PSF 25 !NTITLE REMARKS original generated structure x-plor psf file REMARKS 12 patches were applied to the molecule. REMARKS topology top_all27_prot_lipid.inp REMARKS segment C1 { first NTER; last CTER; auto angles dihedrals } REMARKS segment W1 { first NONE; last NONE; auto angles dihedrals } REMARKS segment C2 { first NTER; last CTER; auto angles dihedrals } REMARKS segment W2 { first NONE; last NONE; auto angles dihedrals } REMARKS segment C3 { first NTER; last CTER; auto angles dihedrals } REMARKS segment W3 { first NONE; last NONE; auto angles dihedrals } REMARKS segment C4 { first NTER; last CTER; auto angles dihedrals } REMARKS segment W4 { first NONE; last NONE; auto angles dihedrals } REMARKS segment X1 { first NONE; last NONE; auto angles dihedrals } REMARKS segment X2 { first NONE; last NONE; auto angles dihedrals } REMARKS patch NTER C1:22 REMARKS patch CTER C1:124 REMARKS patch GLUP C1:71 REMARKS patch NTER C2:22 REMARKS patch CTER C2:124 REMARKS patch GLUP C2:71 REMARKS patch NTER C3:22 REMARKS patch CTER C3:124 REMARKS patch GLUP C3:71 REMARKS patch NTER C4:22 REMARKS patch CTER C4:124 REMARKS patch GLUP C4:71 6345 !NATOM 1 C1 22 SER N NH3 -0.300000 14.0070 0 2 C1 22 SER HT1 HC 0.330000 1.0080 0 3 C1 22 SER HT2 HC 0.330000 1.0080 0 4 C1 22 SER HT3 HC 0.330000 1.0080 0 5 C1 22 SER CA CT1 0.210000 12.0110 0 6 C1 22 SER HA HB 0.100000 1.0080 0 7 C1 22 SER CB CT2 0.050000 12.0110 0 8 C1 22 SER HB1 HA 0.090000 1.0080 0 9 C1 22 SER HB2 HA 0.090000 1.0080 0 10 C1 22 SER OG OH1 -0.660000 15.9990 0 11 C1 22 SER HG1 H 0.430000 1.0080 0 12 C1 22 SER C C 0.510000 12.0110 0 13 C1 22 SER O O -0.510000 15.9990 0 14 C1 23 ALA N NH1 -0.470000 14.0070 0 15 C1 23 ALA HN H 0.310000 1.0080 0 16 C1 23 ALA CA CT1 0.070000 12.0110 0 17 C1 23 ALA HA HB 0.090000 1.0080 0 18 C1 23 ALA CB CT3 -0.270000 12.0110 0 19 C1 23 ALA HB1 HA 0.090000 1.0080 0 20 C1 23 ALA HB2 HA 0.090000 1.0080 0 21 C1 23 ALA HB3 HA 0.090000 1.0080 0 22 C1 23 ALA C C 0.510000 12.0110 0 23 C1 23 ALA O O -0.510000 15.9990 0 24 C1 24 LEU N NH1 -0.470000 14.0070 0 25 C1 24 LEU HN H 0.310000 1.0080 0 26 C1 24 LEU CA CT1 0.070000 12.0110 0 27 C1 24 LEU HA HB 0.090000 1.0080 0 28 C1 24 LEU CB CT2 -0.180000 12.0110 0 29 C1 24 LEU HB1 HA 0.090000 1.0080 0 30 C1 24 LEU HB2 HA 0.090000 1.0080 0 31 C1 24 LEU CG CT1 -0.090000 12.0110 0 32 C1 24 LEU HG HA 0.090000 1.0080 0 33 C1 24 LEU CD1 CT3 -0.270000 12.0110 0 34 C1 24 LEU HD11 HA 0.090000 1.0080 0 35 C1 24 LEU HD12 HA 0.090000 1.0080 0 36 C1 24 LEU HD13 HA 0.090000 1.0080 0 37 C1 24 LEU CD2 CT3 -0.270000 12.0110 0 38 C1 24 LEU HD21 HA 0.090000 1.0080 0 39 C1 24 LEU HD22 HA 0.090000 1.0080 0 40 C1 24 LEU HD23 HA 0.090000 1.0080 0 41 C1 24 LEU C C 0.510000 12.0110 0 42 C1 24 LEU O O -0.510000 15.9990 0 43 C1 25 HSE N NH1 -0.470000 14.0070 0 44 C1 25 HSE HN H 0.310000 1.0080 0 45 C1 25 HSE CA CT1 0.070000 12.0110 0 46 C1 25 HSE HA HB 0.090000 1.0080 0 47 C1 25 HSE CB CT2 -0.080000 12.0110 0 48 C1 25 HSE HB1 HA 0.090000 1.0080 0 49 C1 25 HSE HB2 HA 0.090000 1.0080 0 50 C1 25 HSE ND1 NR2 -0.700000 14.0070 0 51 C1 25 HSE CG CPH1 0.220000 12.0110 0 52 C1 25 HSE CE1 CPH2 0.250000 12.0110 0 53 C1 25 HSE HE1 HR1 0.130000 1.0080 0 54 C1 25 HSE NE2 NR1 -0.360000 14.0070 0 55 C1 25 HSE HE2 H 0.320000 1.0080 0 56 C1 25 HSE CD2 CPH1 -0.050000 12.0110 0 57 C1 25 HSE HD2 HR3 0.090000 1.0080 0 58 C1 25 HSE C C 0.510000 12.0110 0 59 C1 25 HSE O O -0.510000 15.9990 0 60 C1 26 TRP N NH1 -0.470000 14.0070 0 61 C1 26 TRP HN H 0.310000 1.0080 0 62 C1 26 TRP CA CT1 0.070000 12.0110 0 63 C1 26 TRP HA HB 0.090000 1.0080 0 64 C1 26 TRP CB CT2 -0.180000 12.0110 0 65 C1 26 TRP HB1 HA 0.090000 1.0080 0 66 C1 26 TRP HB2 HA 0.090000 1.0080 0 67 C1 26 TRP CG CY -0.030000 12.0110 0 68 C1 26 TRP CD1 CA 0.035000 12.0110 0 69 C1 26 TRP HD1 HP 0.115000 1.0080 0 70 C1 26 TRP NE1 NY -0.610000 14.0070 0 71 C1 26 TRP HE1 H 0.380000 1.0080 0 72 C1 26 TRP CE2 CPT 0.130000 12.0110 0 73 C1 26 TRP CD2 CPT -0.020000 12.0110 0 74 C1 26 TRP CE3 CA -0.115000 12.0110 0 75 C1 26 TRP HE3 HP 0.115000 1.0080 0 76 C1 26 TRP CZ3 CA -0.115000 12.0110 0 77 C1 26 TRP HZ3 HP 0.115000 1.0080 0 78 C1 26 TRP CZ2 CA -0.115000 12.0110 0 79 C1 26 TRP HZ2 HP 0.115000 1.0080 0 80 C1 26 TRP CH2 CA -0.115000 12.0110 0 81 C1 26 TRP HH2 HP 0.115000 1.0080 0 82 C1 26 TRP C C 0.510000 12.0110 0 83 C1 26 TRP O O -0.510000 15.9990 0 84 C1 27 ARG N NH1 -0.470000 14.0070 0 85 C1 27 ARG HN H 0.310000 1.0080 0 86 C1 27 ARG CA CT1 0.070000 12.0110 0 87 C1 27 ARG HA HB 0.090000 1.0080 0 88 C1 27 ARG CB CT2 -0.180000 12.0110 0 89 C1 27 ARG HB1 HA 0.090000 1.0080 0 90 C1 27 ARG HB2 HA 0.090000 1.0080 0 91 C1 27 ARG CG CT2 -0.180000 12.0110 0 92 C1 27 ARG HG1 HA 0.090000 1.0080 0 93 C1 27 ARG HG2 HA 0.090000 1.0080 0 94 C1 27 ARG CD CT2 0.200000 12.0110 0 95 C1 27 ARG HD1 HA 0.090000 1.0080 0 96 C1 27 ARG HD2 HA 0.090000 1.0080 0 97 C1 27 ARG NE NC2 -0.700000 14.0070 0 98 C1 27 ARG HE HC 0.440000 1.0080 0 99 C1 27 ARG CZ C 0.640000 12.0110 0 100 C1 27 ARG NH1 NC2 -0.800000 14.0070 0 101 C1 27 ARG HH11 HC 0.460000 1.0080 0 102 C1 27 ARG HH12 HC 0.460000 1.0080 0 103 C1 27 ARG NH2 NC2 -0.800000 14.0070 0 104 C1 27 ARG HH21 HC 0.460000 1.0080 0 105 C1 27 ARG HH22 HC 0.460000 1.0080 0 106 C1 27 ARG C C 0.510000 12.0110 0 107 C1 27 ARG O O -0.510000 15.9990 0 108 C1 28 ALA N NH1 -0.470000 14.0070 0 109 C1 28 ALA HN H 0.310000 1.0080 0 110 C1 28 ALA CA CT1 0.070000 12.0110 0 111 C1 28 ALA HA HB 0.090000 1.0080 0 112 C1 28 ALA CB CT3 -0.270000 12.0110 0 113 C1 28 ALA HB1 HA 0.090000 1.0080 0 114 C1 28 ALA HB2 HA 0.090000 1.0080 0 115 C1 28 ALA HB3 HA 0.090000 1.0080 0 116 C1 28 ALA C C 0.510000 12.0110 0 117 C1 28 ALA O O -0.510000 15.9990 0 118 C1 29 ALA N NH1 -0.470000 14.0070 0 119 C1 29 ALA HN H 0.310000 1.0080 0 120 C1 29 ALA CA CT1 0.070000 12.0110 0 121 C1 29 ALA HA HB 0.090000 1.0080 0 122 C1 29 ALA CB CT3 -0.270000 12.0110 0 123 C1 29 ALA HB1 HA 0.090000 1.0080 0 124 C1 29 ALA HB2 HA 0.090000 1.0080 0 125 C1 29 ALA HB3 HA 0.090000 1.0080 0 126 C1 29 ALA C C 0.510000 12.0110 0 127 C1 29 ALA O O -0.510000 15.9990 0 128 C1 30 GLY N NH1 -0.470000 14.0070 0 129 C1 30 GLY HN H 0.310000 1.0080 0 130 C1 30 GLY CA CT2 -0.020000 12.0110 0 131 C1 30 GLY HA1 HB 0.090000 1.0080 0 132 C1 30 GLY HA2 HB 0.090000 1.0080 0 133 C1 30 GLY C C 0.510000 12.0110 0 134 C1 30 GLY O O -0.510000 15.9990 0 135 C1 31 ALA N NH1 -0.470000 14.0070 0 136 C1 31 ALA HN H 0.310000 1.0080 0 137 C1 31 ALA CA CT1 0.070000 12.0110 0 138 C1 31 ALA HA HB 0.090000 1.0080 0 139 C1 31 ALA CB CT3 -0.270000 12.0110 0 140 C1 31 ALA HB1 HA 0.090000 1.0080 0 141 C1 31 ALA HB2 HA 0.090000 1.0080 0 142 C1 31 ALA HB3 HA 0.090000 1.0080 0 143 C1 31 ALA C C 0.510000 12.0110 0 144 C1 31 ALA O O -0.510000 15.9990 0 145 C1 32 ALA N NH1 -0.470000 14.0070 0 146 C1 32 ALA HN H 0.310000 1.0080 0 147 C1 32 ALA CA CT1 0.070000 12.0110 0 148 C1 32 ALA HA HB 0.090000 1.0080 0 149 C1 32 ALA CB CT3 -0.270000 12.0110 0 150 C1 32 ALA HB1 HA 0.090000 1.0080 0 151 C1 32 ALA HB2 HA 0.090000 1.0080 0 152 C1 32 ALA HB3 HA 0.090000 1.0080 0 153 C1 32 ALA C C 0.510000 12.0110 0 154 C1 32 ALA O O -0.510000 15.9990 0 155 C1 33 THR N NH1 -0.470000 14.0070 0 156 C1 33 THR HN H 0.310000 1.0080 0 157 C1 33 THR CA CT1 0.070000 12.0110 0 158 C1 33 THR HA HB 0.090000 1.0080 0 159 C1 33 THR CB CT1 0.140000 12.0110 0 160 C1 33 THR HB HA 0.090000 1.0080 0 161 C1 33 THR OG1 OH1 -0.660000 15.9990 0 162 C1 33 THR HG1 H 0.430000 1.0080 0 163 C1 33 THR CG2 CT3 -0.270000 12.0110 0 164 C1 33 THR HG21 HA 0.090000 1.0080 0 165 C1 33 THR HG22 HA 0.090000 1.0080 0 166 C1 33 THR HG23 HA 0.090000 1.0080 0 167 C1 33 THR C C 0.510000 12.0110 0 168 C1 33 THR O O -0.510000 15.9990 0 169 C1 34 VAL N NH1 -0.470000 14.0070 0 170 C1 34 VAL HN H 0.310000 1.0080 0 171 C1 34 VAL CA CT1 0.070000 12.0110 0 172 C1 34 VAL HA HB 0.090000 1.0080 0 173 C1 34 VAL CB CT1 -0.090000 12.0110 0 174 C1 34 VAL HB HA 0.090000 1.0080 0 175 C1 34 VAL CG1 CT3 -0.270000 12.0110 0 176 C1 34 VAL HG11 HA 0.090000 1.0080 0 177 C1 34 VAL HG12 HA 0.090000 1.0080 0 178 C1 34 VAL HG13 HA 0.090000 1.0080 0 179 C1 34 VAL CG2 CT3 -0.270000 12.0110 0 180 C1 34 VAL HG21 HA 0.090000 1.0080 0 181 C1 34 VAL HG22 HA 0.090000 1.0080 0 182 C1 34 VAL HG23 HA 0.090000 1.0080 0 183 C1 34 VAL C C 0.510000 12.0110 0 184 C1 34 VAL O O -0.510000 15.9990 0 185 C1 35 LEU N NH1 -0.470000 14.0070 0 186 C1 35 LEU HN H 0.310000 1.0080 0 187 C1 35 LEU CA CT1 0.070000 12.0110 0 188 C1 35 LEU HA HB 0.090000 1.0080 0 189 C1 35 LEU CB CT2 -0.180000 12.0110 0 190 C1 35 LEU HB1 HA 0.090000 1.0080 0 191 C1 35 LEU HB2 HA 0.090000 1.0080 0 192 C1 35 LEU CG CT1 -0.090000 12.0110 0 193 C1 35 LEU HG HA 0.090000 1.0080 0 194 C1 35 LEU CD1 CT3 -0.270000 12.0110 0 195 C1 35 LEU HD11 HA 0.090000 1.0080 0 196 C1 35 LEU HD12 HA 0.090000 1.0080 0 197 C1 35 LEU HD13 HA 0.090000 1.0080 0 198 C1 35 LEU CD2 CT3 -0.270000 12.0110 0 199 C1 35 LEU HD21 HA 0.090000 1.0080 0 200 C1 35 LEU HD22 HA 0.090000 1.0080 0 201 C1 35 LEU HD23 HA 0.090000 1.0080 0 202 C1 35 LEU C C 0.510000 12.0110 0 203 C1 35 LEU O O -0.510000 15.9990 0 204 C1 36 LEU N NH1 -0.470000 14.0070 0 205 C1 36 LEU HN H 0.310000 1.0080 0 206 C1 36 LEU CA CT1 0.070000 12.0110 0 207 C1 36 LEU HA HB 0.090000 1.0080 0 208 C1 36 LEU CB CT2 -0.180000 12.0110 0 209 C1 36 LEU HB1 HA 0.090000 