOM O4' OS -0.26377 ATOM C3' CT1 0.31534 ATOM O3' OT -0.17823 ATOM C2' CT1 0.40544 ATOM O2' OT -0.17823 ATOM C1' CT1 0.25098 ATOM N9 NY -0.21387 ATOM C8 CT1 0.44405 ATOM N7 NY -0.21387 ATOM C5 CT1 0.06049 ATOM C6 CT1 -0.10907 ATOM O6 OS -0.46339 ATOM N1 NY -0.10694 ATOM C2 CT1 0.38355 ATOM N2 NY 0.00000 ATOM N3 NY -0.21387 ATOM C4 CT1 0.38355 BOND PB O1B PB O2B PB O3B PB O3A PA O1A PA O2A BOND PA O3A PA O5' O5' C5' C5' C4' C4' O4' C4' C3' BOND O4' C1' C3' O3' C3' C2' C2' O2' C2' C1' C1' N9 BOND N9 C8 N9 C4 C8 N7 N7 C5 C5 C6 C5 C4 BOND C6 O6 C6 N1 N1 C2 C2 N2 C2 N3 N3 C4 IC O1B PB O3A PA 1.4800 110.2700 -110.2900 132.3800 1.6000 IC O2B PB O3A PA 1.4800 105.5200 18.5700 132.3800 1.6000 IC O3B PB O3A PA 1.5200 104.3300 130.6600 132.3800 1.6000 IC PB O3A PA O1A 1.5700 132.3800 60.1200 109.4500 1.4600 IC PB O3A PA O2A 1.5700 132.3800 -71.1200 107.1000 1.4600 IC PB O3A PA O5' 1.5700 132.3800 176.5700 99.2100 1.5900 IC O1A PA O5' C5' 1.4600 111.1800 41.2200 124.4500 1.4300 IC O2A PA O5' C5' 1.4600 108.1300 174.5900 124.4500 1.4300 IC O3A PA O5' C5' 1.6000 99.2100 -73.9000 124.4500 1.4300 IC PA O5' C5' C4' 1.5900 124.4500 -127.2600 110.0300 1.5500 IC O5' C5' C4' O4' 1.4300 110.0300 -71.3600 108.3000 1.4200 IC O5' C5' C4' C3' 1.4300 110.0300 46.9800 117.9500 1.5400 IC C5' C4' O4' C1' 1.5500 108.3000 127.4100 111.3700 1.4400 IC C3' C4' O4' C1' 1.5400 104.5300 0.8500 111.3700 1.4400 IC C4' O4' C1' C2' 1.4200 111.3700 -21.1000 106.0800 1.5000 IC C4' O4' C1' N9 1.4200 111.3700 -142.2800 105.2700 1.4700 IC O4' C1' C2' C3' 1.4400 106.0800 31.8200 101.6800 1.5100 IC N9 C1' C2' C3' 1.4700 114.0200 147.1900 101.6800 1.5100 IC O4' C1' C2' O2' 1.4400 106.0800 155.8200 112.7000 1.4200 IC O2' C2' C3' C4' 1.4200 115.2800 -153.3200 105.3800 1.5400 IC C1' C2' C3' C4' 1.5000 101.6800 -31.0800 105.3800 1.5400 IC O2' C2' C3' O3' 1.4200 115.2800 -35.5800 109.8900 1.4100 IC O3' C3' C4' C5' 1.4100 109.3800 141.0900 117.9500 1.5500 IC C2' C3' C4' C5' 1.5100 105.3800 -100.8300 117.9500 1.5500 IC O3' C3' C4' O4' 1.4100 109.3800 -98.6100 104.5300 1.4200 IC O4' C1' N9 C8 1.4400 105.2700 66.1400 128.2700 1.3700 IC C2' C1' N9 C8 1.5000 114.0200 -49.7000 128.2700 1.3700 IC O4' C1' N9 C4 1.4400 105.2700 -109.3500 126.7500 1.3800 IC C1' C8 *N9 C4 1.4700 128.2700 176.2600 104.8600 1.3800 IC C1' N9 C8 N7 1.4700 128.2700 -176.7600 115.2100 1.3000 IC C4 N9 C8 N7 1.3800 104.8600 -0.4900 115.2100 1.3000 IC N9 C8 N7 C5 1.3700 115.2100 0.2600 102.9700 1.4000 IC C8 N7 C5 C6 1.3000 102.9700 179.9300 129.8500 1.4200 IC C8 N7 C5 C4 1.3000 102.9700 0.0700 111.0100 1.3700 IC N7 C5 C6 O6 1.4000 129.8500 0.4800 127.6700 1.2300 IC C4 C5 C6 O6 1.3700 119.1400 -179.6800 127.6700 1.2300 IC N7 C5 C6 N1 1.4000 129.8500 -179.4200 112.1900 1.3800 IC C5 C6 N1 C2 1.4200 112.1900 -0.5700 124.9200 1.3700 IC O6 C6 N1 C2 1.2300 120.1400 179.5300 124.9200 1.3700 IC C6 N1 C2 N2 1.3800 124.9200 -179.5900 117.5400 1.3200 IC C6 N1 C2 N3 1.3800 124.9200 0.7200 123.8300 1.3300 IC N1 C2 N3 C4 1.3700 123.8300 -0.6200 112.1500 1.3600 IC N2 C2 N3 C4 1.3200 118.6300 179.7000 112.1500 1.3600 IC C2 N3 C4 N9 1.3300 112.1500 -179.7500 126.2800 1.3800 IC C2 N3 C4 C5 1.3300 112.1500 0.5300 127.7700 1.3700 IC C5 C4 N9 C1' 1.3700 105.9500 176.8300 126.7500 1.4700 IC N3 C4 N9 C1' 1.3600 126.2800 -2.9400 126.7500 1.4700 IC C5 C4 N9 C8 1.3700 105.9500 0.4900 104.8600 1.3700 IC N9 C4 C5 N7 1.3800 105.9500 -0.3600 111.0100 1.4000 IC N3 C4 C5 N7 1.3600 127.7700 179.4000 111.0100 1.4000 IC N9 C4 C5 C6 1.3800 105.9500 179.7600 119.1400 1.4200 PATC FIRS NONE LAST NONE RESI GTP -2.00000 ATOM PG PB 0.00000 ATOM O3B OS -0.46518 ATOM O1G OT -0.20829 ATOM O2G OT -0.17358 ATOM O3G OT -0.17358 ATOM PB PA 0.00000 ATOM O1B OT -0.45130 ATOM O2B OT -0.17358 ATOM PA PA 0.00000 ATOM O1A OT -0.45130 ATOM O2A OT -0.17358 ATOM O3A OS -0.46518 ATOM O5' OS -0.46518 ATOM C5' CT1 0.11751 ATOM C4' CT1 0.20891 ATOM O4' OS -0.25689 ATOM C3' CT1 0.40477 ATOM O3' OT -0.17358 ATOM C2' CT1 0.49617 ATOM O2' OT -0.17358 ATOM C1' CT1 0.33948 ATOM N9 NY -0.20829 ATOM C8 CT1 0.53534 ATOM N7 NY -0.20829 ATOM C5 CT1 0.10446 ATOM C6 CT1 -0.08332 ATOM O6 OT -0.45130 ATOM N1 NY -0.10415 ATOM C2 CT1 0.43088 ATOM N2 NY 0.00000 ATOM N3 NY -0.20829 ATOM C4 CT1 0.43088 BOND PG O3B PG O1G PG O2G PG O3G O3B PB PB O1B BOND PB O2B PB O3A PA O1A PA O2A PA O3A PA O5' BOND O5' C5' C5' C4' C4' O4' C4' C3' O4' C1' C3' O3' BOND C3' C2' C2' O2' C2' C1' C1' N9 N9 C8 N9 C4 BOND C8 N7 N7 C5 C5 C6 C5 C4 C6 O6 C6 N1 BOND N1 C2 C2 N2 C2 N3 N3 C4 IC O1G PG O3B PB 1.8800 104.5300 169.4600 132.7100 1.5900 IC O2G PG O3B PB 1.4500 109.1700 -70.9400 132.7100 1.5900 IC O3G PG O3B PB 1.5000 99.7000 48.5400 132.7100 1.5900 IC PG O3B PB O1B 1.6300 132.7100 -83.5500 110.9800 1.4700 IC PG O3B PB O2B 1.6300 132.7100 53.9700 111.5800 1.4500 IC PG O3B PB O3A 1.6300 132.7100 164.6700 104.8700 1.6300 IC O3B PB O3A PA 1.5900 104.8700 -93.5500 138.3900 1.6200 IC O1B PB O3A PA 1.4700 104.0500 149.8100 138.3900 1.6200 IC O2B PB O3A PA 1.4500 102.9000 23.2700 138.3900 1.6200 IC PB O3A PA O1A 1.6300 138.3900 -70.7300 107.1300 1.4700 IC PB O3A PA O2A 1.6300 138.3900 62.3600 110.2600 1.4700 IC PB O3A PA O5' 1.6300 138.3900 179.0500 92.8300 1.6500 IC O1A PA O5' C5' 1.4700 108.3900 159.0800 120.6900 1.4600 IC O2A PA O5' C5' 1.4700 113.8100 21.8000 120.6900 1.4600 IC O3A PA O5' C5' 1.6200 92.8300 -91.8300 120.6900 1.4600 IC PA O5' C5' C4' 1.6500 120.6900 -117.0300 111.6900 1.5800 IC O5' C5' C4' O4' 1.4600 111.6900 -64.3100 102.8400 1.4000 IC O5' C5' C4' C3' 1.4600 111.6900 51.4400 122.0500 1.5300 IC C5' C4' O4' C1' 1.5800 102.8400 134.2400 113.7900 1.4000 IC C3' C4' O4' C1' 1.5300 103.9600 6.1100 113.7900 1.4000 IC C4' O4' C1' C2' 1.4000 113.7900 -25.6800 101.8700 1.4900 IC C4' O4' C1' N9 1.4000 113.7900 -146.2900 105.7100 1.4700 IC O4' C1' C2' C3' 1.4000 101.8700 34.7100 104.4500 1.4800 IC N9 C1' C2' C3' 1.4700 115.0800 148.5300 104.4500 1.4800 IC O4' C1' C2' O2' 1.4000 101.8700 164.9300 111.7700 1.4100 IC O2' C2' C3' C4' 1.4100 119.2200 -157.2400 103.5800 1.5300 IC C1' C2' C3' C4' 1.4900 104.4500 -31.5700 103.5800 1.5300 IC O2' C2' C3' O3' 1.4100 119.2200 -41.2800 111.1300 1.3900 IC O3' C3' C4' C5' 1.3900 108.2000 143.1300 122.0500 1.5800 IC C2' C3' C4' C5' 1.4800 103.5800 -98.8600 122.0500 1.5800 IC O3' C3' C4' O4' 1.3900 108.2000 -101.6800 103.9600 1.4000 IC O4' C1' N9 C8 1.4000 105.7100 