*HEADER ANTIMICROBIAL PROTEIN 05-JUL-10 SMS20125 *TITLE DPC MICELLE BOUND VK22 *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: FOWLICIDIN-1, GLY-LINKERS; *COMPND 3 CHAIN: A; *COMPND 4 FRAGMENT: UNP RESIDUES 127-148; *COMPND 5 SYNONYM: VK22; *COMPND 6 ENGINEERED: YES; *COMPND 7 OTHER_DETAILS: FOUR CHAINS (A, B, C AND D) OF VK22 WERE LINKED BY *COMPND 8 THREE GLY-LINKERS. *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 ORGANISM_SCIENTIFIC: GALLUS GALLUS; *SOURCE 4 ORGANISM_COMMON: CHICKEN; *SOURCE 5 ORGANISM_TAXID: 9031; *SOURCE 6 OTHER_DETAILS: SYNTHESIZED COMMERCIALLY BY GL BIOCHEM *KEYWDS FOWLICIDIN1, DPC MICELLE BOUND, VK22, ANTIMICROBIAL PEPTIDE, OLIGOMER *KEYWDS 2 OF ANTIMICROBIAL PEPTIDE, ANTIMICROBIAL PROTEIN *EXPDTA SOLUTION NMR *NUMMDL 20 *AUTHOR S.BHATTACHARJYA, R.SARAVANAN ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### loop_ _Homonucl_NOE.ID _Homonucl_NOE.Comp_index_ID_1 _Homonucl_NOE.Comp_ID_1 _Homonucl_NOE.Atom_ID_1 _Homonucl_NOE.Comp_index_ID_2 _Homonucl_NOE.Comp_ID_2 _Homonucl_NOE.Atom_ID_2 _Homonucl_NOE.Val 1 2 TRP HA 2 TRP H 3.80 2 2 TRP HB2 2 TRP H 4.53 3 2 TRP HE1 2 TRP HE1 4.00 4 2 TRP HZ2 2 TRP HE1 4.25 5 3 PRO HB2 4 LEU H 4.88 6 3 PRO HB2 6 ILE H 4.75 7 3 PRO HB2 7 ARG H 5.00 8 4 LEU H 6 ILE H 4.75 9 4 LEU HA 4 LEU H 3.65 10 4 LEU HB 4 LEU H 3.15 11 4 LEU HG 4 LEU H 4.00 12 4 LEU HA 8 THR H 5.10 13 4 LEU H 5 VAL H 3.50 14 5 VAL H 6 ILE H 3.50 15 5 VAL H 7 ARG H 4.20 16 5 VAL HA 5 VAL H 4.00 17 5 VAL HB 5 VAL H 3.78 18 5 VAL QQG 5 VAL H 4.20 19 5 VAL HA 6 ILE H 4.60 20 5 VAL HB 8 THR H 5.00 21 5 VAL HB 8 THR HB 5.00 22 5 VAL QQG 8 THR HB 5.00 23 5 VAL QQG 2 TRP HZ2 5.50 24 5 VAL HA 8 THR H 4.75 25 5 VAL QQG 6 ILE H 5.00 26 5 VAL QQG 8 THR H 4.95 27 7 ARG H 6 ILE H 3.35 28 6 ILE H 8 THR H 4.40 29 6 ILE HA 7 ARG H 4.60 30 6 ILE HA 8 THR H 4.80 31 6 ILE HB 6 ILE H 3.60 32 6 ILE HA 6 ILE H 3.50 33 6 ILE HG21 6 ILE H 3.80 34 6 ILE HG23 6 ILE H 3.70 35 7 ARG HA 7 ARG H 3.50 36 7 ARG HA 8 THR H 4.20 37 7 ARG HA 11 ALA H 4.80 38 7 ARG HB2 7 ARG H 3.50 39 7 ARG HB2 8 THR H 4.25 40 7 ARG HB2 11 ALA HA 5.50 41 7 ARG HB3 7 ARG H 3.50 42 7 ARG HB3 8 THR H 5.00 43 7 ARG QD 7 ARG H 4.80 44 7 ARG QG 7 ARG H 4.50 45 8 THR H 7 ARG H 3.20 46 8 THR HA 8 THR H 3.98 47 8 THR HB 8 THR H 3.65 48 8 THR HA 9 VAL H 3.76 49 8 THR HB 9 VAL H 4.00 50 8 THR HB 11 ALA H 5.25 51 8 THR HA 11 ALA H 3.85 52 8 THR QG2 8 THR H 4.35 53 8 THR QG2 9 VAL H 3.90 54 9 VAL HA 9 VAL H 3.70 55 9 VAL HB 9 VAL H 3.70 56 9 VAL HB 12 GLY H 5.50 57 9 VAL QQG 9 VAL H 3.70 58 9 VAL QQG 11 ALA H 4.50 59 9 VAL QQG 12 GLY H 4.70 60 9 VAL H 11 ALA H 4.50 61 9 VAL HA 11 ALA H 4.60 62 9 VAL HB 11 ALA H 4.80 63 10 ILE HB 11 ALA H 4.50 64 10 ILE HB 12 GLY H 4.80 65 10 ILE HB 14 ASN H 5.20 66 10 ILE HG12 11 ALA H 4.90 67 10 ILE HG12 12 GLY H 5.40 68 10 ILE HG21 11 ALA H 4.90 69 10 ILE HG21 12 GLY H 5.10 70 10 ILE HG12 13 TYR HD1 5.00 71 10 ILE HG23 11 ALA H 4.85 72 10 ILE HG23 14 ASN H 4.93 73 10 ILE HA 11 ALA H 4.30 74 10 ILE H 11 ALA H 3.50 75 10 ILE C 13 TYR N 3.20 76 10 ILE O 13 TYR H 2.00 77 11 ALA H 12 GLY H 3.10 78 11 ALA HA 11 ALA H 3.95 79 11 ALA HB 11 ALA H 3.65 80 11 ALA HB 12 GLY H 4.00 81 11 ALA HB 14 ASN H 5.20 82 12 GLY H 10 ILE H 4.96 83 12 GLY H 13 TYR H 4.25 84 12 GLY H 14 ASN H 4.70 85 12 GLY HA2 12 GLY H 3.95 86 12 GLY HA2 14 ASN H 5.00 87 12 GLY HA2 15 LEU H 5.00 88 12 GLY HA2 16 TYR H 5.00 89 12 GLY C 15 LEU N 3.20 90 12 GLY O 15 LEU H 2.00 91 12 GLY HA 13 TYR H 3.78 92 13 TYR HA 13 TYR H 3.50 93 13 TYR HA 14 ASN H 3.85 94 13 TYR HA 16 TYR H 3.85 95 13 TYR HA 16 TYR HE1 5.00 96 13 TYR HB2 13 TYR H 3.50 97 13 TYR HB2 14 ASN H 4.50 98 13 TYR HB2 15 LEU H 5.00 99 13 TYR HB3 13 TYR H 3.50 100 13 TYR HB3 14 ASN H 3.85 101 13 TYR H 14 ASN H 3.65 102 13 TYR C 16 TYR N 3.20 103 13 TYR O 16 TYR H 2.00 104 14 ASN H 15 LEU H 3.85 105 14 ASN HA 14 ASN H 3.50 106 14 ASN HA 15 LEU H 4.13 107 14 ASN HA 16 TYR H 4.87 108 14 ASN HA 17 ARG H 4.40 109 14 ASN HA 18 ALA H 4.80 110 14 ASN HB2 15 LEU H 4.70 111 14 ASN HB3 15 LEU H 4.70 112 14 ASN HB3 14 ASN H 4.00 113 14 ASN H 15 LEU H 4.15 114 15 LEU H 13 TYR H 4.50 115 15 LEU H 16 TYR H 3.50 116 15 LEU H 17 ARG H 4.50 117 15 LEU HA 15 LEU H 3.95 118 15 LEU HA 16 TYR H 3.95 119 15 LEU HA 17 ARG H 4.20 120 15 LEU HA 19 ILE H 4.97 121 15 LEU HB2 15 LEU H 4.57 122 15 LEU HB2 16 TYR H 4.37 123 15 LEU HB3 15 LEU H 4.57 124 15 LEU HB3 16 TYR H 4.37 125 15 LEU QQD 15 LEU H 4.17 126 15 LEU QQD 16 TYR H 4.60 127 15 LEU C 18 ALA N 3.20 128 15 LEU O 18 ALA H 2.00 129 15 LEU QQD 16 TYR HA 5.00 130 15 LEU QQD 16 TYR H 5.00 131 16 TYR HA 16 TYR H 3.50 132 16 TYR HA 17 ARG H 4.00 133 16 TYR HA 18 ALA H 4.50 134 16 TYR HA 19 ILE H 5.00 135 16 TYR HB2 16 TYR H 3.50 136 16 TYR HB3 16 TYR H 3.50 137 16 TYR HB2 17 ARG H 5.00 138 16 TYR HB3 17 ARG H 5.20 139 16 TYR H 17 ARG H 4.50 140 17 ARG H 18 ALA H 4.00 141 17 ARG H 19 ILE H 4.50 142 17 ARG HA 17 ARG H 3.50 143 17 ARG HB3 17 ARG H 4.30 144 17 ARG HB2 17 ARG H 4.30 145 17 ARG HA 19 ILE H 4.50 146 17 ARG HA 20 LYS H 4.50 147 17 ARG HA 21 LYS H 4.50 148 17 ARG HB 21 LYS H 4.50 149 17 ARG HB3 20 LYS H 4.50 150 17 ARG QG 17 ARG H 3.90 151 17 ARG C 20 LYS N 3.20 152 17 ARG O 20 LYS H 2.00 153 18 ALA HA 18 ALA H 3.50 154 18 ALA HB 18 ALA H 3.50 155 18 ALA HB 19 ILE HA 3.80 156 18 ALA H 19 ILE H 3.50 157 19 ILE HA 19 ILE H 3.80 158 19 ILE HA 20 LYS H 3.53 159 19 ILE HA 21 LYS H 4.53 160 19 ILE HB 19 ILE H 4.20 161 19 ILE HG21 19 ILE H 4.80 162 19 ILE QD1 19 ILE H 4.90 163 19 ILE QD1 20 LYS H 4.73 164 19 ILE H 20 LYS H 4.10 165 18 ALA H 20 LYS H 4.10 166 20 LYS HA 20 LYS H 3.60 167 20 LYS HB2 20 LYS H 3.60 168 20 LYS QG 20 LYS H 3.65 169 20 LYS HA 21 LYS H 3.53 170 20 LYS QG 21 LYS H 4.65 171 20 LYS H 21 LYS H 4.30 172 19 ILE H 21 LYS H 4.30 173 18 ALA HB 21 LYS H 4.80 174 20 LYS HA 20 LYS H 3.60 175 20 LYS HB2 20 LYS H 4.10 176 19 ILE QD1 22 LYS H 4.73 177 19 ILE HG21 22 LYS H 4.80 178 21 LYS HA 21 LYS H 3.62 179 21 LYS HB2 21 LYS H 3.63 180 21 LYS QG 21 LYS H 3.65 181 22 LYS HA 22 LYS H 3.62 182 22 LYS H 21 LYS H 4.30 183 34 TRP HA 34 TRP H 3.80 184 34 TRP HB2 34 TRP H 4.53 185 34 TRP HE1 34 TRP HE1 4.00 186 34 TRP HZ2 34 TRP HE1 4.25 187 35 PRO HB2 36 LEU H 4.88 188 35 PRO HB2 38 ILE H 4.75 189 35 PRO HB2 39 ARG H 5.00 190 36 LEU H 38 ILE H 4.75 191 36 LEU HA 36 LEU H 3.65 192 36 LEU HB 36 LEU H 3.15 193 36 LEU HG 36 LEU H 4.00 194 36 LEU HA 40 THR H 5.10 195 36 LEU H 37 VAL H 3.50 196 37 VAL H 38 ILE H 3.50 197 37 VAL H 39 ARG H 4.20 198 37 VAL HA 37 VAL H 4.00 199 37 VAL HB 37 VAL H 3.78 200 37 VAL QQG 37 VAL H 4.20 201 37 VAL HA 38 ILE H 4.60 202 37 VAL HB 40 THR H 5.00 203 37 VAL HB 40 THR HB 5.00 204 37 VAL QQG 40 THR HB 5.00 205 37 VAL QQG 34 TRP HZ2 5.50 206 37 VAL HA 40 THR H 4.75 207 37 VAL QQG 38 ILE H 5.00 208 37 VAL QQG 40 THR H 4.95 209 39 ARG H 38 ILE H 3.35 210 38 ILE H 40 THR H 4.40 211 38 ILE HA 39 ARG H 4.60 212 38 ILE HA 40 THR H 4.80 213 38 ILE HB 38 ILE H 3.60 214 38 ILE HA 38 ILE H 3.50 215 38 ILE HG21 38 ILE H 3.80 216 38 ILE HG23 38 ILE H 3.70 217 39 ARG HA 39 ARG H 3.50 218 39 ARG HA 40 THR H 4.20 219 39 ARG HA 43 ALA H 4.80 220 39 ARG HB2 39 ARG H 3.50 221 39 ARG HB2 40 THR H 4.25 222 39 ARG HB2 43 ALA HA 5.50 223 39 ARG HB3 39 ARG H 3.50 224 39 ARG HB3 40 THR H 5.00 225 39 ARG QD 39 ARG H 4.80 226 39 ARG QG 39 ARG H 4.50 227 40 THR H 39 ARG H 3.20 228 40 THR HA 40 THR H 3.98 229 40 THR HB 40 THR H 3.65 230 40 THR HA 41 VAL H 3.76 231 40 THR HB 41 VAL H 4.00 232 40 THR HB 43 ALA H 5.25 233 40 THR HA 43 ALA H 3.85 234 40 THR QG2 40 THR H 4.35 235 40 THR QG2 41 VAL H 3.90 236 41 VAL HA 41 VAL H 3.70 237 41 VAL HB 41 VAL H 3.70 238 41 VAL HB 44 GLY H 5.50 239 41 VAL QQG 41 VAL H 3.70 240 41 VAL QQG 43 ALA H 4.50 241 41 VAL QQG 44 GLY H 4.70 242 41 VAL H 43 ALA H 4.50 243 41 VAL HA 43 ALA H 4.70 244 41 VAL HB 43 ALA H 4.80 245 42 ILE HB 43 ALA H 4.50 246 42 ILE HB 44 GLY H 4.80 247 42 ILE HB 46 ASN H 5.40 248 42 ILE HG12 43 ALA H 4.90 249 42 ILE HG12 44 GLY H 5.20 250 42 ILE HG21 43 ALA H 4.90 251 42 ILE HG21 44 GLY H 5.50 252 42 ILE HG12 45 TYR HD1 5.30 253 42 ILE HG23 43 ALA H 4.85 254 42 ILE HG23 46 ASN H 4.93 255 42 ILE HA 43 ALA H 4.30 256 42 ILE H 43 ALA H 3.50 257 42 ILE C 45 TYR N 3.20 258 42 ILE O 45 TYR H 2.00 259 43 ALA H 44 GLY H 3.10 260 43 ALA HA 43 ALA H 3.95 261 43 ALA HB 43 ALA H 3.65 262 43 ALA HB 44 GLY H 4.00 263 43 ALA HB 46 ASN H 5.20 264 44 GLY H 42 ILE H 4.96 265 44 GLY H 45 TYR H 4.25 266 44 GLY H 46 ASN H 4.70 267 44 GLY HA2 44 GLY H 3.95 268 44 GLY HA2 46 ASN H 5.00 269 44 GLY HA2 47 LEU H 5.00 270 44 GLY HA2 48 TYR H 5.00 271 44 GLY C 47 LEU N 3.20 272 44 GLY O 47 LEU H 2.00 273 44 GLY HA 45 TYR H 3.78 274 45 TYR HA 45 TYR H 3.50 275 45 TYR HA 46 ASN H 3.85 276 45 TYR HA 48 TYR H 3.85 277 45 TYR HA 48 TYR HE1 5.00 278 45 TYR HB2 45 TYR H 3.50 279 45 TYR HB2 46 ASN H 4.50 280 45 TYR HB2 47 LEU H 5.40 281 45 TYR HB3 45 TYR H 3.50 282 45 TYR HB3 46 ASN H 3.85 283 45 TYR H 46 ASN H 3.65 284 45 TYR C 48 TYR N 3.80 285 45 TYR O 48 TYR H 2.00 286 46 ASN H 47 LEU H 3.85 287 46 ASN HA 46 ASN H 3.50 288 46 ASN HA 47 LEU H 4.13 289 46 ASN HA 48 TYR H 4.87 290 46 ASN HA 49 ARG H 4.30 291 46 ASN HA 50 ALA H 4.80 292 46 ASN HB2 47 LEU H 4.70 293 46 ASN HB3 47 LEU H 4.70 294 46 ASN HB3 46 ASN H 4.00 295 46 ASN H 47 LEU H 4.15 296 47 LEU H 45 TYR H 4.50 297 47 LEU H 48 TYR H 3.50 298 47 LEU H 49 ARG H 4.50 299 47 LEU HA 47 LEU H 3.95 300 47 LEU HA 48 TYR H 3.95 301 47 LEU HA 49 ARG H 4.20 302 47 LEU HA 51 ILE H 4.97 303 47 LEU HB2 47 LEU H 4.57 304 47 LEU HB2 48 TYR H 4.37 305 47 LEU HB3 47 LEU H 4.57 306 47 LEU HB3 48 TYR H 4.37 307 47 LEU QQD 47 LEU H 4.17 308 47 LEU QQD 48 TYR H 4.60 309 47 LEU C 50 ALA N 3.20 310 47 LEU O 50 ALA H 2.00 311 47 LEU QQD 48 TYR