1.0080 0 210 C1 36 LEU HB2 HA 0.090000 1.0080 0 211 C1 36 LEU CG CT1 -0.090000 12.0110 0 212 C1 36 LEU HG HA 0.090000 1.0080 0 213 C1 36 LEU CD1 CT3 -0.270000 12.0110 0 214 C1 36 LEU HD11 HA 0.090000 1.0080 0 215 C1 36 LEU HD12 HA 0.090000 1.0080 0 216 C1 36 LEU HD13 HA 0.090000 1.0080 0 217 C1 36 LEU CD2 CT3 -0.270000 12.0110 0 218 C1 36 LEU HD21 HA 0.090000 1.0080 0 219 C1 36 LEU HD22 HA 0.090000 1.0080 0 220 C1 36 LEU HD23 HA 0.090000 1.0080 0 221 C1 36 LEU C C 0.510000 12.0110 0 222 C1 36 LEU O O -0.510000 15.9990 0 223 C1 37 VAL N NH1 -0.470000 14.0070 0 224 C1 37 VAL HN H 0.310000 1.0080 0 225 C1 37 VAL CA CT1 0.070000 12.0110 0 226 C1 37 VAL HA HB 0.090000 1.0080 0 227 C1 37 VAL CB CT1 -0.090000 12.0110 0 228 C1 37 VAL HB HA 0.090000 1.0080 0 229 C1 37 VAL CG1 CT3 -0.270000 12.0110 0 230 C1 37 VAL HG11 HA 0.090000 1.0080 0 231 C1 37 VAL HG12 HA 0.090000 1.0080 0 232 C1 37 VAL HG13 HA 0.090000 1.0080 0 233 C1 37 VAL CG2 CT3 -0.270000 12.0110 0 234 C1 37 VAL HG21 HA 0.090000 1.0080 0 235 C1 37 VAL HG22 HA 0.090000 1.0080 0 236 C1 37 VAL HG23 HA 0.090000 1.0080 0 237 C1 37 VAL C C 0.510000 12.0110 0 238 C1 37 VAL O O -0.510000 15.9990 0 239 C1 38 ILE N NH1 -0.470000 14.0070 0 240 C1 38 ILE HN H 0.310000 1.0080 0 241 C1 38 ILE CA CT1 0.070000 12.0110 0 242 C1 38 ILE HA HB 0.090000 1.0080 0 243 C1 38 ILE CB CT1 -0.090000 12.0110 0 244 C1 38 ILE HB HA 0.090000 1.0080 0 245 C1 38 ILE CG2 CT3 -0.270000 12.0110 0 246 C1 38 ILE HG21 HA 0.090000 1.0080 0 247 C1 38 ILE HG22 HA 0.090000 1.0080 0 248 C1 38 ILE HG23 HA 0.090000 1.0080 0 249 C1 38 ILE CG1 CT2 -0.180000 12.0110 0 250 C1 38 ILE HG11 HA 0.090000 1.0080 0 251 C1 38 ILE HG12 HA 0.090000 1.0080 0 252 C1 38 ILE CD CT3 -0.270000 12.0110 0 253 C1 38 ILE HD1 HA 0.090000 1.0080 0 254 C1 38 ILE HD2 HA 0.090000 1.0080 0 255 C1 38 ILE HD3 HA 0.090000 1.0080 0 256 C1 38 ILE C C 0.510000 12.0110 0 257 C1 38 ILE O O -0.510000 15.9990 0 258 C1 39 VAL N NH1 -0.470000 14.0070 0 259 C1 39 VAL HN H 0.310000 1.0080 0 260 C1 39 VAL CA CT1 0.070000 12.0110 0 261 C1 39 VAL HA HB 0.090000 1.0080 0 262 C1 39 VAL CB CT1 -0.090000 12.0110 0 263 C1 39 VAL HB HA 0.090000 1.0080 0 264 C1 39 VAL CG1 CT3 -0.270000 12.0110 0 265 C1 39 VAL HG11 HA 0.090000 1.0080 0 266 C1 39 VAL HG12 HA 0.090000 1.0080 0 267 C1 39 VAL HG13 HA 0.090000 1.0080 0 268 C1 39 VAL CG2 CT3 -0.270000 12.0110 0 269 C1 39 VAL HG21 HA 0.090000 1.0080 0 270 C1 39 VAL HG22 HA 0.090000 1.0080 0 271 C1 39 VAL HG23 HA 0.090000 1.0080 0 272 C1 39 VAL C C 0.510000 12.0110 0 273 C1 39 VAL O O -0.510000 15.9990 0 274 C1 40 LEU N NH1 -0.470000 14.0070 0 275 C1 40 LEU HN H 0.310000 1.0080 0 276 C1 40 LEU CA CT1 0.070000 12.0110 0 277 C1 40 LEU HA HB 0.090000 1.0080 0 278 C1 40 LEU CB CT2 -0.180000 12.0110 0 279 C1 40 LEU HB1 HA 0.090000 1.0080 0 280 C1 40 LEU HB2 HA 0.090000 1.0080 0 281 C1 40 LEU CG CT1 -0.090000 12.0110 0 282 C1 40 LEU HG HA 0.090000 1.0080 0 283 C1 40 LEU CD1 CT3 -0.270000 12.0110 0 284 C1 40 LEU HD11 HA 0.090000 1.0080 0 285 C1 40 LEU HD12 HA 0.090000 1.0080 0 286 C1 40 LEU HD13 HA 0.090000 1.0080 0 287 C1 40 LEU CD2 CT3 -0.270000 12.0110 0 288 C1 40 LEU HD21 HA 0.090000 1.0080 0 289 C1 40 LEU HD22 HA 0.090000 1.0080 0 290 C1 40 LEU HD23 HA 0.090000 1.0080 0 291 C1 40 LEU C C 0.510000 12.0110 0 292 C1 40 LEU O O -0.510000 15.9990 0 293 C1 41 LEU N NH1 -0.470000 14.0070 0 294 C1 41 LEU HN H 0.310000 1.0080 0 295 C1 41 LEU CA CT1 0.070000 12.0110 0 296 C1 41 LEU HA HB 0.090000 1.0080 0 297 C1 41 LEU CB CT2 -0.180000 12.0110 0 298 C1 41 LEU HB1 HA 0.090000 1.0080 0 299 C1 41 LEU HB2 HA 0.090000 1.0080 0 300 C1 41 LEU CG CT1 -0.090000 12.0110 0 301 C1 41 LEU HG HA 0.090000 1.0080 0 302 C1 41 LEU CD1 CT3 -0.270000 12.0110 0 303 C1 41 LEU HD11 HA 0.090000 1.0080 0 304 C1 41 LEU HD12 HA 0.090000 1.0080 0 305 C1 41 LEU HD13 HA 0.090000 1.0080 0 306 C1 41 LEU CD2 CT3 -0.270000 12.0110 0 307 C1 41 LEU HD21 HA 0.090000 1.0080 0 308 C1 41 LEU HD22 HA 0.090000 1.0080 0 309 C1 41 LEU HD23 HA 0.090000 1.0080 0 310 C1 41 LEU C C 0.510000 12.0110 0 311 C1 41 LEU O O -0.510000 15.9990 0 312 C1 42 ALA N NH1 -0.470000 14.0070 0 313 C1 42 ALA HN H 0.310000 1.0080 0 314 C1 42 ALA CA CT1 0.070000 12.0110 0 315 C1 42 ALA HA HB 0.090000 1.0080 0 316 C1 42 ALA CB CT3 -0.270000 12.0110 0 317 C1 42 ALA HB1 HA 0.090000 1.0080 0 318 C1 42 ALA HB2 HA 0.090000 1.0080 0 319 C1 42 ALA HB3 HA 0.090000 1.0080 0 320 C1 42 ALA C C 0.510000 12.0110 0 321 C1 42 ALA O O -0.510000 15.9990 0 322 C1 43 GLY N NH1 -0.470000 14.0070 0 323 C1 43 GLY HN H 0.310000 1.0080 0 324 C1 43 GLY CA CT2 -0.020000 12.0110 0 325 C1 43 GLY HA1 HB 0.090000 1.0080 0 326 C1 43 GLY HA2 HB 0.090000 1.0080 0 327 C1 43 GLY C C 0.510000 12.0110 0 328 C1 43 GLY O O -0.510000 15.9990 0 329 C1 44 SER N NH1 -0.470000 14.0070 0 330 C1 44 SER HN H 0.310000 1.0080 0 331 C1 44 SER CA CT1 0.070000 12.0110 0 332 C1 44 SER HA HB 0.090000 1.0080 0 333 C1 44 SER CB CT2 0.050000 12.0110 0 334 C1 44 SER HB1 HA 0.090000 1.0080 0 335 C1 44 SER HB2 HA 0.090000 1.0080 0 336 C1 44 SER OG OH1 -0.660000 15.9990 0 337 C1 44 SER HG1 H 0.430000 1.0080 0 338 C1 44 SER C C 0.510000 12.0110 0 339 C1 44 SER O O -0.510000 15.9990 0 340 C1 45 TYR N NH1 -0.470000 14.0070 0 341 C1 45 TYR HN H 0.310000 1.0080 0 342 C1 45 TYR CA CT1 0.070000 12.0110 0 343 C1 45 TYR HA HB 0.090000 1.0080 0 344 C1 45 TYR CB CT2 -0.180000 12.0110 0 345 C1 45 TYR HB1 HA 0.090000 1.0080 0 346 C1 45 TYR HB2 HA 0.090000 1.0080 0 347 C1 45 TYR CG CA 0.000000 12.0110 0 348 C1 45 TYR CD1 CA -0.115000 12.0110 0 349 C1 45 TYR HD1 HP 0.115000 1.0080 0 350 C1 45 TYR CE1 CA -0.115000 12.0110 0 351 C1 45 TYR HE1 HP 0.115000 1.0080 0 352 C1 45 TYR CZ CA 0.110000 12.0110 0 353 C1 45 TYR OH OH1 -0.540000 15.9990 0 354 C1 45 TYR HH H 0.430000 1.0080 0 355 C1 45 TYR CD2 CA -0.115000 12.0110 0 356 C1 45 TYR HD2 HP 0.115000 1.0080 0 357 C1 45 TYR CE2 CA -0.115000 12.0110 0 358 C1 45 TYR HE2 HP 0.115000 1.0080 0 359 C1 45 TYR C C 0.510000 12.0110 0 360 C1 45 TYR O O -0.510000 15.9990 0 361 C1 46 LEU N NH1 -0.470000 14.0070 0 362 C1 46 LEU HN H 0.310000 1.0080 0 363 C1 46 LEU CA CT1 0.070000 12.0110 0 364 C1 46 LEU HA HB 0.090000 1.0080 0 365 C1 46 LEU CB CT2 -0.180000 12.0110 0 366 C1 46 LEU HB1 HA 0.090000 1.0080 0 367 C1 46 LEU HB2 HA 0.090000 1.0080 0 368 C1 46 LEU CG CT1 -0.090000 12.0110 0 369 C1 46 LEU HG HA 0.090000 1.0080 0 370 C1 46 LEU CD1 CT3 -0.270000 12.0110 0 371 C1 46 LEU HD11 HA 0.090000 1.0080 0 372 C1 46 LEU HD12 HA 0.090000 1.0080 0 373 C1 46 LEU HD13 HA 0.090000 1.0080 0 374 C1 46 LEU CD2 CT3 -0.270000 12.0110 0 375 C1 46 LEU HD21 HA 0.090000 1.0080 0 376 C1 46 LEU HD22 HA 0.090000 1.0080 0 377 C1 46 LEU HD23 HA 0.090000 1.0080 0 378 C1 46 LEU C C 0.510000 12.0110 0 379 C1 46 LEU O O -0.510000 15.9990 0 380 C1 47 ALA N NH1 -0.470000 14.0070 0 381 C1 47 ALA HN H 0.310000 1.0080 0 382 C1 47 ALA CA CT1 0.070000 12.0110 0 383 C1 47 ALA HA HB 0.090000 1.0080 0 384 C1 47 ALA CB CT3 -0.270000 12.0110 0 385 C1 47 ALA HB1 HA 0.090000 1.0080 0 386 C1 47 ALA HB2 HA 0.090000 1.0080 0 387 C1 47 ALA HB3 HA 0.090000 1.0080 0 388 C1 47 ALA C C 0.510000 12.0110 0 389 C1 47 ALA O O -0.510000 15.9990 0 390 C1 48 VAL N NH1 -0.470000 14.0070 0 391 C1 48 VAL HN H 0.310000 1.0080 0 392 C1 48 VAL CA CT1 0.070000 12.0110 0 393 C1 48 VAL HA HB 0.090000 1.0080 0 394 C1 48 VAL CB CT1 -0.090000 12.0110 0 395 C1 48 VAL HB HA 0.090000 1.0080 0 396 C1 48 VAL CG1 CT3 -0.270000 12.0110 0 397 C1 48 VAL HG11 HA 0.090000 1.0080 0 398 C1 48 VAL HG12 HA 0.090000 1.0080 0 399 C1 48 VAL HG13 HA 0.090000 1.0080 0 400 C1 48 VAL CG2 CT3 -0.270000 12.0110 0 401 C1 48 VAL HG21 HA 0.090000 1.0080 0 402 C1 48 VAL HG22 HA 0.090000 1.0080 0 403 C1 48 VAL HG23 HA 0.090000 1.0080 0 404 C1 48 VAL C C 0.510000 12.0110 0 405 C1 48 VAL O O -0.510000 15.9990 0 406 C1 49 LEU N NH1 -0.470000 14.0070 0 407 C1 49 LEU HN H 0.310000 1.0080 0 408 C1 49 LEU CA CT1 0.070000 12.0110 0 409 C1 49 LEU HA HB 0.090000 1.0080 0 410 C1 49 LEU CB CT2 -0.180000 12.0110 0 411 C1 49 LEU HB1 HA 0.090000 1.0080 0 412 C1 49 LEU HB2 HA 0.090000 1.0080 0 413 C1 49 LEU CG CT1 -0.090000 12.0110 0 414 C1 49 LEU HG HA 0.090000 1.0080 0 415 C1 49 LEU CD1 CT3 -0.270000 12.0110 0 416 C1 49 LEU HD11 HA 0.090000 1.0080 0 417 C1 49 LEU HD12 HA 0.090000 1.0080 0 418 C1 49 LEU HD13 HA 0.090000 1.0080 0 419 C1 49 LEU CD2 CT3 -0.270000 12.0110 0 420 C1 49 LEU HD21 HA 0.090000 1.0080 0 421 C1 49 LEU HD22 HA 0.090000 1.0080 0 422 C1 49 LEU HD23 HA 0.090000 1.0080 0 423 C1 49 LEU C C 0.510000 12.0110 0 424 C1 49 LEU O O -0.510000 15.9990 0 425 C1 50 ALA N NH1 -0.470000 14.0070 0 426 C1 50 ALA HN H 0.310000 1.0080 0 427 C1 50 ALA CA CT1 0.070000 12.0110 0 428 C1 50 ALA HA HB 0.090000 1.0080 0 429 C1 50 ALA CB CT3 -0.270000 12.0110 0 430 C1 50 ALA HB1 HA 0.090000 1.0080 0 431 C1 50 ALA HB2 HA 0.090000 1.0080 0 432 C1 50 ALA HB3 HA 0.090000 1.0080 0 433 C1 50 ALA C C 0.510000 12.0110 0 434 C1 50 ALA O O -0.510000 15.9990 0 435 C1 51 GLU N NH1 -0.470000 14.0070 0 436 C1 51 GLU HN H 0.310000 1.0080 0 437 C1 51 GLU CA CT1 0.070000 12.0110 0 438 C1 51 GLU HA HB 0.090000 1.0080 0 439 C1 51 GLU CB CT2 -0.180000 12.0110 0 440 C1 51 GLU HB1 HA 0.090000 1.0080 0 441 C1 51 GLU HB2 HA 0.090000 1.0080 0 442 C1 51 GLU CG CT2 -0.280000 12.0110 0 443 C1 51 GLU HG1 HA 0.090000 1.0080 0 444 C1 51 GLU HG2 HA 0.090000 