63.5000 128.7400 1.3800 IC C2' C1' N9 C8 1.4900 115.0800 -48.0600 128.7400 1.3800 IC O4' C1' N9 C4 1.4000 105.7100 -115.5600 126.0600 1.4100 IC C1' C8 *N9 C4 1.4700 128.7400 179.2200 105.2000 1.4100 IC C1' N9 C8 N7 1.4700 128.7400 -179.5900 114.7600 1.3000 IC C4 N9 C8 N7 1.4100 105.2000 -0.3700 114.7600 1.3000 IC N9 C8 N7 C5 1.3800 114.7600 -0.1500 104.3800 1.4100 IC C8 N7 C5 C6 1.3000 104.3800 179.3500 130.6100 1.4500 IC C8 N7 C5 C4 1.3000 104.3800 0.6300 110.2600 1.3900 IC N7 C5 C6 O6 1.4100 130.6100 2.2000 129.6000 1.2400 IC C4 C5 C6 O6 1.3900 119.1200 -179.1800 129.6000 1.2400 IC N7 C5 C6 N1 1.4100 130.6100 -178.2100 111.8600 1.4100 IC C5 C6 N1 C2 1.4500 111.8600 -0.5300 124.8100 1.3900 IC O6 C6 N1 C2 1.2400 118.5400 179.1100 124.8100 1.3900 IC C6 N1 C2 N2 1.4100 124.8100 -179.2600 114.6600 1.3100 IC C6 N1 C2 N3 1.4100 124.8100 0.7200 124.8600 1.3500 IC N1 C2 N3 C4 1.3900 124.8600 -0.6500 111.5100 1.4000 IC N2 C2 N3 C4 1.3100 120.4700 179.3300 111.5100 1.4000 IC C2 N3 C4 N9 1.3500 111.5100 179.6600 126.7600 1.4100 IC C2 N3 C4 C5 1.3500 111.5100 0.5700 127.8400 1.3900 IC C5 C4 N9 C1' 1.3900 105.3900 179.9700 126.0600 1.4700 IC N3 C4 N9 C1' 1.4000 126.7600 0.7200 126.0600 1.4700 IC C5 C4 N9 C8 1.3900 105.3900 0.7200 105.2000 1.3800 IC N9 C4 C5 N7 1.4100 105.3900 -0.8600 110.2600 1.4100 IC N3 C4 C5 N7 1.4000 127.8400 178.3800 110.2600 1.4100 IC N9 C4 C5 C6 1.4100 105.3900 -179.7400 119.1200 1.4500 PATC FIRS NONE LAST NONE RESI ATP -4.00000 PATC FIRS NONE LAST NONE RESI MG 2.00000 PATC FIRS NONE LAST NONE RESI ADE -1.00000 ATOM P P 1.50000 ATOM OP1 ON3 -0.80000 ATOM OP2 ON3 -0.80000 ATOM O5' ON2 -0.55000 ATOM C5' CN8 0.10000 ATOM C4' CN6 0.20000 ATOM O4' ON6 -0.40000 ATOM C1' CN6B 0.20000 ATOM C5 CN5 0.23000 ATOM N7 NN4 -0.63000 ATOM C8 CN4 0.56000 ATOM N9 NN2 -0.16000 ATOM N1 NN3A -0.74000 ATOM C2 CN4 0.69000 ATOM N3 NN3A -0.69000 ATOM C4 CN5 0.31000 ATOM C6 CN2 0.43000 ATOM N6 NN1 0.00000 ATOM C2' CN6 0.23000 ATOM O2' ON5 -0.23000 ATOM C3' CN6 0.10000 ATOM O3' ON2 -0.55000 BOND P OP1 P OP2 P O5' O5' C5' C5' C4' C4' O4' BOND C4' C3' O4' C1' C1' N9 C1' C2' N9 C4 N9 C8 BOND C4 N3 C4 C5 N3 C2 C2 N1 N1 C6 C6 N6 BOND C6 C5 C5 N7 N7 C8 C2' C3' C2' O2' C3' O3' BOND O3' +P IMPR N6 N1 C5 C6 IC -O3' P O5' C5' 1.6001 101.4500 -39.2500 119.0000 1.4401 IC -O3' O5' *P OP1 1.6001 101.4500 -115.8200 109.7400 1.4802 IC -O3' O5' *P OP2 1.6001 101.4500 115.9000 109.8000 1.4801 IC P O5' C5' C4' 1.5996 119.0000 -151.3900 110.0400 1.5160 IC O5' C5' C4' C3' 1.4401 108.8300 -179.8500 116.1000 1.5284 IC C5' C4' C3' O3' 1.5160 116.1000 76.7000 115.1200 1.4212 IC C4' C3' O3' +P 1.5284 111.9200 159.1300 119.0500 1.6001 IC C3' O3' +P +O5' 1.4212 119.0500 -98.8600 101.4500 1.5996 IC O4' C3' *C4' C5' 1.4572 104.0600 -120.0400 116.1000 1.5160 IC C2' C4' *C3' O3' 1.5284 100.1600 -124.0800 115.1200 1.4212 IC C4' C3' C2' C1' 1.5284 100.1600 39.5800 102.0400 1.5251 IC C3' C2' C1' N9 1.5284 101.9700 144.3900 113.7100 1.4896 IC O4' C1' N9 C4 1.5251 113.7100 -96.0000 125.9700 1.3703 IC C1' C4 *N9 C8 1.4896 125.9700 -179.9400 106.0000 1.3670 IC C4 N9 C8 N7 1.3760 106.0000 0.0000 113.6000 1.3120 IC C8 N9 C4 C5 1.3670 106.0000 0.0000 105.6000 1.3820 IC C8 N7 C5 C6 0.0000 0.0000 180.0000 0.0000 0.0000 IC N7 C5 C6 N1 0.0000 0.0000 180.0000 0.0000 0.0000 IC C5 C6 N1 C2 0.0000 0.0000 0.0000 0.0000 0.0000 IC N9 C5 *C4 N3 1.3760 105.6000 -180.0000 126.9000 1.3420 IC C5 N1 *C6 N6 1.4090 117.6000 -180.0000 121.2000 1.3370 IC C5 N1 *C6 N6 1.4090 117.6000 -180.0000 119.0000 1.3370 IC C1' C3' *C2' O2' 1.5284 102.0400 -114.6700 110.8100 1.4212 PATC FIRS NONE LAST NONE RESI CYT -1.00000 PATC FIRS NONE LAST NONE RESI GUA -1.00000 ATOM P P 1.50000 ATOM OP1 ON3 -0.80000 ATOM OP2 ON3 -0.80000 ATOM O5' ON2 -0.55000 ATOM C5' CN8 0.10000 ATOM C4' CN6 0.20000 ATOM O4' ON6 -0.40000 ATOM C1' CN6B 0.20000 ATOM N9 NN2 -0.14000 ATOM C4 CN5 0.14000 ATOM N3 NN3A -0.66000 ATOM C2 CN2 0.76000 ATOM N1 NN2G -0.10000 ATOM N2 NN1 0.00000 ATOM C6 CN1 0.55000 ATOM O6 ON1 -0.47000 ATOM C5 CN5 -0.08000 ATOM N7 NN4 -0.69000 ATOM C8 CN4 0.69000 ATOM C2' CN6 0.23000 ATOM O2' ON5 -0.23000 ATOM C3' CN6 0.10000 ATOM O3' ON2 -0.55000 BOND P OP1 P OP2 P O5' O5' C5' C5' C4' C4' O4' BOND C4' C3' O4' C1' C1' N9 C1' C2' N9 C4 N9 C8 BOND C4 N3 C4 C5 N3 C2 C2 N2 C2 N1 N1 C6 BOND C6 O6 C6 C5 C5 N7 N7 C8 C2' C3' C3' O3' BOND O3' +P C2' O2' IMPR N2 N3 N1 C2 O6 N1 C5 C6 IC -O3' P O5' C5' 1.6001 101.4500 -39.2500 119.0000 1.4401 IC -O3' O5' *P OP1 1.6001 101.4500 -115.8200 109.7400 1.4802 IC -O3' O5' *P OP2 1.6001 101.4500 115.9000 109.8000 1.4801 IC P O5' C5' C4' 1.5996 119.0000 -151.3900 110.0400 1.5160 IC O5' C5' C4' C3' 1.4401 108.8300 -179.8500 116.1000 1.5284 IC C5' C4' C3' O3' 1.5160 116.1000 76.7000 115.1200 1.4212 IC C4' C3' O3' +P 1.5284 111.9200 159.1300 119.0500 1.6001 IC C3' O3' +P +O5' 1.4212 119.0500 -98.8600 101.4500 1.5996 IC O4' C3' *C4' C5' 1.4572 104.0600 -120.0400 116.1000 1.5160 IC C2' C4' *C3' O3' 1.5284 100.1600 -124.0800 115.1200 1.4212 IC C4' C3' C2' C1' 1.5284 100.1600 39.5800 102.0400 1.5251 IC C3' C2' C1' N9 1.5284 101.9700 144.3900 113.7100 1.4896 IC O4' C1' N9 C4 1.5251 113.7100 -96.0000 125.5900 1.3783 IC C1' C4 *N9 C8 1.4896 125.5900 -179.9900 106.0000 1.3740 IC C4 N9 C8 N7 1.3770 106.0000 0.0000 113.5000 1.3040 IC C8 N9 C4 C5 1.3740 106.0000 0.0000 105.6000 1.3770 IC N9 C5 *C4 N3 1.3770 105.6000 180.0000 128.4000 1.3550 IC C5 C4 N3 C2 1.3770 128.4000 0.0000 111.8000 1.3270 IC C4 N3 C2 N1 1.3550 111.8000 0.0000 124.0000 1.3750 IC N1 N3 *C2 N2 1.3750 124.0000 180.0000 119.7000 1.3410 IC N3 C2 N1 C6 1.3270 124.0000 0.0000 124.9000 1.3930 IC C5 N1 *C6 O6 1.4150 111.7000 180.0000 120.0000 1.2390 IC C1' C3' *C2' O2' 1.5284 102.0400 -114.6700 110.8100 1.4212 PATC FIRS NONE LAST NONE RESI THY -1.00000 ATOM P P 1.50000 ATOM OP1 ON3 -0.80000 ATOM OP2 ON3 -0.80000 ATOM O5' ON2 -0.55000 ATOM C5' CN8 0.10000 ATOM C4' CN6 0.20000 ATOM O4' ON6 -0.40000 ATOM C1' CN6B 0.20000 ATOM N1 NN2 -0.30000 ATOM C6 CN3 0.30000 ATOM C2 CN1 0.57000 ATOM O2 ON1 -0.47000 ATOM N3 NN2U -0.10000 ATOM C4 CN1 0.54000 ATOM O4 ON1 -0.49000 ATOM C5 CN3 -0.15000 ATOM C7 CN9 0.10000 ATOM C2' CN6 0.23000 ATOM O2' ON5 -0.23000 ATOM C3' CN6 0.10000 ATOM O3' ON2 -0.55000 BOND P OP1 P OP2 P O5' O5' C5' C5' C4' C4' O4' BOND C4' C3' O4' C1' C1' N1 C1' C2' N1 C2 N1 C6 BOND C2 O2 C2 N3 N3 C4 C4 O4 C4 C5 C5 C7 BOND C5 C6 