HA 5.00 312 47 LEU QQD 48 TYR H 5.00 313 48 TYR HA 48 TYR H 3.50 314 48 TYR HA 49 ARG H 4.00 315 48 TYR HA 50 ALA H 4.50 316 48 TYR HA 51 ILE H 5.00 317 48 TYR HB2 48 TYR H 3.50 318 48 TYR HB3 48 TYR H 3.50 319 48 TYR HB2 49 ARG H 5.00 320 48 TYR HB3 49 ARG H 5.20 321 48 TYR H 49 ARG H 4.50 322 49 ARG H 50 ALA H 4.00 323 49 ARG H 51 ILE H 4.40 324 49 ARG HA 49 ARG H 3.50 325 49 ARG HB3 49 ARG H 4.30 326 49 ARG HB2 49 ARG H 4.30 327 49 ARG HA 51 ILE H 4.50 328 49 ARG HA 52 LYS H 4.50 329 49 ARG HA 53 LYS H 4.50 330 49 ARG HB 53 LYS H 4.50 331 49 ARG HB3 52 LYS H 4.50 332 49 ARG QG 49 ARG H 3.90 333 49 ARG C 52 LYS N 3.20 334 49 ARG O 52 LYS H 2.00 335 50 ALA HA 50 ALA H 3.50 336 50 ALA HB 50 ALA H 3.50 337 50 ALA HB 51 ILE HA 3.80 338 50 ALA H 51 ILE H 3.50 339 51 ILE HA 51 ILE H 3.80 340 51 ILE HA 52 LYS H 3.53 341 51 ILE HA 53 LYS H 4.53 342 51 ILE HB 51 ILE H 4.20 343 51 ILE HG21 51 ILE H 4.80 344 51 ILE QD1 51 ILE H 4.90 345 51 ILE QD1 52 LYS H 4.73 346 51 ILE H 52 LYS H 4.10 347 50 ALA H 52 LYS H 4.10 348 52 LYS HA 52 LYS H 3.60 349 52 LYS HB2 52 LYS H 3.60 350 52 LYS QG 52 LYS H 3.65 351 52 LYS HA 53 LYS H 3.53 352 52 LYS QG 53 LYS H 4.65 353 52 LYS H 53 LYS H 4.30 354 51 ILE H 53 LYS H 4.30 355 50 ALA HB 53 LYS H 4.80 356 52 LYS HA 52 LYS H 3.60 357 52 LYS HB2 52 LYS H 4.10 358 51 ILE QD1 54 LYS H 4.73 359 51 ILE HG21 54 LYS H 4.80 360 53 LYS HA 53 LYS H 3.62 361 53 LYS HB2 53 LYS H 3.63 362 53 LYS QG 53 LYS H 3.65 363 54 LYS HA 54 LYS H 3.62 364 54 LYS H 53 LYS H 4.30 365 6 ILE HG21 48 TYR HA 5.20 366 16 TYR HA 38 ILE HG21 5.20 367 17 ARG HA 38 ILE H 5.50 368 6 ILE H 49 ARG HA 5.50 369 17 ARG H 38 ILE HA 5.50 370 6 ILE HA 49 ARG H 5.50 371 17 ARG HA 38 ILE HB 5.50 372 6 ILE HB 49 ARG HA 5.50 373 66 TRP HA 66 TRP H 3.80 374 66 TRP HB2 66 TRP H 4.53 375 66 TRP HE1 66 TRP HE1 4.00 376 66 TRP HZ2 66 TRP HE1 4.25 377 67 PRO HB2 68 LEU H 4.88 378 67 PRO HB2 70 ILE H 4.75 379 67 PRO HB2 71 ARG H 5.00 380 68 LEU H 70 ILE H 4.75 381 68 LEU HA 68 LEU H 3.65 382 68 LEU HB 68 LEU H 3.15 383 68 LEU HG 68 LEU H 4.00 384 68 LEU HA 72 THR H 5.10 385 68 LEU H 69 VAL H 3.50 386 69 VAL H 70 ILE H 3.50 387 69 VAL H 71 ARG H 4.20 388 69 VAL HA 69 VAL H 4.00 389 69 VAL HB 69 VAL H 3.78 390 69 VAL QQG 69 VAL H 4.20 391 69 VAL HA 70 ILE H 4.60 392 69 VAL HB 72 THR H 5.00 393 69 VAL HB 72 THR HB 5.00 394 69 VAL QQG 72 THR HB 5.00 395 69 VAL QQG 66 TRP HZ2 5.50 396 69 VAL HA 72 THR H 4.75 397 69 VAL QQG 70 ILE H 5.00 398 69 VAL QQG 72 THR H 4.95 399 71 ARG H 70 ILE H 3.35 400 70 ILE H 72 THR H 4.40 401 70 ILE HA 71 ARG H 4.60 402 70 ILE HA 72 THR H 4.80 403 70 ILE HB 70 ILE H 3.60 404 70 ILE HA 70 ILE H 3.50 405 70 ILE HG21 70 ILE H 3.80 406 70 ILE HG23 70 ILE H 3.70 407 71 ARG HA 71 ARG H 3.50 408 71 ARG HA 72 THR H 4.20 409 71 ARG HA 75 ALA H 4.80 410 71 ARG HB2 71 ARG H 3.50 411 71 ARG HB2 72 THR H 4.25 412 71 ARG HB2 75 ALA HA 5.50 413 71 ARG HB3 71 ARG H 3.50 414 71 ARG HB3 72 THR H 5.00 415 71 ARG QD 71 ARG H 4.80 416 71 ARG QG 71 ARG H 4.50 417 72 THR H 71 ARG H 3.20 418 72 THR HA 72 THR H 3.98 419 72 THR HB 72 THR H 3.65 420 72 THR HA 73 VAL H 3.76 421 72 THR HB 73 VAL H 4.00 422 72 THR HB 75 ALA H 5.25 423 72 THR HA 75 ALA H 3.85 424 72 THR QG2 72 THR H 4.35 425 72 THR QG2 73 VAL H 3.90 426 73 VAL HA 73 VAL H 3.70 427 73 VAL HB 73 VAL H 3.70 428 73 VAL HB 76 GLY H 5.50 429 73 VAL QQG 73 VAL H 3.70 430 73 VAL QQG 75 ALA H 4.50 431 73 VAL QQG 76 GLY H 4.70 432 73 VAL H 75 ALA H 4.50 433 73 VAL HA 75 ALA H 4.60 434 73 VAL HB 75 ALA H 4.80 435 74 ILE HB 75 ALA H 4.50 436 74 ILE HB 76 GLY H 4.80 437 74 ILE HB 78 ASN H 5.20 438 74 ILE HG12 75 ALA H 4.90 439 74 ILE HG12 76 GLY H 5.40 440 74 ILE HG21 75 ALA H 4.90 441 74 ILE HG21 76 GLY H 5.10 442 74 ILE HG12 77 TYR HD1 5.00 443 74 ILE HG23 75 ALA H 4.85 444 74 ILE HG23 78 ASN H 4.93 445 74 ILE HA 75 ALA H 4.30 446 74 ILE H 75 ALA H 3.50 447 74 ILE C 77 TYR N 3.20 448 74 ILE O 77 TYR H 2.00 449 75 ALA H 76 GLY H 3.10 450 75 ALA HA 75 ALA H 3.95 451 75 ALA HB 75 ALA H 3.65 452 75 ALA HB 76 GLY H 4.00 453 75 ALA HB 78 ASN H 5.20 454 76 GLY H 74 ILE H 4.96 455 76 GLY H 77 TYR H 4.25 456 76 GLY H 78 ASN H 4.70 457 76 GLY HA2 76 GLY H 3.95 458 76 GLY HA2 78 ASN H 5.00 459 76 GLY HA2 79 LEU H 5.00 460 76 GLY HA2 80 TYR H 5.00 461 76 GLY C 79 LEU N 3.20 462 76 GLY O 79 LEU H 2.00 463 76 GLY HA 77 TYR H 3.78 464 77 TYR HA 77 TYR H 3.50 465 77 TYR HA 78 ASN H 3.85 466 77 TYR HA 80 TYR H 3.85 467 77 TYR HA 80 TYR HE1 5.00 468 77 TYR HB2 77 TYR H 3.50 469 77 TYR HB2 78 ASN H 4.50 470 77 TYR HB2 79 LEU H 5.00 471 77 TYR HB3 77 TYR H 3.50 472 77 TYR HB3 78 ASN H 3.85 473 77 TYR H 78 ASN H 3.65 474 77 TYR C 80 TYR N 3.20 475 77 TYR O 80 TYR H 2.00 476 78 ASN H 79 LEU H 3.85 477 78 ASN HA 78 ASN H 3.50 478 78 ASN HA 79 LEU H 4.13 479 78 ASN HA 80 TYR H 4.87 480 78 ASN HA 81 ARG H 4.40 481 78 ASN HA 82 ALA H 4.80 482 78 ASN HB2 79 LEU H 4.70 483 78 ASN HB3 79 LEU H 4.70 484 78 ASN HB3 78 ASN H 4.00 485 78 ASN H 79 LEU H 4.15 486 79 LEU H 77 TYR H 4.50 487 79 LEU H 80 TYR H 3.50 488 79 LEU H 81 ARG H 4.50 489 79 LEU HA 79 LEU H 3.95 490 79 LEU HA 80 TYR H 3.95 491 79 LEU HA 81 ARG H 4.20 492 79 LEU HA 83 ILE H 4.97 493 79 LEU HB2 79 LEU H 4.57 494 79 LEU HB2 80 TYR H 4.37 495 79 LEU HB3 79 LEU H 4.57 496 79 LEU HB3 80 TYR H 4.37 497 79 LEU QQD 79 LEU H 4.17 498 79 LEU QQD 80 TYR H 4.60 499 79 LEU C 82 ALA N 3.20 500 79 LEU O 82 ALA H 2.00 501 79 LEU QQD 80 TYR HA 5.00 502 79 LEU QQD 80 TYR H 5.00 503 80 TYR HA 80 TYR H 3.50 504 80 TYR HA 81 ARG H 4.00 505 80 TYR HA 82 ALA H 4.50 506 80 TYR HA 83 ILE H 5.00 507 80 TYR HB2 80 TYR H 3.50 508 80 TYR HB3 80 TYR H 3.50 509 80 TYR HB2 81 ARG H 5.00 510 80 TYR HB3 81 ARG H 5.20 511 80 TYR H 81 ARG H 4.50 512 81 ARG H 82 ALA H 4.00 513 81 ARG H 83 ILE H 4.50 514 81 ARG HA 81 ARG H 3.50 515 81 ARG HB3 81 ARG H 4.30 516 81 ARG HB2 81 ARG H 4.30 517 81 ARG HA 83 ILE H 4.50 518 81 ARG HA 84 LYS H 4.50 519 81 ARG HA 85 LYS H 4.50 520 81 ARG HB 85 LYS H 4.50 521 81 ARG HB3 84 LYS H 4.50 522 81 ARG QG 81 ARG H 3.90 523 81 ARG C 84 LYS N 3.20 524 81 ARG O 84 LYS H 2.00 525 82 ALA HA 82 ALA H 3.50 526 82 ALA HB 82 ALA H 3.50 527 82 ALA HB 83 ILE HA 3.80 528 82 ALA H 83 ILE H 3.50 529 83 ILE HA 83 ILE H 3.80 530 83 ILE HA 84 LYS H 3.53 531 83 ILE HA 85 LYS H 4.53 532 83 ILE HB 83 ILE H 4.20 533 83 ILE HG21 83 ILE H 4.80 534 83 ILE QD1 83 ILE H 4.90 535 83 ILE QD1 84 LYS H 4.73 536 83 ILE H 84 LYS H 4.10 537 82 ALA H 84 LYS H 4.10 538 84 LYS HA 84 LYS H 3.60 539 84 LYS HB2 84 LYS H 3.60 540 84 LYS QG 84 LYS H 3.65 541 84 LYS HA 85 LYS H 3.53 542 84 LYS QG 85 LYS H 4.65 543 84 LYS H 85 LYS H 4.30 544 83 ILE H 85 LYS H 4.30 545 82 ALA HB 85 LYS H 4.80 546 84 LYS HA 84 LYS H 3.60 547 84 LYS HB2 84 LYS H 4.10 548 83 ILE QD1 86 LYS H 4.73 549 83 ILE HG21 86 LYS H 4.80 550 85 LYS HA 85 LYS H 3.62 551 85 LYS HB2 85 LYS H 3.63 552 85 LYS QG 85 LYS H 3.65 553 86 LYS HA 86 LYS H 3.62 554 86 LYS H 85 LYS H 4.30 555 98 TRP HA 98 TRP H 3.80 556 98 TRP HB2 98 TRP H 4.53 557 98 TRP HE1 98 TRP HE1 4.00 558 98 TRP HZ2 98 TRP HE1 4.25 559 99 PRO HB2 100 LEU H 4.88 560 99 PRO HB2 102 ILE H 4.75 561 99 PRO HB2 103 ARG H 5.00 562 100 LEU H 102 ILE H 4.75 563 100 LEU HA 100 LEU H 3.65 564 100 LEU HB 100 LEU H 3.15 565 100 LEU HG 100 LEU H 4.00 566 100 LEU HA 104 THR H 5.10 567 100 LEU H 101 VAL H 3.50 568 101 VAL H 102 ILE H 3.50 569 101 VAL H 103 ARG H 4.20 570 101 VAL HA 101 VAL H 4.00 571 101 VAL HB 101 VAL H 3.78 572 101 VAL QQG 101 VAL H 4.20 573 101 VAL HA 102 ILE H 4.60 574 101 VAL HB 104 THR H 5.00 575 101 VAL HB 104 THR HB 5.00 576 101 VAL QQG 104 THR HB 5.00 577 101 VAL QQG 98 TRP HZ2 5.50 578 101 VAL HA 104 THR H 4.75 579 101 VAL QQG 102 ILE H 5.00 580 101 VAL QQG 104 THR H 4.95 581 103 ARG H 102 ILE H 3.35 582 102 ILE H 104 THR H 4.40 583 102 ILE HA 103 ARG H 4.60 584 102 ILE HA 104 THR H 4.80 585 102 ILE HB 102 ILE H 3.60 586 102 ILE HA 102 ILE H 3.50 587 102 ILE HG21 102 ILE H 3.80 588 102 ILE HG23 102 ILE H 3.70 589 103 ARG HA 103 ARG H 3.50 590 103 ARG HA 104 THR H 4.20 591 103 ARG HA 107 ALA H 4.80 592 103 ARG HB2 103 ARG H 3.50 593 103 ARG HB2 104 THR H 4.25 594 103 ARG HB2 107 ALA HA 5.50 595 103 ARG HB3 103 ARG H 3.50 596 103 ARG HB3 104 THR H 5.00 597 103 ARG QD 103 ARG H 4.80 598 103 ARG QG 103 ARG H 4.50 599 104 THR H 103 ARG H 3.20 600 104 THR HA 104 THR H 3.98 601 104 THR HB 104 THR H 3.65 602 104 THR HA 105 VAL H 3.76 603 104 THR HB 105 VAL H 4.00 604 104 THR HB 107 ALA H 5.25 605 104 THR HA 107 ALA H 3.85 606 104 THR QG2 104 THR H 4.35 607 104 THR QG2 105 VAL H 3.90 608 105 VAL HA 105 VAL H 3.70 609 105 VAL HB 105 VAL H 3.70 610 105 VAL HB 108 GLY H 5.50 611 105 VAL QQG 105 VAL H 3.70 612 105 VAL QQG 107 ALA H 4.50 613 105 VAL QQG 108 GLY H 4.70 614 105 VAL H 107 ALA H 4.50 615 105 VAL HA 107 ALA H 4.70 616 105 VAL HB 107 ALA H 4.80 617 106 ILE HB 107 ALA H 4.50 618 106 ILE HB 108 GLY H 4.80 619 106 ILE HB 110 ASN H 5.40 620 106 ILE HG12 107 ALA H 4.90 621 106 ILE HG12 108 GLY H 5.20 622 106 ILE HG21 107 ALA H 4.90 623 106 ILE HG21 108 GLY H 5.50 624 106 ILE HG12 109 TYR HD1 5.30 625 106 ILE HG23 107 ALA H 4.85 626 106 ILE HG23 110 ASN H 4.93 627 106 ILE HA 107 ALA H 4.30 628 106 ILE H 107 ALA H 3.50 629 106 ILE C 109 TYR N 3.20 630 106 ILE O 109 TYR H 2.00 631 107 ALA H 108 GLY H 3.10 632 107 ALA HA 107 ALA H 3.95 633 107 ALA HB 107 ALA H 3.65 634 107 ALA HB 108 GLY H 4.00 635 107 ALA HB 110 ASN H 5.20 636 108 GLY H 106 ILE H 4.96 637 108 GLY H 109 TYR H 4.25 638 108 GLY H 110 ASN H 4.70 639 108 GLY HA2 108 GLY H 3.95 640 108 GLY HA2 110 ASN H 5.00 641 108 GLY HA2 111 LEU H 5.00 642 108 GLY HA2 112 TYR H 5.00 643 108 GLY C 111 LEU N 3.20 644 108 GLY O 111 LEU H 2.00 645 108 GLY HA 109 TYR H 3.78 646 