1.0080 0 445 C1 51 GLU CD CC 0.620000 12.0110 0 446 C1 51 GLU OE1 OC -0.760000 15.9990 0 447 C1 51 GLU OE2 OC -0.760000 15.9990 0 448 C1 51 GLU C C 0.510000 12.0110 0 449 C1 51 GLU O O -0.510000 15.9990 0 450 C1 52 ARG N NH1 -0.470000 14.0070 0 451 C1 52 ARG HN H 0.310000 1.0080 0 452 C1 52 ARG CA CT1 0.070000 12.0110 0 453 C1 52 ARG HA HB 0.090000 1.0080 0 454 C1 52 ARG CB CT2 -0.180000 12.0110 0 455 C1 52 ARG HB1 HA 0.090000 1.0080 0 456 C1 52 ARG HB2 HA 0.090000 1.0080 0 457 C1 52 ARG CG CT2 -0.180000 12.0110 0 458 C1 52 ARG HG1 HA 0.090000 1.0080 0 459 C1 52 ARG HG2 HA 0.090000 1.0080 0 460 C1 52 ARG CD CT2 0.200000 12.0110 0 461 C1 52 ARG HD1 HA 0.090000 1.0080 0 462 C1 52 ARG HD2 HA 0.090000 1.0080 0 463 C1 52 ARG NE NC2 -0.700000 14.0070 0 464 C1 52 ARG HE HC 0.440000 1.0080 0 465 C1 52 ARG CZ C 0.640000 12.0110 0 466 C1 52 ARG NH1 NC2 -0.800000 14.0070 0 467 C1 52 ARG HH11 HC 0.460000 1.0080 0 468 C1 52 ARG HH12 HC 0.460000 1.0080 0 469 C1 52 ARG NH2 NC2 -0.800000 14.0070 0 470 C1 52 ARG HH21 HC 0.460000 1.0080 0 471 C1 52 ARG HH22 HC 0.460000 1.0080 0 472 C1 52 ARG C C 0.510000 12.0110 0 473 C1 52 ARG O O -0.510000 15.9990 0 474 C1 53 GLY N NH1 -0.470000 14.0070 0 475 C1 53 GLY HN H 0.310000 1.0080 0 476 C1 53 GLY CA CT2 -0.020000 12.0110 0 477 C1 53 GLY HA1 HB 0.090000 1.0080 0 478 C1 53 GLY HA2 HB 0.090000 1.0080 0 479 C1 53 GLY C C 0.510000 12.0110 0 480 C1 53 GLY O O -0.510000 15.9990 0 481 C1 54 ALA N NH1 -0.470000 14.0070 0 482 C1 54 ALA HN H 0.310000 1.0080 0 483 C1 54 ALA CA CT1 0.070000 12.0110 0 484 C1 54 ALA HA HB 0.090000 1.0080 0 485 C1 54 ALA CB CT3 -0.270000 12.0110 0 486 C1 54 ALA HB1 HA 0.090000 1.0080 0 487 C1 54 ALA HB2 HA 0.090000 1.0080 0 488 C1 54 ALA HB3 HA 0.090000 1.0080 0 489 C1 54 ALA C C 0.510000 12.0110 0 490 C1 54 ALA O O -0.510000 15.9990 0 491 C1 55 PRO N N -0.290000 14.0070 0 492 C1 55 PRO CD CP3 0.000000 12.0110 0 493 C1 55 PRO HD1 HA 0.090000 1.0080 0 494 C1 55 PRO HD2 HA 0.090000 1.0080 0 495 C1 55 PRO CA CP1 0.020000 12.0110 0 496 C1 55 PRO HA HB 0.090000 1.0080 0 497 C1 55 PRO CB CP2 -0.180000 12.0110 0 498 C1 55 PRO HB1 HA 0.090000 1.0080 0 499 C1 55 PRO HB2 HA 0.090000 1.0080 0 500 C1 55 PRO CG CP2 -0.180000 12.0110 0 501 C1 55 PRO HG1 HA 0.090000 1.0080 0 502 C1 55 PRO HG2 HA 0.090000 1.0080 0 503 C1 55 PRO C C 0.510000 12.0110 0 504 C1 55 PRO O O -0.510000 15.9990 0 505 C1 56 GLY N NH1 -0.470000 14.0070 0 506 C1 56 GLY HN H 0.310000 1.0080 0 507 C1 56 GLY CA CT2 -0.020000 12.0110 0 508 C1 56 GLY HA1 HB 0.090000 1.0080 0 509 C1 56 GLY HA2 HB 0.090000 1.0080 0 510 C1 56 GLY C C 0.510000 12.0110 0 511 C1 56 GLY O O -0.510000 15.9990 0 512 C1 57 ALA N NH1 -0.470000 14.0070 0 513 C1 57 ALA HN H 0.310000 1.0080 0 514 C1 57 ALA CA CT1 0.070000 12.0110 0 515 C1 57 ALA HA HB 0.090000 1.0080 0 516 C1 57 ALA CB CT3 -0.270000 12.0110 0 517 C1 57 ALA HB1 HA 0.090000 1.0080 0 518 C1 57 ALA HB2 HA 0.090000 1.0080 0 519 C1 57 ALA HB3 HA 0.090000 1.0080 0 520 C1 57 ALA C C 0.510000 12.0110 0 521 C1 57 ALA O O -0.510000 15.9990 0 522 C1 58 GLN N NH1 -0.470000 14.0070 0 523 C1 58 GLN HN H 0.310000 1.0080 0 524 C1 58 GLN CA CT1 0.070000 12.0110 0 525 C1 58 GLN HA HB 0.090000 1.0080 0 526 C1 58 GLN CB CT2 -0.180000 12.0110 0 527 C1 58 GLN HB1 HA 0.090000 1.0080 0 528 C1 58 GLN HB2 HA 0.090000 1.0080 0 529 C1 58 GLN CG CT2 -0.180000 12.0110 0 530 C1 58 GLN HG1 HA 0.090000 1.0080 0 531 C1 58 GLN HG2 HA 0.090000 1.0080 0 532 C1 58 GLN CD CC 0.550000 12.0110 0 533 C1 58 GLN OE1 O -0.550000 15.9990 0 534 C1 58 GLN NE2 NH2 -0.620000 14.0070 0 535 C1 58 GLN HE21 H 0.320000 1.0080 0 536 C1 58 GLN HE22 H 0.300000 1.0080 0 537 C1 58 GLN C C 0.510000 12.0110 0 538 C1 58 GLN O O -0.510000 15.9990 0 539 C1 59 LEU N NH1 -0.470000 14.0070 0 540 C1 59 LEU HN H 0.310000 1.0080 0 541 C1 59 LEU CA CT1 0.070000 12.0110 0 542 C1 59 LEU HA HB 0.090000 1.0080 0 543 C1 59 LEU CB CT2 -0.180000 12.0110 0 544 C1 59 LEU HB1 HA 0.090000 1.0080 0 545 C1 59 LEU HB2 HA 0.090000 1.0080 0 546 C1 59 LEU CG CT1 -0.090000 12.0110 0 547 C1 59 LEU HG HA 0.090000 1.0080 0 548 C1 59 LEU CD1 CT3 -0.270000 12.0110 0 549 C1 59 LEU HD11 HA 0.090000 1.0080 0 550 C1 59 LEU HD12 HA 0.090000 1.0080 0 551 C1 59 LEU HD13 HA 0.090000 1.0080 0 552 C1 59 LEU CD2 CT3 -0.270000 12.0110 0 553 C1 59 LEU HD21 HA 0.090000 1.0080 0 554 C1 59 LEU HD22 HA 0.090000 1.0080 0 555 C1 59 LEU HD23 HA 0.090000 1.0080 0 556 C1 59 LEU C C 0.510000 12.0110 0 557 C1 59 LEU O O -0.510000 15.9990 0 558 C1 60 ILE N NH1 -0.470000 14.0070 0 559 C1 60 ILE HN H 0.310000 1.0080 0 560 C1 60 ILE CA CT1 0.070000 12.0110 0 561 C1 60 ILE HA HB 0.090000 1.0080 0 562 C1 60 ILE CB CT1 -0.090000 12.0110 0 563 C1 60 ILE HB HA 0.090000 1.0080 0 564 C1 60 ILE CG2 CT3 -0.270000 12.0110 0 565 C1 60 ILE HG21 HA 0.090000 1.0080 0 566 C1 60 ILE HG22 HA 0.090000 1.0080 0 567 C1 60 ILE HG23 HA 0.090000 1.0080 0 568 C1 60 ILE CG1 CT2 -0.180000 12.0110 0 569 C1 60 ILE HG11 HA 0.090000 1.0080 0 570 C1 60 ILE HG12 HA 0.090000 1.0080 0 571 C1 60 ILE CD CT3 -0.270000 12.0110 0 572 C1 60 ILE HD1 HA 0.090000 1.0080 0 573 C1 60 ILE HD2 HA 0.090000 1.0080 0 574 C1 60 ILE HD3 HA 0.090000 1.0080 0 575 C1 60 ILE C C 0.510000 12.0110 0 576 C1 60 ILE O O -0.510000 15.9990 0 577 C1 61 THR N NH1 -0.470000 14.0070 0 578 C1 61 THR HN H 0.310000 1.0080 0 579 C1 61 THR CA CT1 0.070000 12.0110 0 580 C1 61 THR HA HB 0.090000 1.0080 0 581 C1 61 THR CB CT1 0.140000 12.0110 0 582 C1 61 THR HB HA 0.090000 1.0080 0 583 C1 61 THR OG1 OH1 -0.660000 15.9990 0 584 C1 61 THR HG1 H 0.430000 1.0080 0 585 C1 61 THR CG2 CT3 -0.270000 12.0110 0 586 C1 61 THR HG21 HA 0.090000 1.0080 0 587 C1 61 THR HG22 HA 0.090000 1.0080 0 588 C1 61 THR HG23 HA 0.090000 1.0080 0 589 C1 61 THR C C 0.510000 12.0110 0 590 C1 61 THR O O -0.510000 15.9990 0 591 C1 62 TYR N NH1 -0.470000 14.0070 0 592 C1 62 TYR HN H 0.310000 1.0080 0 593 C1 62 TYR CA CT1 0.070000 12.0110 0 594 C1 62 TYR HA HB 0.090000 1.0080 0 595 C1 62 TYR CB CT2 -0.180000 12.0110 0 596 C1 62 TYR HB1 HA 0.090000 1.0080 0 597 C1 62 TYR HB2 HA 0.090000 1.0080 0 598 C1 62 TYR CG CA 0.000000 12.0110 0 599 C1 62 TYR CD1 CA -0.115000 12.0110 0 600 C1 62 TYR HD1 HP 0.115000 1.0080 0 601 C1 62 TYR CE1 CA -0.115000 12.0110 0 602 C1 62 TYR HE1 HP 0.115000 1.0080 0 603 C1 62 TYR CZ CA 0.110000 12.0110 0 604 C1 62 TYR OH OH1 -0.540000 15.9990 0 605 C1 62 TYR HH H 0.430000 1.0080 0 606 C1 62 TYR CD2 CA -0.115000 12.0110 0 607 C1 62 TYR HD2 HP 0.115000 1.0080 0 608 C1 62 TYR CE2 CA -0.115000 12.0110 0 609 C1 62 TYR HE2 HP 0.115000 1.0080 0 610 C1 62 TYR C C 0.510000 12.0110 0 611 C1 62 TYR O O -0.510000 15.9990 0 612 C1 63 PRO N N -0.290000 14.0070 0 613 C1 63 PRO CD CP3 0.000000 12.0110 0 614 C1 63 PRO HD1 HA 0.090000 1.0080 0 615 C1 63 PRO HD2 HA 0.090000 1.0080 0 616 C1 63 PRO CA CP1 0.020000 12.0110 0 617 C1 63 PRO HA HB 0.090000 1.0080 0 618 C1 63 PRO CB CP2 -0.180000 12.0110 0 619 C1 63 PRO HB1 HA 0.090000 1.0080 0 620 C1 63 PRO HB2 HA 0.090000 1.0080 0 621 C1 63 PRO CG CP2 -0.180000 12.0110 0 622 C1 63 PRO HG1 HA 0.090000 1.0080 0 623 C1 63 PRO HG2 HA 0.090000 1.0080 0 624 C1 63 PRO C C 0.510000 12.0110 0 625 C1 63 PRO O O -0.510000 15.9990 0 626 C1 64 ARG N NH1 -0.470000 14.0070 0 627 C1 64 ARG HN H 0.310000 1.0080 0 628 C1 64 ARG CA CT1 0.070000 12.0110 0 629 C1 64 ARG HA HB 0.090000 1.0080 0 630 C1 64 ARG CB CT2 -0.180000 12.0110 0 631 C1 64 ARG HB1 HA 0.090000 1.0080 0 632 C1 64 ARG HB2 HA 0.090000 1.0080 0 633 C1 64 ARG CG CT2 -0.180000 12.0110 0 634 C1 64 ARG HG1 HA 0.090000 1.0080 0 635 C1 64 ARG HG2 HA 0.090000 1.0080 0 636 C1 64 ARG CD CT2 0.200000 12.0110 0 637 C1 64 ARG HD1 HA 0.090000 1.0080 0 638 C1 64 ARG HD2 HA 0.090000 1.0080 0 639 C1 64 ARG NE NC2 -0.700000 14.0070 0 640 C1 64 ARG HE HC 0.440000 1.0080 0 641 C1 64 ARG CZ C 0.640000 12.0110 0 642 C1 64 ARG NH1 NC2 -0.800000 14.0070 0 643 C1 64 ARG HH11 HC 0.460000 1.0080 0 644 C1 64 ARG HH12 HC 0.460000 1.0080 0 645 C1 64 ARG NH2 NC2 -0.800000 14.0070 0 646 C1 64 ARG HH21 HC 0.460000 1.0080 0 647 C1 64 ARG HH22 HC 0.460000 1.0080 0 648 C1 64 ARG C C 0.510000 12.0110 0 649 C1 64 ARG O O -0.510000 15.9990 0 650 C1 65 ALA N NH1 -0.470000 14.0070 0 651 C1 65 ALA HN H 0.310000 1.0080 0 652 C1 65 ALA CA CT1 0.070000 12.0110 0 653 C1 65 ALA HA HB 0.090000 1.0080 0 654 C1 65 ALA CB CT3 -0.270000 12.0110 0 655 C1 65 ALA HB1 HA 0.090000 1.0080 0 656 C1 65 ALA HB2 HA 0.090000 1.0080 0 657 C1 65 ALA HB3 HA 0.090000 1.0080 0 658 C1 65 ALA C C 0.510000 12.0110 0 659 C1 65 ALA O O -0.510000 15.9990 0 660 C1 66 LEU N NH1 -0.470000 14.0070 0 661 C1 66 LEU HN H 0.310000 1.0080 0 662 C1 66 LEU CA CT1 0.070000 12.0110 0 663 C1 66 LEU HA HB 0.090000 1.0080 0 664 C1 66 LEU CB CT2 -0.180000 12.0110 0 665 C1 66 LEU HB1 HA 0.090000 1.0080 0 666 C1 66 LEU HB2 HA 0.090000 1.0080 0 667 C1 66 LEU CG CT1 -0.090000 12.0110 0 668 C1 66 LEU HG HA 0.090000 1.0080 0 669 C1 66 LEU CD1 CT3 -0.270000 12.0110 0 670 C1 66 LEU HD11 HA 0.090000 1.0080 0 671 C1 66 LEU HD12 HA 0.090000 1.0080 0 672 C1 66 LEU HD13 HA 0.090000 1.0080 0 673 C1 66 LEU CD2 CT3 -0.270000 12.0110 0 674 C1 66 LEU HD21 HA 0.090000 1.0080 0 675 C1 66 LEU HD22 HA 0.090000 1.0080 0 676 C1 66 LEU HD23 HA 0.090000 1.0080 0 677 C1 66 LEU C C 0.510000 12.0110 0 678 C1 66 LEU O O -0.510000 15.9990 0 679 C1 67 TRP N NH1 -0.470000 14.0070 0 680 C1 67 TRP HN