C2' C3' C3' O3' O3' +P C2' O2' IMPR O2 N1 N3 C2 O4 N3 C5 C4 C7 C4 C6 C5 IC -O3' P O5' C5' 1.6001 101.4500 -39.2500 119.0000 1.4401 IC -O3' O5' *P OP1 1.6001 101.4500 -115.8200 109.7400 1.4802 IC -O3' O5' *P OP2 1.6001 101.4500 115.9000 109.8000 1.4801 IC P O5' C5' C4' 1.5996 119.0000 -151.3900 110.0400 1.5160 IC O5' C5' C4' C3' 1.4401 108.8300 -179.8500 116.1000 1.5284 IC C5' C4' C3' O3' 1.5160 116.1000 76.7000 115.1200 1.4212 IC C4' C3' O3' +P 1.5284 111.9200 159.1300 119.0500 1.6001 IC C3' O3' +P +O5' 1.4212 119.0500 -98.8600 101.4500 1.5996 IC O4' C3' *C4' C5' 1.4572 104.0600 -120.0400 116.1000 1.5160 IC C2' C4' *C3' O3' 1.5284 100.1600 -124.0800 115.1200 1.4212 IC C4' C3' C2' C1' 1.5284 100.1600 39.5800 102.0400 1.5251 IC C3' C2' C1' N1 1.5284 101.9700 144.3900 113.7100 1.4896 IC O4' C1' N1 C2 1.5251 113.7100 -96.0000 117.0600 1.3746 IC C1' C2 *N1 C6 1.4896 117.0600 -179.9600 122.0800 1.3704 IC C2 N1 C6 C5 1.3746 122.0800 -0.0200 121.2300 1.3432 IC C6 N1 C2 N3 1.3704 122.0800 0.0600 115.3800 1.3813 IC N1 N3 *C2 O2 1.3746 115.3800 -179.9500 121.7000 1.2191 IC N1 C2 N3 C4 1.3746 115.3800 -0.0700 126.4600 1.3795 IC C5 N3 *C4 O4 1.4439 114.0700 179.9800 120.5900 1.2327 IC C4 C6 *C5 C7 1.4439 120.7800 -179.9400 121.6300 1.5000 IC C1' C3' *C2' O2' 1.5284 102.0400 -114.6700 110.8100 1.4212 PATC FIRS NONE LAST NONE RESI URA -1.00000 ATOM P P 1.50000 ATOM OP1 ON3 -0.80000 ATOM OP2 ON3 -0.80000 ATOM O5' ON2 -0.55000 ATOM C5' CN8 0.10000 ATOM C4' CN6 0.20000 ATOM O4' ON6 -0.40000 ATOM C1' CN6B 0.20000 ATOM N1 NN2 -0.30000 ATOM C6 CN3 0.30000 ATOM C2 CN1 0.57000 ATOM O2 ON1 -0.47000 ATOM N3 NN2U -0.10000 ATOM C4 CN1 0.54000 ATOM O4 ON1 -0.49000 ATOM C5 CN3 -0.05000 ATOM C2' CN6 0.23000 ATOM O2' ON5 -0.23000 ATOM C3' CN6 0.10000 ATOM O3' ON2 -0.55000 BOND P OP1 P OP2 P O5' O5' C5' C5' C4' C4' O4' BOND C4' C3' O4' C1' C1' N1 C1' C2' N1 C2 N1 C6 BOND C2 O2 C2 N3 N3 C4 C4 O4 C4 C5 C5 C6 BOND C2' C3' C3' O3' O3' +P C2' O2' IMPR O2 N1 N3 C2 O4 N3 C5 C4 IC -O3' P O5' C5' 1.6001 101.4500 -39.2500 119.0000 1.4401 IC -O3' O5' *P OP1 1.6001 101.4500 -115.8200 109.7400 1.4802 IC -O3' O5' *P OP2 1.6001 101.4500 115.9000 109.8000 1.4801 IC P O5' C5' C4' 1.5996 119.0000 -151.3900 110.0400 1.5160 IC O5' C5' C4' C3' 1.4401 108.8300 -179.8500 116.1000 1.5284 IC C5' C4' C3' O3' 1.5160 116.1000 76.7000 115.1200 1.4212 IC C4' C3' O3' +P 1.5284 111.9200 159.1300 119.0500 1.6001 IC C3' O3' +P +O5' 1.4212 119.0500 -98.8600 101.4500 1.5996 IC O4' C3' *C4' C5' 1.4572 104.0600 -120.0400 116.1000 1.5160 IC C2' C4' *C3' O3' 1.5284 100.1600 -124.0800 115.1200 1.4212 IC C4' C3' C2' C1' 1.5284 100.1600 39.5800 102.0400 1.5251 IC C3' C2' C1' N1 1.5284 101.9700 144.3900 113.7100 1.4896 IC O4' C1' N1 C2 1.5251 113.7100 -96.0000 117.0600 1.3746 IC C1' C2 *N1 C6 1.4896 117.0600 -180.0000 121.3000 1.3790 IC C2 N1 C6 C5 1.3790 121.3000 0.0000 122.8000 1.3380 IC C6 N1 C2 N3 1.3800 121.3000 0.0000 114.8000 1.3730 IC N1 N3 *C2 O2 1.3790 114.8000 -180.0000 122.0000 1.2180 IC N1 C2 N3 C4 1.3790 114.8000 0.0000 127.0000 1.3830 IC C5 N3 *C4 O4 1.4400 114.7000 180.0000 119.8000 1.2270 IC C1' C3' *C2' O2' 1.5284 102.0400 -114.6700 110.8100 1.4212 PATC FIRS NONE LAST NONE RESI DADE -1.00000 ATOM P P 1.50000 ATOM OP1 ON3 -0.80000 ATOM OP2 ON3 -0.80000 ATOM O5' ON2 -0.55000 ATOM C5' CN8 0.10000 ATOM C4' CN6 0.20000 ATOM O4' ON6 -0.40000 ATOM C1' CN6B 0.20000 ATOM C5 CN5 0.23000 ATOM N7 NN4 -0.63000 ATOM C8 CN4 0.56000 ATOM N9 NN2 -0.16000 ATOM N1 NN3A -0.74000 ATOM C2 CN4 0.69000 ATOM N3 NN3A -0.69000 ATOM C4 CN5 0.31000 ATOM C6 CN2 0.43000 ATOM N6 NN1 0.00000 ATOM C2' CN6C 0.00000 ATOM C3' CN6 0.10000 ATOM O3' ON2 -0.55000 BOND P OP1 P OP2 P O5' O5' C5' C5' C4' C4' O4' BOND C4' C3' O4' C1' C1' N9 C1' C2' N9 C4 N9 C8 BOND C4 N3 C4 C5 N3 C2 C2 N1 N1 C6 C6 N6 BOND C6 C5 C5 N7 N7 C8 C2' C3' C3' O3' O3' +P IMPR N6 N1 C5 C6 IC -O3' P O5' C5' 1.6001 101.4500 -39.2500 119.0000 1.4401 IC -O3' O5' *P OP1 1.6001 101.4500 -115.8200 109.7400 1.4802 IC -O3' O5' *P OP2 1.6001 101.4500 115.9000 109.8000 1.4801 IC P O5' C5' C4' 1.5996 119.0000 -151.3900 110.0400 1.5160 IC O5' C5' C4' C3' 1.4401 108.8300 -179.8500 116.1000 1.5284 IC C5' C4' C3' O3' 1.5160 116.1000 76.7000 115.1200 1.4212 IC C4' C3' O3' +P 1.5284 111.9200 159.1300 119.0500 1.6001 IC C3' O3' +P +O5' 1.4212 119.0500 -98.8600 101.4500 1.5996 IC O4' C3' *C4' C5' 1.4572 104.0600 -120.0400 116.1000 1.5160 IC C2' C4' *C3' O3' 1.5284 100.1600 -124.0800 115.1200 1.4212 IC C4' C3' C2' C1' 1.5284 100.1600 39.5800 102.0400 1.5251 IC C3' C2' C1' N9 1.5284 101.9700 144.3900 113.7100 1.4896 IC O4' C1' N9 C4 1.5251 113.7100 -96.0000 125.9700 1.3703 IC C1' C4 *N9 C8 1.4896 125.9700 -179.9400 106.0000 1.3670 IC C4 N9 C8 N7 1.3760 106.0000 0.0000 113.6000 1.3120 IC C8 N9 C4 C5 1.3670 106.0000 0.0000 105.6000 1.3820 IC C8 N7 C5 C6 0.0000 0.0000 180.0000 0.0000 0.0000 IC N7 C5 C6 N1 0.0000 0.0000 180.0000 0.0000 0.0000 IC C5 C6 N1 C2 0.0000 0.0000 0.0000 0.0000 0.0000 IC N9 C5 *C4 N3 1.3760 105.6000 -180.0000 126.9000 1.3420 IC C5 N1 *C6 N6 1.4090 117.6000 -180.0000 121.2000 1.3370 IC C5 N1 *C6 N6 1.4090 117.6000 -180.0000 119.0000 1.3370 PATC FIRS NONE LAST NONE RESI DCYT -1.00000 ATOM C2' CN6C -1.00000 PATC FIRS NONE LAST NONE RESI DGUA -1.00000 ATOM P P 1.50000 ATOM OP1 ON3 -0.80000 ATOM OP2 ON3 -0.80000 ATOM O5' ON2 -0.55000 ATOM C5' CN8 0.10000 ATOM C4' CN6 0.20000 ATOM O4' ON6 -0.40000 ATOM C1' CN6B 0.20000 ATOM N9 NN2 -0.14000 ATOM C4 CN5 0.14000 ATOM N3 NN3A -0.66000 ATOM C2 CN2 0.76000 ATOM N1 NN2G -0.10000 ATOM N2 NN1 0.00000 ATOM C6 CN1 0.55000 ATOM O6 ON1 -0.47000 ATOM C5 CN5 -0.08000 ATOM N7 NN4 -0.69000 ATOM C8 CN4 0.69000 ATOM C2' CN6C 0.00000 ATOM C3' CN6 0.10000 ATOM O3' ON2 -0.55000 BOND P OP1 P OP2 P O5' O5' C5' C5' C4' C4' O4' BOND C4' C3' O4' C1' C1' N9 C1' C2' N9 C4 N9 C8 BOND C4 N3 C4 C5 N3 C2 C2 N2 C2 N1 N1 C6 BOND C6 O6 C6 C5 C5 N7 N7 C8 C2' C3' C3' O3' BOND O3' +P IMPR N2 N3 N1 C2 O6 N1 C5 C6 IC -O3' P O5' C5' 1.6001 101.4500 -39.2500 119.0000 1.4401 IC -O3' O5' *P OP1 1.6001 101.4500 -115.8200 109.7400 1.4802 IC -O3' O5' *P OP2 1.6001 101.4500 115.9000 109.8000 1.4801 IC P O5' C5' C4' 1.5996 119.0000 -151.3900 110.0400 1.5160 IC O5' C5' C4' C3' 1.4401 108.8300 -179.8500 116.1000 1.5284 IC C5' C4' C3' O3' 1.5160 116.1000 76.7000 115.1200 1.4212 IC C4' C3' O3' +P 1.5284 111.9200 159.1300 119.0500 1.6001 IC C3' O3' +P +O5' 1.4212 119.0500 -98.8600 101.4500 1.5996 IC O4' C3' *C4' C5' 1.4572 104.0600 -120.0400 116.1000 1.5160 IC C2' C4' *C3' O3' 1.5284 100.1600 -124.0800 115.1200 1.4212 IC C4' C3' C2' C1' 1.5284 100.1600 39.5800 102.0400 1.5251 IC C3' C2' C1' N9 1.5284 101.9700 144.3900 113.7100 1.4896 IC O4' C1' N9 C4 1.5251 113.7100 -96.0000 125.5900 1.3783 IC C1' C4 *N9 C8 1.4896 125.5900 -179.9900 106.0000 1.3740 IC C4 N9 C8 N7 1.3770 106.0000 0.0000 113.5000 1.3040 IC C8 N9 C4 C5 1.3740 106.0000 0.0000 105.6000 1.3770 IC N9 C5 *C4 N3 1.3770 105.6000 180.0000 128.4000 1.3550 IC C5 C4 N3 C2 1.3770 128.4000 0.0000 111.8000 1.3270 IC C4 N3 C2 N1 1.3550 111.8000 0.0000 124.0000 1.3750 IC N1 N3 *C2 N2 1.3750 124.0000 180.0000 119.7000 1.3410 IC N3 C2 N1 C6 1.3270 124.0000 0.0000 124.9000 1.3930 IC C5 N1 *C6 O6 1.4150 111.7000 180.0000 120.0000 1.2390 PATC FIRS NONE LAST NONE RESI DTHY -1.00000 ATOM P P 1.50000 ATOM OP1 ON3 -0.80000 ATOM OP2 ON3 -0.80000 ATOM O5' ON2 -0.55000 ATOM C5' CN8 0.10000 ATOM C4' CN6 0.20000 ATOM O4' ON6 -0.40000 ATOM C1' CN6B 0.20000 ATOM N1 NN2 -0.30000 ATOM C6 CN3 0.30000 ATOM C2 CN1 0.57000 ATOM O2 ON1 -0.47000 ATOM N3 NN2U -0.10000 ATOM C4 CN1 0.54000 ATOM O4 ON1 -0.49000 ATOM C5 CN3 -0.15000 ATOM C7 CN9 0.10000 ATOM C2' CN6C 0.00000 ATOM C3' CN6 0.10000 ATOM O3' ON2 -0.55000 BOND P OP1 P OP2 P O5' O5' C5' C5' C4' C4' O4' BOND C4' C3' O4' C1' C1' N1 C1' C2' N1 C2 N1 C6 BOND C2 O2 C2 N3 N3 C4 C4 O4 C4 C5 C5 C7 BOND C5 C6 C2' C3' C3' O3' O3' +P IMPR O2 N1 N3 C2 O4 N3 C5 C4 C7 C4 C6 C5 IC -O3' P O5' C5' 1.6001 101.4500 -39.2500 119.0000 1.4401 IC -O3' O5' *P OP1 1.6001 101.4500 -115.8200 109.7400 1.4802 IC -O3' O5' *P OP2 1.6001 101.4500 115.9000 109.8000 1.4801 IC P O5' C5' C4' 1.5996 119.0000 -151.3900 110.0400 1.5160 IC O5' C5' C4' C3' 1.4401 108.8300 -179.8500 116.1000 1.5284 IC C5' C4' C3' O3' 1.5160 116.1000 76.7000 115.1200 1.4212 IC C4' C3' O3' +P 1.5284 111.9200 159.1300 119.0500 1.6001 IC C3' O3' +P +O5' 1.4212 119.0500 -98.8600 101.4500 1.5996 IC O4' C3' *C4' C5' 1.4572 104.0600 -120.0400 116.1000 1.5160 IC C2' C4' *C3' O3' 1.5284 100.1600 -124.0800 115.1200 1.4212 IC C4' C3' C2' C1' 1.5284 100.1600 39.5800 102.0400 1.5251 IC C3' C2' C1' N1 1.5284 101.9700 144.3900 113.7100 1.4896 IC O4' C1' N1 C2 1.5251 113.7100 -96.0000 117.0600 1.3746 IC C1' C2 *N1 C6 1.4896 117.0600 -179.9600 122.0800 1.3704 IC C2 N1 C6 C5 1.3746 122.0800 -0.0200 121.2300 1.3432 IC C6 N1 C2 N3 1.3704 122.0800 0.0600 115.3800 1.3813 IC N1 N3 *C2 O2 1.3746 115.3800 -179.9500 121.7000 1.2191 IC N1 C2 N3 C4 1.3746 115.3800 -0.0700 126.4600 1.3795 IC C5 N3 *C4 O4 1.4439 114.0700 179.9800 120.5900 1.2327 IC C4 C6 *C5 C7 1.4439 120.7800 -179.9400 121.6300 1.5000 PATC FIRS NONE LAST NONE RESI DURA -1.00000 ATOM P P 1.50000 ATOM OP1 ON3 -0.80000 ATOM OP2 ON3 -0.80000 ATOM O5' ON2 -0.55000 ATOM C5' CN8 0.10000 ATOM C4' CN6 0.20000 ATOM O4' ON6 -0.40000 ATOM C1' CN6B 0.20000 ATOM N1 NN2 -0.30000 ATOM C6 CN3 0.30000 ATOM C2 CN1 0.57000 ATOM O2 ON1 -0.47000 ATOM N3 NN2U -0.10000 ATOM C4 CN1 0.54000 ATOM O4 ON1 -0.49000 ATOM C5 CN3 -0.05000 ATOM C2' CN6C 0.00000 ATOM C3' CN6 0.10000 ATOM O3' ON2 -0.55000 BOND P OP1 P OP2 P O5' O5' C5' C5' C4' C4' O4' BOND C4' C3' O4' C1' C1' N1 C1' C2' N1 C2 N1 C6 BOND C2 O2 C2 N3 N3 C4 C4 O4 C4 C5 C5 C6 BOND C2' C3' C3' O3' O3' +P IMPR O2 N1 N3 C2 O4 N3 C5 C4 IC -O3' P O5' C5' 1.6001 101.4500 -39.2500 119.0000 1.4401 IC -O3' O5' *P OP1 1.6001 101.4500 -115.8200 109.7400 1.4802 IC -O3' O5' *P OP2 1.6001 101.4500 115.9000 109.8000 1.4801 IC P O5' C5' C4' 1.5996 119.0000 -151.3900 110.0400 1.5160 IC O5' C5' C4' C3' 1.4401 108.8300 -179.8500 116.1000 1.5284 IC C5' C4' C3' O3' 1.5160 116.1000 76.7000 115.1200 1.4212 IC C4' C3' O3' +P 1.5284 111.9200 159.1300 119.0500 1.6001 IC C3' O3' +P +O5' 1.4212 119.0500 -98.8600 101.4500 1.5996 IC O4' C3' *C4' C5' 1.4572 104.0600 -120.0400 116.1000 1.5160 IC C2' C4' *C3' O3' 1.5284 100.1600 -124.0800 115.1200 1.4212 IC C4' C3' C2' C1' 1.5284 100.1600 39.5800 102.0400 1.5251 IC C3' C2' C1' N1 1.5284 101.9700 144.3900 113.7100 1.4896 IC O4' C1' N1 C2 1.5251 113.7100 -96.0000 117.0600 1.3746 IC C1' C2 *N1 C6 1.4896 117.0600 -180.0000 121.3000 1.3790 IC C2 N1 C6 C5 1.3790 121.3000 0.0000 122.8000 1.3380 IC C6 N1 C2 N3 1.3800 121.3000 0.0000 114.8000 1.3730 IC N1 N3 *C2 O2 1.3790 114.8000 -180.0000 122.0000 1.2180 IC N1 C2 N3 C4 1.3790 114.8000 0.0000 127.0000 1.3830 IC C5 N3 *C4 O4 1.4400 114.7000 180.0000 119.8000 1.2270 PATC FIRS NONE LAST NONE RESI ADP -3.00000 PATC FIRS NONE LAST NONE RESI DEOT 0.00000 PATC FIRS NONE LAST NONE RESI DMPA -1.00000 PATC FIRS NONE LAST NONE RESI DUM 0.00000 ATOM DUM DUM 0.00000 PATC FIRS NONE LAST NONE RESI MP_0 0.00000 ATOM C1 CN9 0.10000 ATOM O1 ON2 -0.56000 ATOM P1 P 1.50000 ATOM O2 ON4 -0.20000 ATOM O3 ON4 -0.20000 ATOM O4 ON3 -0.64000 BOND P1 O1 P1 O2 P1 O3 P1 O4 O1 C1 IC O3 P1 O1 C1 0.0000 0.0000 0.0000 0.0000 0.0000 IC O4 P1 O1 C1 0.0000 0.0000 0.0000 0.0000 0.0000 IC O2 P1 O1 C1 0.0000 0.0000 0.0000 0.0000 0.0000 IC O3 P1 O4 O1 0.0000 0.0000 0.0000 0.0000 0.0000 PATC FIRS NONE LAST NONE RESI MP_1 -1.00000 ATOM C1 CN9 0.10000 ATOM O1 ON2 -0.62000 ATOM P1 P 1.50000 ATOM O2 ON4 -0.34000 ATOM O3 ON3 -0.82000 ATOM O4 ON3 -0.82000 BOND P1 O1 P1 O2 P1 O3 P1 O4 O1 C1 IC O3 P1 O1 C1 0.0000 0.0000 0.0000 0.0000 0.0000 IC O4 P1 O1 C1 0.0000 0.0000 0.0000 0.0000 0.0000 IC O2 P1 O1 C1 0.0000 0.0000 0.0000 0.0000 0.0000 IC O3 P1 O4 O1 0.0000 0.0000 0.0000 0.0000 0.0000 PATC FIRS NONE LAST NONE RESI MP_2 -2.00000 ATOM P1 P 1.10000 ATOM O1 ON2 -0.40000 ATOM O2 ON3 -0.90000 ATOM O3 ON3 -0.90000 ATOM O4 ON3 -0.90000 ATOM C1 CN9 0.00000 BOND P1 O1 P1 O2 P1 O3 P1 O4 O1 C1 IC O3 P1 O1 C1 0.0000 0.0000 0.0000 0.0000 0.0000 IC O4 P1 O1 C1 0.0000 0.0000 0.0000 0.0000 0.0000 IC O2 P1 O1 C1 0.0000 0.0000 0.0000 0.0000 0.0000 IC O3 P1 O4 O1 0.0000 0.0000 0.0000 0.0000 0.0000 PATC FIRS NONE LAST NONE RESI NAD -1.00000 ATOM C4B CN6 0.20000 ATOM O4B ON6 -0.40000 ATOM C1B CN6B 0.20000 ATOM C5A CN5 0.23000 ATOM N7A NN4 -0.63000 ATOM C8A CN4 0.56000 ATOM N9A NN2 -0.16000 ATOM N1A NN3A -0.74000 ATOM C2A CN4 0.69000 ATOM N3A NN3A -0.69000 ATOM C4A CN5 0.31000 ATOM C6A CN2 0.43000 ATOM N6A NN1 0.00000 ATOM C2B CN6 0.23000 ATOM O2B ON5 -0.23000 ATOM C3B CN6 0.23000 ATOM O3B ON5 -0.23000 ATOM C5B CN8 0.10000 ATOM PA P 1.50000 ATOM O1A ON3 -0.82000 ATOM O2A ON3 -0.82000 