109 TYR HA 109 TYR H 3.50 647 109 TYR HA 110 ASN H 3.85 648 109 TYR HA 112 TYR H 3.85 649 109 TYR HA 112 TYR HE1 5.00 650 109 TYR HB2 109 TYR H 3.50 651 109 TYR HB2 110 ASN H 4.50 652 109 TYR HB2 111 LEU H 5.40 653 109 TYR HB3 109 TYR H 3.50 654 109 TYR HB3 110 ASN H 3.85 655 109 TYR H 110 ASN H 3.65 656 109 TYR C 112 TYR N 3.80 657 109 TYR O 112 TYR H 2.00 658 110 ASN H 111 LEU H 3.85 659 110 ASN HA 110 ASN H 3.50 660 110 ASN HA 111 LEU H 4.13 661 110 ASN HA 112 TYR H 4.87 662 110 ASN HA 113 ARG H 4.30 663 110 ASN HA 114 ALA H 4.80 664 110 ASN HB2 111 LEU H 4.70 665 110 ASN HB3 111 LEU H 4.70 666 110 ASN HB3 110 ASN H 4.00 667 110 ASN H 111 LEU H 4.15 668 111 LEU H 109 TYR H 4.50 669 111 LEU H 112 TYR H 3.50 670 111 LEU H 113 ARG H 4.50 671 111 LEU HA 111 LEU H 3.95 672 111 LEU HA 112 TYR H 3.95 673 111 LEU HA 113 ARG H 4.20 674 111 LEU HA 115 ILE H 4.97 675 111 LEU HB2 111 LEU H 4.57 676 111 LEU HB2 112 TYR H 4.37 677 111 LEU HB3 111 LEU H 4.57 678 111 LEU HB3 112 TYR H 4.37 679 111 LEU QQD 111 LEU H 4.17 680 111 LEU QQD 112 TYR H 4.60 681 111 LEU C 114 ALA N 3.20 682 111 LEU O 114 ALA H 2.00 683 111 LEU QQD 112 TYR HA 5.00 684 111 LEU QQD 112 TYR H 5.00 685 112 TYR HA 112 TYR H 3.50 686 112 TYR HA 113 ARG H 4.00 687 112 TYR HA 114 ALA H 4.50 688 112 TYR HA 115 ILE H 5.00 689 112 TYR HB2 112 TYR H 3.50 690 112 TYR HB3 112 TYR H 3.50 691 112 TYR HB2 113 ARG H 5.00 692 112 TYR HB3 113 ARG H 5.20 693 112 TYR H 113 ARG H 4.50 694 113 ARG H 114 ALA H 4.00 695 113 ARG H 115 ILE H 4.40 696 113 ARG HA 113 ARG H 3.50 697 113 ARG HB3 113 ARG H 4.30 698 113 ARG HB2 113 ARG H 4.30 699 113 ARG HA 115 ILE H 4.50 700 113 ARG HA 116 LYS H 4.50 701 113 ARG HA 117 LYS H 4.50 702 113 ARG HB 117 LYS H 4.50 703 113 ARG HB3 116 LYS H 4.50 704 113 ARG QG 113 ARG H 3.90 705 113 ARG C 116 LYS N 3.20 706 113 ARG O 116 LYS H 2.00 707 114 ALA HA 114 ALA H 3.50 708 114 ALA HB 114 ALA H 3.50 709 114 ALA HB 115 ILE HA 3.80 710 114 ALA H 115 ILE H 3.50 711 115 ILE HA 115 ILE H 3.80 712 115 ILE HA 116 LYS H 3.53 713 115 ILE HA 117 LYS H 4.53 714 115 ILE HB 115 ILE H 4.20 715 115 ILE HG21 115 ILE H 4.80 716 115 ILE QD1 115 ILE H 4.90 717 115 ILE QD1 116 LYS H 4.73 718 115 ILE H 116 LYS H 4.10 719 114 ALA H 116 LYS H 4.10 720 116 LYS HA 116 LYS H 3.60 721 116 LYS HB2 116 LYS H 3.60 722 116 LYS QG 116 LYS H 3.65 723 116 LYS HA 116 LYS H 3.53 724 116 LYS QG 117 LYS H 4.65 725 116 LYS H 117 LYS H 4.30 726 115 ILE H 117 LYS H 4.30 727 114 ALA HB 117 LYS H 4.80 728 116 LYS HA 116 LYS H 3.60 729 116 LYS HB2 116 LYS H 4.10 730 115 ILE QD1 118 LYS H 4.73 731 115 ILE HG21 118 LYS H 4.80 732 117 LYS HA 117 LYS H 3.62 733 117 LYS HB2 117 LYS H 3.63 734 117 LYS QG 117 LYS H 3.65 735 118 LYS HA 118 LYS H 3.62 736 118 LYS H 118 LYS H 4.30 737 70 ILE HG21 112 TYR HA 5.20 738 80 TYR HA 102 ILE HG21 5.20 739 81 ARG HA 102 ILE H 5.50 740 70 ILE H 113 ARG HA 5.50 741 81 ARG H 102 ILE HA 5.50 742 70 ILE HA 113 ARG H 5.50 743 81 ARG HA 102 ILE HB 5.50 744 70 ILE HB 113 ARG HA 5.50 745 12 GLY QA 107 ALA H 6.00 746 11 ALA H 108 GLY QA 6.00 747 44 GLY QA 75 ALA H 6.00 748 76 GLY QA 43 ALA H 6.00 749 9 VAL QA 112 TYR H 6.00 750 105 VAL QA 16 TYR H 6.00 751 73 VAL QA 48 TYR H 6.00 752 41 VAL QA 80 TYR H 6.00 753 12 GLY QA 104 THR H 6.00 754 8 THR H 108 GLY QA 6.00 755 44 GLY QA 72 THR H 6.00 756 76 GLY QA 40 THR H 6.00 757 5 VAL HA 8 THR HB 4.50 758 69 VAL HA 72 THR HB 4.50 759 37 VAL HA 40 THR HB 4.50 760 101 VAL HA 104 THR HB 4.50 761 8 THR HA 11 ALA HB 4.50 762 72 THR HA 75 ALA HB 4.50 763 40 THR HA 43 ALA HB 4.50 764 104 THR HA 107 ALA HB 4.50 765 10 ILE HA 13 TYR QB 4.50 766 74 ILE HA 77 TYR QB 4.50 767 42 ILE HA 45 TYR QB 4.50 768 106 ILE HA 109 TYR QB 4.50 769 11 ALA HA 14 ASN QB 4.50 770 75 ALA HA 78 ASN QB 4.50 771 43 ALA HA 46 ASN QB 4.50 772 107 ALA HA 110 ASN QB 4.50 773 12 GLY QA 15 LEU HB2 4.50 774 76 GLY QA 79 LEU HB2 4.50 775 44 GLY QA 47 LEU HB2 4.50 776 108 GLY QA 111 LEU HB2 4.50 777 13 TYR HA 16 TYR QB 4.50 778 77 TYR HA 80 TYR QB 4.50 779 45 TYR HA 48 TYR QB 4.50 780 109 TYR HA 112 TYR QB 4.50 781 14 ASN HA 17 ARG HB2 4.50 782 78 ASN HA 81 ARG HB2 4.50 783 46 ASN HA 49 ARG HB2 4.50 784 110 ASN HA 113 ARG HB2 4.50 785 15 LEU HA 18 ALA HB 4.50 786 79 LEU HA 82 ALA HB 4.50 787 47 LEU HA 50 ALA HB 4.50 788 111 LEU HA 114 ALA HB 4.50 789 16 TYR HA 19 ILE HB 4.50 790 80 TYR HA 83 ILE HB 4.50 791 48 TYR HA 51 ILE HB 4.50 792 112 TYR HA 115 ILE HB 4.50 793 17 ARG HA 20 LYS HB 4.50 794 81 ARG HA 84 LYS HB 4.50 795 49 ARG HA 52 LYS HB 4.50 796 113 ARG HA 116 LYS HB 4.50 797 18 ALA HA 21 LYS HB 4.50 798 82 ALA HA 85 LYS HB 4.50 799 50 ALA HA 53 LYS HB 4.50 800 114 ALA HA 117 LYS HB 4.50 801 19 ILE HA 22 LYS HB 4.50 802 83 ILE HA 86 LYS HB 4.50 803 51 ILE HA 54 LYS HB 4.50 804 115 ILE HA 118 LYS HB 4.50 stop_ Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 VAL 1 H VAL 1 1.807 0.001 0.856 2 HA VAL 1 HA VAL 1 2.181 1.020 -1.582 3 HB VAL 1 HB VAL 1 4.012 -0.598 -1.983 4 HG11 VAL 1 1HG1 VAL 1 5.134 0.782 -0.656 5 HG12 VAL 1 2HG1 VAL 1 3.672 1.134 0.268 6 HG13 VAL 1 3HG1 VAL 1 4.698 -0.228 0.722 7 HG21 VAL 1 3HG2 VAL 1 3.268 -1.934 0.597 8 HG22 VAL 1 1HG2 VAL 1 2.645 -2.515 -0.948 9 HG23 VAL 1 2HG2 VAL 1 4.384 -2.480 -0.655 10 H TRP 2 H TRP 2 -0.361 0.020 -1.860 11 HA TRP 2 HA TRP 2 -0.016 -1.873 -4.088 12 HB2 TRP 2 2HB TRP 2 -2.274 -2.803 -3.487 13 HB3 TRP 2 3HB TRP 2 -1.004 -3.148 -2.316 14 HD1 TRP 2 HD1 TRP 2 -1.017 -1.458 -0.076 15 HE1 TRP 2 HE1 TRP 2 -3.050 -0.543 1.212 16 HE3 TRP 2 HE3 TRP 2 -4.606 -2.105 -3.658 17 HZ2 TRP 2 HZ2 TRP 2 -5.809 -0.149 0.768 18 HZ3 TRP 2 HZ3 TRP 2 -6.918 -1.434 -3.147 19 HH2 TRP 2 HH2 TRP 2 -7.505 -0.477 -0.979 20 HA PRO 3 HA PRO 3 -2.123 2.018 -5.500 21 HB2 PRO 3 2HB PRO 3 -0.622 2.293 -7.746 22 HB3 PRO 3 3HB PRO 3 -0.130 2.941 -6.177 23 HG2 PRO 3 2HG PRO 3 0.728 0.416 -7.537 24 HG3 PRO 3 3HG PRO 3 1.710 1.602 -6.657 25 HD2 PRO 3 2HD PRO 3 0.912 -0.736 -5.550 26 HD3 PRO 3 3HD PRO 3 1.124 0.747 -4.598 27 H LEU 4 H LEU 4 -3.600 -0.098 -5.689 28 HA LEU 4 HA LEU 4 -3.809 -1.005 -8.450 29 HB2 LEU 4 2HB LEU 4 -4.161 -2.812 -7.098 30 HB3 LEU 4 3HB LEU 4 -4.933 -1.855 -5.836 31 HG LEU 4 HG LEU 4 -6.970 -1.722 -7.234 32 HD11 LEU 4 1HD1 LEU 4 -5.202 -2.757 -9.222 33 HD12 LEU 4 2HD1 LEU 4 -6.865 -2.198 -9.395 34 HD13 LEU 4 3HD1 LEU 4 -6.540 -3.883 -8.990 35 HD21 LEU 4 3HD2 LEU 4 -7.770 -3.817 -6.624 36 HD22 LEU 4 1HD2 LEU 4 -6.419 -3.567 -5.518 37 HD23 LEU 4 2HD2 LEU 4 -6.223 -4.608 -6.928 38 H VAL 5 H VAL 5 -5.381 1.136 -6.205 39 HA VAL 5 HA VAL 5 -7.719 1.484 -7.888 40 HB VAL 5 HB VAL 5 -8.428 3.146 -6.215 41 HG11 VAL 5 1HG1 VAL 5 -7.854 0.344 -5.666 42 HG12 VAL 5 2HG1 VAL 5 -8.015 1.317 -4.203 43 HG13 VAL 5 3HG1 VAL 5 -9.324 1.275 -5.384 44 HG21 VAL 5 3HG2 VAL 5 -6.723 4.227 -5.217 45 HG22 VAL 5 1HG2 VAL 5 -6.809 2.899 -4.059 46 HG23 VAL 5 2HG2 VAL 5 -5.627 2.853 -5.367 47 H ILE 6 H ILE 6 -4.763 3.206 -7.072 48 HA ILE 6 HA ILE 6 -5.432 5.645 -8.351 49 HB ILE 6 HB ILE 6 -3.105 6.230 -8.168 50 HG12 ILE 6 2HG1 ILE 6 -1.685 4.226 -7.050 51 HG13 ILE 6 3HG1 ILE 6 -2.764 3.285 -8.074 52 HG21 ILE 6 1HG2 ILE 6 -4.585 6.072 -6.111 53 HG22 ILE 6 2HG2 ILE 6 -3.716 4.586 -5.730 54 HG23 ILE 6 3HG2 ILE 6 -2.844 6.115 -5.832 55 HD11 ILE 6 3HD1 ILE 6 -1.767 5.437 -9.617 56 HD12 ILE 6 1HD1 ILE 6 -0.407 4.679 -8.789 57 HD13 ILE 6 2HD1 ILE 6 -1.470 3.709 -9.809 58 H ARG 7 H ARG 7 -4.355 2.590 -9.518 59 HA ARG 7 HA ARG 7 -3.389 3.637 -12.042 60 HB2 ARG 7 2HB ARG 7 -3.108 1.220 -12.621 61 HB3 ARG 7 3HB ARG 7 -2.237 1.719 -11.177 62 HG2 ARG 7 2HG ARG 7 -3.910 0.713 -9.765 63 HG3 ARG 7 3HG ARG 7 -4.899 0.313 -11.172 64 HD2 ARG 7 2HD ARG 7 -2.133 -0.747 -10.597 65 HD3 ARG 7 3HD ARG 7 -3.643 -1.628 -10.361 66 HE ARG 7 HE ARG 7 -3.731 -0.928 -12.974 67 HH11 ARG 7 1HH1 ARG 7 -1.357 -2.538 -11.001 68 HH12 ARG 7 2HH1 ARG 7 -0.733 -3.495 -12.303 69 HH21 ARG 7 1HH2 ARG 7 -2.918 -2.183 -14.697 70 HH22 ARG 7 2HH2 ARG 7 -1.621 -3.292 -14.405 71 H THR 8 H THR 8 -6.307 2.327 -10.709 72 HA THR 8 HA THR 8 -7.637 1.354 -12.917 73 HB THR 8 HB THR 8 -9.231 3.077 -11.095 74 HG1 THR 8 HG1 THR 8 -7.889 0.716 -10.218 75 HG21 THR 8 3HG2 THR 8 -10.549 1.733 -12.457 76 HG22 THR 8 1HG2 THR 8 -10.462 0.794 -10.967 77 HG23 THR 8 2HG2 THR 8 -9.446 0.361 -12.343 78 H VAL 9 H VAL 9 -7.547 4.726 -11.777 79 HA VAL 9 HA VAL 9 -9.090 5.742 -13.939 80 HB VAL 9 HB VAL 9 -8.277 7.971 -13.190 81 HG11 VAL 9 1HG1 VAL 9 -9.790 6.042 -11.661 82 HG12 VAL 9 2HG1 VAL 9 -9.028 7.240 -10.613 83 HG13 VAL 9 3HG1 VAL 9 -10.093 7.760 -11.920 84 HG21 VAL 9 3HG2 VAL 9 -6.216 7.937 -12.287 85 HG22 VAL 9 1HG2 VAL 9 -7.077 7.585 -10.789 86 HG23 VAL 9 2HG2 VAL 9 -6.375 6.271 -11.732 87 H ILE 10 H ILE 10 -5.628 5.444 -13.324 88 HA ILE 10 HA ILE 10 -4.677 6.971 -15.460 89 HB ILE 10 HB ILE 10 -3.357 4.471 -14.411 90 HG12 ILE 10 2HG1 ILE 10 -4.184 6.498 -12.805 91 HG13 ILE 10 3HG1 ILE 10 -2.760 5.513 -12.489 92 HG21 ILE 10 1HG2 ILE 10 -2.365 6.939 -15.809 93 HG22 ILE 10 2HG2 ILE 10 -1.292 5.853 -14.927 94 HG23 ILE 10 3HG2 ILE 10 -2.207 5.256 -16.312 95 HD11 ILE 10 3HD1 ILE 10 -1.311 7.169 -13.312 96 HD12 ILE 10 1HD1 ILE 10 -2.634 8.069 -14.053 97 HD13 ILE 10 2HD1 ILE 10 -2.480 8.013 -12.297 98 H ALA 11 H ALA 11 -6.274 3.948 -15.447 99 HA ALA 11 HA ALA 11 -5.274 2.580 -17.602 100 HB1 ALA 11 1HB ALA 11 -7.673 1.833 -17.980 101 HB2 ALA 11 2HB ALA 11 -7.002 1.565 -16.371 102 HB3 ALA 11 3HB ALA 11 -8.106 2.911 -16.653 103 H GLY 12 H GLY 12 -7.020 5.582 -17.597 104 HA2 GLY 12 2HA GLY 12 -7.420 5.470 -20.497 105 HA3 GLY 12 3HA GLY 12 -8.074 6.685 -19.408 106 H TYR 13 H TYR 13 -5.376 6.966 -18.122 107 HA TYR 13 HA TYR 13 -4.482 9.226 -19.412 108 HB2 TYR 13 2HB TYR 13 -3.232 7.310 -17.499 109 HB3 TYR 13 3HB TYR 13 -2.192 8.498 -18.277 110 HD1 TYR 13 HD1 TYR 13 -5.635 