H 0.310000 1.0080 0 681 C1 67 TRP CA CT1 0.070000 12.0110 0 682 C1 67 TRP HA HB 0.090000 1.0080 0 683 C1 67 TRP CB CT2 -0.180000 12.0110 0 684 C1 67 TRP HB1 HA 0.090000 1.0080 0 685 C1 67 TRP HB2 HA 0.090000 1.0080 0 686 C1 67 TRP CG CY -0.030000 12.0110 0 687 C1 67 TRP CD1 CA 0.035000 12.0110 0 688 C1 67 TRP HD1 HP 0.115000 1.0080 0 689 C1 67 TRP NE1 NY -0.610000 14.0070 0 690 C1 67 TRP HE1 H 0.380000 1.0080 0 691 C1 67 TRP CE2 CPT 0.130000 12.0110 0 692 C1 67 TRP CD2 CPT -0.020000 12.0110 0 693 C1 67 TRP CE3 CA -0.115000 12.0110 0 694 C1 67 TRP HE3 HP 0.115000 1.0080 0 695 C1 67 TRP CZ3 CA -0.115000 12.0110 0 696 C1 67 TRP HZ3 HP 0.115000 1.0080 0 697 C1 67 TRP CZ2 CA -0.115000 12.0110 0 698 C1 67 TRP HZ2 HP 0.115000 1.0080 0 699 C1 67 TRP CH2 CA -0.115000 12.0110 0 700 C1 67 TRP HH2 HP 0.115000 1.0080 0 701 C1 67 TRP C C 0.510000 12.0110 0 702 C1 67 TRP O O -0.510000 15.9990 0 703 C1 68 TRP N NH1 -0.470000 14.0070 0 704 C1 68 TRP HN H 0.310000 1.0080 0 705 C1 68 TRP CA CT1 0.070000 12.0110 0 706 C1 68 TRP HA HB 0.090000 1.0080 0 707 C1 68 TRP CB CT2 -0.180000 12.0110 0 708 C1 68 TRP HB1 HA 0.090000 1.0080 0 709 C1 68 TRP HB2 HA 0.090000 1.0080 0 710 C1 68 TRP CG CY -0.030000 12.0110 0 711 C1 68 TRP CD1 CA 0.035000 12.0110 0 712 C1 68 TRP HD1 HP 0.115000 1.0080 0 713 C1 68 TRP NE1 NY -0.610000 14.0070 0 714 C1 68 TRP HE1 H 0.380000 1.0080 0 715 C1 68 TRP CE2 CPT 0.130000 12.0110 0 716 C1 68 TRP CD2 CPT -0.020000 12.0110 0 717 C1 68 TRP CE3 CA -0.115000 12.0110 0 718 C1 68 TRP HE3 HP 0.115000 1.0080 0 719 C1 68 TRP CZ3 CA -0.115000 12.0110 0 720 C1 68 TRP HZ3 HP 0.115000 1.0080 0 721 C1 68 TRP CZ2 CA -0.115000 12.0110 0 722 C1 68 TRP HZ2 HP 0.115000 1.0080 0 723 C1 68 TRP CH2 CA -0.115000 12.0110 0 724 C1 68 TRP HH2 HP 0.115000 1.0080 0 725 C1 68 TRP C C 0.510000 12.0110 0 726 C1 68 TRP O O -0.510000 15.9990 0 727 C1 69 SER N NH1 -0.470000 14.0070 0 728 C1 69 SER HN H 0.310000 1.0080 0 729 C1 69 SER CA CT1 0.070000 12.0110 0 730 C1 69 SER HA HB 0.090000 1.0080 0 731 C1 69 SER CB CT2 0.050000 12.0110 0 732 C1 69 SER HB1 HA 0.090000 1.0080 0 733 C1 69 SER HB2 HA 0.090000 1.0080 0 734 C1 69 SER OG OH1 -0.660000 15.9990 0 735 C1 69 SER HG1 H 0.430000 1.0080 0 736 C1 69 SER C C 0.510000 12.0110 0 737 C1 69 SER O O -0.510000 15.9990 0 738 C1 70 VAL N NH1 -0.470000 14.0070 0 739 C1 70 VAL HN H 0.310000 1.0080 0 740 C1 70 VAL CA CT1 0.070000 12.0110 0 741 C1 70 VAL HA HB 0.090000 1.0080 0 742 C1 70 VAL CB CT1 -0.090000 12.0110 0 743 C1 70 VAL HB HA 0.090000 1.0080 0 744 C1 70 VAL CG1 CT3 -0.270000 12.0110 0 745 C1 70 VAL HG11 HA 0.090000 1.0080 0 746 C1 70 VAL HG12 HA 0.090000 1.0080 0 747 C1 70 VAL HG13 HA 0.090000 1.0080 0 748 C1 70 VAL CG2 CT3 -0.270000 12.0110 0 749 C1 70 VAL HG21 HA 0.090000 1.0080 0 750 C1 70 VAL HG22 HA 0.090000 1.0080 0 751 C1 70 VAL HG23 HA 0.090000 1.0080 0 752 C1 70 VAL C C 0.510000 12.0110 0 753 C1 70 VAL O O -0.510000 15.9990 0 754 C1 71 GLU CG CT2 -0.210000 12.0110 0 755 C1 71 GLU HG1 HA 0.090000 1.0080 0 756 C1 71 GLU HG2 HA 0.090000 1.0080 0 757 C1 71 GLU CD CD 0.750000 12.0110 0 758 C1 71 GLU OE1 OB -0.550000 15.9990 0 759 C1 71 GLU OE2 OH1 -0.610000 15.9990 0 760 C1 71 GLU HE2 H 0.440000 1.0080 0 761 C1 71 GLU N NH1 -0.470000 14.0070 0 762 C1 71 GLU HN H 0.310000 1.0080 0 763 C1 71 GLU CA CT1 0.070000 12.0110 0 764 C1 71 GLU HA HB 0.090000 1.0080 0 765 C1 71 GLU CB CT2 -0.180000 12.0110 0 766 C1 71 GLU HB1 HA 0.090000 1.0080 0 767 C1 71 GLU HB2 HA 0.090000 1.0080 0 768 C1 71 GLU C C 0.510000 12.0110 0 769 C1 71 GLU O O -0.510000 15.9990 0 770 C1 72 THR N NH1 -0.470000 14.0070 0 771 C1 72 THR HN H 0.310000 1.0080 0 772 C1 72 THR CA CT1 0.070000 12.0110 0 773 C1 72 THR HA HB 0.090000 1.0080 0 774 C1 72 THR CB CT1 0.140000 12.0110 0 775 C1 72 THR HB HA 0.090000 1.0080 0 776 C1 72 THR OG1 OH1 -0.660000 15.9990 0 777 C1 72 THR HG1 H 0.430000 1.0080 0 778 C1 72 THR CG2 CT3 -0.270000 12.0110 0 779 C1 72 THR HG21 HA 0.090000 1.0080 0 780 C1 72 THR HG22 HA 0.090000 1.0080 0 781 C1 72 THR HG23 HA 0.090000 1.0080 0 782 C1 72 THR C C 0.510000 12.0110 0 783 C1 72 THR O O -0.510000 15.9990 0 784 C1 73 ALA N NH1 -0.470000 14.0070 0 785 C1 73 ALA HN H 0.310000 1.0080 0 786 C1 73 ALA CA CT1 0.070000 12.0110 0 787 C1 73 ALA HA HB 0.090000 1.0080 0 788 C1 73 ALA CB CT3 -0.270000 12.0110 0 789 C1 73 ALA HB1 HA 0.090000 1.0080 0 790 C1 73 ALA HB2 HA 0.090000 1.0080 0 791 C1 73 ALA HB3 HA 0.090000 1.0080 0 792 C1 73 ALA C C 0.510000 12.0110 0 793 C1 73 ALA O O -0.510000 15.9990 0 794 C1 74 THR N NH1 -0.470000 14.0070 0 795 C1 74 THR HN H 0.310000 1.0080 0 796 C1 74 THR CA CT1 0.070000 12.0110 0 797 C1 74 THR HA HB 0.090000 1.0080 0 798 C1 74 THR CB CT1 0.140000 12.0110 0 799 C1 74 THR HB HA 0.090000 1.0080 0 800 C1 74 THR OG1 OH1 -0.660000 15.9990 0 801 C1 74 THR HG1 H 0.430000 1.0080 0 802 C1 74 THR CG2 CT3 -0.270000 12.0110 0 803 C1 74 THR HG21 HA 0.090000 1.0080 0 804 C1 74 THR HG22 HA 0.090000 1.0080 0 805 C1 74 THR HG23 HA 0.090000 1.0080 0 806 C1 74 THR C C 0.510000 12.0110 0 807 C1 74 THR O O -0.510000 15.9990 0 808 C1 75 THR N NH1 -0.470000 14.0070 0 809 C1 75 THR HN H 0.310000 1.0080 0 810 C1 75 THR CA CT1 0.070000 12.0110 0 811 C1 75 THR HA HB 0.090000 1.0080 0 812 C1 75 THR CB CT1 0.140000 12.0110 0 813 C1 75 THR HB HA 0.090000 1.0080 0 814 C1 75 THR OG1 OH1 -0.660000 15.9990 0 815 C1 75 THR HG1 H 0.430000 1.0080 0 816 C1 75 THR CG2 CT3 -0.270000 12.0110 0 817 C1 75 THR HG21 HA 0.090000 1.0080 0 818 C1 75 THR HG22 HA 0.090000 1.0080 0 819 C1 75 THR HG23 HA 0.090000 1.0080 0 820 C1 75 THR C C 0.510000 12.0110 0 821 C1 75 THR O O -0.510000 15.9990 0 822 C1 76 VAL N NH1 -0.470000 14.0070 0 823 C1 76 VAL HN H 0.310000 1.0080 0 824 C1 76 VAL CA CT1 0.070000 12.0110 0 825 C1 76 VAL HA HB 0.090000 1.0080 0 826 C1 76 VAL CB CT1 -0.090000 12.0110 0 827 C1 76 VAL HB HA 0.090000 1.0080 0 828 C1 76 VAL CG1 CT3 -0.270000 12.0110 0 829 C1 76 VAL HG11 HA 0.090000 1.0080 0 830 C1 76 VAL HG12 HA 0.090000 1.0080 0 831 C1 76 VAL HG13 HA 0.090000 1.0080 0 832 C1 76 VAL CG2 CT3 -0.270000 12.0110 0 833 C1 76 VAL HG21 HA 0.090000 1.0080 0 834 C1 76 VAL HG22 HA 0.090000 1.0080 0 835 C1 76 VAL HG23 HA 0.090000 1.0080 0 836 C1 76 VAL C C 0.510000 12.0110 0 837 C1 76 VAL O O -0.510000 15.9990 0 838 C1 77 GLY N NH1 -0.470000 14.0070 0 839 C1 77 GLY HN H 0.310000 1.0080 0 840 C1 77 GLY CA CT2 -0.020000 12.0110 0 841 C1 77 GLY HA1 HB 0.090000 1.0080 0 842 C1 77 GLY HA2 HB 0.090000 1.0080 0 843 C1 77 GLY C C 0.510000 12.0110 0 844 C1 77 GLY O O -0.510000 15.9990 0 845 C1 78 TYR N NH1 -0.470000 14.0070 0 846 C1 78 TYR HN H 0.310000 1.0080 0 847 C1 78 TYR CA CT1 0.070000 12.0110 0 848 C1 78 TYR HA HB 0.090000 1.0080 0 849 C1 78 TYR CB CT2 -0.180000 12.0110 0 850 C1 78 TYR HB1 HA 0.090000 1.0080 0 851 C1 78 TYR HB2 HA 0.090000 1.0080 0 852 C1 78 TYR CG CA 0.000000 12.0110 0 853 C1 78 TYR CD1 CA -0.115000 12.0110 0 854 C1 78 TYR HD1 HP 0.115000 1.0080 0 855 C1 78 TYR CE1 CA -0.115000 12.0110 0 856 C1 78 TYR HE1 HP 0.115000 1.0080 0 857 C1 78 TYR CZ CA 0.110000 12.0110 0 858 C1 78 TYR OH OH1 -0.540000 15.9990 0 859 C1 78 TYR HH H 0.430000 1.0080 0 860 C1 78 TYR CD2 CA -0.115000 12.0110 0 861 C1 78 TYR HD2 HP 0.115000 1.0080 0 862 C1 78 TYR CE2 CA -0.115000 12.0110 0 863 C1 78 TYR HE2 HP 0.115000 1.0080 0 864 C1 78 TYR C C 0.510000 12.0110 0 865 C1 78 TYR O O -0.510000 15.9990 0 866 C1 79 GLY N NH1 -0.470000 14.0070 0 867 C1 79 GLY HN H 0.310000 1.0080 0 868 C1 79 GLY CA CT2 -0.020000 12.0110 0 869 C1 79 GLY HA1 HB 0.090000 1.0080 0 870 C1 79 GLY HA2 HB 0.090000 1.0080 0 871 C1 79 GLY C C 0.510000 12.0110 0 872 C1 79 GLY O O -0.510000 15.9990 0 873 C1 80 ASP N NH1 -0.470000 14.0070 0 874 C1 80 ASP HN H 0.310000 1.0080 0 875 C1 80 ASP CA CT1 0.070000 12.0110 0 876 C1 80 ASP HA HB 0.090000 1.0080 0 877 C1 80 ASP CB CT2 -0.280000 12.0110 0 878 C1 80 ASP HB1 HA 0.090000 1.0080 0 879 C1 80 ASP HB2 HA 0.090000 1.0080 0 880 C1 80 ASP CG CC 0.620000 12.0110 0 881 C1 80 ASP OD1 OC -0.760000 15.9990 0 882 C1 80 ASP OD2 OC -0.760000 15.9990 0 883 C1 80 ASP C C 0.510000 12.0110 0 884 C1 80 ASP O O -0.510000 15.9990 0 885 C1 81 LEU N NH1 -0.470000 14.0070 0 886 C1 81 LEU HN H 0.310000 1.0080 0 887 C1 81 LEU CA CT1 0.070000 12.0110 0 888 C1 81 LEU HA HB 0.090000 1.0080 0 889 C1 81 LEU CB CT2 -0.180000 12.0110 0 890 C1 81 LEU HB1 HA 0.090000 1.0080 0 891 C1 81 LEU HB2 HA 0.090000 1.0080 0 892 C1 81 LEU CG CT1 -0.090000 12.0110 0 893 C1 81 LEU HG HA 0.090000 1.0080 0 894 C1 81 LEU CD1 CT3 -0.270000 12.0110 0 895 C1 81 LEU HD11 HA 0.090000 1.0080 0 896 C1 81 LEU HD12 HA 0.090000 1.0080 0 897 C1 81 LEU HD13 HA 0.090000 1.0080 0 898 C1 81 LEU CD2 CT3 -0.270000 12.0110 0 899 C1 81 LEU HD21 HA 0.090000 1.0080 0 900 C1 81 LEU HD22 HA 0.090000 1.0080 0 901 C1 81 LEU HD23 HA 0.090000 1.0080 0 902 C1 81 LEU C C 0.510000 12.0110 0 903 C1 81 LEU O O -0.510000 15.9990 0 904 C1 82 TYR N NH1 -0.470000 14.0070 0 905 C1 82 TYR HN H 0.310000 1.0080 0 906 C1 82 TYR CA CT1 0.070000 12.0110 0 907 C1 82 TYR HA HB 0.090000 1.0080 0 908 C1 82 TYR CB CT2 -0.180000 12.0110 0 909 C1 82 TYR HB1 HA 0.090000 1.0080 0 910 C1 82 TYR HB2 HA 0.090000 1.0080 0 911 C1 82 TYR CG CA 0.000000 12.0110 0 912 C1 82 TYR CD1 CA -0.115000 12.0110 0 913 C1 82 TYR HD1 HP 0.115000 1.0080 0 914 C1 82 TYR CE1 CA -0.115000 12.0110 0 915 C1 82 TYR HE1 HP 0.115000 