ATOM O5B ON2 -0.62000 ATOM O3 ON2 -0.68000 ATOM PN P 1.50000 ATOM O1N ON3 -0.82000 ATOM O2N ON3 -0.82000 ATOM O5D ON2 -0.62000 ATOM C5D CN9 0.10000 ATOM C2D CN6 0.23000 ATOM O2D ON5 -0.23000 ATOM C3D CN6 0.23000 ATOM O3D ON5 -0.23000 ATOM C1D CN6B 0.20000 ATOM C4D CN6 0.20000 ATOM O4D ON6 -0.40000 ATOM N1N NN2 -0.07000 ATOM C6N CN3B 0.35000 ATOM C5N CN3 0.06000 ATOM C4N CN3A 0.11000 ATOM C3N CN3 0.05000 ATOM C2N CN3B 0.34000 ATOM C7N CN1A 0.68000 ATOM O7N ON1 -0.40000 ATOM N7N NN1 -0.12000 BOND N1A C2A C2A N3A N3A C4A C4A C5A C5A C6A C6A N6A BOND C6A N1A C5A N7A N7A C8A C8A N9A N9A C4A N9A C1B BOND C1B C2B C2B C3B C3B C4B C4B O4B O4B C1B C2B O2B BOND C3B O3B C4B C5B C5B O5B O5B PA PA O1A PA O2A BOND PA O3 O3 PN PN O1N PN O5D O5D C5D C5D C4D BOND C4D O4D O4D C1D C1D C2D C2D C3D C3D C4D C2D O2D BOND C3D O3D C1D N1N N1N C2N C2N C3N C3N C4N C4N C5N BOND C5N C6N C6N N1N C3N C7N C7N O7N C7N N7N O2N PN IMPR N6A N1A C5A C6A C7N N7N C3N O7N C7N C3N N7N O7N IC PN O3 PA O1A 0.0000 0.0000 0.0000 0.0000 0.0000 IC PN O3 PA O2A 0.0000 0.0000 0.0000 0.0000 0.0000 IC PN O3 PA O5B 0.0000 0.0000 0.0000 0.0000 0.0000 IC O5B C5B C4B O4B 0.0000 0.0000 0.0000 0.0000 0.0000 IC O4B C1B N9A C8A 0.0000 0.0000 0.0000 0.0000 0.0000 IC PA O3 PN O5D 1.4863 65.2800 -169.0000 98.5900 1.5977 IC C5B O5B PA O3 1.4232 127.3100 -165.1000 103.2700 1.4863 IC C5B O5B PA O2A 1.4232 127.3100 73.3300 111.4800 1.4836 IC PA O3 PN O1N 1.4863 65.2800 78.5100 108.9700 1.4756 IC PA O3 PN O2N 1.4863 65.2800 -54.2900 112.8800 1.4636 IC PA O5B C5B C4B 1.5901 127.3100 121.2900 111.6300 1.5491 IC O1A PA O5B C5B 1.5901 127.3100 121.2900 127.3100 1.4232 IC O5B C5B C4B C3B 1.4232 111.6300 -58.2000 111.5800 1.6942 IC C5B C4B C3B O3B 1.5491 111.5800 128.4200 114.1900 1.4337 IC O4B C3B *C4A C5B 1.8868 112.9500 -118.1000 111.5800 1.5491 IC C2B C4B *C3B O3B 1.5097 93.2200 -117.7200 114.1900 1.4337 IC C4B C3B C2B C1B 1.6942 93.2200 -12.9300 117.8200 1.5415 IC C3B C2B C1B N9A 1.5097 117.8200 135.5600 115.0100 1.4847 IC O4B C1B N9A C4A 1.3646 95.4400 -90.7200 125.9600 1.4013 IC C1B C4A *N9A C8A 1.4847 125.9600 -176.5200 105.3400 1.3777 IC C4A N9A C8A N7A 1.4013 105.3400 -0.0700 114.0100 1.3282 IC C8A N9A C4A C5A 1.3777 105.3400 0.1100 105.0600 1.3782 IC C8A N7A C5A C6A 1.3282 103.2100 -179.9200 130.7800 1.4146 IC N7A C5A C6A N1A 1.3814 130.7800 -179.9400 117.8500 1.3482 IC C5A C6A N1A C2A 1.4146 117.8500 -0.1400 118.8700 1.3300 IC N9A C5A *C4A N3A 1.4013 105.0600 -179.6700 126.1400 1.3648 IC C5A N1A *C6A N6A 1.4146 117.8500 179.8900 119.6900 1.3419 IC C5A N1A *C6A N6A 1.4146 117.8500 179.8900 119.6900 1.3419 IC C1B C3B *C2A O2B 1.5415 117.8200 -145.0600 114.1300 1.4294 IC C5D O5D PN O2N 1.4451 128.4000 -49.7200 108.8300 1.4636 IC PN O5D C5D C4D 1.5977 128.4000 0.0000 110.1000 1.5160 IC O5D C5D C4D C3D 1.4451 110.1000 0.0000 108.5000 1.5160 IC C5D C4D C3D C2D 1.5160 108.5000 0.0000 111.0000 1.5160 IC C4D C3D C2D C1D 1.5160 111.0000 0.0000 105.5000 1.5270 IC C3D C2D C1D O4D 1.5160 105.5000 0.0000 105.0000 1.4100 IC C2D C1D O4D C4D 1.5270 105.0000 0.0000 117.8600 1.4712 IC O2D C2D C1D O4D 1.4200 110.1000 180.0000 105.0000 1.4100 IC C3D C2D C1D N1N 1.5160 105.5000 0.0000 113.7000 1.4800 IC O3D C3D C2D C1D 1.4200 110.1000 180.0000 105.5000 1.5270 IC C2D C1D N1N C2N 1.5270 113.7000 0.0000 121.7000 1.3150 IC C1D N1N C2N C3N 1.4800 121.7000 0.0000 122.0000 1.3500 IC N1N C2N C3N C4N 1.3150 122.0000 0.0000 118.0000 1.3600 IC C2N C3N C4N C5N 1.3500 118.0000 0.0000 118.0000 1.3600 IC C3N C4N C5N C6N 1.3600 118.0000 0.0000 118.0000 1.3500 IC C4N C5N C6N N1N 1.3600 118.0000 0.0000 124.5100 1.2199 IC C5N C6N N1N C2N 1.3500 124.5100 0.0000 119.4900 1.3150 IC N1N C2N C3N C7N 1.3150 122.0000 0.0000 131.8000 1.4800 IC C2N C3N C7N O7N 1.3500 131.8000 0.0000 118.5000 1.2300 IC C2N C3N C7N N7N 1.3500 131.8000 0.0000 113.0000 1.3600 PATC FIRS NONE LAST NONE RESI NADH -2.00000 ATOM C4B CN6 0.20000 ATOM O4B ON6 -0.40000 ATOM C1B CN6B 0.20000 ATOM C5A CN5 0.23000 ATOM N7A NN4 -0.63000 ATOM C8A CN4 0.56000 ATOM N9A NN2 -0.16000 ATOM N1A NN3A -0.74000 ATOM C2A CN4 0.69000 ATOM N3A NN3A -0.69000 ATOM C4A CN5 0.31000 ATOM C6A CN2 0.43000 ATOM N6A NN1 0.00000 ATOM C2B CN6 0.23000 ATOM O2B ON5 -0.23000 ATOM C3B CN6 0.23000 ATOM O3B ON5 -0.23000 ATOM C5B CN8 0.10000 ATOM PA P 1.50000 ATOM O1A ON3 -0.82000 ATOM O2A ON3 -0.82000 ATOM O5B ON2 -0.62000 ATOM O3 ON2 -0.68000 ATOM PN P 1.50000 ATOM O1N ON3 -0.82000 ATOM O2N ON3 -0.82000 ATOM O5D ON2 -0.62000 ATOM C5D CN9 0.10000 ATOM C2D CN6 0.23000 ATOM O2D ON5 -0.23000 ATOM C3D CN6 0.23000 ATOM O3D ON5 -0.23000 ATOM C1D CN6B 0.20000 ATOM C4D CN6 0.20000 ATOM O4D ON6 -0.40000 ATOM N1N NN2 -0.27000 ATOM C6N CN3C 0.11000 ATOM C5N CN3 -0.04000 ATOM C4N CN8 -0.10000 ATOM C3N CN3 0.36000 ATOM C2N CN3C 0.04000 ATOM C7N CN1A 0.55000 ATOM O7N ON1 -0.51000 ATOM N7N NN1 -0.14000 BOND N1A C2A C2A N3A N3A C4A C4A C5A C5A C6A C6A N6A BOND C6A N1A C5A N7A N7A C8A C8A N9A N9A C4A N9A C1B BOND C1B C2B C2B C3B C3B C4B C4B O4B O4B C1B C2B O2B BOND C3B O3B C4B C5B C5B O5B O5B PA PA O1A PA O2A BOND PA O3 O3 PN PN O1N PN O5D O5D C5D C5D C4D BOND C4D O4D O4D C1D C1D C2D C2D C3D C3D C4D C2D O2D BOND C3D O3D C1D N1N N1N C2N C2N C3N C3N C4N C4N C5N BOND C5N C6N C6N N1N C3N C7N C7N O7N C7N N7N IMPR N6A N1A C5A C6A C7N N7N C3N O7N C7N C3N N7N O7N IC PA O3 PN O5D 1.5477 110.1100 175.4700 98.5900 1.5945 IC C5B O5B PA O3 1.4379 124.2300 -120.6900 96.2900 1.5477 IC C5B O5B PA O2A 1.4379 124.2300 -4.2000 104.2500 1.4838 IC PA O3 PN O1N 1.5477 110.1100 63.1400 114.1400 1.4739 IC PA O3 PN O2N 1.5477 110.1100 -73.9600 111.0800 1.4835 IC PA O5B C5B C4B 1.5968 124.2300 104.1700 111.4500 1.5366 IC O1A PA O5B C5B 1.4736 106.0600 122.5900 124.2300 1.4379 IC O5B C5B C4B C3B 1.4379 111.4500 -54.0200 111.6400 1.5309 IC C5B C4B C3B O3B 1.5366 111.6400 117.9100 108.2300 1.4176 IC O4B C3B *C4A C5B 3.7210 30.6800 12.4400 22.4600 6.0953 IC C2B C4B *C3B O3B 1.5171 107.2200 -123.0000 108.2300 1.4176 IC C4B C3B C2B C1B 1.5309 107.2200 -27.9300 98.0100 1.5397 IC C3B C2B C1B N9A 1.5171 98.0100 168.0300 114.2500 1.4756 IC O4B C1B N9A C4A 1.4308 112.8500 -160.0500 123.8700 1.3958 IC C1B C4A *N9A C8A 1.4756 123.8700 160.6200 105.3000 1.3614 IC C4A N9A C8A N7A 1.3958 105.3000 2.7300 114.7200 1.3222 IC C8A N9A C4A C5A 1.3614 105.3000 -0.8500 105.3300 1.3777 IC C8A N7A C5A C6A 1.3222 102.8900 -175.7300 131.4300 1.4163 