8.585 -16.808 111 HD2 TYR 13 HD2 TYR 13 -1.733 10.278 -16.895 112 HE1 TYR 13 HE1 TYR 13 -6.336 10.269 -15.158 113 HE2 TYR 13 HE2 TYR 13 -2.423 11.966 -15.244 114 HH TYR 13 HH TYR 13 -5.714 12.434 -14.359 115 H ASN 14 H ASN 14 -3.180 5.927 -19.727 116 HA ASN 14 HA ASN 14 -1.134 6.391 -21.503 117 HB2 ASN 14 2HB ASN 14 -2.741 4.104 -20.701 118 HB3 ASN 14 3HB ASN 14 -2.248 3.994 -22.389 119 HD21 ASN 14 1HD2 ASN 14 -0.456 2.901 -22.652 120 HD22 ASN 14 2HD2 ASN 14 0.888 2.858 -21.566 121 H LEU 15 H LEU 15 -4.526 6.606 -22.052 122 HA LEU 15 HA LEU 15 -4.241 6.531 -24.950 123 HB2 LEU 15 2HB LEU 15 -6.345 6.052 -23.098 124 HB3 LEU 15 3HB LEU 15 -6.836 7.370 -24.159 125 HG LEU 15 HG LEU 15 -5.727 5.245 -25.729 126 HD11 LEU 15 1HD1 LEU 15 -6.271 3.579 -24.243 127 HD12 LEU 15 2HD1 LEU 15 -7.759 3.703 -25.180 128 HD13 LEU 15 3HD1 LEU 15 -7.653 4.460 -23.591 129 HD21 LEU 15 3HD2 LEU 15 -7.585 5.613 -27.026 130 HD22 LEU 15 1HD2 LEU 15 -7.475 7.149 -26.167 131 HD23 LEU 15 2HD2 LEU 15 -8.629 5.924 -25.638 132 H TYR 16 H TYR 16 -4.783 8.818 -22.352 133 HA TYR 16 HA TYR 16 -5.716 11.049 -23.568 134 HB2 TYR 16 2HB TYR 16 -3.445 10.875 -21.580 135 HB3 TYR 16 3HB TYR 16 -4.269 12.370 -22.007 136 HD1 TYR 16 HD1 TYR 16 -6.680 9.879 -22.146 137 HD2 TYR 16 HD2 TYR 16 -4.405 12.112 -19.327 138 HE1 TYR 16 HE1 TYR 16 -8.382 9.432 -20.427 139 HE2 TYR 16 HE2 TYR 16 -6.100 11.670 -17.601 140 HH TYR 16 HH TYR 16 -8.146 9.406 -17.568 141 H ARG 17 H ARG 17 -2.291 10.071 -23.525 142 HA ARG 17 HA ARG 17 -1.550 12.152 -25.371 143 HB2 ARG 17 2HB ARG 17 -0.008 9.794 -24.276 144 HB3 ARG 17 3HB ARG 17 0.685 11.038 -25.308 145 HG2 ARG 17 2HG ARG 17 0.803 12.545 -23.641 146 HG3 ARG 17 3HG ARG 17 -0.709 12.009 -22.905 147 HD2 ARG 17 2HD ARG 17 1.003 11.461 -21.370 148 HD3 ARG 17 3HD ARG 17 0.535 9.948 -22.147 149 HE ARG 17 HE ARG 17 2.681 11.067 -23.562 150 HH11 ARG 17 1HH1 ARG 17 1.987 9.601 -20.482 151 HH12 ARG 17 2HH1 ARG 17 3.588 8.975 -20.272 152 HH21 ARG 17 1HH2 ARG 17 4.794 10.249 -23.297 153 HH22 ARG 17 2HH2 ARG 17 5.185 9.345 -21.873 154 H ALA 18 H ALA 18 -2.530 8.838 -25.561 155 HA ALA 18 HA ALA 18 -1.431 7.969 -27.929 156 HB1 ALA 18 1HB ALA 18 -3.250 6.435 -28.106 157 HB2 ALA 18 2HB ALA 18 -2.894 6.649 -26.391 158 HB3 ALA 18 3HB ALA 18 -4.284 7.461 -27.110 159 H ILE 19 H ILE 19 -4.270 10.034 -27.469 160 HA ILE 19 HA ILE 19 -4.816 10.209 -30.288 161 HB ILE 19 HB ILE 19 -5.898 11.869 -28.008 162 HG12 ILE 19 2HG1 ILE 19 -6.442 9.487 -27.785 163 HG13 ILE 19 3HG1 ILE 19 -7.878 10.423 -28.184 164 HG21 ILE 19 1HG2 ILE 19 -6.241 12.003 -30.898 165 HG22 ILE 19 2HG2 ILE 19 -7.764 11.876 -30.021 166 HG23 ILE 19 3HG2 ILE 19 -6.642 13.185 -29.653 167 HD11 ILE 19 3HD1 ILE 19 -8.254 9.112 -29.917 168 HD12 ILE 19 1HD1 ILE 19 -6.690 9.547 -30.605 169 HD13 ILE 19 2HD1 ILE 19 -6.820 8.169 -29.511 170 H LYS 20 H LYS 20 -2.791 11.846 -28.057 171 HA LYS 20 HA LYS 20 -2.627 14.330 -29.474 172 HB2 LYS 20 2HB LYS 20 -1.346 13.107 -27.113 173 HB3 LYS 20 3HB LYS 20 -0.353 14.266 -27.988 174 HG2 LYS 20 2HG LYS 20 -3.119 14.809 -26.926 175 HG3 LYS 20 3HG LYS 20 -1.610 15.290 -26.145 176 HD2 LYS 20 2HD LYS 20 -1.760 17.189 -27.308 177 HD3 LYS 20 3HD LYS 20 -1.352 16.235 -28.736 178 HE2 LYS 20 2HE LYS 20 -4.070 15.811 -28.381 179 HE3 LYS 20 3HE LYS 20 -3.848 17.520 -28.008 180 HZ1 LYS 20 3HZ LYS 20 -3.889 17.835 -30.194 181 HZ2 LYS 20 1HZ LYS 20 -3.738 16.184 -30.532 182 HZ3 LYS 20 2HZ LYS 20 -2.357 17.121 -30.258 183 H LYS 21 H LYS 21 -1.006 11.258 -29.622 184 HA LYS 21 HA LYS 21 1.181 12.245 -31.234 185 HB2 LYS 21 2HB LYS 21 0.340 9.426 -30.535 186 HB3 LYS 21 3HB LYS 21 1.814 9.852 -31.396 187 HG2 LYS 21 2HG LYS 21 2.665 11.014 -29.475 188 HG3 LYS 21 3HG LYS 21 1.143 10.782 -28.612 189 HD2 LYS 21 2HD LYS 21 2.511 8.357 -29.635 190 HD3 LYS 21 3HD LYS 21 3.252 9.186 -28.264 191 HE2 LYS 21 2HE LYS 21 0.442 8.999 -27.819 192 HE3 LYS 21 3HE LYS 21 1.051 7.406 -28.265 193 HZ1 LYS 21 3HZ LYS 21 1.954 9.122 -26.024 194 HZ2 LYS 21 1HZ LYS 21 2.807 7.755 -26.539 195 HZ3 LYS 21 2HZ LYS 21 1.237 7.592 -25.933 196 H LYS 22 H LYS 22 -1.797 10.410 -31.716 197 HA LYS 22 HA LYS 22 -2.988 9.883 -33.580 198 HB2 LYS 22 2HB LYS 22 -2.899 12.345 -33.886 199 HB3 LYS 22 3HB LYS 22 -1.432 12.151 -34.836 200 HG2 LYS 22 2HG LYS 22 -3.125 12.381 -36.418 201 HG3 LYS 22 3HG LYS 22 -2.822 10.643 -36.355 202 HD2 LYS 22 2HD LYS 22 -4.843 11.554 -34.449 203 HD3 LYS 22 3HD LYS 22 -5.278 11.845 -36.135 204 HE2 LYS 22 2HE LYS 22 -4.141 9.221 -35.826 205 HE3 LYS 22 3HE LYS 22 -5.481 9.444 -34.702 206 HZ1 LYS 22 3HZ LYS 22 -6.152 10.464 -37.256 207 HZ2 LYS 22 1HZ LYS 22 -6.917 9.251 -36.359 208 HZ3 LYS 22 2HZ LYS 22 -5.639 8.858 -37.396 209 H GLY 23 H GLY 23 -1.968 7.843 -33.794 210 HA2 GLY 23 2HA GLY 23 -0.581 7.538 -36.311 211 HA3 GLY 23 3HA GLY 23 0.399 7.143 -34.906 212 H GLY 24 H GLY 24 -1.636 6.006 -33.298 213 HA2 GLY 24 2HA GLY 24 -2.818 3.848 -34.843 214 HA3 GLY 24 3HA GLY 24 -1.523 3.371 -33.754 215 H GLY 25 H GLY 25 -2.301 2.505 -31.956 216 HA2 GLY 25 2HA GLY 25 -4.207 3.944 -30.346 217 HA3 GLY 25 3HA GLY 25 -4.864 2.469 -31.041 218 H GLY 26 H GLY 26 -3.666 3.636 -28.293 219 HA2 GLY 26 2HA GLY 26 -3.515 1.775 -26.580 220 HA3 GLY 26 3HA GLY 26 -2.233 1.148 -27.606 221 H GLY 27 H GLY 27 -0.614 3.109 -28.183 222 HA2 GLY 27 2HA GLY 27 -0.037 5.166 -26.492 223 HA3 GLY 27 3HA GLY 27 0.588 3.757 -25.649 224 H GLY 28 H GLY 28 2.746 4.113 -25.803 225 HA2 GLY 28 2HA GLY 28 4.670 3.452 -27.110 226 HA3 GLY 28 3HA GLY 28 3.855 4.080 -28.535 227 H GLY 29 H GLY 29 4.747 5.878 -29.278 228 HA2 GLY 29 2HA GLY 29 5.402 8.030 -27.428 229 HA3 GLY 29 3HA GLY 29 6.748 7.368 -28.344 230 H GLY 30 H GLY 30 6.155 10.011 -28.602 231 HA2 GLY 30 2HA GLY 30 5.154 10.103 -31.370 232 HA3 GLY 30 3HA GLY 30 4.541 11.247 -30.185 233 H GLY 31 H GLY 31 6.048 11.684 -32.693 234 HA2 GLY 31 2HA GLY 31 8.404 13.048 -31.542 235 HA3 GLY 31 3HA GLY 31 8.361 12.395 -33.174 236 H GLY 32 H GLY 32 8.342 15.190 -31.543 237 HA2 GLY 32 2HA GLY 32 7.880 17.351 -32.173 238 HA3 GLY 32 3HA GLY 32 7.504 16.726 -33.772 239 H VAL 33 H VAL 33 6.199 17.377 -30.571 240 HA VAL 33 HA VAL 33 3.601 17.902 -31.758 241 HB VAL 33 HB VAL 33 2.440 16.535 -29.986 242 HG11 VAL 33 1HG1 VAL 33 2.580 15.840 -32.341 243 HG12 VAL 33 2HG1 VAL 33 4.085 14.990 -31.988 244 HG13 VAL 33 3HG1 VAL 33 2.577 14.462 -31.241 245 HG21 VAL 33 3HG2 VAL 33 4.633 14.650 -29.722 246 HG22 VAL 33 1HG2 VAL 33 4.999 16.213 -28.993 247 HG23 VAL 33 2HG2 VAL 33 3.564 15.319 -28.490 248 H TRP 34 H TRP 34 2.033 18.452 -29.763 249 HA TRP 34 HA TRP 34 3.557 20.185 -27.932 250 HB2 TRP 34 2HB TRP 34 1.661 21.805 -28.081 251 HB3 TRP 34 3HB TRP 34 2.539 21.604 -29.595 252 HD1 TRP 34 HD1 TRP 34 -0.894 21.449 -28.159 253 HE1 TRP 34 HE1 TRP 34 -2.561 20.625 -29.939 254 HE3 TRP 34 HE3 TRP 34 2.426 19.825 -31.692 255 HZ2 TRP 34 HZ2 TRP 34 -2.480 19.443 -32.501 256 HZ3 TRP 34 HZ3 TRP 34 1.549 18.860 -33.779 257 HH2 TRP 34 HH2 TRP 34 -0.853 18.674 -34.173 258 HA PRO 35 HA PRO 35 0.871 17.301 -25.493 259 HB2 PRO 35 2HB PRO 35 2.769 16.742 -23.634 260 HB3 PRO 35 3HB PRO 35 2.625 15.856 -25.157 261 HG2 PRO 35 2HG PRO 35 4.491 18.081 -24.429 262 HG3 PRO 35 3HG PRO 35 4.828 16.585 -25.319 263 HD2 PRO 35 2HD PRO 35 4.462 18.964 -26.558 264 HD3 PRO 35 3HD PRO 35 3.987 17.421 -27.295 265 H LEU 36 H LEU 36 0.345 19.916 -25.360 266 HA LEU 36 HA LEU 36 1.017 20.902 -22.700 267 HB2 LEU 36 2HB LEU 36 -0.762 22.266 -24.695 268 HB3 LEU 36 3HB LEU 36 0.160 22.983 -23.375 269 HG LEU 36 HG LEU 36 1.380 21.780 -25.859 270 HD11 LEU 36 1HD1 LEU 36 1.565 23.902 -26.776 271 HD12 LEU 36 2HD1 LEU 36 1.252 24.705 -25.238 272 HD13 LEU 36 3HD1 LEU 36 -0.063 23.905 -26.097 273 HD21 LEU 36 3HD2 LEU 36 3.166 23.538 -24.745 274 HD22 LEU 36 1HD2 LEU 36 3.207 21.783 -24.572 275 HD23 LEU 36 2HD2 LEU 36 2.442 22.774 -23.329 276 H VAL 37 H VAL 37 -1.542 19.325 -24.366 277 HA VAL 37 HA VAL 37 -3.571 20.074 -22.429 278 HB VAL 37 HB VAL 37 -5.066 18.612 -23.719 279 HG11 VAL 37 1HG1 VAL 37 -5.427 20.399 -24.983 280 HG12 VAL 37 2HG1 VAL 37 -3.800 20.983 -24.624 281 HG13 VAL 37 3HG1 VAL 37 -4.078 19.947 -26.024 282 HG21 VAL 37 3HG2 VAL 37 -2.584 18.017 -25.323 283 HG22 VAL 37 1HG2 VAL 37 -3.556 16.876 -24.392 284 HG23 VAL 37 2HG2 VAL 37 -4.222 17.623 -25.844 285 H ILE 38 H ILE 38 -1.577 17.290 -23.245 286 HA ILE 38 HA ILE 38 -2.783 15.325 -21.713 287 HB ILE 38 HB ILE 38 -0.558 14.259 -21.561 288 HG12 ILE 38 2HG1 ILE 38 1.129 15.721 -23.118 289 HG13 ILE 38 3HG1 ILE 38 0.292 17.001 -22.247 290 HG21 ILE 38 1HG2 ILE 38 -1.638 13.700 -23.524 291 HG22 ILE 38 2HG2 ILE 38 -1.577 15.348 -24.149 292 HG23 ILE 38 3HG2 ILE 38 -0.116 14.361 -24.122 293 HD11 ILE 38 3HD1 ILE 38 0.882 15.307 -20.224 294 HD12 ILE 38 1HD1 ILE 38 2.252 15.043 -21.302 295 HD13 ILE 38 2HD1 ILE 38 1.889 16.667 -20.719 296 H ARG 39 H ARG 39 -0.520 17.851 -20.731 297 HA ARG 39 HA ARG 39 -0.147 16.913 -18.080 298 HB2 ARG 39 2HB ARG 39 0.704 19.229 -17.654 299 HB3 ARG 39 3HB ARG 39 1.471 18.415 -19.011 300 HG2 ARG 39 2HG ARG 39 0.075 19.669 -20.566 301 HG3 ARG 39 3HG ARG 39 -0.719 20.473 -19.210 302 HD2 ARG 39 2HD ARG 39 2.223 20.618 -19.239 303 HD3 ARG 39 3HD ARG 39 1.406 21.480 -20.541 304 HE ARG 39 HE ARG 39 0.080 22.235 -18.277 305 HH11 ARG 39 1HH1 ARG 39 3.395 22.308 -19.337 306 HH12 ARG 39 2HH1 ARG 39 3.794 23.722 -18.418 307 HH21 ARG 39 1HH2 ARG 39 0.593 24.097 -17.063 308 HH22 ARG 39 2HH2 ARG 39 2.200 24.738 -17.125 309 H THR 40 H THR 40 -2.374 19.230 -19.549 310 HA THR 40 HA THR 40 -3.516 20.369 -17.321 311 HB THR 40 HB THR 40 -5.373 19.538 -19.499 312 HG1 THR 40 HG1 THR 40 -4.387 21.298 -20.776 313 HG21 THR 40 3HG2 THR 40 -6.113 21.065 -17.738 314 HG22 THR 40 1HG2 THR 40 -6.088 21.875 -19.303 315 HG23 THR 40 2HG2 THR 40 -4.800 22.173 -18.136 316 H VAL 41 H VAL 41 -4.251 17.234 -18.786 317 HA VAL 41 HA VAL 41 -6.390 16.646 -16.971 318 HB VAL 41 HB VAL 41 -4.900 14.549 -18.516 319 HG11 VAL 41 1HG1 VAL 41 -7.737 14.934 -17.596 320 HG12 VAL 41 2HG1 VAL 41 -7.274 13.700 -18.769 321 HG13 VAL 41 3HG1 VAL 41 -6.602 13.664 -17.139 322 HG21 VAL 41 3HG2 VAL 41 -5.185 16.298 -20.127 323 HG22 VAL 41 1HG2 VAL 41 -6.404 15.062 -20.441 324 HG23 VAL 41 2HG2 VAL 41 -6.855 16.559 -19.624 325 H ILE 42 H ILE 42 -2.990 15.691 -17.247 326 HA ILE 42 HA ILE 42 -2.950 13.850 -15.129 327 HB ILE 42 HB ILE 42 -0.663 15.602 -16.031 328 HG12 ILE 42 2HG1 ILE 42 -2.116 13.652 -17.490 329 HG13 ILE 42 3HG1 ILE 42 -0.632 14.473 -17.961 330 HG21 ILE 42 1HG2 ILE 42 -0.725 12.943 -14.612 331 HG22 ILE 42 2HG2 ILE 42 0.729 13.734 -15.219 332 HG23 ILE 42 3HG2 ILE 42 -0.215 14.488 -13.934 333 HD11 ILE 42 3HD1 ILE 42 -0.770 11.934 -16.353 334 HD12 ILE 42 1HD1 ILE 42 -0.448 12.033 -18.084 335 HD13 ILE 42 2HD1 ILE 42 0.690 12.734 -16.933 336 H ALA 43 H ALA 43 -3.158 17.265 -15.133 337 HA ALA 43 HA ALA 43 -1.892 18.076 -12.841 338 HB1 ALA 43 1HB ALA 43 -4.508 18.956 -14.030 339 HB2 ALA 43 2HB ALA 43 -3.790 19.749 -12.628 340 HB3 ALA 43 3HB ALA 43 -2.926 19.725 -14.165 341 H GLY 44 H GLY 44 -4.634 15.995 -13.123 342 HA2 GLY 44 2HA GLY 44 -5.325 16.292 -10.296 343 HA3 GLY 44 3HA GLY 44 -6.214 15.357 -11.489 344 H TYR 45 H TYR 45 -3.764 14.034 -12.460 345 HA TYR 45 HA TYR 45 -3.861 11.685 -11.040 346 HB2 TYR 45 2HB TYR 45 -2.810 11.513 -13.107 347 HB3 TYR 45 3HB TYR 45 -1.772 12.902 -12.811 348 HD1 TYR 45 HD2 TYR 45 -2.350 9.834 -10.768 349 HD2 TYR 45 HD1 TYR 45 0.412 12.146 -13.032 350 HE1 TYR 45 HE2 TYR 45 -0.534 8.323 -10.084 351 HE2 TYR 45 HE1 TYR 45 2.236 10.642 -12.356 352 HH TYR 45 HH TYR 45 1.973 7.767 -11.357 353 H ASN 46 H ASN 46 -1.446 14.278 -10.686 354 HA ASN 46 HA ASN 46 0.139 13.207 -8.722 355 HB2 ASN 46 2HB ASN 46 -0.478 15.883 -9.689 356 HB3 ASN 46 3HB ASN 46 -0.090 15.877 -7.971 357 HD21 ASN 46 1HD2 ASN 46 1.075 15.213 -11.178 358 HD22 ASN 46 2HD2 ASN 46 2.752 15.133 -10.769 359 H LEU 47 H LEU 47 -3.121 14.332 -8.456 360 HA LEU 47 HA LEU 47 -3.035 14.329 -5.540 361 HB2 LEU 47 2HB LEU 47 -4.568 15.674 -7.492 362 HB3 LEU 47 3HB LEU 47 -5.676 14.643 -6.589 363 HG LEU 47 HG LEU 47 -5.695 16.798 -5.577 364 HD11 LEU 47 1HD1 LEU 47 -5.042 14.482 -4.211 365 HD12 LEU 47 2HD1 LEU 47 -5.677 15.972 -3.514 366 HD13 LEU 47 3HD1 LEU 47 -3.937 15.693 -3.560 367 HD21 LEU 47 3HD2 LEU 47 -2.746 16.607 -5.902 368 HD22 LEU 47 1HD2 LEU 47 -3.380 17.526 -4.537 369 HD23 LEU 47 2HD2 LEU 47 -3.831 17.969 -6.184 370 H TYR 48 H TYR 48 -4.344 12.482 -8.223 371 HA TYR 48 HA TYR 48 -6.173 10.845 -7.038 372 HB2 TYR 48 2HB TYR 48 -4.388 10.652 -9.334 373 HB3 TYR 48 3HB TYR 48 -4.734 9.078 -8.625 374 HD1 TYR 48 HD2 TYR 48 -7.477 9.239 -7.776 375 HD2 TYR 48 HD1 TYR 48 -5.659 10.898 -11.247 376 HE1 TYR 48 HE2 TYR 48 -9.649 9.193 -8.929 377 HE2 TYR 48 HE1 TYR 48 -7.826 10.858 -12.409 378 HH TYR 48 HH TYR 48 -10.366 10.899 -11.567 379 H ARG 49 H ARG 49 -2.651 10.351 -7.064 380 HA ARG 49 HA ARG 49 -2.828 8.060 -5.330 381 HB2 ARG 49 2HB ARG 49 -0.477 9.657 -6.353 382 HB3 ARG 49 3HB ARG 49 -0.320 8.234 -5.331 383 HG2 ARG 49 2HG ARG 49 -1.487 6.910 -7.061 384 HG3 ARG 49 3HG ARG 49 -1.512 8.342 -8.093 385 HD2 ARG 49 2HD ARG 49 0.871 6.785 -7.123 386 HD3 ARG 49 3HD ARG 49 0.347 7.053 -8.785 387 HE ARG 49 HE ARG 49 0.834 9.552 -7.922 388 HH11 ARG 49 1HH1 ARG 49 2.697 6.615 -7.783 389 HH12 ARG 49 2HH1 ARG 49 4.226 7.428 -7.848 390 HH21 ARG 49 1HH2 ARG 49 2.840 10.634 -8.007 391 HH22 ARG 49 2HH2 ARG 49 4.306 9.714 -7.974 392 H ALA 50 H ALA 50 -2.481 11.471 -4.960 393 HA ALA 50 HA ALA 50 -1.139 11.742 -2.570 394 HB1 ALA 50 1HB ALA 50 -3.590 13.332 -3.296 395 HB2 ALA 50 2HB ALA 50 -2.222 13.842 -2.305 396 HB3 ALA 50 3HB ALA 50 -2.009 13.584 -4.037 397 H ILE 51 H ILE 51 -4.461 10.730 -3.124 398 HA ILE 51 HA ILE 51 -5.064 10.679 -0.288 399 HB ILE 51 HB ILE 51 -6.695 9.763 -2.660 400 HG12 ILE 51 2HG1 ILE 51 -6.368 12.171 -2.645 401 HG13 ILE 51 3HG1 ILE 51 -8.025 11.801 -2.182 402 HG21 ILE 51 1HG2 ILE 51 -7.216 9.738 0.278 403 HG22 ILE 51 2HG2 ILE 51 -8.552 9.996 -0.842 404 HG23 ILE 51 3HG2 ILE 51 -7.591 8.520 -0.940 405 HD11 ILE 51 3HD1 ILE 51 -6.031 13.279 -0.766 406 HD12 ILE 51 1HD1 ILE 51 -7.742 13.069 -0.397 407 HD13 ILE 51 2HD1 ILE 51 -6.562 11.904 0.202 408 H LYS 52 H LYS 52 -3.831 8.552 -2.678 409 HA LYS 52 HA LYS 52 -4.629 6.097 -1.446 410 HB2 LYS 52 2HB LYS 52 -3.644 5.082 -3.221 411 HB3 LYS 52 3HB LYS 52 -3.712 6.702 -3.902 412 HG2 LYS 52 2HG LYS 52 -1.538 6.220 -4.325 413 HG3 LYS 52 3HG LYS 52 -1.359 6.907 -2.709 414 HD2 LYS 52 2HD LYS 52 -1.877 4.284 -2.152 415 HD3 LYS 52 3HD LYS 52 -0.950 4.160 -3.650 416 HE2 LYS 52 2HE LYS 52 0.401 6.060 -2.128 417 HE3 LYS 52 3HE LYS 52 -0.064 4.810 -0.975 418 HZ1 LYS 52 3HZ LYS 52 1.192 3.234 -2.037 419 HZ2 LYS 52 1HZ LYS 52 2.145 4.609 -2.294 420 HZ3 LYS 52 2HZ LYS 52 1.151 4.025 -3.532 421 H LYS 53 H LYS 53 -2.092 8.367 -0.939 422 HA LYS 53 HA LYS 53 -0.227 6.617 0.308 423 HB2 LYS 53 2HB LYS 53 1.007 8.539 0.843 424 HB3 LYS 53 3HB LYS 53 0.194 8.957 -0.659 425 HG2 LYS 53 2HG LYS 53 -1.620 9.954 0.922 426 HG3 LYS 53 3HG LYS 53 -0.313 9.945 2.108 427 HD2 LYS 53 2HD LYS 53 0.341 11.049 -0.554 428 HD3 LYS 53 3HD LYS 53 -0.780 11.993 0.431 429 HE2 LYS 53 2HE LYS 53 0.867 11.882 2.294 430 HE3 LYS 53 3HE LYS 53 1.993 11.087 1.195 431 HZ1 LYS 53 3HZ LYS 53 2.388 12.996 0.069 432 HZ2 LYS 53 1HZ LYS 53 1.985 13.688 1.559 433 HZ3 LYS 53 2HZ LYS 53 0.836 13.620 0.321 434 H LYS 54 H LYS 54 -2.898 8.595 1.466 435 HA LYS 54 HA LYS 54 -2.368 7.782 4.224 436 HB2 LYS 54 2HB LYS 54 -4.326 9.752 3.036 437 HB3 LYS 54 3HB LYS 54 -4.260 9.355 4.748 438 HG2 LYS 54 2HG LYS 54 -1.695 10.001 4.360 439 HG3 LYS 54 3HG LYS 54 -2.438 10.998 3.107 440 HD2 LYS 54 2HD LYS 54 -4.008 11.259 5.450 441 HD3 LYS 54 3HD LYS 54 -2.318 11.455 5.919 442 HE2 LYS 54 2HE LYS 54 -2.712 13.597 5.306 443 HE3 LYS 54 3HE LYS 54 -2.334 12.962 3.706 444 HZ1 LYS 54 3HZ LYS 54 -4.303 13.856 3.173 445 HZ2 LYS 54 1HZ LYS 54 -4.854 13.897 4.773 446 HZ3 LYS 54 2HZ LYS 54 -4.959 12.465 3.879 447 H GLY 55 H GLY 55 -4.253 7.073 5.551 448 HA2 GLY 55 2HA GLY 55 -5.754 5.053 4.048 449 HA3 GLY 55 3HA GLY 55 -5.503 5.072 5.788 450 H GLY 56 H GLY 56 -6.266 7.834 6.151 451 HA2 GLY 56 2HA GLY 56 -8.626 8.710 5.156 452 HA3 GLY 56 3HA GLY 56 -9.125 7.433 6.254 453 H GLY 57 H GLY 57 -10.020 9.952 6.711 454 HA2 GLY 57 2HA GLY 57 -10.293 11.029 8.815 455 HA3 GLY 57 3HA GLY 57 -8.638 10.595 9.219 456 H GLY 58 H GLY 58 -10.695 12.864 7.556 457 HA2 GLY 58 2HA GLY 58 -9.771 15.207 7.844 458 HA3 GLY 58 3HA GLY 58 -8.341 14.571 7.044 459 H GLY 59 H GLY 59 -8.391 14.146 4.824 460 HA2 GLY 59 2HA GLY 59 -10.665 15.416 3.435 461 HA3 GLY 59 3HA GLY 59 -9.014 15.398 2.832 462 H GLY 60 H GLY 60 -11.883 14.247 2.101 463 HA2 GLY 60 2HA GLY 60 -11.004 12.260 0.362 464 HA3 GLY 60 3HA GLY 60 -11.513 11.451 1.837 465 H GLY 61 H GLY 61 -12.944 14.369 0.457 466 HA2 GLY 61 2HA GLY 61 -14.901 13.974 -1.104 467 HA3 GLY 61 3HA GLY 61 -15.450 12.843 0.124 468 H GLY 62 H GLY 62 -14.315 14.808 2.186 469 HA2 GLY 62 2HA GLY 62 -15.211 16.415 3.560 470 HA3 GLY 62 3HA GLY 62 -15.613 17.258 2.071 471 H GLY 63 H GLY 63 -16.776 14.486 3.997 472 HA2 GLY 63 2HA GLY 63 -18.941 14.392 4.973 473 HA3 GLY 63 3HA GLY 63 -19.478 15.615 3.831 474 H GLY 64 H GLY 64 -18.044 14.018 1.661 475 HA2 GLY 64 2HA GLY 64 -18.539 12.341 0.165 476 HA3 GLY 64 3HA GLY 64 -19.369 11.508 1.471 477 H VAL 65 H VAL 65 -20.290 14.746 0.641 478 HA VAL 65 HA VAL 65 -22.783 13.687 -0.520 479 HB VAL 65 HB VAL 65 -23.127 14.877 1.596 480 HG11 VAL 65 1HG1 VAL 65 -21.161 16.374 1.397 481 HG12 VAL 65 2HG1 VAL 65 -22.037 17.308 0.183 482 HG13 VAL 65 3HG1 VAL 65 -22.643 17.223 1.838 483 HG21 VAL 65 3HG2 VAL 65 -24.918 16.270 0.885 484 HG22 VAL 65 1HG2 VAL 65 -24.156 16.558 -0.680 485 HG23 VAL 65 2HG2 VAL 65 -24.792 14.960 -0.290 486 H TRP 66 H TRP 66 -20.100 15.831 -0.974 487 HA TRP 66 HA TRP 66 -21.145 16.510 -3.639 488 HB2 TRP 66 2HB TRP 66 -20.625 18.752 -3.445 489 HB3 TRP 66 3HB TRP 66 -21.129 18.390 -1.796 490 HD1 TRP 66 HD1 TRP 66 -19.057 17.969 0.003 491 HE1 TRP 66 HE1 TRP 66 -16.744 19.094 0.100 492 HE3 TRP 66 HE3 TRP 66 -18.819 19.750 -4.783 493 HZ2 TRP 66 HZ2 TRP 66 -15.044 20.545 -1.624 494 HZ3 TRP 66 HZ3 TRP 66 -16.815 20.997 -5.479 495 HH2 TRP 66 HH2 TRP 66 -14.968 21.386 -3.931 496 HA PRO 67 HA PRO 67 -17.305 15.100 -5.229 497 HB2 PRO 67 2HB PRO 67 -16.999 16.718 -7.387 498 HB3 PRO 67 3HB PRO 67 -18.192 15.415 -7.325 499 HG2 PRO 67 2HG PRO 67 -18.567 18.350 -6.868 500 HG3 PRO 67 3HG PRO 67 -19.586 17.220 -7.778 501 HD2 PRO 67 2HD PRO 67 -20.184 18.017 -5.261 502 HD3 PRO 67 3HD PRO 67 -20.599 16.404 -5.875 503 H LEU 68 H LEU 68 -15.985 15.794 -3.449 504 HA LEU 68 HA LEU 68 -14.746 18.424 -3.647 505 HB2 LEU 68 2HB LEU 68 -15.185 18.018 -1.439 506 HB3 LEU 68 3HB LEU 68 -14.887 16.287 -1.587 507 HG LEU 68 HG LEU 68 -12.492 16.668 -1.577 508 HD11 LEU 68 1HD1 LEU 68 -12.119 19.278 -0.788 509 HD12 LEU 68 2HD1 LEU 68 -13.313 19.411 -2.079 510 HD13 LEU 68 3HD1 LEU 68 -11.770 18.614 -2.385 511 HD21 LEU 68 3HD2 LEU 68 -12.357 17.816 0.726 512 HD22 LEU 68 1HD2 LEU 68 -13.287 16.325 0.581 513 HD23 LEU 68 2HD2 LEU 68 -14.118 17.880 0.629 514 H VAL 69 H VAL 69 -13.519 15.106 -3.165 515 HA VAL 69 HA VAL 69 -10.955 15.843 -4.280 516 HB VAL 69 HB VAL 69 -10.306 13.516 -3.817 517 HG11 VAL 69 1HG1 VAL 69 -10.932 15.509 -1.968 518 HG12 VAL 69 2HG1 VAL 69 -11.546 14.012 -1.263 519 HG13 VAL 69 3HG1 VAL 69 -9.850 14.137 -1.732 520 HG21 VAL 69 3HG2 VAL 69 -13.191 13.223 -2.994 521 HG22 VAL 69 1HG2 VAL 69 -12.343 12.348 -4.269 522 HG23 VAL 69 2HG2 VAL 69 -11.924 12.068 -2.579 