1.0080 0 916 C1 82 TYR CZ CA 0.110000 12.0110 0 917 C1 82 TYR OH OH1 -0.540000 15.9990 0 918 C1 82 TYR HH H 0.430000 1.0080 0 919 C1 82 TYR CD2 CA -0.115000 12.0110 0 920 C1 82 TYR HD2 HP 0.115000 1.0080 0 921 C1 82 TYR CE2 CA -0.115000 12.0110 0 922 C1 82 TYR HE2 HP 0.115000 1.0080 0 923 C1 82 TYR C C 0.510000 12.0110 0 924 C1 82 TYR O O -0.510000 15.9990 0 925 C1 83 PRO N N -0.290000 14.0070 0 926 C1 83 PRO CD CP3 0.000000 12.0110 0 927 C1 83 PRO HD1 HA 0.090000 1.0080 0 928 C1 83 PRO HD2 HA 0.090000 1.0080 0 929 C1 83 PRO CA CP1 0.020000 12.0110 0 930 C1 83 PRO HA HB 0.090000 1.0080 0 931 C1 83 PRO CB CP2 -0.180000 12.0110 0 932 C1 83 PRO HB1 HA 0.090000 1.0080 0 933 C1 83 PRO HB2 HA 0.090000 1.0080 0 934 C1 83 PRO CG CP2 -0.180000 12.0110 0 935 C1 83 PRO HG1 HA 0.090000 1.0080 0 936 C1 83 PRO HG2 HA 0.090000 1.0080 0 937 C1 83 PRO C C 0.510000 12.0110 0 938 C1 83 PRO O O -0.510000 15.9990 0 939 C1 84 VAL N NH1 -0.470000 14.0070 0 940 C1 84 VAL HN H 0.310000 1.0080 0 941 C1 84 VAL CA CT1 0.070000 12.0110 0 942 C1 84 VAL HA HB 0.090000 1.0080 0 943 C1 84 VAL CB CT1 -0.090000 12.0110 0 944 C1 84 VAL HB HA 0.090000 1.0080 0 945 C1 84 VAL CG1 CT3 -0.270000 12.0110 0 946 C1 84 VAL HG11 HA 0.090000 1.0080 0 947 C1 84 VAL HG12 HA 0.090000 1.0080 0 948 C1 84 VAL HG13 HA 0.090000 1.0080 0 949 C1 84 VAL CG2 CT3 -0.270000 12.0110 0 950 C1 84 VAL HG21 HA 0.090000 1.0080 0 951 C1 84 VAL HG22 HA 0.090000 1.0080 0 952 C1 84 VAL HG23 HA 0.090000 1.0080 0 953 C1 84 VAL C C 0.510000 12.0110 0 954 C1 84 VAL O O -0.510000 15.9990 0 955 C1 85 THR N NH1 -0.470000 14.0070 0 956 C1 85 THR HN H 0.310000 1.0080 0 957 C1 85 THR CA CT1 0.070000 12.0110 0 958 C1 85 THR HA HB 0.090000 1.0080 0 959 C1 85 THR CB CT1 0.140000 12.0110 0 960 C1 85 THR HB HA 0.090000 1.0080 0 961 C1 85 THR OG1 OH1 -0.660000 15.9990 0 962 C1 85 THR HG1 H 0.430000 1.0080 0 963 C1 85 THR CG2 CT3 -0.270000 12.0110 0 964 C1 85 THR HG21 HA 0.090000 1.0080 0 965 C1 85 THR HG22 HA 0.090000 1.0080 0 966 C1 85 THR HG23 HA 0.090000 1.0080 0 967 C1 85 THR C C 0.510000 12.0110 0 968 C1 85 THR O O -0.510000 15.9990 0 969 C1 86 LEU N NH1 -0.470000 14.0070 0 970 C1 86 LEU HN H 0.310000 1.0080 0 971 C1 86 LEU CA CT1 0.070000 12.0110 0 972 C1 86 LEU HA HB 0.090000 1.0080 0 973 C1 86 LEU CB CT2 -0.180000 12.0110 0 974 C1 86 LEU HB1 HA 0.090000 1.0080 0 975 C1 86 LEU HB2 HA 0.090000 1.0080 0 976 C1 86 LEU CG CT1 -0.090000 12.0110 0 977 C1 86 LEU HG HA 0.090000 1.0080 0 978 C1 86 LEU CD1 CT3 -0.270000 12.0110 0 979 C1 86 LEU HD11 HA 0.090000 1.0080 0 980 C1 86 LEU HD12 HA 0.090000 1.0080 0 981 C1 86 LEU HD13 HA 0.090000 1.0080 0 982 C1 86 LEU CD2 CT3 -0.270000 12.0110 0 983 C1 86 LEU HD21 HA 0.090000 1.0080 0 984 C1 86 LEU HD22 HA 0.090000 1.0080 0 985 C1 86 LEU HD23 HA 0.090000 1.0080 0 986 C1 86 LEU C C 0.510000 12.0110 0 987 C1 86 LEU O O -0.510000 15.9990 0 988 C1 87 TRP N NH1 -0.470000 14.0070 0 989 C1 87 TRP HN H 0.310000 1.0080 0 990 C1 87 TRP CA CT1 0.070000 12.0110 0 991 C1 87 TRP HA HB 0.090000 1.0080 0 992 C1 87 TRP CB CT2 -0.180000 12.0110 0 993 C1 87 TRP HB1 HA 0.090000 1.0080 0 994 C1 87 TRP HB2 HA 0.090000 1.0080 0 995 C1 87 TRP CG CY -0.030000 12.0110 0 996 C1 87 TRP CD1 CA 0.035000 12.0110 0 997 C1 87 TRP HD1 HP 0.115000 1.0080 0 998 C1 87 TRP NE1 NY -0.610000 14.0070 0 999 C1 87 TRP HE1 H 0.380000 1.0080 0 1000 C1 87 TRP CE2 CPT 0.130000 12.0110 0 1001 C1 87 TRP CD2 CPT -0.020000 12.0110 0 1002 C1 87 TRP CE3 CA -0.115000 12.0110 0 1003 C1 87 TRP HE3 HP 0.115000 1.0080 0 1004 C1 87 TRP CZ3 CA -0.115000 12.0110 0 1005 C1 87 TRP HZ3 HP 0.115000 1.0080 0 1006 C1 87 TRP CZ2 CA -0.115000 12.0110 0 1007 C1 87 TRP HZ2 HP 0.115000 1.0080 0 1008 C1 87 TRP CH2 CA -0.115000 12.0110 0 1009 C1 87 TRP HH2 HP 0.115000 1.0080 0 1010 C1 87 TRP C C 0.510000 12.0110 0 1011 C1 87 TRP O O -0.510000 15.9990 0 1012 C1 88 GLY N NH1 -0.470000 14.0070 0 1013 C1 88 GLY HN H 0.310000 1.0080 0 1014 C1 88 GLY CA CT2 -0.020000 12.0110 0 1015 C1 88 GLY HA1 HB 0.090000 1.0080 0 1016 C1 88 GLY HA2 HB 0.090000 1.0080 0 1017 C1 88 GLY C C 0.510000 12.0110 0 1018 C1 88 GLY O O -0.510000 15.9990 0 1019 C1 89 ARG N NH1 -0.470000 14.0070 0 1020 C1 89 ARG HN H 0.310000 1.0080 0 1021 C1 89 ARG CA CT1 0.070000 12.0110 0 1022 C1 89 ARG HA HB 0.090000 1.0080 0 1023 C1 89 ARG CB CT2 -0.180000 12.0110 0 1024 C1 89 ARG HB1 HA 0.090000 1.0080 0 1025 C1 89 ARG HB2 HA 0.090000 1.0080 0 1026 C1 89 ARG CG CT2 -0.180000 12.0110 0 1027 C1 89 ARG HG1 HA 0.090000 1.0080 0 1028 C1 89 ARG HG2 HA 0.090000 1.0080 0 1029 C1 89 ARG CD CT2 0.200000 12.0110 0 1030 C1 89 ARG HD1 HA 0.090000 1.0080 0 1031 C1 89 ARG HD2 HA 0.090000 1.0080 0 1032 C1 89 ARG NE NC2 -0.700000 14.0070 0 1033 C1 89 ARG HE HC 0.440000 1.0080 0 1034 C1 89 ARG CZ C 0.640000 12.0110 0 1035 C1 89 ARG NH1 NC2 -0.800000 14.0070 0 1036 C1 89 ARG HH11 HC 0.460000 1.0080 0 1037 C1 89 ARG HH12 HC 0.460000 1.0080 0 1038 C1 89 ARG NH2 NC2 -0.800000 14.0070 0 1039 C1 89 ARG HH21 HC 0.460000 1.0080 0 1040 C1 89 ARG HH22 HC 0.460000 1.0080 0 1041 C1 89 ARG C C 0.510000 12.0110 0 1042 C1 89 ARG O O -0.510000 15.9990 0 1043 C1 90 CYS N NH1 -0.470000 14.0070 0 1044 C1 90 CYS HN H 0.310000 1.0080 0 1045 C1 90 CYS CA CT1 0.070000 12.0110 0 1046 C1 90 CYS HA HB 0.090000 1.0080 0 1047 C1 90 CYS CB CT2 -0.110000 12.0110 0 1048 C1 90 CYS HB1 HA 0.090000 1.0080 0 1049 C1 90 CYS HB2 HA 0.090000 1.0080 0 1050 C1 90 CYS SG S -0.230000 32.0600 0 1051 C1 90 CYS HG1 HS 0.160000 1.0080 0 1052 C1 90 CYS C C 0.510000 12.0110 0 1053 C1 90 CYS O O -0.510000 15.9990 0 1054 C1 91 VAL N NH1 -0.470000 14.0070 0 1055 C1 91 VAL HN H 0.310000 1.0080 0 1056 C1 91 VAL CA CT1 0.070000 12.0110 0 1057 C1 91 VAL HA HB 0.090000 1.0080 0 1058 C1 91 VAL CB CT1 -0.090000 12.0110 0 1059 C1 91 VAL HB HA 0.090000 1.0080 0 1060 C1 91 VAL CG1 CT3 -0.270000 12.0110 0 1061 C1 91 VAL HG11 HA 0.090000 1.0080 0 1062 C1 91 VAL HG12 HA 0.090000 1.0080 0 1063 C1 91 VAL HG13 HA 0.090000 1.0080 0 1064 C1 91 VAL CG2 CT3 -0.270000 12.0110 0 1065 C1 91 VAL HG21 HA 0.090000 1.0080 0 1066 C1 91 VAL HG22 HA 0.090000 1.0080 0 1067 C1 91 VAL HG23 HA 0.090000 1.0080 0 1068 C1 91 VAL C C 0.510000 12.0110 0 1069 C1 91 VAL O O -0.510000 15.9990 0 1070 C1 92 ALA N NH1 -0.470000 14.0070 0 1071 C1 92 ALA HN H 0.310000 1.0080 0 1072 C1 92 ALA CA CT1 0.070000 12.0110 0 1073 C1 92 ALA HA HB 0.090000 1.0080 0 1074 C1 92 ALA CB CT3 -0.270000 12.0110 0 1075 C1 92 ALA HB1 HA 0.090000 1.0080 0 1076 C1 92 ALA HB2 HA 0.090000 1.0080 0 1077 C1 92 ALA HB3 HA 0.090000 1.0080 0 1078 C1 92 ALA C C 0.510000 12.0110 0 1079 C1 92 ALA O O -0.510000 15.9990 0 1080 C1 93 VAL N NH1 -0.470000 14.0070 0 1081 C1 93 VAL HN H 0.310000 1.0080 0 1082 C1 93 VAL CA CT1 0.070000 12.0110 0 1083 C1 93 VAL HA HB 0.090000 1.0080 0 1084 C1 93 VAL CB CT1 -0.090000 12.0110 0 1085 C1 93 VAL HB HA 0.090000 1.0080 0 1086 C1 93 VAL CG1 CT3 -0.270000 12.0110 0 1087 C1 93 VAL HG11 HA 0.090000 1.0080 0 1088 C1 93 VAL HG12 HA 0.090000 1.0080 0 1089 C1 93 VAL HG13 HA 0.090000 1.0080 0 1090 C1 93 VAL CG2 CT3 -0.270000 12.0110 0 1091 C1 93 VAL HG21 HA 0.090000 1.0080 0 1092 C1 93 VAL HG22 HA 0.090000 1.0080 0 1093 C1 93 VAL HG23 HA 0.090000 1.0080 0 1094 C1 93 VAL C C 0.510000 12.0110 0 1095 C1 93 VAL O O -0.510000 15.9990 0 1096 C1 94 VAL N NH1 -0.470000 14.0070 0 1097 C1 94 VAL HN H 0.310000 1.0080 0 1098 C1 94 VAL CA CT1 0.070000 12.0110 0 1099 C1 94 VAL HA HB 0.090000 1.0080 0 1100 C1 94 VAL CB CT1 -0.090000 12.0110 0 1101 C1 94 VAL HB HA 0.090000 1.0080 0 1102 C1 94 VAL CG1 CT3 -0.270000 12.0110 0 1103 C1 94 VAL HG11 HA 0.090000 1.0080 0 1104 C1 94 VAL HG12 HA 0.090000 1.0080 0 1105 C1 94 VAL HG13 HA 0.090000 1.0080 0 1106 C1 94 VAL CG2 CT3 -0.270000 12.0110 0 1107 C1 94 VAL HG21 HA 0.090000 1.0080 0 1108 C1 94 VAL HG22 HA 0.090000 1.0080 0 1109 C1 94 VAL HG23 HA 0.090000 1.0080 0 1110 C1 94 VAL C C 0.510000 12.0110 0 1111 C1 94 VAL O O -0.510000 15.9990 0 1112 C1 95 VAL N NH1 -0.470000 14.0070 0 1113 C1 95 VAL HN H 0.310000 1.0080 0 1114 C1 95 VAL CA CT1 0.070000 12.0110 0 1115 C1 95 VAL HA HB 0.090000 1.0080 0 1116 C1 95 VAL CB CT1 -0.090000 12.0110 0 1117 C1 95 VAL HB HA 0.090000 1.0080 0 1118 C1 95 VAL CG1 CT3 -0.270000 12.0110 0 1119 C1 95 VAL HG11 HA 0.090000 1.0080 0 1120 C1 95 VAL HG12 HA 0.090000 1.0080 0 1121 C1 95 VAL HG13 HA 0.090000 1.0080 0 1122 C1 95 VAL CG2 CT3 -0.270000 12.0110 0 1123 C1 95 VAL HG21 HA 0.090000 1.0080 0 1124 C1 95 VAL HG22 HA 0.090000 1.0080 0 1125 C1 95 VAL HG23 HA 0.090000 1.0080 0 1126 C1 95 VAL C C 0.510000 12.0110 0 1127 C1 95 VAL O O -0.510000 15.9990 0 1128 C1 96 MET N NH1 -0.470000 14.0070 0 1129 C1 96 MET HN H 0.310000 1.0080 0 1130 C1 96 MET CA CT1 0.070000 12.0110 0 1131 C1 96 MET HA HB 0.090000 1.0080 0 1132 C1 96 MET CB CT2 -0.180000 12.0110 0 1133 C1 96 MET HB1 HA 0.090000 1.0080 0 1134 C1 96 MET HB2 HA 0.090000 1.0080 0 1135 C1 96 MET CG CT2 -0.140000 12.0110 0 1136 C1 96 MET HG1 HA 0.090000 1.0080 0 1137 C1 96 MET HG2 HA 0.090000 1.0080 0 1138 C1 96 MET SD S -0.090000 32.0600 0 1139 C1 96 MET CE CT3 -0.220000 12.0110 0 1140 C1 96 MET HE1 HA 0.090000 1.0080 0 1141 C1 96 MET HE2 HA 0.090000 1.0080 0 1142 C1 96 MET HE3 HA 0.090000 1.0080 0 1143 C1 96 MET C C 0.510000 12.0110 0 1144 C1 96 MET O O -0.510000 15.9990 0 1145 C1 97 VAL N NH1 -0.470000 14.0070 0 1146 C1 97 VAL HN H 0.310000 1.0080 0 