IC N7A C5A C6A N1A 1.3877 131.4300 177.7600 117.3500 1.3499 IC C5A C6A N1A C2A 1.4163 117.3500 0.1900 119.3600 1.3330 IC N9A C5A *C4A N3A 1.3958 105.3300 -177.7600 126.5600 1.3567 IC C5A N1A *C6A N6A 1.4163 117.3500 178.9100 119.8200 1.3439 IC C5A N1A *C6A N6A 1.4163 117.3500 178.9100 119.8200 1.3439 IC C1B C3B *C2A O2B 4.3577 16.7300 79.1600 23.4900 5.5426 IC C5D O5D PN O2N 1.4351 125.3100 34.3100 105.6900 1.4835 IC PN O5D C5D C4D 1.5945 125.3100 -133.0600 113.6100 1.5644 IC O5D C5D C4D C3D 1.4351 113.6100 37.0100 114.9200 1.5111 IC C5D C4D C3D C2D 1.5644 114.9200 71.4900 99.0600 1.5369 IC C4D C3D C2D C1D 1.5111 99.0600 54.7600 97.0800 1.5500 IC C3D C2D C1D O4D 1.5369 97.0800 -39.1200 103.1400 1.4628 IC C2D C1D O4D C4D 1.5500 103.1400 9.4700 109.0900 1.4960 IC O2D C2D C1D O4D 1.4207 114.0200 -166.3900 103.1400 1.4628 IC C3D C2D C1D N1N 1.5369 97.0800 88.6400 116.5800 1.5502 IC O3D C3D C2D C1D 1.4176 119.7600 -172.5200 97.0800 1.5500 IC C2D C1D N1N C2N 1.5500 116.5800 -19.6500 116.3400 1.3499 IC C1D N1N C2N C3N 1.5502 116.3400 134.6600 130.5700 1.3607 IC N1N C2N C3N C4N 1.3499 130.5700 5.8200 111.7400 1.5356 IC C2N C3N C4N C5N 1.3607 111.7400 -1.0500 119.2600 1.5319 IC C3N C4N C5N C6N 1.5356 119.2600 -1.2600 113.6900 1.3745 IC C4N C5N C6N N1N 1.5319 113.6900 -0.2900 128.1500 1.3388 IC C5N C6N N1N C2N 1.3745 128.1500 4.1400 116.2600 1.3499 IC N1N C2N C3N C7N 1.3499 130.5700 -147.4600 122.7200 1.5282 IC C2N C3N C7N O7N 1.3607 122.7200 -140.4700 119.4100 1.2169 IC C2N C3N C7N N7N 1.3607 122.7200 46.6100 116.6800 1.3621 PATC FIRS NONE LAST NONE RESI NIC 1.00000 ATOM N1 NN2 -0.07000 ATOM C6 CN3B 0.35000 ATOM C5 CN3 0.06000 ATOM C4 CN3A 0.11000 ATOM C3 CN3 0.05000 ATOM C2 CN3B 0.34000 ATOM C7 CN1A 0.68000 ATOM O7 ON1 -0.40000 ATOM N7 NN1 -0.12000 BOND N1 C6 C6 C5 C5 C4 C4 C3 C3 C2 N1 C2 BOND C3 C7 C7 O7 C7 N7 IMPR C7 N7 C3 O7 C7 C3 N7 O7 IC N1 C6 C5 C4 0.0000 0.0000 0.0000 0.0000 0.0000 IC C6 C5 C4 C3 0.0000 0.0000 0.0000 0.0000 0.0000 IC C5 C4 C3 C2 0.0000 0.0000 0.0000 0.0000 0.0000 IC C4 C3 C2 N1 0.0000 0.0000 0.0000 0.0000 0.0000 IC C3 C2 N1 C6 0.0000 0.0000 0.0000 0.0000 0.0000 IC C2 N1 C6 C5 0.0000 0.0000 0.0000 0.0000 0.0000 IC C5 C4 C3 C7 0.0000 0.0000 0.0000 0.0000 0.0000 IC N1 C2 C3 C7 0.0000 0.0000 0.0000 0.0000 0.0000 IC C4 C3 C7 O7 0.0000 0.0000 0.0000 0.0000 0.0000 IC C4 C3 C7 N7 0.0000 0.0000 0.0000 0.0000 0.0000 PATC FIRS NONE LAST NONE RESI NICH 0.00000 ATOM N2 NN2 -0.27000 ATOM C3 CN3C 0.11000 ATOM C5 CN3 -0.04000 ATOM C7 CN8 -0.10000 ATOM C10 CN3C 0.04000 ATOM C9 CN3 0.36000 ATOM C12 CN1A 0.55000 ATOM O13 ON1 -0.51000 ATOM N14 NN1 -0.14000 BOND N2 C3 C3 C5 C5 C7 C7 C9 C9 C10 N2 C10 BOND C9 C12 C12 O13 C12 N14 IMPR C12 N14 C9 O13 C12 C9 N14 O13 IC N2 C3 C5 C7 0.0000 0.0000 0.0000 0.0000 0.0000 IC C3 C5 C7 C9 0.0000 0.0000 0.0000 0.0000 0.0000 IC C5 C7 C9 C10 0.0000 0.0000 0.0000 0.0000 0.0000 IC C7 C9 C10 N2 0.0000 0.0000 0.0000 0.0000 0.0000 IC C9 C10 N2 C3 0.0000 0.0000 0.0000 0.0000 0.0000 IC C10 N2 C3 C5 0.0000 0.0000 0.0000 0.0000 0.0000 IC C5 C7 C9 C12 0.0000 0.0000 0.0000 0.0000 0.0000 IC N2 C10 C9 C12 0.0000 0.0000 0.0000 0.0000 0.0000 IC C7 C9 C12 O13 0.0000 0.0000 0.0000 0.0000 0.0000 IC C7 C9 C12 N14 0.0000 0.0000 0.0000 0.0000 0.0000 PATC FIRS NONE LAST NONE RESI PPI1 -3.00000 ATOM C1 CN9 0.10000 ATOM O11 ON2 -0.62000 ATOM P1 P 1.50000 ATOM O12 ON2 -0.74000 ATOM O13 ON3 -0.82000 ATOM O14 ON3 -0.82000 ATOM P2 P2 1.10000 ATOM O22 ON3 -0.90000 ATOM O23 ON3 -0.90000 ATOM O24 ON3 -0.90000 BOND P1 O11 P1 O12 P1 O13 P1 O14 O11 C1 O12 P2 BOND P2 O22 P2 O23 P2 O24 IC C1 O11 P1 O12 0.0000 0.0000 180.0000 0.0000 0.0000 IC O11 P1 O12 P2 0.0000 0.0000 180.0000 0.0000 0.0000 IC P1 O12 P2 O22 0.0000 0.0000 180.0000 0.0000 0.0000 IC C1 O11 P1 O13 0.0000 0.0000 60.0000 0.0000 0.0000 IC C1 O11 P1 O14 0.0000 0.0000 -60.0000 0.0000 0.0000 IC P1 O12 P2 O23 0.0000 0.0000 60.0000 0.0000 0.0000 IC P1 O12 P2 O24 0.0000 0.0000 -60.0000 0.0000 0.0000 PATC FIRS NONE LAST NONE RESI RIBT 0.00000 ATOM C5' CN9 0.00000 ATOM N1 NN5 0.00000 ATOM C2' CN6 0.23000 ATOM O2' ON5 -0.23000 ATOM C3' CN6 0.23000 ATOM O3' ON5 -0.23000 ATOM C1' CN6B 0.20000 ATOM C4' CN6 0.20000 ATOM O4' ON6 -0.40000 BOND C1' O4' C1' N1 C1' C2' C2' O2' C2' C3' C3' O3' BOND C3' C4' C4' O4' C4' C5' IC C4' O4' C1' C2' 1.4525 109.8400 0.0100 106.8500 1.5501 IC O4' C1' C2' C3' 1.4284 106.8500 23.5900 102.3700 1.5478 IC C1' C2' C3' C4' 1.5501 102.3700 -36.2600 100.5400 1.5386 IC C2' C3' C4' O4' 1.5478 100.5400 37.4200 105.0400 1.4525 IC C3' C4' O4' C1' 1.5386 105.0400 -24.0500 109.8400 1.4284 IC N1 C1' C2' C3' 1.4718 115.0300 142.0100 102.3700 1.5478 IC C5' C4' O4' C1' 1.5235 108.2600 102.9200 109.8400 1.4284 IC O2' C2' C3' C4' 1.4293 111.8400 -157.0900 100.5400 1.5386 IC O3' C3' C4' O4' 1.4352 111.9800 -83.0200 105.0400 1.4525 PATC FIRS NONE LAST NONE RESI SOD 1.00000 ATOM NA SOD 1.00000 PATC FIRS NONE LAST NONE PRES NTER 1.00000 ATOM CA CT1 1.00000 IC H N CA C 0.0000 0.0000 180.0000 0.0000 0.0000 IC H2 CA *N H 0.0000 0.0000 120.0000 0.0000 0.0000 IC H3 CA *N H2 0.0000 0.0000 120.0000 0.0000 0.0000 PRES GLYP 1.00000 ATOM CA CT2 1.00000 IC H2 CA *N H 0.0000 0.0000 120.0000 0.0000 0.0000 IC H3 CA *N H2 0.0000 0.0000 120.0000 0.0000 0.0000 PRES PROP 1.00000 ATOM CA CP1 1.00000 IC H1 CA *N CD 0.0000 0.0000 120.0000 0.0000 0.0000 IC H2 CA *N H1 0.0000 0.0000 120.0000 0.0000 0.0000 PRES ACE 0.00000 IC CY N CA C 0.0000 0.0000 -60.0000 0.0000 0.0000 IC CY CA *N HN 0.0000 0.0000 180.0000 0.0000 0.0000 IC CAY CY N CA 0.0000 0.0000 180.0000 0.0000 0.0000 IC N CAY *CY OY 0.0000 0.0000 180.0000 0.0000 0.0000 IC OY CY CAY HY1 0.0000 0.0000 180.0000 0.0000 0.0000 IC OY CY CAY HY2 0.0000 0.0000 60.0000 0.0000 0.0000 IC OY CY CAY HY3 0.0000 0.0000 -60.0000 0.0000 0.0000 PRES ACP 0.00000 IC CY N CA C 0.0000 0.0000 -60.0000 0.0000 0.0000 IC CY CA *N CD 0.0000 0.0000 180.0000 0.0000 0.0000 IC CAY CY N CA 0.0000 0.0000 180.0000 0.0000 0.0000 IC N CAY *CY OY 0.0000 0.0000 180.0000 0.0000 0.0000 IC OY CY CAY HY1 0.0000 0.0000 180.0000 0.0000 0.0000 IC OY CY CAY HY2 0.0000 0.0000 60.0000 0.0000 0.0000 IC OY CY CAY HY3 0.0000 0.0000 -60.0000 0.0000 0.0000 PRES CTER -1.00000 IC N CA C OXT 0.0000 0.0000 180.0000 0.0000 0.0000 IC OXT CA *C O 0.0000 0.0000 180.0000 0.0000 0.0000 PRES CT1 0.00000 DELE ATOM O IC N CA C OT2 0.0000 0.0000 180.0000 0.0000 0.0000 IC OT2 CA *C OT1 0.0000 