523 H ILE 70 H ILE 70 -13.754 13.914 -5.209 524 HA ILE 70 HA ILE 70 -12.655 12.716 -7.504 525 HB ILE 70 HB ILE 70 -14.951 12.317 -8.223 526 HG12 ILE 70 2HG1 ILE 70 -15.707 14.156 -5.941 527 HG13 ILE 70 3HG1 ILE 70 -15.909 14.498 -7.656 528 HG21 ILE 70 1HG2 ILE 70 -15.041 10.660 -6.749 529 HG22 ILE 70 2HG2 ILE 70 -13.788 11.476 -5.815 530 HG23 ILE 70 3HG2 ILE 70 -15.489 11.775 -5.458 531 HD11 ILE 70 3HD1 ILE 70 -17.736 13.294 -5.915 532 HD12 ILE 70 1HD1 ILE 70 -17.881 13.505 -7.660 533 HD13 ILE 70 2HD1 ILE 70 -17.185 12.022 -7.005 534 H ARG 71 H ARG 71 -13.654 15.934 -6.882 535 HA ARG 71 HA ARG 71 -14.015 16.592 -9.692 536 HB2 ARG 71 2HB ARG 71 -14.886 18.616 -8.997 537 HB3 ARG 71 3HB ARG 71 -15.309 17.576 -7.644 538 HG2 ARG 71 2HG ARG 71 -14.437 19.262 -6.441 539 HG3 ARG 71 3HG ARG 71 -12.913 18.451 -6.810 540 HD2 ARG 71 2HD ARG 71 -12.213 20.324 -7.778 541 HD3 ARG 71 3HD ARG 71 -13.459 20.104 -9.007 542 HE ARG 71 HE ARG 71 -14.621 21.317 -6.767 543 HH11 ARG 71 1HH1 ARG 71 -12.314 22.023 -9.277 544 HH12 ARG 71 2HH1 ARG 71 -12.631 23.726 -9.270 545 HH21 ARG 71 1HH2 ARG 71 -15.047 23.557 -6.748 546 HH22 ARG 71 2HH2 ARG 71 -14.186 24.598 -7.830 547 H THR 72 H THR 72 -11.532 16.568 -7.335 548 HA THR 72 HA THR 72 -9.869 18.639 -7.997 549 HB THR 72 HB THR 72 -8.760 15.873 -7.577 550 HG1 THR 72 HG1 THR 72 -9.991 17.598 -5.675 551 HG21 THR 72 3HG2 THR 72 -6.846 16.969 -7.269 552 HG22 THR 72 1HG2 THR 72 -7.581 17.937 -5.991 553 HG23 THR 72 2HG2 THR 72 -7.663 18.480 -7.667 554 H VAL 73 H VAL 73 -9.663 15.381 -9.445 555 HA VAL 73 HA VAL 73 -7.868 16.165 -11.488 556 HB VAL 73 HB VAL 73 -9.709 13.771 -11.399 557 HG11 VAL 73 1HG1 VAL 73 -7.861 12.841 -12.930 558 HG12 VAL 73 2HG1 VAL 73 -9.050 13.942 -13.628 559 HG13 VAL 73 3HG1 VAL 73 -7.441 14.531 -13.206 560 HG21 VAL 73 3HG2 VAL 73 -7.726 14.322 -9.643 561 HG22 VAL 73 1HG2 VAL 73 -8.207 12.691 -10.113 562 HG23 VAL 73 2HG2 VAL 73 -6.826 13.462 -10.893 563 H ILE 74 H ILE 74 -11.377 15.879 -11.338 564 HA ILE 74 HA ILE 74 -12.022 16.095 -14.020 565 HB ILE 74 HB ILE 74 -13.519 17.360 -11.722 566 HG12 ILE 74 2HG1 ILE 74 -12.936 14.824 -11.667 567 HG13 ILE 74 3HG1 ILE 74 -14.593 15.325 -11.349 568 HG21 ILE 74 1HG2 ILE 74 -14.235 16.760 -14.567 569 HG22 ILE 74 2HG2 ILE 74 -15.476 16.833 -13.318 570 HG23 ILE 74 3HG2 ILE 74 -14.474 18.245 -13.648 571 HD11 ILE 74 3HD1 ILE 74 -13.864 13.387 -13.093 572 HD12 ILE 74 1HD1 ILE 74 -15.378 14.289 -13.166 573 HD13 ILE 74 2HD1 ILE 74 -14.009 14.780 -14.164 574 H ALA 75 H ALA 75 -10.782 18.500 -11.855 575 HA ALA 75 HA ALA 75 -11.567 20.886 -12.917 576 HB1 ALA 75 1HB ALA 75 -9.755 21.850 -11.881 577 HB2 ALA 75 2HB ALA 75 -9.860 20.312 -11.023 578 HB3 ALA 75 3HB ALA 75 -8.670 20.526 -12.307 579 H GLY 76 H GLY 76 -9.453 18.523 -14.362 580 HA2 GLY 76 2HA GLY 76 -8.746 20.378 -16.523 581 HA3 GLY 76 3HA GLY 76 -8.010 18.810 -16.230 582 H TYR 77 H TYR 77 -10.687 17.557 -15.880 583 HA TYR 77 HA TYR 77 -11.046 16.549 -18.437 584 HB2 TYR 77 2HB TYR 77 -12.884 16.661 -16.053 585 HB3 TYR 77 3HB TYR 77 -13.356 15.866 -17.551 586 HD1 TYR 77 HD2 TYR 77 -9.852 15.652 -16.891 587 HD2 TYR 77 HD1 TYR 77 -13.601 13.859 -15.982 588 HE1 TYR 77 HE2 TYR 77 -8.692 13.607 -16.167 589 HE2 TYR 77 HE1 TYR 77 -12.452 11.809 -15.254 590 HH TYR 77 HH TYR 77 -10.490 10.840 -14.860 591 H ASN 78 H ASN 78 -12.764 19.186 -16.810 592 HA ASN 78 HA ASN 78 -14.768 19.720 -18.597 593 HB2 ASN 78 2HB ASN 78 -13.443 21.132 -16.493 594 HB3 ASN 78 3HB ASN 78 -13.681 22.237 -17.844 595 HD21 ASN 78 1HD2 ASN 78 -15.348 19.920 -15.773 596 HD22 ASN 78 2HD2 ASN 78 -16.889 20.698 -15.840 597 H LEU 79 H LEU 79 -11.358 20.232 -18.996 598 HA LEU 79 HA LEU 79 -11.666 21.934 -21.314 599 HB2 LEU 79 2HB LEU 79 -9.635 21.441 -19.478 600 HB3 LEU 79 3HB LEU 79 -9.045 20.750 -20.989 601 HG LEU 79 HG LEU 79 -8.271 23.052 -20.652 602 HD11 LEU 79 1HD1 LEU 79 -10.028 23.603 -22.872 603 HD12 LEU 79 2HD1 LEU 79 -9.403 21.956 -22.945 604 HD13 LEU 79 3HD1 LEU 79 -8.287 23.319 -22.856 605 HD21 LEU 79 3HD2 LEU 79 -9.777 24.911 -20.647 606 HD22 LEU 79 1HD2 LEU 79 -10.273 23.801 -19.370 607 HD23 LEU 79 2HD2 LEU 79 -11.167 23.852 -20.890 608 H TYR 80 H TYR 80 -11.002 18.562 -20.610 609 HA TYR 80 HA TYR 80 -10.018 17.584 -22.949 610 HB2 TYR 80 2HB TYR 80 -11.188 16.483 -20.691 611 HB3 TYR 80 3HB TYR 80 -12.224 15.927 -22.000 612 HD1 TYR 80 HD2 TYR 80 -10.972 14.904 -24.066 613 HD2 TYR 80 HD1 TYR 80 -9.270 15.287 -20.185 614 HE1 TYR 80 HE2 TYR 80 -9.342 13.146 -24.614 615 HE2 TYR 80 HE1 TYR 80 -7.634 13.530 -20.723 616 HH TYR 80 HH TYR 80 -7.940 11.434 -23.213 617 H ARG 81 H ARG 81 -13.457 18.168 -22.246 618 HA ARG 81 HA ARG 81 -14.263 17.508 -24.924 619 HB2 ARG 81 2HB ARG 81 -15.544 17.939 -22.404 620 HB3 ARG 81 3HB ARG 81 -16.293 18.988 -23.600 621 HG2 ARG 81 2HG ARG 81 -16.066 16.550 -24.893 622 HG3 ARG 81 3HG ARG 81 -16.524 16.130 -23.241 623 HD2 ARG 81 2HD ARG 81 -18.038 18.390 -24.219 624 HD3 ARG 81 3HD ARG 81 -18.207 16.995 -25.283 625 HE ARG 81 HE ARG 81 -19.366 15.899 -23.626 626 HH11 ARG 81 1HH1 ARG 81 -17.888 18.772 -22.329 627 HH12 ARG 81 2HH1 ARG 81 -18.740 18.688 -20.823 628 HH21 ARG 81 1HH2 ARG 81 -20.493 15.777 -21.647 629 HH22 ARG 81 2HH2 ARG 81 -20.221 16.983 -20.435 630 H ALA 82 H ALA 82 -13.275 20.357 -23.237 631 HA ALA 82 HA ALA 82 -14.488 22.397 -24.632 632 HB1 ALA 82 1HB ALA 82 -11.588 22.437 -23.827 633 HB2 ALA 82 2HB ALA 82 -12.698 23.802 -23.956 634 HB3 ALA 82 3HB ALA 82 -12.917 22.605 -22.679 635 H ILE 83 H ILE 83 -11.758 20.393 -25.604 636 HA ILE 83 HA ILE 83 -11.272 21.906 -28.010 637 HB ILE 83 HB ILE 83 -10.204 19.207 -27.173 638 HG12 ILE 83 2HG1 ILE 83 -9.512 20.948 -25.626 639 HG13 ILE 83 3HG1 ILE 83 -8.144 20.483 -26.630 640 HG21 ILE 83 1HG2 ILE 83 -9.962 20.753 -29.625 641 HG22 ILE 83 2HG2 ILE 83 -8.402 20.347 -28.911 642 HG23 ILE 83 3HG2 ILE 83 -9.551 19.069 -29.303 643 HD11 ILE 83 3HD1 ILE 83 -9.864 22.920 -27.022 644 HD12 ILE 83 1HD1 ILE 83 -8.250 22.891 -26.312 645 HD13 ILE 83 2HD1 ILE 83 -8.476 22.460 -28.007 646 H LYS 84 H LYS 84 -13.307 19.316 -27.059 647 HA LYS 84 HA LYS 84 -13.615 18.117 -29.639 648 HB2 LYS 84 2HB LYS 84 -14.243 16.594 -28.062 649 HB3 LYS 84 3HB LYS 84 -14.856 17.824 -26.964 650 HG2 LYS 84 2HG LYS 84 -16.666 16.437 -27.735 651 HG3 LYS 84 3HG LYS 84 -16.850 18.068 -28.385 652 HD2 LYS 84 2HD LYS 84 -15.454 16.974 -30.384 653 HD3 LYS 84 3HD LYS 84 -16.245 15.519 -29.772 654 HE2 LYS 84 2HE LYS 84 -17.590 18.065 -30.669 655 HE3 LYS 84 3HE LYS 84 -17.589 16.521 -31.519 656 HZ1 LYS 84 3HZ LYS 84 -18.760 16.956 -28.825 657 HZ2 LYS 84 1HZ LYS 84 -18.844 15.539 -29.745 658 HZ3 LYS 84 2HZ LYS 84 -19.647 16.934 -30.265 659 H LYS 85 H LYS 85 -15.343 20.568 -27.786 660 HA LYS 85 HA LYS 85 -17.518 20.811 -29.614 661 HB2 LYS 85 2HB LYS 85 -17.997 22.918 -28.370 662 HB3 LYS 85 3HB LYS 85 -17.828 21.508 -27.332 663 HG2 LYS 85 2HG LYS 85 -15.567 22.187 -26.749 664 HG3 LYS 85 3HG LYS 85 -15.699 23.582 -27.822 665 HD2 LYS 85 2HD LYS 85 -16.174 24.486 -25.735 666 HD3 LYS 85 3HD LYS 85 -17.778 24.179 -26.404 667 HE2 LYS 85 2HE LYS 85 -18.262 22.664 -24.829 668 HE3 LYS 85 3HE LYS 85 -16.678 21.900 -24.955 669 HZ1 LYS 85 3HZ LYS 85 -16.371 24.412 -23.746 670 HZ2 LYS 85 1HZ LYS 85 -16.086 22.883 -23.080 671 HZ3 LYS 85 2HZ LYS 85 -17.615 23.593 -22.944 672 H LYS 86 H LYS 86 -14.442 22.483 -29.188 673 HA LYS 86 HA LYS 86 -13.344 24.031 -30.451 674 HB2 LYS 86 2HB LYS 86 -13.522 22.001 -31.989 675 HB3 LYS 86 3HB LYS 86 -14.831 22.855 -32.796 676 HG2 LYS 86 2HG LYS 86 -12.534 24.563 -32.526 677 HG3 LYS 86 3HG LYS 86 -12.098 23.047 -33.319 678 HD2 LYS 86 2HD LYS 86 -14.072 23.402 -34.841 679 HD3 LYS 86 3HD LYS 86 -14.225 25.017 -34.144 680 HE2 LYS 86 2HE LYS 86 -11.687 25.189 -34.773 681 HE3 LYS 86 3HE LYS 86 -12.088 23.894 -35.899 682 HZ1 LYS 86 3HZ LYS 86 -12.585 25.632 -37.220 683 HZ2 LYS 86 1HZ LYS 86 -12.876 26.692 -35.934 684 HZ3 LYS 86 2HZ LYS 86 -14.065 25.584 -36.401 685 H GLY 87 H GLY 87 -14.398 25.866 -29.605 686 HA2 GLY 87 2HA GLY 87 -15.828 27.388 -31.588 687 HA3 GLY 87 3HA GLY 87 -16.822 26.944 -30.208 688 H GLY 88 H GLY 88 -14.891 27.143 -28.177 689 HA2 GLY 88 2HA GLY 88 -13.211 29.094 -27.766 690 HA3 GLY 88 3HA GLY 88 -14.645 30.066 -28.063 691 H GLY 89 H GLY 89 -12.770 28.813 -25.688 692 HA2 GLY 89 2HA GLY 89 -13.377 29.396 -23.403 693 HA3 GLY 89 3HA GLY 89 -15.017 28.885 -23.774 694 H GLY 90 H GLY 90 -12.611 28.046 -21.906 695 HA2 GLY 90 2HA GLY 90 -12.204 25.286 -22.553 696 HA3 GLY 90 3HA GLY 90 -11.753 26.082 -21.052 697 H GLY 91 H GLY 91 -13.219 26.137 -19.326 698 HA2 GLY 91 2HA GLY 91 -15.114 23.941 -19.357 699 HA3 GLY 91 3HA GLY 91 -14.639 24.893 -17.958 700 H GLY 92 H GLY 92 -17.247 24.268 -18.205 701 HA2 GLY 92 2HA GLY 92 -19.073 25.754 -17.690 702 HA3 GLY 92 3HA GLY 92 -18.433 26.880 -18.879 703 H GLY 93 H GLY 93 -20.118 23.819 -18.443 704 HA2 GLY 93 2HA GLY 93 -21.558 22.669 -19.812 705 HA3 GLY 93 3HA GLY 93 -21.924 24.234 -20.523 706 H GLY 94 H GLY 94 -22.170 22.430 -22.309 707 HA2 GLY 94 2HA GLY 94 -20.194 22.955 -24.245 708 HA3 GLY 94 3HA GLY 94 -19.898 21.364 -23.558 709 H GLY 95 H GLY 95 -20.281 20.821 -25.903 710 HA2 GLY 95 2HA GLY 95 -23.146 20.712 -26.559 711 HA3 GLY 95 3HA GLY 95 -21.827 20.495 -27.700 712 H GLY 96 H GLY 96 -21.159 18.479 -28.172 713 HA2 GLY 96 2HA GLY 96 -20.692 16.223 -27.152 714 HA3 GLY 96 3HA GLY 96 -22.354 16.292 -26.585 715 H VAL 97 H VAL 97 -20.428 14.963 -28.860 716 HA VAL 97 HA VAL 97 -22.711 14.404 -30.596 717 HB VAL 97 HB VAL 97 -20.039 15.336 -31.655 718 HG11 VAL 97 1HG1 VAL 97 -20.637 13.830 -33.261 719 HG12 VAL 97 2HG1 VAL 97 -22.361 13.979 -32.919 720 HG13 VAL 97 3HG1 VAL 97 -21.531 15.236 -33.836 721 HG21 VAL 97 3HG2 VAL 97 -21.518 17.133 -30.799 722 HG22 VAL 97 1HG2 