1147 C1 97 VAL CA CT1 0.070000 12.0110 0 1148 C1 97 VAL HA HB 0.090000 1.0080 0 1149 C1 97 VAL CB CT1 -0.090000 12.0110 0 1150 C1 97 VAL HB HA 0.090000 1.0080 0 1151 C1 97 VAL CG1 CT3 -0.270000 12.0110 0 1152 C1 97 VAL HG11 HA 0.090000 1.0080 0 1153 C1 97 VAL HG12 HA 0.090000 1.0080 0 1154 C1 97 VAL HG13 HA 0.090000 1.0080 0 1155 C1 97 VAL CG2 CT3 -0.270000 12.0110 0 1156 C1 97 VAL HG21 HA 0.090000 1.0080 0 1157 C1 97 VAL HG22 HA 0.090000 1.0080 0 1158 C1 97 VAL HG23 HA 0.090000 1.0080 0 1159 C1 97 VAL C C 0.510000 12.0110 0 1160 C1 97 VAL O O -0.510000 15.9990 0 1161 C1 98 ALA N NH1 -0.470000 14.0070 0 1162 C1 98 ALA HN H 0.310000 1.0080 0 1163 C1 98 ALA CA CT1 0.070000 12.0110 0 1164 C1 98 ALA HA HB 0.090000 1.0080 0 1165 C1 98 ALA CB CT3 -0.270000 12.0110 0 1166 C1 98 ALA HB1 HA 0.090000 1.0080 0 1167 C1 98 ALA HB2 HA 0.090000 1.0080 0 1168 C1 98 ALA HB3 HA 0.090000 1.0080 0 1169 C1 98 ALA C C 0.510000 12.0110 0 1170 C1 98 ALA O O -0.510000 15.9990 0 1171 C1 99 GLY N NH1 -0.470000 14.0070 0 1172 C1 99 GLY HN H 0.310000 1.0080 0 1173 C1 99 GLY CA CT2 -0.020000 12.0110 0 1174 C1 99 GLY HA1 HB 0.090000 1.0080 0 1175 C1 99 GLY HA2 HB 0.090000 1.0080 0 1176 C1 99 GLY C C 0.510000 12.0110 0 1177 C1 99 GLY O O -0.510000 15.9990 0 1178 C1 100 ILE N NH1 -0.470000 14.0070 0 1179 C1 100 ILE HN H 0.310000 1.0080 0 1180 C1 100 ILE CA CT1 0.070000 12.0110 0 1181 C1 100 ILE HA HB 0.090000 1.0080 0 1182 C1 100 ILE CB CT1 -0.090000 12.0110 0 1183 C1 100 ILE HB HA 0.090000 1.0080 0 1184 C1 100 ILE CG2 CT3 -0.270000 12.0110 0 1185 C1 100 ILE HG21 HA 0.090000 1.0080 0 1186 C1 100 ILE HG22 HA 0.090000 1.0080 0 1187 C1 100 ILE HG23 HA 0.090000 1.0080 0 1188 C1 100 ILE CG1 CT2 -0.180000 12.0110 0 1189 C1 100 ILE HG11 HA 0.090000 1.0080 0 1190 C1 100 ILE HG12 HA 0.090000 1.0080 0 1191 C1 100 ILE CD CT3 -0.270000 12.0110 0 1192 C1 100 ILE HD1 HA 0.090000 1.0080 0 1193 C1 100 ILE HD2 HA 0.090000 1.0080 0 1194 C1 100 ILE HD3 HA 0.090000 1.0080 0 1195 C1 100 ILE C C 0.510000 12.0110 0 1196 C1 100 ILE O O -0.510000 15.9990 0 1197 C1 101 THR N NH1 -0.470000 14.0070 0 1198 C1 101 THR HN H 0.310000 1.0080 0 1199 C1 101 THR CA CT1 0.070000 12.0110 0 1200 C1 101 THR HA HB 0.090000 1.0080 0 1201 C1 101 THR CB CT1 0.140000 12.0110 0 1202 C1 101 THR HB HA 0.090000 1.0080 0 1203 C1 101 THR OG1 OH1 -0.660000 15.9990 0 1204 C1 101 THR HG1 H 0.430000 1.0080 0 1205 C1 101 THR CG2 CT3 -0.270000 12.0110 0 1206 C1 101 THR HG21 HA 0.090000 1.0080 0 1207 C1 101 THR HG22 HA 0.090000 1.0080 0 1208 C1 101 THR HG23 HA 0.090000 1.0080 0 1209 C1 101 THR C C 0.510000 12.0110 0 1210 C1 101 THR O O -0.510000 15.9990 0 1211 C1 102 SER N NH1 -0.470000 14.0070 0 1212 C1 102 SER HN H 0.310000 1.0080 0 1213 C1 102 SER CA CT1 0.070000 12.0110 0 1214 C1 102 SER HA HB 0.090000 1.0080 0 1215 C1 102 SER CB CT2 0.050000 12.0110 0 1216 C1 102 SER HB1 HA 0.090000 1.0080 0 1217 C1 102 SER HB2 HA 0.090000 1.0080 0 1218 C1 102 SER OG OH1 -0.660000 15.9990 0 1219 C1 102 SER HG1 H 0.430000 1.0080 0 1220 C1 102 SER C C 0.510000 12.0110 0 1221 C1 102 SER O O -0.510000 15.9990 0 1222 C1 103 PHE N NH1 -0.470000 14.0070 0 1223 C1 103 PHE HN H 0.310000 1.0080 0 1224 C1 103 PHE CA CT1 0.070000 12.0110 0 1225 C1 103 PHE HA HB 0.090000 1.0080 0 1226 C1 103 PHE CB CT2 -0.180000 12.0110 0 1227 C1 103 PHE HB1 HA 0.090000 1.0080 0 1228 C1 103 PHE HB2 HA 0.090000 1.0080 0 1229 C1 103 PHE CG CA 0.000000 12.0110 0 1230 C1 103 PHE CD1 CA -0.115000 12.0110 0 1231 C1 103 PHE HD1 HP 0.115000 1.0080 0 1232 C1 103 PHE CE1 CA -0.115000 12.0110 0 1233 C1 103 PHE HE1 HP 0.115000 1.0080 0 1234 C1 103 PHE CZ CA -0.115000 12.0110 0 1235 C1 103 PHE HZ HP 0.115000 1.0080 0 1236 C1 103 PHE CD2 CA -0.115000 12.0110 0 1237 C1 103 PHE HD2 HP 0.115000 1.0080 0 1238 C1 103 PHE CE2 CA -0.115000 12.0110 0 1239 C1 103 PHE HE2 HP 0.115000 1.0080 0 1240 C1 103 PHE C C 0.510000 12.0110 0 1241 C1 103 PHE O O -0.510000 15.9990 0 1242 C1 104 GLY N NH1 -0.470000 14.0070 0 1243 C1 104 GLY HN H 0.310000 1.0080 0 1244 C1 104 GLY CA CT2 -0.020000 12.0110 0 1245 C1 104 GLY HA1 HB 0.090000 1.0080 0 1246 C1 104 GLY HA2 HB 0.090000 1.0080 0 1247 C1 104 GLY C C 0.510000 12.0110 0 1248 C1 104 GLY O O -0.510000 15.9990 0 1249 C1 105 LEU N NH1 -0.470000 14.0070 0 1250 C1 105 LEU HN H 0.310000 1.0080 0 1251 C1 105 LEU CA CT1 0.070000 12.0110 0 1252 C1 105 LEU HA HB 0.090000 1.0080 0 1253 C1 105 LEU CB CT2 -0.180000 12.0110 0 1254 C1 105 LEU HB1 HA 0.090000 1.0080 0 1255 C1 105 LEU HB2 HA 0.090000 1.0080 0 1256 C1 105 LEU CG CT1 -0.090000 12.0110 0 1257 C1 105 LEU HG HA 0.090000 1.0080 0 1258 C1 105 LEU CD1 CT3 -0.270000 12.0110 0 1259 C1 105 LEU HD11 HA 0.090000 1.0080 0 1260 C1 105 LEU HD12 HA 0.090000 1.0080 0 1261 C1 105 LEU HD13 HA 0.090000 1.0080 0 1262 C1 105 LEU CD2 CT3 -0.270000 12.0110 0 1263 C1 105 LEU HD21 HA 0.090000 1.0080 0 1264 C1 105 LEU HD22 HA 0.090000 1.0080 0 1265 C1 105 LEU HD23 HA 0.090000 1.0080 0 1266 C1 105 LEU C C 0.510000 12.0110 0 1267 C1 105 LEU O O -0.510000 15.9990 0 1268 C1 106 VAL N NH1 -0.470000 14.0070 0 1269 C1 106 VAL HN H 0.310000 1.0080 0 1270 C1 106 VAL CA CT1 0.070000 12.0110 0 1271 C1 106 VAL HA HB 0.090000 1.0080 0 1272 C1 106 VAL CB CT1 -0.090000 12.0110 0 1273 C1 106 VAL HB HA 0.090000 1.0080 0 1274 C1 106 VAL CG1 CT3 -0.270000 12.0110 0 1275 C1 106 VAL HG11 HA 0.090000 1.0080 0 1276 C1 106 VAL HG12 HA 0.090000 1.0080 0 1277 C1 106 VAL HG13 HA 0.090000 1.0080 0 1278 C1 106 VAL CG2 CT3 -0.270000 12.0110 0 1279 C1 106 VAL HG21 HA 0.090000 1.0080 0 1280 C1 106 VAL HG22 HA 0.090000 1.0080 0 1281 C1 106 VAL HG23 HA 0.090000 1.0080 0 1282 C1 106 VAL C C 0.510000 12.0110 0 1283 C1 106 VAL O O -0.510000 15.9990 0 1284 C1 107 THR N NH1 -0.470000 14.0070 0 1285 C1 107 THR HN H 0.310000 1.0080 0 1286 C1 107 THR CA CT1 0.070000 12.0110 0 1287 C1 107 THR HA HB 0.090000 1.0080 0 1288 C1 107 THR CB CT1 0.140000 12.0110 0 1289 C1 107 THR HB HA 0.090000 1.0080 0 1290 C1 107 THR OG1 OH1 -0.660000 15.9990 0 1291 C1 107 THR HG1 H 0.430000 1.0080 0 1292 C1 107 THR CG2 CT3 -0.270000 12.0110 0 1293 C1 107 THR HG21 HA 0.090000 1.0080 0 1294 C1 107 THR HG22 HA 0.090000 1.0080 0 1295 C1 107 THR HG23 HA 0.090000 1.0080 0 1296 C1 107 THR C C 0.510000 12.0110 0 1297 C1 107 THR O O -0.510000 15.9990 0 1298 C1 108 ALA N NH1 -0.470000 14.0070 0 1299 C1 108 ALA HN H 0.310000 1.0080 0 1300 C1 108 ALA CA CT1 0.070000 12.0110 0 1301 C1 108 ALA HA HB 0.090000 1.0080 0 1302 C1 108 ALA CB CT3 -0.270000 12.0110 0 1303 C1 108 ALA HB1 HA 0.090000 1.0080 0 1304 C1 108 ALA HB2 HA 0.090000 1.0080 0 1305 C1 108 ALA HB3 HA 0.090000 1.0080 0 1306 C1 108 ALA C C 0.510000 12.0110 0 1307 C1 108 ALA O O -0.510000 15.9990 0 1308 C1 109 ALA N NH1 -0.470000 14.0070 0 1309 C1 109 ALA HN H 0.310000 1.0080 0 1310 C1 109 ALA CA CT1 0.070000 12.0110 0 1311 C1 109 ALA HA HB 0.090000 1.0080 0 1312 C1 109 ALA CB CT3 -0.270000 12.0110 0 1313 C1 109 ALA HB1 HA 0.090000 1.0080 0 1314 C1 109 ALA HB2 HA 0.090000 1.0080 0 1315 C1 109 ALA HB3 HA 0.090000 1.0080 0 1316 C1 109 ALA C C 0.510000 12.0110 0 1317 C1 109 ALA O O -0.510000 15.9990 0 1318 C1 110 LEU N NH1 -0.470000 14.0070 0 1319 C1 110 LEU HN H 0.310000 1.0080 0 1320 C1 110 LEU CA CT1 0.070000 12.0110 0 1321 C1 110 LEU HA HB 0.090000 1.0080 0 1322 C1 110 LEU CB CT2 -0.180000 12.0110 0 1323 C1 110 LEU HB1 HA 0.090000 1.0080 0 1324 C1 110 LEU HB2 HA 0.090000 1.0080 0 1325 C1 110 LEU CG CT1 -0.090000 12.0110 0 1326 C1 110 LEU HG HA 0.090000 1.0080 0 1327 C1 110 LEU CD1 CT3 -0.270000 12.0110 0 1328 C1 110 LEU HD11 HA 0.090000 1.0080 0 1329 C1 110 LEU HD12 HA 0.090000 1.0080 0 1330 C1 110 LEU HD13 HA 0.090000 1.0080 0 1331 C1 110 LEU CD2 CT3 -0.270000 12.0110 0 1332 C1 110 LEU HD21 HA 0.090000 1.0080 0 1333 C1 110 LEU HD22 HA 0.090000 1.0080 0 1334 C1 110 LEU HD23 HA 0.090000 1.0080 0 1335 C1 110 LEU C C 0.510000 12.0110 0 1336 C1 110 LEU O O -0.510000 15.9990 0 1337 C1 111 ALA N NH1 -0.470000 14.0070 0 1338 C1 111 ALA HN H 0.310000 1.0080 0 1339 C1 111 ALA CA CT1 0.070000 12.0110 0 1340 C1 111 ALA HA HB 0.090000 1.0080 0 1341 C1 111 ALA CB CT3 -0.270000 12.0110 0 1342 C1 111 ALA HB1 HA 0.090000 1.0080 0 1343 C1 111 ALA HB2 HA 0.090000 1.0080 0 1344 C1 111 ALA HB3 HA 0.090000 1.0080 0 1345 C1 111 ALA C C 0.510000 12.0110 0 1346 C1 111 ALA O O -0.510000 15.9990 0 1347 C1 112 THR N NH1 -0.470000 14.0070 0 1348 C1 112 THR HN H 0.310000 1.0080 0 1349 C1 112 THR CA CT1 0.070000 12.0110 0 1350 C1 112 THR HA HB 0.090000 1.0080 0 1351 C1 112 THR CB CT1 0.140000 12.0110 0 1352 C1 112 THR HB HA 0.090000 1.0080 0 1353 C1 112 THR OG1 OH1 -0.660000 15.9990 0 1354 C1 112 THR HG1 H 0.430000 1.0080 0 1355 C1 112 THR CG2 CT3 -0.270000 12.0110 0 1356 C1 112 THR HG21 HA 0.090000 1.0080 0 1357 C1 112 THR HG22 HA 0.090000 1.0080 0 1358 C1 112 THR HG23 HA 0.090000 1.0080 0 1359 C1 112 THR C C 0.510000 12.0110 0 1360 C1 112 THR O O -0.510000 15.9990 0 1361 C1 113 TRP N NH1 -0.470000 14.0070 0 1362 C1 113 TRP HN H 0.310000 1.0080 0 1363 C1 113 TRP CA CT1 0.070000 12.0110 0 1364 C1 113 TRP HA HB 0.090000 1.0080 0 1365 C1 113 TRP CB CT2 -0.180000 12.0110 0 1366 C1 113 TRP HB1 HA 0.090000 1.0080 0 1367 C1 113 TRP HB2 HA 0.090000 1.0080 0 1368 C1 113 TRP CG CY -0.030000 12.0110 0 1369 C1 113 TRP CD1 CA 0.035000 12.0110 0 1370 C1 113 TRP HD1 HP 0.115000 1.0080 0 1371 C1 113 TRP NE1 NY -0.610000 14.0070 0 