0.0000 180.0000 0.0000 0.0000 IC CA C OT2 CT 0.0000 0.0000 180.0000 0.0000 0.0000 IC C OT2 CT HT1 0.0000 0.0000 0.0000 0.0000 0.0000 IC C OT2 CT HT2 0.0000 0.0000 120.0000 0.0000 0.0000 IC C OT2 CT HT3 0.0000 0.0000 240.0000 0.0000 0.0000 PRES CT2 0.00000 IC N CA C O 0.0000 0.0000 180.0000 0.0000 0.0000 IC NT CA *C O 0.0000 0.0000 180.0000 0.0000 0.0000 IC CA C NT HT1 0.0000 0.0000 180.0000 0.0000 0.0000 IC HT1 C *NT HT2 0.0000 0.0000 180.0000 0.0000 0.0000 PRES CT3 0.00000 IC N CA C O 0.0000 0.0000 180.0000 0.0000 0.0000 IC NT CA *C O 0.0000 0.0000 180.0000 0.0000 0.0000 IC C CAT *NT HNT 0.0000 0.0000 180.0000 0.0000 0.0000 IC CA C NT CAT 0.0000 0.0000 180.0000 0.0000 0.0000 IC C NT CAT HT1 0.0000 0.0000 60.0000 0.0000 0.0000 IC C NT CAT HT2 0.0000 0.0000 180.0000 0.0000 0.0000 IC C NT CAT HT3 0.0000 0.0000 -60.0000 0.0000 0.0000 PRES ASPP 0.00000 IC HD2 OD2 CG OD1 0.0000 0.0000 0.0000 0.0000 0.0000 PRES GLUP 0.00000 IC HE2 OE2 CD OE1 0.0000 0.0000 0.0000 0.0000 0.0000 PRES LINK 0.00000 IC 1:N 1:CA 1:C 2:N 0.0000 0.0000 180.0000 0.0000 0.0000 IC 2:N 1:CA 1:*C 1:O 0.0000 0.0000 180.0000 0.0000 0.0000 IC 1:CA 1:C 2:N 2:CA 0.0000 0.0000 180.0000 0.0000 0.0000 IC 1:C 2:N 2:CA 2:C 0.0000 0.0000 180.0000 0.0000 0.0000 IC 1:C 2:CA 2:*N 2:HN 0.0000 0.0000 180.0000 0.0000 0.0000 PRES DISU -0.36000 DELE ATOM 1:HG DELE ATOM 2:HG IC 1:CA 1:CB 1:SG 2:SG 0.0000 0.0000 180.0000 0.0000 0.0000 IC 1:CB 1:SG 2:SG 2:CB 0.0000 0.0000 90.0000 0.0000 0.0000 IC 1:SG 2:SG 2:CB 2:CA 0.0000 0.0000 180.0000 0.0000 0.0000 PRES FHEM 0.00000 PRES PHEM 0.00000 IC 1:CD2 1:NE2 2:FE 2:NA 0.0000 0.0000 0.0000 0.0000 0.0000 IC 1:CD2 1:NE2 2:FE 2:NB 0.0000 0.0000 0.0000 0.0000 0.0000 IC 1:CD2 1:NE2 2:FE 2:NB 0.0000 0.0000 0.0000 0.0000 0.0000 IC 1:CD2 1:NE2 2:FE 2:NB 0.0000 0.0000 0.0000 0.0000 0.0000 IC 1:CE1 1:NE2 2:FE 2:NA 0.0000 0.0000 0.0000 0.0000 0.0000 PRES PLO2 0.00000 IC 1:O2 1:O1 2:FE 2:NA 0.0000 0.0000 0.0000 0.0000 0.0000 IC 1:O2 1:O1 2:FE 3:NE2 0.0000 0.0000 0.0000 0.0000 0.0000 PRES PLIG 0.00000 IC 1:O 1:C 2:FE 2:NA 0.0000 0.0000 0.0000 0.0000 0.0000 IC 1:O 1:C 2:FE 3:NE2 0.0000 0.0000 0.0000 0.0000 0.0000 PRES LIG1 0.00000 IC 1:N 1:CA 1:C 2:N 0.0000 0.0000 180.0000 0.0000 0.0000 IC 2:N 1:CA 1:*C 1:O 0.0000 0.0000 180.0000 0.0000 0.0000 IC 1:CA 1:C 2:N 2:CA 0.0000 0.0000 180.0000 0.0000 0.0000 IC 1:C 2:N 2:CA 2:C 0.0000 0.0000 180.0000 0.0000 0.0000 IC 1:C 2:CA 2:*N 2:HN 0.0000 0.0000 180.0000 0.0000 0.0000 PRES LIG2 0.00000 IC 1:N 1:CA 1:C 2:N 0.0000 0.0000 0.0000 0.0000 0.0000 IC 2:N 1:CA 1:*C 1:O 0.0000 0.0000 0.0000 0.0000 0.0000 IC 1:CA 1:C 2:N 2:CA 0.0000 0.0000 0.0000 0.0000 0.0000 IC 1:C 2:N 2:CA 2:C 0.0000 0.0000 0.0000 0.0000 0.0000 IC 1:C 2:CA 2:*N 2:HN 0.0000 0.0000 0.0000 0.0000 0.0000 PRES LIG3 0.00000 IC 1:N 1:CA 1:C 2:N 0.0000 0.0000 0.0000 0.0000 0.0000 IC 2:N 1:CA 1:*C 1:O 0.0000 0.0000 0.0000 0.0000 0.0000 IC 1:CA 1:C 2:N 2:CA 0.0000 0.0000 0.0000 0.0000 0.0000 IC 1:C 2:N 2:CA 2:C 0.0000 0.0000 0.0000 0.0000 0.0000 IC 1:C 2:CA 2:*N 2:HN 0.0000 0.0000 0.0000 0.0000 0.0000 PRES TP1 -1.00000 ATOM CE1 CA -0.18910 ATOM CE2 CA -0.18910 ATOM CZ CA -0.14408 ATOM OH ON2B -0.32417 ATOM P1 P 1.53934 ATOM O2 ON4 -0.32417 ATOM O3 ON3 -0.68436 ATOM O4 ON3 -0.68436 DELE ATOM HH BOND P1 OH P1 O2 P1 O3 P1 O4 ANGL CZ OH P1 OH P1 O2 OH P1 O3 OH P1 O4 ANGL O2 P1 O3 O2 P1 O4 O3 P1 O4 DIHE CE1 CZ OH P1 CE2 CZ OH P1 CZ OH P1 O2 DIHE CZ OH P1 O3 CZ OH P1 O4 IC CE1 CZ OH P1 0.0000 0.0000 0.0000 0.0000 0.0000 IC CZ OH P1 O2 0.0000 0.0000 180.0000 0.0000 0.0000 IC O2 OH *P1 O3 0.0000 0.0000 -115.8200 0.0000 0.0000 IC O2 OH *P1 O4 0.0000 0.0000 115.9000 0.0000 0.0000 IC H2 O2 P1 OH 0.0000 0.0000 180.0000 0.0000 0.0000 PRES TP1A -1.00000 ATOM CG CA 0.00000 ATOM CE1 CA -0.18910 ATOM CE2 CA -0.18910 ATOM CZ CA -0.14408 ATOM OH ON2B -0.32417 ATOM P1 P 1.53934 ATOM O2 ON4 -0.32417 ATOM O3 ON3 -0.68436 ATOM O4 ON3 -0.68436 DELE ATOM N DELE ATOM HN DELE ATOM CA DELE ATOM HA DELE ATOM CB DELE ATOM HB2 DELE ATOM HB3 DELE ATOM C DELE ATOM O DELE ATOM HH BOND P1 OH P1 O2 P1 O3 P1 O4 ANGL CZ OH P1 OH P1 O2 OH P1 O3 OH P1 O4 ANGL O2 P1 O3 O2 P1 O4 O3 P1 O4 DIHE CE1 CZ OH P1 CE2 CZ OH P1 CZ OH P1 O2 DIHE CZ OH P1 O3 CZ OH P1 O4 IC CE1 CZ OH P1 0.0000 0.0000 0.0000 0.0000 0.0000 IC CZ OH P1 O2 0.0000 0.0000 180.0000 0.0000 0.0000 IC O2 OH *P1 O3 0.0000 0.0000 -115.8200 0.0000 0.0000 IC O2 OH *P1 O4 0.0000 0.0000 115.9000 0.0000 0.0000 IC H2 O2 P1 OH 0.0000 0.0000 180.0000 0.0000 0.0000 IC CD1 CD2 *CG HG 1.3978 120.0900 179.6400 120.5800 1.0799 PRES TP2 -2.00000 ATOM CE1 CA -0.19336 ATOM CE2 CA -0.19336 ATOM CZ CA -0.25781 ATOM OH ON2B -0.25781 ATOM P1 P 1.55411 ATOM O2 ON3 -0.88392 ATOM O3 ON3 -0.88392 ATOM O4 ON3 -0.88392 DELE ATOM HH BOND P1 OH P1 O2 P1 O3 P1 O4 ANGL CZ OH P1 OH P1 O2 OH P1 O3 OH P1 O4 ANGL O2 P1 O3 O2 P1 O4 O3 P1 O4 DIHE CE1 CZ OH P1 CE2 CZ OH P1 CZ OH P1 O2 DIHE CZ OH P1 O3 CZ OH P1 O4 IC CE1 CZ OH P1 0.0000 0.0000 0.0000 0.0000 0.0000 IC CZ OH P1 O2 0.0000 0.0000 180.0000 0.0000 0.0000 IC O2 OH *P1 O3 0.0000 0.0000 -115.8200 0.0000 0.0000 IC O2 OH *P1 O4 0.0000 0.0000 115.9000 0.0000 0.0000 PRES TP2A -2.00000 ATOM CG CA 0.00000 ATOM CE1 CA -0.19336 ATOM CE2 CA -0.19336 ATOM CZ CA -0.25781 ATOM OH ON2B -0.25781 ATOM P1 P 1.55411 ATOM O2 ON3 -0.88392 ATOM O3 ON3 -0.88392 ATOM O4 ON3 -0.88392 DELE ATOM N DELE ATOM HN DELE ATOM CA DELE ATOM HA DELE ATOM CB DELE ATOM HB2 DELE ATOM HB3 DELE ATOM C DELE ATOM O DELE ATOM HH BOND P1 OH P1 O2 P1 O3 P1 O4 ANGL CZ OH P1 OH P1 O2 OH P1 O3 OH P1 O4 ANGL O2 P1 O3 O2 P1 O4 O3 P1 O4 DIHE CE1 CZ OH P1 CE2 CZ OH P1 CZ OH P1 O2 DIHE CZ OH P1 O3 CZ OH P1 O4 IC CE1 CZ OH P1 0.0000 0.0000 0.0000 0.0000 0.0000 IC CZ OH P1 O2 0.0000 0.0000 180.0000 0.0000 0.0000 IC O2 OH *P1 O3 0.0000 0.0000 -115.8200 0.0000 0.0000 IC O2 OH *P1 O4 0.0000 0.0000 115.9000 0.0000 0.0000 IC CD1 CD2 *CG HG 1.3978 120.0900 179.6400 120.5800 1.0799 PRES DEO1 0.00000 DELE ATOM O2' DELE ATOM HO2' IC C1' C3' *C2' H2'' 0.0000 0.0000 -115.0000 0.0000 0.0000 PRES DEO2 0.00000 DELE ATOM O2' DELE ATOM HO2' IC C1' C3' *C2' H2'' 0.0000 0.0000 -115.0000 0.0000 0.0000 PRES PYRC 0.00000 ATOM N1 NN2 -0.13037 ATOM C6 CN3 0.13037 DELE ATOM P DELE ATOM OP1 DELE ATOM OP2 DELE ATOM O5' DELE ATOM C5' DELE ATOM H5' DELE ATOM H5'' DELE ATOM C4' DELE ATOM H4' DELE ATOM O4' DELE ATOM C1' DELE ATOM H1' DELE ATOM C2' DELE ATOM H2' DELE ATOM O2' DELE ATOM HO2' DELE ATOM C3' DELE ATOM O3' DELE ATOM H3' IC C5 C6 N1 H1 0.0000 0.0000 180.0000 0.0000 0.0000 PRES PYRU 0.00000 ATOM N1 NN2 -0.21702 ATOM C6 CN3 0.21702 DELE ATOM P DELE ATOM OP1 DELE ATOM OP2 DELE ATOM O5' DELE ATOM C5' DELE ATOM H5' DELE ATOM H5'' DELE ATOM C4' DELE ATOM H4' DELE ATOM O4' DELE ATOM C1' DELE ATOM H1' DELE ATOM C2' DELE ATOM H2' DELE ATOM O2' DELE ATOM HO2' DELE ATOM C3' DELE ATOM O3' DELE ATOM H3' IC C5 C6 N1 H1 0.0000 0.0000 180.0000 0.0000 0.0000 PRES PURG 0.00000 ATOM N9 NN2 -0.14000 ATOM C4 CN5 0.14000 DELE ATOM P DELE ATOM OP1 DELE ATOM OP2 DELE ATOM O5' DELE ATOM C5' DELE ATOM H5' DELE ATOM H5'' DELE ATOM C4' DELE ATOM H4' DELE ATOM O4' DELE ATOM C1' DELE ATOM H1' DELE ATOM C2' DELE ATOM H2' DELE ATOM O2' DELE ATOM HO2' DELE ATOM C3' DELE ATOM O3' DELE ATOM H3' IC C5 C4 N9 H9 0.0000 0.0000 180.0000 0.0000 0.0000 PRES PURA 0.00000 ATOM C5 CN5 0.25957 ATOM N7 NN4 -0.54900 ATOM C8 CN4 0.42886 ATOM N9 NN2 -0.13943 DELE ATOM P DELE ATOM OP1 DELE ATOM OP2 DELE ATOM O5' DELE ATOM C5' DELE ATOM H5' DELE ATOM H5'' DELE ATOM C4' DELE ATOM H4' DELE ATOM O4' DELE ATOM C1' DELE ATOM H1' DELE ATOM C2' DELE ATOM H2' DELE ATOM O2' DELE ATOM HO2' DELE ATOM C3' DELE ATOM O3' DELE ATOM H3' IC C5 C4 N9 H9 0.0000 0.0000 180.0000 0.0000 0.0000 PRES 5TER 0.00000 DELE ATOM P DELE ATOM OP1 DELE ATOM OP2 IC HO5' O5' C5' C4' 0.0000 0.0000 180.0000 0.0000 0.0000 PRES 5MET 0.00000 DELE ATOM O5' DELE ATOM P DELE ATOM OP1 DELE ATOM OP2 PRES 5PHO -1.00000 IC C4' C5' O5' P 0.0000 0.0000 180.0000 0.0000 0.0000 IC C5' O5' P OP3 0.0000 0.0000 -39.5200 0.0000 0.0000 IC OP3 O5' *P OP1 0.0000 0.0000 -115.8200 0.0000 0.0000 IC OP3 O5' *P OP2 0.0000 0.0000 115.9000 0.0000 0.0000 IC HOP3 OP3 P O5' 0.0000 0.0000 180.0000 0.0000 0.0000 PRES 3TER 0.00000 IC HO3' O3' C3' C4' 0.9600 114.9700 148.6300 111.9200 1.5284 PRES 3PHO -1.00000 IC C4' C3' O3' P3 0.0000 0.0000 180.0000 0.0000 0.0000 IC C3' O3' P3 OP33 0.0000 0.0000 -39.5200 0.0000 0.0000 IC OP33 O3' *P3 OP31 0.0000 0.0000 -115.8200 0.0000 0.0000 IC OP33 O3' *P3 OP32 0.0000 0.0000 115.9000 0.0000 0.0000 IC H3T OP33 P3 O3' 0.0000 0.0000 180.0000 0.0000 0.0000 PRES 25P1 -1.00000 DELE ATOM 1:O3' DELE ATOM 1:H2'' IC 1:C2' 1:C4' 1:*C3 1:H3' 0.0000 0.0000 -124.0800 0.0000 0.0000 PRES 25P2 -1.00000 DELE ATOM 1:O3' DELE ATOM 1:H2'' IC 1:C2' 1:C4' 1:*C3 1:H3' 0.0000 0.0000 -124.0800 0.0000 0.0000 PRES 9MG 0.00000 DELE ATOM P DELE ATOM OP1 DELE ATOM OP2 DELE ATOM O5' DELE ATOM C5' DELE ATOM H5' DELE ATOM H5'' DELE ATOM C4' DELE ATOM H4' DELE ATOM O4' DELE ATOM C1' DELE ATOM H1' DELE ATOM C2' DELE ATOM H2' DELE ATOM O2' DELE ATOM HO2' DELE ATOM C3' DELE ATOM O3' DELE ATOM H3' IC C8 C4 *N9 C9 0.0000 0.0000 180.0000 0.0000 0.0000 IC C8 N9 C9 H91 0.0000 0.0000 180.0000 0.0000 0.0000 IC N9 H91 *C9 H92 0.0000 0.0000 -115.0000 0.0000 0.0000 IC H91 H92 *C9 H93 0.0000 0.0000 115.0000 0.0000 0.0000 PRES 9EG 0.00000 DELE ATOM P DELE ATOM OP1 DELE ATOM OP2 DELE ATOM O5' DELE ATOM C5' DELE ATOM H5' DELE ATOM H5'' DELE ATOM C4' DELE ATOM H4' DELE ATOM O4' DELE ATOM C1' DELE ATOM H1' DELE ATOM C2' DELE ATOM H2' DELE ATOM O2' DELE ATOM HO2' DELE ATOM C3' DELE ATOM O3' DELE ATOM H3' IC C8 C4 *N9 C9 0.0000 0.0000 180.0000 0.0000 0.0000 IC C8 N9 C9 C9B 0.0000 0.0000 0.0000 0.0000 0.0000 IC N9 C9B *C9 H91 0.0000 0.0000 -115.0000 0.0000 0.0000 IC C9B H91 *C9 H92 0.0000 0.0000 115.0000 0.0000 0.0000 IC N9 C9 C9B H9B1 0.0000 0.0000 180.0000 0.0000 0.0000 IC C9 H9B1 *C9B H9B2 0.0000 0.0000 -115.0000 0.0000 0.0000 IC H9B1 H9B2 *C9B H9B3 0.0000 0.0000 115.0000 0.0000 0.0000 PRES 9MA 0.00000 DELE ATOM P DELE ATOM OP1 DELE ATOM OP2 DELE ATOM O5' DELE ATOM C5' DELE ATOM H5' DELE ATOM H5'' DELE ATOM C4' DELE ATOM H4' DELE ATOM O4' DELE ATOM C1' DELE ATOM H1' DELE ATOM C2' DELE ATOM H2' DELE ATOM O2' DELE ATOM HO2' DELE ATOM C3' DELE ATOM O3' DELE ATOM H3' IC C8 C4 *N9 C9 0.0000 0.0000 180.0000 0.0000 0.0000 IC C4 N9 C9 H91 0.0000 0.0000 180.0000 0.0000 0.0000 IC N9 H91 *C9 H92 0.0000 0.0000 -115.0000 0.0000 0.0000 IC H91 H92 *C9 H93 0.0000 0.0000 115.0000 0.0000 0.0000 PRES 1MC 0.00000 DELE ATOM P DELE ATOM OP1 DELE ATOM OP2 DELE ATOM O5' DELE ATOM C5' DELE ATOM H5' DELE ATOM H5'' DELE ATOM C4' DELE ATOM H4' DELE ATOM O4' DELE ATOM C1' DELE ATOM H1' DELE ATOM C2' DELE ATOM H2' DELE ATOM O2' DELE ATOM HO2' DELE ATOM C3' DELE ATOM O3' DELE ATOM H3' IC C6 C2 *N1 C1 0.0000 0.0000 180.0000 0.0000 0.0000 IC C2 N1 C1 H11 0.0000 0.0000 180.0000 0.0000 0.0000 IC N1 H11 *C1 H12 0.0000 0.0000 -115.0000 0.0000 0.0000 IC H11 H12 *C1 H13 0.0000 0.0000 115.0000 0.0000 0.0000 PRES 5MC1 0.00000 DELE ATOM P DELE ATOM OP1 DELE ATOM OP2 DELE ATOM O5' DELE ATOM C5' DELE ATOM H5' DELE ATOM H5'' DELE ATOM C4' DELE ATOM H4' DELE ATOM O4' DELE ATOM C1' DELE ATOM H1' DELE ATOM C2' DELE ATOM H2' DELE ATOM O2' DELE ATOM HO2' DELE ATOM C3' DELE ATOM O3' DELE ATOM H3' DELE ATOM H5 IC C5 C6 N1 H1 0.0000 0.0000 180.0000 0.0000 0.0000 IC C6 C4 *C5 C7 0.0000 0.0000 180.0000 0.0000 0.0000 IC C4 C5 C7 H5M1 0.0000 0.0000 180.0000 0.0000 0.0000 IC C5 H5M1 *C7 H5M2 0.0000 0.0000 -115.0000 0.0000 0.0000 IC H5M1 H5M2 *C7 H5M3 0.0000 0.0000 115.0000 0.0000 0.0000 PRES 5MC2 0.00000 DELE ATOM H5 IC C6 C4 *C5 C7 0.0000 0.0000 180.0000 0.0000 0.0000 IC C4 C5 C7 H5M1 0.0000 0.0000 180.0000 0.0000 0.0000 IC C5 H5M1 *C7 H5M2 0.0000 0.0000 -115.0000 0.0000 0.0000 IC H5M1 H5M2 *C7 H5M3 0.0000 0.0000 115.0000 0.0000 0.0000 PRES INO1 0.00000 ATOM N3 NN3I -0.54062 ATOM C2 CN4 0.78559 ATOM N1 NN2G -0.24497 DELE ATOM N2 DELE ATOM H21 DELE ATOM H22 IC N1 N3 *C2 H2 1.3750 124.0000 180.0000 119.7000 1.3410 PRES 1MT 0.00000 DELE ATOM P DELE ATOM OP1 DELE ATOM OP2 DELE ATOM O5' DELE ATOM C5' DELE ATOM H5' DELE ATOM H5'' DELE ATOM C4' DELE ATOM H4' DELE ATOM O4' DELE ATOM C1' DELE ATOM H1' DELE ATOM C2' DELE ATOM H2' DELE ATOM O2' DELE ATOM HO2' DELE ATOM C3' DELE ATOM O3' DELE ATOM H3' IC C6 C2 *N1 C1 0.0000 0.0000 180.0000 0.0000 0.0000 IC C2 N1 C1 H11 0.0000 0.0000 180.0000 0.0000 0.0000 IC N1 H11 *C1 H12 0.0000 0.0000 -115.0000 0.0000 0.0000 IC H11 H12 *C1 H13 0.0000 0.0000 115.0000 0.0000 0.0000 PRES 5DP -3.00000 IC C5' O5' P O13 0.0000 0.0000 180.0000 0.0000 0.0000 IC O5' P O13 P2 0.0000 0.0000 180.0000 0.0000 0.0000 IC P O13 P2 O21 0.0000 0.0000 180.0000 0.0000 0.0000 IC P O13 P2 O22 0.0000 0.0000 60.0000 0.0000 0.0000 IC P O13 P2 O23 0.0000 0.0000 -60.0000 0.0000 0.0000