1372 C1 113 TRP HE1 H 0.380000 1.0080 0 1373 C1 113 TRP CE2 CPT 0.130000 12.0110 0 1374 C1 113 TRP CD2 CPT -0.020000 12.0110 0 1375 C1 113 TRP CE3 CA -0.115000 12.0110 0 1376 C1 113 TRP HE3 HP 0.115000 1.0080 0 1377 C1 113 TRP CZ3 CA -0.115000 12.0110 0 1378 C1 113 TRP HZ3 HP 0.115000 1.0080 0 1379 C1 113 TRP CZ2 CA -0.115000 12.0110 0 1380 C1 113 TRP HZ2 HP 0.115000 1.0080 0 1381 C1 113 TRP CH2 CA -0.115000 12.0110 0 1382 C1 113 TRP HH2 HP 0.115000 1.0080 0 1383 C1 113 TRP C C 0.510000 12.0110 0 1384 C1 113 TRP O O -0.510000 15.9990 0 1385 C1 114 PHE N NH1 -0.470000 14.0070 0 1386 C1 114 PHE HN H 0.310000 1.0080 0 1387 C1 114 PHE CA CT1 0.070000 12.0110 0 1388 C1 114 PHE HA HB 0.090000 1.0080 0 1389 C1 114 PHE CB CT2 -0.180000 12.0110 0 1390 C1 114 PHE HB1 HA 0.090000 1.0080 0 1391 C1 114 PHE HB2 HA 0.090000 1.0080 0 1392 C1 114 PHE CG CA 0.000000 12.0110 0 1393 C1 114 PHE CD1 CA -0.115000 12.0110 0 1394 C1 114 PHE HD1 HP 0.115000 1.0080 0 1395 C1 114 PHE CE1 CA -0.115000 12.0110 0 1396 C1 114 PHE HE1 HP 0.115000 1.0080 0 1397 C1 114 PHE CZ CA -0.115000 12.0110 0 1398 C1 114 PHE HZ HP 0.115000 1.0080 0 1399 C1 114 PHE CD2 CA -0.115000 12.0110 0 1400 C1 114 PHE HD2 HP 0.115000 1.0080 0 1401 C1 114 PHE CE2 CA -0.115000 12.0110 0 1402 C1 114 PHE HE2 HP 0.115000 1.0080 0 1403 C1 114 PHE C C 0.510000 12.0110 0 1404 C1 114 PHE O O -0.510000 15.9990 0 1405 C1 115 VAL N NH1 -0.470000 14.0070 0 1406 C1 115 VAL HN H 0.310000 1.0080 0 1407 C1 115 VAL CA CT1 0.070000 12.0110 0 1408 C1 115 VAL HA HB 0.090000 1.0080 0 1409 C1 115 VAL CB CT1 -0.090000 12.0110 0 1410 C1 115 VAL HB HA 0.090000 1.0080 0 1411 C1 115 VAL CG1 CT3 -0.270000 12.0110 0 1412 C1 115 VAL HG11 HA 0.090000 1.0080 0 1413 C1 115 VAL HG12 HA 0.090000 1.0080 0 1414 C1 115 VAL HG13 HA 0.090000 1.0080 0 1415 C1 115 VAL CG2 CT3 -0.270000 12.0110 0 1416 C1 115 VAL HG21 HA 0.090000 1.0080 0 1417 C1 115 VAL HG22 HA 0.090000 1.0080 0 1418 C1 115 VAL HG23 HA 0.090000 1.0080 0 1419 C1 115 VAL C C 0.510000 12.0110 0 1420 C1 115 VAL O O -0.510000 15.9990 0 1421 C1 116 GLY N NH1 -0.470000 14.0070 0 1422 C1 116 GLY HN H 0.310000 1.0080 0 1423 C1 116 GLY CA CT2 -0.020000 12.0110 0 1424 C1 116 GLY HA1 HB 0.090000 1.0080 0 1425 C1 116 GLY HA2 HB 0.090000 1.0080 0 1426 C1 116 GLY C C 0.510000 12.0110 0 1427 C1 116 GLY O O -0.510000 15.9990 0 1428 C1 117 ARG N NH1 -0.470000 14.0070 0 1429 C1 117 ARG HN H 0.310000 1.0080 0 1430 C1 117 ARG CA CT1 0.070000 12.0110 0 1431 C1 117 ARG HA HB 0.090000 1.0080 0 1432 C1 117 ARG CB CT2 -0.180000 12.0110 0 1433 C1 117 ARG HB1 HA 0.090000 1.0080 0 1434 C1 117 ARG HB2 HA 0.090000 1.0080 0 1435 C1 117 ARG CG CT2 -0.180000 12.0110 0 1436 C1 117 ARG HG1 HA 0.090000 1.0080 0 1437 C1 117 ARG HG2 HA 0.090000 1.0080 0 1438 C1 117 ARG CD CT2 0.200000 12.0110 0 1439 C1 117 ARG HD1 HA 0.090000 1.0080 0 1440 C1 117 ARG HD2 HA 0.090000 1.0080 0 1441 C1 117 ARG NE NC2 -0.700000 14.0070 0 1442 C1 117 ARG HE HC 0.440000 1.0080 0 1443 C1 117 ARG CZ C 0.640000 12.0110 0 1444 C1 117 ARG NH1 NC2 -0.800000 14.0070 0 1445 C1 117 ARG HH11 HC 0.460000 1.0080 0 1446 C1 117 ARG HH12 HC 0.460000 1.0080 0 1447 C1 117 ARG NH2 NC2 -0.800000 14.0070 0 1448 C1 117 ARG HH21 HC 0.460000 1.0080 0 1449 C1 117 ARG HH22 HC 0.460000 1.0080 0 1450 C1 117 ARG C C 0.510000 12.0110 0 1451 C1 117 ARG O O -0.510000 15.9990 0 1452 C1 118 GLU N NH1 -0.470000 14.0070 0 1453 C1 118 GLU HN H 0.310000 1.0080 0 1454 C1 118 GLU CA CT1 0.070000 12.0110 0 1455 C1 118 GLU HA HB 0.090000 1.0080 0 1456 C1 118 GLU CB CT2 -0.180000 12.0110 0 1457 C1 118 GLU HB1 HA 0.090000 1.0080 0 1458 C1 118 GLU HB2 HA 0.090000 1.0080 0 1459 C1 118 GLU CG CT2 -0.280000 12.0110 0 1460 C1 118 GLU HG1 HA 0.090000 1.0080 0 1461 C1 118 GLU HG2 HA 0.090000 1.0080 0 1462 C1 118 GLU CD CC 0.620000 12.0110 0 1463 C1 118 GLU OE1 OC -0.760000 15.9990 0 1464 C1 118 GLU OE2 OC -0.760000 15.9990 0 1465 C1 118 GLU C C 0.510000 12.0110 0 1466 C1 118 GLU O O -0.510000 15.9990 0 1467 C1 119 GLN N NH1 -0.470000 14.0070 0 1468 C1 119 GLN HN H 0.310000 1.0080 0 1469 C1 119 GLN CA CT1 0.070000 12.0110 0 1470 C1 119 GLN HA HB 0.090000 1.0080 0 1471 C1 119 GLN CB CT2 -0.180000 12.0110 0 1472 C1 119 GLN HB1 HA 0.090000 1.0080 0 1473 C1 119 GLN HB2 HA 0.090000 1.0080 0 1474 C1 119 GLN CG CT2 -0.180000 12.0110 0 1475 C1 119 GLN HG1 HA 0.090000 1.0080 0 1476 C1 119 GLN HG2 HA 0.090000 1.0080 0 1477 C1 119 GLN CD CC 0.550000 12.0110 0 1478 C1 119 GLN OE1 O -0.550000 15.9990 0 1479 C1 119 GLN NE2 NH2 -0.620000 14.0070 0 1480 C1 119 GLN HE21 H 0.320000 1.0080 0 1481 C1 119 GLN HE22 H 0.300000 1.0080 0 1482 C1 119 GLN C C 0.510000 12.0110 0 1483 C1 119 GLN O O -0.510000 15.9990 0 1484 C1 120 GLU N NH1 -0.470000 14.0070 0 1485 C1 120 GLU HN H 0.310000 1.0080 0 1486 C1 120 GLU CA CT1 0.070000 12.0110 0 1487 C1 120 GLU HA HB 0.090000 1.0080 0 1488 C1 120 GLU CB CT2 -0.180000 12.0110 0 1489 C1 120 GLU HB1 HA 0.090000 1.0080 0 1490 C1 120 GLU HB2 HA 0.090000 1.0080 0 1491 C1 120 GLU CG CT2 -0.280000 12.0110 0 1492 C1 120 GLU HG1 HA 0.090000 1.0080 0 1493 C1 120 GLU HG2 HA 0.090000 1.0080 0 1494 C1 120 GLU CD CC 0.620000 12.0110 0 1495 C1 120 GLU OE1 OC -0.760000 15.9990 0 1496 C1 120 GLU OE2 OC -0.760000 15.9990 0 1497 C1 120 GLU C C 0.510000 12.0110 0 1498 C1 120 GLU O O -0.510000 15.9990 0 1499 C1 121 ARG N NH1 -0.470000 14.0070 0 1500 C1 121 ARG HN H 0.310000 1.0080 0 1501 C1 121 ARG CA CT1 0.070000 12.0110 0 1502 C1 121 ARG HA HB 0.090000 1.0080 0 1503 C1 121 ARG CB CT2 -0.180000 12.0110 0 1504 C1 121 ARG HB1 HA 0.090000 1.0080 0 1505 C1 121 ARG HB2 HA 0.090000 1.0080 0 1506 C1 121 ARG CG CT2 -0.180000 12.0110 0 1507 C1 121 ARG HG1 HA 0.090000 1.0080 0 1508 C1 121 ARG HG2 HA 0.090000 1.0080 0 1509 C1 121 ARG CD CT2 0.200000 12.0110 0 1510 C1 121 ARG HD1 HA 0.090000 1.0080 0 1511 C1 121 ARG HD2 HA 0.090000 1.0080 0 1512 C1 121 ARG NE NC2 -0.700000 14.0070 0 1513 C1 121 ARG HE HC 0.440000 1.0080 0 1514 C1 121 ARG CZ C 0.640000 12.0110 0 1515 C1 121 ARG NH1 NC2 -0.800000 14.0070 0 1516 C1 121 ARG HH11 HC 0.460000 1.0080 0 1517 C1 121 ARG HH12 HC 0.460000 1.0080 0 1518 C1 121 ARG NH2 NC2 -0.800000 14.0070 0 1519 C1 121 ARG HH21 HC 0.460000 1.0080 0 1520 C1 121 ARG HH22 HC 0.460000 1.0080 0 1521 C1 121 ARG C C 0.510000 12.0110 0 1522 C1 121 ARG O O -0.510000 15.9990 0 1523 C1 122 ARG N NH1 -0.470000 14.0070 0 1524 C1 122 ARG HN H 0.310000 1.0080 0 1525 C1 122 ARG CA CT1 0.070000 12.0110 0 1526 C1 122 ARG HA HB 0.090000 1.0080 0 1527 C1 122 ARG CB CT2 -0.180000 12.0110 0 1528 C1 122 ARG HB1 HA 0.090000 1.0080 0 1529 C1 122 ARG HB2 HA 0.090000 1.0080 0 1530 C1 122 ARG CG CT2 -0.180000 12.0110 0 1531 C1 122 ARG HG1 HA 0.090000 1.0080 0 1532 C1 122 ARG HG2 HA 0.090000 1.0080 0 1533 C1 122 ARG CD CT2 0.200000 12.0110 0 1534 C1 122 ARG HD1 HA 0.090000 1.0080 0 1535 C1 122 ARG HD2 HA 0.090000 1.0080 0 1536 C1 122 ARG NE NC2 -0.700000 14.0070 0 1537 C1 122 ARG HE HC 0.440000 1.0080 0 1538 C1 122 ARG CZ C 0.640000 12.0110 0 1539 C1 122 ARG NH1 NC2 -0.800000 14.0070 0 1540 C1 122 ARG HH11 HC 0.460000 1.0080 0 1541 C1 122 ARG HH12 HC 0.460000 1.0080 0 1542 C1 122 ARG NH2 NC2 -0.800000 14.0070 0 1543 C1 122 ARG HH21 HC 0.460000 1.0080 0 1544 C1 122 ARG HH22 HC 0.460000 1.0080 0 1545 C1 122 ARG C C 0.510000 12.0110 0 1546 C1 122 ARG O O -0.510000 15.9990 0 1547 C1 123 GLY N NH1 -0.470000 14.0070 0 1548 C1 123 GLY HN H 0.310000 1.0080 0 1549 C1 123 GLY CA CT2 -0.020000 12.0110 0 1550 C1 123 GLY HA1 HB 0.090000 1.0080 0 1551 C1 123 GLY HA2 HB 0.090000 1.0080 0 1552 C1 123 GLY C C 0.510000 12.0110 0 1553 C1 123 GLY O O -0.510000 15.9990 0 1554 C1 124 HSE C CC 0.340000 12.0110 0 1555 C1 124 HSE OT1 OC -0.670000 15.9990 0 1556 C1 124 HSE OT2 OC -0.670000 15.9990 0 1557 C1 124 HSE N NH1 -0.470000 14.0070 0 1558 C1 124 HSE HN H 0.310000 1.0080 0 1559 C1 124 HSE CA CT1 0.070000 12.0110 0 1560 C1 124 HSE HA HB 0.090000 1.0080 0 1561 C1 124 HSE CB CT2 -0.080000 12.0110 0 1562 C1 124 HSE HB1 HA 0.090000 1.0080 0 1563 C1 124 HSE HB2 HA 0.090000 1.0080 0 1564 C1 124 HSE ND1 NR2 -0.700000 14.0070 0 1565 C1 124 HSE CG CPH1 0.220000 12.0110 0 1566 C1 124 HSE CE1 CPH2 0.250000 12.0110 0 1567 C1 124 HSE HE1 HR1 0.130000 1.0080 0 1568 C1 124 HSE NE2 NR1 -0.360000 14.0070 0 1569 C1 124 HSE HE2 H 0.320000 1.0080 0 1570 C1 124 HSE CD2 CPH1 -0.050000 12.0110 0 1571 C1 124 HSE HD2 HR3 0.090000 1.0080 0 1572 W1 1 TIP3 OH2 OT -0.834000 15.9994 0 1573 W1 1 TIP3 H1 HT 0.417000 1.0080 0 1574 W1 1 TIP3 H2 HT 0.417000 1.0080 0 1575 W1 2 TIP3 OH2 OT -0.834000 15.9994 0 1576 W1 2 TIP3 H1 HT 0.417000 1.0080 0 1577 W1 2 TIP3 H2 HT 0.417000 1.0080 0 1578 W1 4 TIP3 OH2 OT -0.834000 15.9994 0 1579 W1 4 TIP3 H1 HT 0.417000 1.0080 0 1580 W1 4 TIP3 H2 HT 0.417000 1.0080 0 1581 W1 9 TIP3 OH2 OT -0.834000 15.9994 0 1582 W1 9 TIP3 H1 HT 0.417000 1.0080 0 1583 W1 9 TIP3 H2 HT 0.417000 1.0080 0 1584 C2 22 SER N NH3 -0.300000 14.0070 0 1585 C2 22 SER HT1 HC 0.330000 1.0080 0 1586 C2 22 SER HT2 HC 0.330000 1.0080 0 1587 C2 22 SER HT3 HC 0.330000 1.0080 0 1588 C2 22 SER CA CT1 0.210000 12.0110 0 1589 C2 22 SER HA HB 0.100000 1.0080 0 1590 C2 22 SER CB CT2 0.050000 12.0110 0 1591 C2 22 SER HB1 HA 0.090000 1.0080 0 1592 C2 22 SER HB2 HA 0.090000 1.0080 0 1593 C2 22 SER OG OH1 -0.660000 15.9990 0 1594 C2 22 SER HG1 H 0.430000 1.0080 0 1595 C2 22 SER C C 0.510000 12.0110 0 1596 C2 22 SER O O -0.510000 15.9990 0 1597 C2 23 ALA N NH1 -0.470000 14.0070 0 1598 C2 23 ALA HN H 0.310000 1.0080 0 1599 C2 23 ALA CA CT1 0.070000 12.0110 0 1600 C2 23 ALA HA HB 0.090000 1.0080 0 1601 C2 23 ALA CB CT3 -0.270000 12.0110 0 1602 C2 23 ALA HB1 HA 0.090000 1.0080 0 1603 C2 23 ALA HB2 HA 0.090000 1.0080 0 1604 C2 23 ALA HB3 HA 0.090000 1.0080 0 1605 C2 23 ALA C C 0.510000 12.0110 0 1606 C2 23 ALA O O -0.510000 15.9990 0 1607 C2 24 LEU N NH1 -0.470000 14.0070 0 1608 C2 24 LEU HN H 0.310000 1.0080 0 1609 C2 24 LEU CA CT1 0.070000 12.0110 0 1610 C2 24 LEU HA HB 0.090000 1.0080 0 1611 C2 24 LEU CB CT2 -0.180000 12.0110 0 1612 C2 24 LEU HB1 HA 0.090000 1.0080 0 1613 C2 24 LEU HB2 HA 0.090000 1.0080 0 1614 C2 24 LEU CG CT1 -0.090000 12.0110 0 1615 C2 24 LEU HG HA 0.090000 1.0080 0 1616 C2 24 LEU CD1 CT3 -0.270000 12.0110 0 1617 C2 24 LEU HD11 HA 0.090000 1.0080 0 1618 C2 24 LEU HD12 HA 0.090000 1.0080 0 1619 C2 24 LEU HD13 HA 0.090000 1.0080 0 1620 C2 24 LEU CD2 CT3 -0.270000 12.0110 0 1621 C2 24 LEU HD21 HA 0.090000 1.0080 0 1622 C2 24 LEU HD22 HA 0.090000 1.0080 0 1623 C2 24 LEU HD23 HA 0.090000 1.0080 0 1624 C2 24 LEU C C 0.510000 12.0110 0 1625 C2 24 LEU O O -0.510000 15.9990 0 1626 C2 25 HSE N NH1 -0.470000 14.0070 0 1627 C2 25 HSE HN H 0.310000 1.0080 0 1628 C2 25 HSE CA CT1 0.070000 12.0110 0 1629 C2 25 HSE HA HB 0.090000 1.0080 0 1630 C2 25 HSE CB CT2 -0.080000 12.0110 0 1631 C2 25 HSE HB1 HA 0.090000 1.0080 0 1632 C2 25 HSE HB2 HA 0.090000 1.0080 0 1633 C2 25 HSE ND1 NR2 -0.700000 14.0070 0 1634 C2 25 HSE CG CPH1 0.220000 12.0110 0 1635 C2 25 HSE CE1 CPH2 0.250000 12.0110 0 1636 C2 25 HSE HE1 HR1 0.130000 1.0080 0 1637 C2 25 HSE NE2 NR1 -0.360000 14.0070 0 1638 C2 25 HSE HE2 H 0.320000 1.0080 0 1639 C2 25 HSE CD2 CPH1 -0.050000 12.0110 0 1640 C2 25 HSE HD2 HR3 0.090000 1.0080 0 1641 C2 25 HSE C C 0.510000 12.0110 0 1642 C2 25 HSE O O -0.510000 15.9990 0 1643 C2 26 TRP N NH1 -0.470000 14.0070 0 1644 C2 26 TRP HN H 0.310000 1.0080 0 1645 C2 26 TRP CA CT1 0.070000 12.0110 0 1646 C2 26 TRP HA HB 0.090000 1.0080 0 1647 C2 26 TRP CB CT2 -0.180000 12.0110 0 1648 C2 26 TRP HB1 HA 0.090000 1.0080 0 1649 C2 26 TRP HB2 HA 0.090000 1.0080 0 1650 C2 26 TRP CG CY -0.030000 12.0110 0 1651 C2 26 TRP CD1 CA 0.035000 12.0110 0 1652 C2 26 TRP HD1 HP 0.115000 1.0080 0 1653 C2 26 TRP NE1 NY -0.610000 14.0070 0 1654 C2 26 TRP HE1 H 0.380000 1.0080 0 1655 C2 26 TRP CE2 CPT 0.130000 12.0110 0 1656 C2 26 TRP CD2 CPT -0.020000 12.0110 0 1657 C2 26 TRP CE3 CA -0.115000 12.0110 0 1658 C2 26 TRP HE3 HP 0.115000 1.0080 0 1659 C2 26 TRP CZ3 CA -0.115000 12.0110 0 1660 C2 26 TRP HZ3 HP 0.115000 1.0080 0 1661 C2 26 TRP CZ2 CA -0.115000 12.0110 0 1662 C2 26 TRP HZ2 HP 0.115000 1.0080 0 1663 C2 26 TRP CH2 CA -0.115000 12.0110 0 1664 C2 26 TRP HH2 HP 0.115000 1.0080 0 1665 C2 26 TRP C C 0.510000 12.0110 0 1666 C2 26 TRP O O -0.510000 15.9990 0 1667 C2 27 ARG N NH1 -0.470000 14.0070 0 1668 C2 27 ARG HN H 0.310000 1.0080 0 1669 C2 27 ARG CA CT1 0.070000 12.0110 0 1670 C2 27 ARG HA HB 0.090000 1.0080 0 1671 C2 27 ARG CB CT2 -0.180000 12.0110 0 1672 C2 27 ARG HB1 HA 0.090000 1.0080 0 1673 C2 27 ARG HB2 HA 0.090000 1.0080 0 1674 C2 27 ARG CG CT2 -0.180000 12.0110 0 1675 C2 27 ARG HG1 HA 0.090000 1.0080 0 1676 C2 27 ARG HG2 HA 0.090000 1.0080 0 1677 C2 27 ARG CD CT2 0.200000 12.0110 0 1678 C2 27 ARG HD1 HA 0.090000 1.0080 0 1679 C2 27 ARG HD2 HA 0.090000 1.0080 0 1680 C2 27 ARG NE NC2 -0.700000 14.0070 0 1681 C2 27 ARG HE HC 0.440000 1.0080 0 1682 C2 27 ARG CZ C 0.640000 12.0110 0 1683 C2 27 ARG NH1 NC2 -0.800000 14.0070 0 1684 C2 27 ARG HH11 HC 0.460000 1.0080 0 1685 C2 27 ARG HH12 HC 0.460000 1.0080 0 1686 C2 27 ARG NH2 NC2 -0.800000 14.0070 0 1687 C2 27 ARG HH21 HC 0.460000 1.0080 0 1688 C2 27 ARG HH22 HC 0.460000 1.0080 0 1689 C2 27 ARG C C 0.510000 12.0110 0 1690 C2 27 ARG O O -0.510000 15.9990 0 1691 C2 28 ALA N NH1 -0.470000 14.0070 0 1692 C2 28 ALA HN H 0.310000 1.0080 0 1693 C2 28 ALA CA CT1 0.070000 12.0110 0 1694 C2 28 ALA HA HB 0.090000 1.0080 0 1695 C2 28 ALA CB CT3 -0.270000 12.0110 0 1696 C2 28 ALA HB1 HA 0.090000 1.0080 0 1697 C2 28 ALA HB2 HA 0.090000 1.0080 0 1698 C2 28 ALA HB3 HA 0.090000 1.0080 0 1699 C2 28 ALA C C 0.510000 12.0110 0 1700 C2 28 ALA O O -0.510000 15.9990 0 1701 C2 29 ALA N NH1 -0.470000 14.0070 0 1702 C2 29 ALA HN H 0.310000 1.0080 0 1703 C2 29 ALA CA CT1 0.070000 12.0110 0 1704 C2 29 ALA HA HB 0.090000 1.0080 0 1705 C2 29 ALA CB CT3 -0.270000 12.0110 0 1706 C2 29 ALA HB1 HA 0.090000 1.0080 0 1707 C2 29 ALA HB2 HA 0.090000 1.0080 0 1708 C2 29 ALA HB3 HA 0.090000 1.0080 0 1709 C2 29 ALA C C 0.510000 12.0110 0 1710 C2 29 ALA O O -0.510000 15.9990 0 1711 C2 30 GLY N NH1 -0.470000 14.0070 0 1712 C2 30 GLY HN H 0.310000 1.0080 0 1713 C2 30 GLY CA CT2 -0.020000 12.0110 0 1714 C2 30 GLY HA1 HB 0.090000 1.0080 0 1715 C2 30 GLY HA2 HB 0.090000 1.0080 0 1716 C2 30 GLY C C 0.510000 12.0110 0 1717 C2 30 GLY O O -0.510000 15.9990 0 1718 C2 31 ALA N NH1 -0.470000 14.0070 0 1719 C2 31 ALA HN H 0.310000 1.0080 0 1720 C2 31 ALA CA CT1 0.070000 12.0110 0 1721 C2 31 ALA HA HB 0.090000 1.0080 0 1722 C2 31 ALA CB CT3 -0.270000 12.0110 0 1723 C2 31 ALA HB1 HA 0.090000 1.0080 0 1724 C2 31 ALA HB2 HA 0.090000 1.0080 0 1725 C2 31 ALA HB3 HA 0.090000 1.0080 0 1726 C2 31 ALA C C 0.510000 12.0110 0 1727 C2 31 ALA O O -0.510000 15.9990 0 1728 C2 32 ALA N NH1 -0.470000 14.0070 0 1729 C2 32 ALA HN H 0.310000 1.0080 0 1730 C2 32 ALA CA CT1 0.070000 12.0110 0 1731 C2 32 ALA HA HB 0.090000 1.0080 0 1732 C2 32 ALA CB CT3 -0.270000 12.0110 0 1733 C2 32 ALA HB1 HA 0.090000 1.0080 0 1734 C2 32 ALA HB2 HA 0.090000 1.0080 0 1735 C2 32 ALA HB3 HA 0.090000 1.0080 0 1736 C2 32 ALA C C 0.510000 12.0110 0 1737 C2 32 ALA O O -0.510000 15.9990 0 1738 C2 33 THR N NH1 -0.470000 14.0070 0 1739 C2 33 THR HN H 0.310000 1.0080 0 1740 C2 33 THR CA CT1 0.070000 12.0110 0 1741 C2 33 THR HA HB 0.090000 1.0080 0 1742 C2 33 THR CB CT1 0.140000 12.0110 0 1743 C2 33 THR HB HA 0.090000 1.0080 0 1744 C2 33 THR OG1 OH1 -0.660000 15.9990 0 1745 C2 33 THR HG1 H 0.430000 1.0080 0 1746 C2 33 THR CG2 CT3 -0.270000 12.0110 0 1747 C2 33 THR HG21 HA 0.090000 1.0080 0 1748 C2 33 THR HG22 HA 0.090000 1.0080 0 1749 C2 33 THR HG23 HA 0.090000 1.0080 0 1750 C2 33 THR C C 0.510000 12.0110 0 1751 C2 33 THR O O -0.510000 15.9990 0 1752 C2 34 VAL N NH1 -0.470000 14.0070 0 1753 C2 34 VAL HN H 0.310000 1.0080 0 1754 C2 34 VAL CA CT1 0.070000 12.0110 0 1755 C2 34 VAL HA HB 0.090000 1.0080 0 1756 C2 34 VAL CB CT1 -0.090000 12.0110 0 1757 C2 34 VAL HB HA 0.090000 1.0080 0 1758 C2 34 VAL CG1 CT3 -0.270000 12.0110 0 1759 C2 34 VAL HG11 HA 0.090000 1.0080 0 1760 C2 34 VAL HG12 HA 0.090000 1.0080 0 1761 C2 34 VAL HG13 HA 0.090000 1.0080 0 1762 C2 34 VAL CG2 CT3 -0.270000 12.0110 0 1763 C2 34 VAL HG21 HA 0.090000 1.0080 0 1764 C2 34 VAL HG22 HA 0.090000 1.0080 0 1765 C2 34 VAL HG23 HA 0.090000 1.0080 0 1766 C2 34 VAL C C 0.510000 12.0110 0 1767 C2 34 VAL O O -0.510000 15.9990 0 1768 C2 35 LEU N NH1 -0.470000 14.0070 0 1769 C2 35 LEU HN H 0.310000 1.0080 0 1770 C2 35 LEU CA CT1 0.070000 12.0110 0 1771 C2 35 LEU HA HB 0.090000 1.0080 0 1772 C2 35 LEU CB CT2 -0.180000 12.0110 0 1773 C2 35 LEU HB1 HA 0.090000 1.0080 0 1774 C2 35 LEU HB2 HA 0.090000 1.0080 0 1775 C2 35 LEU CG CT1 -0.090000 12.0110 0 1776 C2 35 LEU HG HA 0.090000 1.0080 0 1777 C2 35 LEU CD1 CT3 -0.270000 12.0110 0 1778 C2 35 LEU HD11 HA 0.090000 1.0080 0 1779 C2 35 LEU HD12 HA 0.090000 1.0080 0 1780 C2 35 LEU HD13 HA 0.090000 1.0080 0 1781 C2 35 LEU CD2 CT3 -0.270000 12.0110 0 1782 C2 35 LEU HD21 HA 0.090000 1.0080 0 1783 C2 35 LEU HD22 HA 0.090000 1.0080 0 1784 C2 35 LEU HD23 HA 0.090000 1.0080 0 1785 C2 35 LEU C C 0.510000 12.0110 0 1786 C2 35 LEU O O -0.510000 15.9990 0 1787 C2 36 LEU N NH1 -0.470000 14.0070 0 1788 C2 36 LEU HN H 0.310000 1.0080 0 1789 C2 36 LEU CA CT1 0.070000 12.0110 0 1790 C2 36 LEU HA HB 0.090000 1.0080 0 1791 C2 36 LEU CB CT2 -0.180000 12.0110 0 1792 C2 36 LEU HB1 HA 0.090000 1.0080 0 1793 C2 36 LEU HB2 HA 0.090000 1.0080 0 1794 C2 36 LEU CG CT1 -0.090000 12.0110 0 1795 C2 36 LEU HG HA 0.090000 1.0080 0 1796 C2 36 LEU CD1 CT3 -0.270000 12.0110 0 1797 C2 36 LEU HD11 HA 0.090000 1.0080 0 1798 C2 36 LEU HD12 HA 0.090000 1.0080 0 1799 C2 36 LEU HD13 HA 0.090000 1.0080 0 1800 C2 36 LEU CD2 CT3 -0.270000 12.0110 0 1801 C2 36 LEU HD21 HA 0.090000 1.0080 0 1802 C2 36 LEU HD22 HA 0.090000 1.0080 0 1803 C2 36 LEU HD23 HA 0.090000 1.0080 0 1804 C2 36 LEU C C 0.510000 12.0110 0 1805 C2 36 LEU O O -0.510000 15.9990 0 1806 C2 37 VAL N NH1 -0.470000 14.0070 0 1807 C2 37 VAL HN H 0.310000 1.0080 0 1808 C2 37 VAL CA CT1 0.070000 12.0110 0 1809 C2 37 VAL HA HB 0.090000 1.0080 0 1810 C2 37 VAL CB CT1 -0.090000 12.0110 0 1811 C2 37 VAL HB HA 0.090000 1.0080 0 1812 C2 37 VAL CG1 CT3 -0.270000 12.0110 0 1813 C2 37 VAL HG11 HA 0.090000 1.0080 0 1814 C2 37 VAL HG12 HA 0.090000 1.0080 0 1815 C2 37 VAL HG13 HA 0.090000 1.0080 0 1816 C2 37 VAL CG2 CT3 -0.270000 12.0110 0 1817 C2 37 VAL HG21 HA 0.090000 1.0080 0 1818 C2 37 VAL HG22 HA 0.090000 1.0080 0 1819 C2 37 VAL HG23 HA 0.090000 1.0080 0 1820 C2 37 VAL C C 0.510000 12.0110 0 1821 C2 37 VAL O O -0.510000 15.9990 0 1822 C2 38 ILE N NH1 -0.470000 14.0070 0 1823 C2 38 ILE HN H 0.310000 1.0080 0 1824 C2 38 ILE CA CT1 0.070000 12.0110 0 1825 C2 38 ILE HA HB