VAL 97 -21.234 17.234 -32.537 723 HG23 VAL 97 2HG2 VAL 97 -22.764 16.602 -31.929 724 H TRP 98 H TRP 98 -19.210 13.767 -30.314 725 HA TRP 98 HA TRP 98 -19.821 10.891 -30.368 726 HB2 TRP 98 2HB TRP 98 -17.728 10.570 -31.721 727 HB3 TRP 98 3HB TRP 98 -19.031 11.391 -32.576 728 HD1 TRP 98 HD1 TRP 98 -18.758 14.183 -32.678 729 HE1 TRP 98 HE1 TRP 98 -16.607 15.557 -33.010 730 HE3 TRP 98 HE3 TRP 98 -15.319 10.644 -31.341 731 HZ2 TRP 98 HZ2 TRP 98 -13.821 15.189 -32.742 732 HZ3 TRP 98 HZ3 TRP 98 -12.931 11.235 -31.406 733 HH2 TRP 98 HH2 TRP 98 -12.200 13.461 -32.093 734 HA PRO 99 HA PRO 99 -17.172 12.019 -26.725 735 HB2 PRO 99 2HB PRO 99 -18.608 10.567 -24.936 736 HB3 PRO 99 3HB PRO 99 -19.009 12.235 -25.363 737 HG2 PRO 99 2HG PRO 99 -20.212 9.682 -26.361 738 HG3 PRO 99 3HG PRO 99 -21.019 11.187 -25.885 739 HD2 PRO 99 2HD PRO 99 -20.567 10.532 -28.473 740 HD3 PRO 99 3HD PRO 99 -20.571 12.212 -27.900 741 H LEU 100 H LEU 100 -15.891 10.506 -28.291 742 HA LEU 100 HA LEU 100 -15.868 7.730 -27.407 743 HB2 LEU 100 2HB LEU 100 -14.877 9.231 -29.725 744 HB3 LEU 100 3HB LEU 100 -13.798 7.957 -29.162 745 HG LEU 100 HG LEU 100 -16.670 7.307 -29.633 746 HD11 LEU 100 1HD1 LEU 100 -15.761 6.656 -32.010 747 HD12 LEU 100 2HD1 LEU 100 -14.658 8.000 -31.714 748 HD13 LEU 100 3HD1 LEU 100 -16.401 8.269 -31.691 749 HD21 LEU 100 3HD2 LEU 100 -15.381 5.214 -30.519 750 HD22 LEU 100 1HD2 LEU 100 -15.559 5.480 -28.785 751 HD23 LEU 100 2HD2 LEU 100 -14.043 5.890 -29.589 752 H VAL 101 H VAL 101 -13.847 10.613 -27.316 753 HA VAL 101 HA VAL 101 -11.755 9.200 -25.858 754 HB VAL 101 HB VAL 101 -10.541 11.352 -25.930 755 HG11 VAL 101 1HG1 VAL 101 -11.493 9.932 -28.346 756 HG12 VAL 101 2HG1 VAL 101 -10.639 11.456 -28.597 757 HG13 VAL 101 3HG1 VAL 101 -9.857 10.140 -27.721 758 HG21 VAL 101 3HG2 VAL 101 -12.240 12.981 -25.882 759 HG22 VAL 101 1HG2 VAL 101 -11.522 13.109 -27.487 760 HG23 VAL 101 2HG2 VAL 101 -13.064 12.281 -27.275 761 H ILE 102 H ILE 102 -14.031 11.877 -25.367 762 HA ILE 102 HA ILE 102 -13.316 12.680 -22.831 763 HB ILE 102 HB ILE 102 -15.594 13.459 -22.520 764 HG12 ILE 102 2HG1 ILE 102 -17.082 12.855 -24.693 765 HG13 ILE 102 3HG1 ILE 102 -16.156 11.366 -24.542 766 HG21 ILE 102 1HG2 ILE 102 -14.454 14.938 -23.875 767 HG22 ILE 102 2HG2 ILE 102 -14.329 13.788 -25.204 768 HG23 ILE 102 3HG2 ILE 102 -15.871 14.568 -24.857 769 HD11 ILE 102 3HD1 ILE 102 -17.668 10.704 -23.070 770 HD12 ILE 102 1HD1 ILE 102 -17.017 11.914 -21.964 771 HD13 ILE 102 2HD1 ILE 102 -18.393 12.310 -22.994 772 H ARG 103 H ARG 103 -15.173 9.861 -23.802 773 HA ARG 103 HA ARG 103 -16.078 9.146 -21.211 774 HB2 ARG 103 2HB ARG 103 -16.480 6.905 -22.246 775 HB3 ARG 103 3HB ARG 103 -17.208 8.244 -23.123 776 HG2 ARG 103 2HG ARG 103 -16.293 7.271 -24.916 777 HG3 ARG 103 3HG ARG 103 -14.807 8.051 -24.368 778 HD2 ARG 103 2HD ARG 103 -14.067 5.900 -24.598 779 HD3 ARG 103 3HD ARG 103 -14.595 5.866 -22.916 780 HE ARG 103 HE ARG 103 -16.792 5.100 -24.355 781 HH11 ARG 103 1HH1 ARG 103 -13.509 3.980 -24.051 782 HH12 ARG 103 2HH1 ARG 103 -13.906 2.326 -24.377 783 HH21 ARG 103 1HH2 ARG 103 -17.327 2.925 -24.785 784 HH22 ARG 103 2HH2 ARG 103 -16.077 1.727 -24.795 785 H THR 104 H THR 104 -13.295 8.135 -23.163 786 HA THR 104 HA THR 104 -12.270 6.172 -21.488 787 HB THR 104 HB THR 104 -10.469 8.064 -22.980 788 HG1 THR 104 HG1 THR 104 -11.684 5.852 -24.244 789 HG21 THR 104 3HG2 THR 104 -9.128 6.090 -23.334 790 HG22 THR 104 1HG2 THR 104 -10.372 5.068 -22.617 791 HG23 THR 104 2HG2 THR 104 -9.497 6.225 -21.615 792 H VAL 105 H VAL 105 -12.115 9.650 -21.231 793 HA VAL 105 HA VAL 105 -10.042 9.741 -19.274 794 HB VAL 105 HB VAL 105 -12.099 11.897 -19.450 795 HG11 VAL 105 1HG1 VAL 105 -9.914 11.806 -18.018 796 HG12 VAL 105 2HG1 VAL 105 -9.138 12.262 -19.536 797 HG13 VAL 105 3HG1 VAL 105 -10.381 13.298 -18.833 798 HG21 VAL 105 3HG2 VAL 105 -11.905 11.499 -21.747 799 HG22 VAL 105 1HG2 VAL 105 -10.732 12.778 -21.434 800 HG23 VAL 105 2HG2 VAL 105 -10.189 11.112 -21.629 801 H ILE 106 H ILE 106 -13.566 10.248 -19.030 802 HA ILE 106 HA ILE 106 -13.626 10.345 -16.215 803 HB ILE 106 HB ILE 106 -15.857 9.554 -18.091 804 HG12 ILE 106 2HG1 ILE 106 -14.842 12.219 -17.128 805 HG13 ILE 106 3HG1 ILE 106 -15.173 11.702 -18.777 806 HG21 ILE 106 1HG2 ILE 106 -15.903 10.527 -15.238 807 HG22 ILE 106 2HG2 ILE 106 -17.325 10.325 -16.260 808 HG23 ILE 106 3HG2 ILE 106 -16.354 8.922 -15.816 809 HD11 ILE 106 3HD1 ILE 106 -16.960 13.061 -18.387 810 HD12 ILE 106 1HD1 ILE 106 -17.628 11.508 -17.885 811 HD13 ILE 106 2HD1 ILE 106 -17.042 12.649 -16.674 812 H ALA 107 H ALA 107 -13.163 7.746 -18.330 813 HA ALA 107 HA ALA 107 -14.434 5.592 -17.218 814 HB1 ALA 107 1HB ALA 107 -12.540 4.224 -18.002 815 HB2 ALA 107 2HB ALA 107 -13.073 5.396 -19.208 816 HB3 ALA 107 3HB ALA 107 -11.610 5.699 -18.270 817 H GLY 108 H GLY 108 -11.981 7.541 -15.795 818 HA2 GLY 108 2HA GLY 108 -11.351 5.533 -13.763 819 HA3 GLY 108 3HA GLY 108 -10.557 7.088 -13.967 820 H TYR 109 H TYR 109 -13.105 8.540 -14.127 821 HA TYR 109 HA TYR 109 -13.380 9.384 -11.529 822 HB2 TYR 109 2HB TYR 109 -14.299 10.652 -13.377 823 HB3 TYR 109 3HB TYR 109 -15.460 9.375 -13.724 824 HD1 TYR 109 HD2 TYR 109 -17.302 8.920 -12.086 825 HD2 TYR 109 HD1 TYR 109 -14.746 12.304 -11.739 826 HE1 TYR 109 HE2 TYR 109 -18.933 9.991 -10.588 827 HE2 TYR 109 HE1 TYR 109 -16.369 13.383 -10.238 828 HH TYR 109 HH TYR 109 -19.205 12.961 -9.986 829 H ASN 110 H ASN 110 -15.296 6.909 -13.203 830 HA ASN 110 HA ASN 110 -17.194 6.329 -11.320 831 HB2 ASN 110 2HB ASN 110 -15.836 4.804 -13.449 832 HB3 ASN 110 3HB ASN 110 -16.582 3.820 -12.193 833 HD21 ASN 110 1HD2 ASN 110 -18.393 3.070 -13.043 834 HD22 ASN 110 2HD2 ASN 110 -19.611 4.019 -13.818 835 H LEU 111 H LEU 111 -13.788 5.658 -11.192 836 HA LEU 111 HA LEU 111 -14.070 3.903 -8.887 837 HB2 LEU 111 2HB LEU 111 -12.276 3.964 -10.923 838 HB3 LEU 111 3HB LEU 111 -11.389 4.823 -9.665 839 HG LEU 111 HG LEU 111 -10.848 2.424 -9.746 840 HD11 LEU 111 1HD1 LEU 111 -12.181 2.430 -7.183 841 HD12 LEU 111 2HD1 LEU 111 -11.417 3.983 -7.520 842 HD13 LEU 111 3HD1 LEU 111 -10.460 2.502 -7.561 843 HD21 LEU 111 3HD2 LEU 111 -12.386 0.735 -9.423 844 HD22 LEU 111 1HD2 LEU 111 -13.305 1.874 -10.408 845 HD23 LEU 111 2HD2 LEU 111 -13.565 1.806 -8.664 846 H TYR 112 H TYR 112 -13.099 7.172 -9.674 847 HA TYR 112 HA TYR 112 -11.717 8.007 -7.486 848 HB2 TYR 112 2HB TYR 112 -12.971 9.265 -9.580 849 HB3 TYR 112 3HB TYR 112 -13.866 9.877 -8.193 850 HD1 TYR 112 HD2 TYR 112 -11.467 9.739 -6.252 851 HD2 TYR 112 HD1 TYR 112 -11.934 11.341 -10.166 852 HE1 TYR 112 HE2 TYR 112 -9.666 11.353 -5.800 853 HE2 TYR 112 HE1 TYR 112 -10.133 12.958 -9.725 854 HH TYR 112 HH TYR 112 -8.968 13.623 -6.668 855 H ARG 113 H ARG 113 -15.267 7.864 -7.731 856 HA ARG 113 HA ARG 113 -15.622 8.546 -4.962 857 HB2 ARG 113 2HB ARG 113 -17.373 7.966 -7.279 858 HB3 ARG 113 3HB ARG 113 -18.042 7.599 -5.694 859 HG2 ARG 113 2HG ARG 113 -16.876 10.147 -5.489 860 HG3 ARG 113 3HG ARG 113 -17.777 10.123 -7.006 861 HD2 ARG 113 2HD ARG 113 -19.548 8.916 -5.363 862 HD3 ARG 113 3HD ARG 113 -18.736 9.989 -4.223 863 HE ARG 113 HE ARG 113 -19.305 11.621 -6.300 864 HH11 ARG 113 1HH1 ARG 113 -21.216 9.407 -4.412 865 HH12 ARG 113 2HH1 ARG 113 -22.682 10.313 -4.593 866 HH21 ARG 113 1HH2 ARG 113 -21.228 12.823 -6.546 867 HH22 ARG 113 2HH2 ARG 113 -22.688 12.255 -5.808 868 H ALA 114 H ALA 114 -15.261 5.640 -6.802 869 HA ALA 114 HA ALA 114 -16.528 3.734 -5.277 870 HB1 ALA 114 1HB ALA 114 -13.790 3.354 -6.470 871 HB2 ALA 114 2HB ALA 114 -15.032 2.131 -6.196 872 HB3 ALA 114 3HB ALA 114 -15.274 3.374 -7.423 873 H ILE 115 H ILE 115 -13.458 5.346 -4.656 874 HA ILE 115 HA ILE 115 -12.923 3.728 -2.314 875 HB ILE 115 HB ILE 115 -11.482 6.163 -3.370 876 HG12 ILE 115 2HG1 ILE 115 -11.360 4.255 -4.898 877 HG13 ILE 115 3HG1 ILE 115 -9.797 4.539 -4.141 878 HG21 ILE 115 1HG2 ILE 115 -11.195 4.592 -0.919 879 HG22 ILE 115 2HG2 ILE 115 -9.698 4.790 -1.829 880 HG23 ILE 115 3HG2 ILE 115 -10.607 6.209 -1.308 881 HD11 ILE 115 3HD1 ILE 115 -11.201 2.705 -2.518 882 HD12 ILE 115 1HD1 ILE 115 -11.351 2.167 -4.190 883 HD13 ILE 115 2HD1 ILE 115 -9.754 2.432 -3.489 884 H LYS 116 H LYS 116 -14.520 6.671 -3.070 885 HA LYS 116 HA LYS 116 -14.284 7.843 -0.454 886 HB2 LYS 116 2HB LYS 116 -15.276 9.672 -1.358 887 HB3 LYS 116 3HB LYS 116 -14.832 8.892 -2.871 888 HG2 LYS 116 2HG LYS 116 -17.007 9.322 -3.325 889 HG3 LYS 116 3HG LYS 116 -17.206 7.754 -2.539 890 HD2 LYS 116 2HD LYS 116 -17.254 9.460 -0.408 891 HD3 LYS 116 3HD LYS 116 -18.037 10.426 -1.661 892 HE2 LYS 116 2HE LYS 116 -19.154 7.898 -1.932 893 HE3 LYS 116 3HE LYS 116 -19.030 8.136 -0.190 894 HZ1 LYS 116 3HZ LYS 116 -20.451 9.916 -0.240 895 HZ2 LYS 116 1HZ LYS 116 -21.109 8.966 -1.475 896 HZ3 LYS 116 2HZ LYS 116 -20.129 10.290 -1.858 897 H LYS 117 H LYS 117 -16.290 5.500 -1.929 898 HA LYS 117 HA LYS 117 -18.513 5.864 -0.110 899 HB2 LYS 117 2HB LYS 117 -17.916 4.151 -2.453 900 HB3 LYS 117 3HB LYS 117 -19.013 3.474 -1.256 901 HG2 LYS 117 2HG LYS 117 -20.272 5.709 -1.463 902 HG3 LYS 117 3HG LYS 117 -19.352 5.914 -2.955 903 HD2 LYS 117 2HD LYS 117 -20.362 3.286 -2.991 904 HD3 LYS 117 3HD LYS 117 -21.690 4.326 -2.469 905 HE2 LYS 117 2HE LYS 117 -21.129 5.814 -4.430 906 HE3 LYS 117 3HE LYS 117 -20.053 4.534 -4.988 907 HZ1 LYS 117 3HZ LYS 117 -21.855 3.070 -5.272 908 HZ2 LYS 117 1HZ LYS 117 -22.357 4.536 -5.951 909 HZ3 LYS 117 2HZ LYS 117 -22.924 4.072 -4.426 910 H LYS 118 H LYS 118 -15.823 3.620 -0.555 911 HA LYS 118 HA LYS 118 -16.600 1.867 1.559 912 HB2 LYS 118 2HB LYS 118 -13.910 2.245 0.229 913 HB3 LYS 118 3HB LYS 118 -14.338 0.914 1.296 914 HG2 LYS 118 2HG LYS 118 -16.173 1.266 -0.951 915 HG3 LYS 118 3HG LYS 118 -14.516 0.880 -1.423 916 HD2 LYS 118 2HD LYS 118 -14.769 -0.928 0.487 917 HD3 LYS 118 3HD LYS 118 -16.485 -0.735 0.121 918 HE2 LYS 118 2HE LYS 118 -16.202 -2.149 -1.571 919 HE3 LYS 118 3HE LYS 118 -15.221 -0.916 -2.361 920 HZ1 LYS 118 3HZ LYS 118 -13.603 -2.425 -2.263 921 HZ2 LYS 118 1HZ LYS 118 -14.415 -3.381 -1.127 922 HZ3 LYS 118 2HZ LYS 118 -13.494 -2.058 -0.615 Start of MODEL 2 1 H1 VAL 1 H VAL 1 3.613 -1.370 -6.944 2 HA VAL 1 HA VAL 1 5.579 -0.631 -5.694 3 HB VAL 1 HB VAL 1 4.553 2.135 -6.345 4 HG11 VAL 1 1HG1 VAL 1 6.906 2.692 -5.425 5 HG12 VAL 1 2HG1 VAL 1 5.607 2.332 -4.286 6 HG13 VAL 1 3HG1 VAL 1 6.810 1.101 -4.671 7 HG21 VAL 1 3HG2 VAL 1 5.534 1.687 -8.330 8 HG22 VAL 1 1HG2 VAL 1 7.014 2.034 -7.436 9 HG23 VAL 1 2HG2 VAL 1 6.500 0.364 -7.677 10 H TRP 2 H TRP 2 2.426 0.996 -5.681 11 HA TRP 2 HA TRP 2 1.541 -0.113 -3.293 12 HB2 TRP 2 2HB TRP 2 2.974 0.990 -1.885 13 HB3 TRP 2 3HB TRP 2 3.173 2.355 -2.982 14 HD1 TRP 2 HD1 TRP 2 2.336 4.462 -1.810 15 HE1 TRP 2 HE1 TRP 2 0.316 5.085 -0.342 16 HE3 TRP 2 HE3 TRP 2 0.140 -0.141 -1.454 17 HZ2 TRP 2 HZ2 TRP 2 -1.913 3.796 0.815 18 HZ3 TRP 2 HZ3 TRP 2 -1.934 -0.361 -0.148 19 HH2 TRP 2 HH2 TRP 2 -2.937 1.568 0.963 20 HA PRO 3 HA PRO 3 -1.239 3.692 -4.359 21 HB2 PRO 3 2HB PRO 3 -0.354 5.380 -6.293 22 HB3 PRO 3 3HB PRO 3 0.032 5.593 -4.581 23 HG2 PRO 3 2HG PRO 3 1.692 4.387 -6.761 24 HG3 PRO 3 3HG PRO 3 2.178 5.504 -5.472 25 HD2 PRO 3 2HD PRO 3 2.647 2.840 -5.345 26 HD3 PRO 3 3HD PRO 3 2.331 3.825 -3.901 27 H LEU 4 H LEU 4 -2.426 1.956 -5.267 28 HA LEU 4 HA LEU 4 -2.138 1.438 -8.119 29 HB2 LEU 4 2HB LEU 4 -3.741 -0.342 -7.774 30 HB3 LEU 4 3HB LEU 4 -2.437 -0.445 -6.592 31 HG LEU 4 HG LEU 4 -4.483 1.044 -5.369 32 HD11 LEU 4 1HD1 LEU 4 -6.452 -0.192 -5.597 33 HD12 LEU 4 2HD1 LEU 4 -5.635 -1.515 -6.428 34 HD13 LEU 4 3HD1 LEU 4 -5.881 0.025 -7.251 35 HD21 LEU 4 3HD2 LEU 4 -4.675 -1.170 -4.050 36 HD22 LEU 4 1HD2 LEU 4 -3.143 -0.296 -4.031 37 HD23 LEU 4 2HD2 LEU 4 -3.340 -1.707 -5.071 38 H VAL 5 H VAL 5 -4.061 3.301 -5.979 39 HA VAL 5 HA VAL 5 -6.414 3.491 -7.565 40 HB VAL 5 HB VAL 5 -6.937 5.483 -6.183 41 HG11 VAL 5 1HG1 VAL 5 -5.993 3.537 -4.177 42 HG12 VAL 5 2HG1 VAL 5 -7.605 4.201 -4.447 43 HG13 VAL 5 3HG1 VAL 5 -7.008 2.892 -5.466 44 HG21 VAL 5 3HG2 VAL 5 -5.147 5.550 -4.158 45 HG22 VAL 5 1HG2 VAL 5 -4.083 5.211 -5.523 46 HG23 VAL 5 2HG2 VAL 5 -5.113 6.642 -5.542 47 H ILE 6 H ILE 6 -3.438 5.372 -7.355 48 HA ILE 6 HA ILE 6 -4.169 7.572 -8.894 49 HB ILE 6 HB ILE 6 -1.863 8.013 -9.219 50 HG12 ILE 6 2HG1 ILE 6 -1.403 5.081 -8.633 51 HG13 ILE 6 3HG1 ILE 6 -1.169 5.893 -10.178 52 HG21 ILE 6 1HG2 ILE 6 -2.743 8.052 -6.868 53 HG22 ILE 6 2HG2 ILE 6 -1.985 6.478 -6.633 54 HG23 ILE 6 3HG2 ILE 6 -0.993 7.886 -7.009 55 HD11 ILE 6 3HD1 ILE 6 0.396 7.291 -8.324 56 HD12 ILE 6 1HD1 ILE 6 0.653 5.577 -8.000 57 HD13 ILE 6 2HD1 ILE 6 0.940 6.222 -9.616 58 H ARG 7 H ARG 7 -3.414 4.316 -9.841 59 HA ARG 7 HA ARG 7 -3.051 4.966 -12.631 60 HB2 ARG 7 2HB ARG 7 -2.445 2.771 -12.929 61 HB3 ARG 7 3HB ARG 7 -2.083 2.956 -11.218 62 HG2 ARG 7 2HG ARG 7 -3.275 1.071 -11.016 63 HG3 ARG 7 3HG ARG 7 -4.660 2.161 -11.092 64 HD2 ARG 7 2HD ARG 7 -5.252 0.652 -12.705 65 HD3 ARG 7 3HD ARG 7 -4.362 1.817 -13.685 66 HE ARG 7 HE ARG 7 -2.585 -0.147 -12.750 67 HH11 ARG 7 1HH1 ARG 7 -5.242 0.234 -14.967 68 HH12 ARG 7 2HH1 ARG 7 -4.704 -1.023 -16.032 69 HH21 ARG 7 1HH2 ARG 7 -1.866 -1.803 -14.144 70 HH22 ARG 7 2HH2 ARG 7 -2.784 -2.181 -15.562 71 H THR 8 H THR 8 -5.673 4.297 -10.541 72 HA THR 8 HA THR 8 -7.533 3.027 -12.116 73 HB THR 8 HB THR 8 -8.217 5.371 -10.339 74 HG1 THR 8 HG1 THR 8 -8.410 3.552 -8.745 75 HG21 THR 8 3HG2 THR 8 -10.343 4.491 -10.199 76 HG22 THR 8 1HG2 THR 8 -9.809 2.857 -10.590 77 HG23 THR 8 2HG2 THR 8 -9.921 4.076 -11.860 78 H VAL 9 H VAL 9 -7.308 6.576 -11.775 79 HA VAL 9 HA VAL 9 -9.005 7.101 -13.981 80 HB VAL 9 HB VAL 9 -7.017 8.876 -12.562 81 HG11 VAL 9 1HG1 VAL 9 -8.295 10.743 -13.639 82 HG12 VAL 9 2HG1 VAL 9 -7.304 9.790 -14.746 83 HG13 VAL 9 3HG1 VAL 9 -9.049 9.539 -14.684 84 HG21 VAL 9 3HG2 VAL 9 -8.696 9.501 -11.163 85 HG22 VAL 9 1HG2 VAL 9 -9.949 9.258 -12.381 86 HG23 VAL 9 2HG2 VAL 9 -9.263 7.872 -11.532 87 H ILE 10 H ILE 10 -5.499 6.921 -13.619 88 HA ILE 10 HA ILE 10 -4.685 7.969 -16.046 89 HB ILE 10 HB ILE 10 -3.477 5.643 -14.544 90 HG12 ILE 10 2HG1 ILE 10 -3.759 7.973 -13.437 91 HG13 ILE 10 3HG1 ILE 10 -2.184 7.190 -13.364 92 HG21 ILE 10 1HG2 ILE 10 -2.662 7.084 -16.991 93 HG22 ILE 10 2HG2 ILE 10 -1.396 6.755 -15.809 94 HG23 ILE 10 3HG2 ILE 10 -2.336 5.426 -16.486 95 HD11 ILE 10 3HD1 ILE 10 -2.620 8.953 -15.675 96 HD12 ILE 10 1HD1 ILE 10 -2.564 9.743 -14.100 97 HD13 ILE 10 2HD1 ILE 10 -1.206 8.756 -14.640 98 H ALA 11 H ALA 11 -6.309 4.993 -15.389 99 HA ALA 11 HA ALA 11 -5.622 3.332 -17.444 100 HB1 ALA 11 1HB ALA 11 -8.081 2.635 -17.426 101 HB2 ALA 11 2HB ALA 11 -7.188 2.516 -15.909 102 HB3 ALA 11 3HB ALA 11 -8.291 3.866 -16.180 103 H GLY 12 H GLY 12 -7.301 6.360 -17.650 104 HA2 GLY 12 2HA GLY 12 -8.071 5.860 -20.433 105 HA3 GLY 12 3HA GLY 12 -8.565 7.234 -19.454 106 H TYR 13 H TYR 13 -5.832 7.768 -18.534 107 HA TYR 13 HA TYR 13 -5.064 9.675 -20.392 108 HB2 TYR 13 2HB TYR 13 -4.153 10.001 -18.282 109 HB3 TYR 13 3HB TYR 13 -3.655 8.321 -18.123 110 HD1 TYR 13 HD2 TYR 13 -2.969 10.816 -20.813 111 HD2 TYR 13 HD1 TYR 13 -1.366 8.337 -17.748 112 HE1 TYR 13 HE2 TYR 13 -0.693 11.429 -21.515 113 HE2 TYR 13 HE1 TYR 13 0.915 8.945 -18.441 114 HH TYR 13 HH TYR 13 2.134 9.874 -20.148 115 H ASN 14 H ASN 14 -3.829 6.378 -19.948 116 HA ASN 14 HA ASN 14 -1.758 6.349 -21.746 117 HB2 ASN 14 2HB ASN 14 -3.228 4.428 -20.330 118 HB3 ASN 14 3HB ASN 14 -3.317 3.924 -22.015 119 HD21 ASN 14 1HD2 ASN 14 -1.724 3.280 -19.366 120 HD22 ASN 14 2HD2 ASN 14 -0.140 2.960 -19.979 121 H LEU 15 H LEU 15 -5.120 6.655 -22.400 122 HA LEU 15 HA LEU 15 -4.806 5.975 -25.219 123 HB2 LEU 15 2HB LEU 15 -6.976 6.045 -23.344 124 HB3 LEU 15 3HB LEU 15 -7.367 7.040 -24.746 125 HG LEU 15 HG LEU 15 -6.303 4.528 -25.624 126 HD11 LEU 15 1HD1 LEU 15 -8.826 4.127 -24.085 127 HD12 LEU 15 2HD1 LEU 15 -7.273 3.979 -23.265 128 HD13 LEU 15 3HD1 LEU 15 -7.645 2.942 -24.641 129 HD21 LEU 15 3HD2 LEU 15 -7.959 4.721 -27.138 130 HD22 LEU 15 1HD2 LEU 15 -8.071 6.365 -26.508 131 HD23 LEU 15 2HD2 LEU 15 -9.172 5.118 -25.921 132 H TYR 16 H TYR 16 -5.232 8.751 -23.134 133 HA TYR 16 HA TYR 16 -6.057 10.742 -24.774 134 HB2 TYR 16 2HB TYR 16 -4.904 10.666 -22.305 135 HB3 TYR 16 3HB TYR 16 -3.653 11.481 -23.237 136 HD1 TYR 16 HD2 TYR 16 -5.279 13.046 -25.143 137 HD2 TYR 16 HD1 TYR 16 -5.835 12.347 -20.983 138 HE1 TYR 16 HE2 TYR 16 -6.517 15.163 -24.959 139 HE2 TYR 16 HE1 TYR 16 -7.076 14.461 -20.788 140 HH TYR 16 HH TYR 16 -6.980 16.856 -22.962 141 H ARG 17 H ARG 17 -2.688 9.617 -24.512 142 HA ARG 17 HA ARG 17 -1.843 11.256 -26.723 143 HB2 ARG 17 2HB ARG 17 -0.578 9.570 -24.703 144 HB3 ARG 17 3HB ARG 17 0.165 9.403 -26.288 145 HG2 ARG 17 2HG ARG 17 1.152 11.390 -26.143 146 HG3 ARG 17 3HG ARG 17 -0.328 12.175 -25.588 147 HD2 ARG 17 2HD ARG 17 1.622 12.217 -23.982 148 HD3 ARG 17 3HD ARG 17 0.100 11.605 -23.337 149 HE ARG 17 HE ARG 17 1.070 9.539 -23.080 150 HH11 ARG 17 1HH1 ARG 17 3.108 11.545 -25.066 151 HH12 ARG 17 2HH1 ARG 17 4.440 10.436 -25.046 152 HH21 ARG 17 1HH2 ARG 17 2.815 8.072 -23.047 153 HH22 ARG 17 2HH2 ARG 17 4.271 8.460 -23.899 154 H ALA 18 H ALA 18 -2.991 8.022 -26.267 155 HA ALA 18 HA ALA 18 -1.944 6.649 -28.408 156 HB1 ALA 18 1HB ALA 18 -3.841 5.208 -28.298 157 HB2 ALA 18 2HB ALA 18 -3.475 5.737 -26.655 158 HB3 ALA 18 3HB ALA 18 -4.820 6.462 -27.536 159 H ILE 19 H ILE 19 -4.618 8.959 -28.391 160 HA ILE 19 HA ILE 19 -5.152 8.595 -31.204 161 HB ILE 19 HB ILE 19 -6.195 10.689 -29.294 162 HG12 ILE 19 2HG1 ILE 19 -6.872 8.458 -28.609 163 HG13 ILE 19 3HG1 ILE 19 -8.253 9.301 -29.302 164 HG21 ILE 19 1HG2 ILE 19 -6.480 10.312 -32.165 165 HG22 ILE 19 2HG2 ILE 19 -8.028 10.379 -31.323 166 HG23 ILE 19 3HG2 ILE 19 -6.878 11.706 -31.160 167 HD11 ILE 19 3HD1 ILE 19 -7.038 7.946 -31.427 168 HD12 ILE 19 1HD1 ILE 19 -7.066 6.816 -30.073 169 HD13 ILE 19 2HD1 ILE 19 -8.564 7.563 -30.629 170 H LYS 20 H LYS 20 -3.083 10.529 -29.278 171 HA LYS 20 HA LYS 20 -2.803 12.715 -31.103 172 HB2 LYS 20 2HB LYS 20 -2.175 13.365 -28.991 173 HB3 LYS 20 3HB LYS 20 -1.445 11.810 -28.612 174 HG2 LYS 20 2HG LYS 20 0.256 13.512 -28.750 175 HG3 LYS 20 3HG LYS 20 0.450 12.363 -30.076 176 HD2 LYS 20 2HD LYS 20 -1.152 14.182 -31.254 177 HD3 LYS 20 3HD LYS 20 -0.277 15.223 -30.128 178 HE2 LYS 20 2HE LYS 20 1.647 15.039 -31.272 179 HE3 LYS 20 3HE LYS 20 1.417 13.316 -31.567 180 HZ1 LYS 20 3HZ LYS 20 -0.013 15.455 -33.047 181 HZ2 LYS 20 1HZ LYS 20 -0.015 13.798 -33.392 182 HZ3 LYS 20 2HZ LYS 20 1.398 14.703 -33.601 183 H LYS 21 H LYS 21 -1.173 9.652 -30.591 184 HA LYS 21 HA LYS 21 0.972 10.243 -32.419 185 HB2 LYS 21 2HB LYS 21 1.579 7.867 -32.099 186 HB3 LYS 21 3HB LYS 21 1.380 8.722 -30.575 187 HG2 LYS 21 2HG LYS 21 -0.857 7.751 -30.333 188 HG3 LYS 21 3HG LYS 21 -0.629 6.872 -31.846 189 HD2 LYS 21 2HD LYS 21 1.344 6.584 -29.612 190 HD3 LYS 21 3HD LYS 21 -0.165 5.669 -29.594 191 HE2 LYS 21 2HE LYS 21 0.400 4.787 -31.840 192 HE3 LYS 21 3HE LYS 21 1.948 5.626 -31.747 193 HZ1 LYS 21 3HZ LYS 21 2.586 4.289 -29.898 194 HZ2 LYS 21 1HZ LYS 21 2.040 3.247 -31.114 195 HZ3 LYS 21 2HZ LYS 21 1.051 3.587 -29.786 196 H LYS 22 H LYS 22 -2.056 8.434 -32.509 197 HA LYS 22 HA LYS 22 -3.259 7.535 -34.218 198 HB2 LYS 22 2HB LYS 22 -2.972 9.986 -34.943 199 HB3 LYS 22 3HB LYS 22 -1.766 9.380 -36.072 200 HG2 LYS 22 2HG LYS 22 -3.848 7.720 -36.591 201 HG3 LYS 22 3HG LYS 22 -4.690 9.211 -36.160 202 HD2 LYS 22 2HD LYS 22 -3.677 10.418 -37.891 203 HD3 LYS 22 3HD LYS 22 -2.406 9.213 -38.108 204 HE2 LYS 22 2HE LYS 22 -3.619 8.257 -39.702 205 HE3 LYS 22 3HE LYS 22 -4.870 7.899 -38.513 206 HZ1 LYS 22 3HZ LYS 22 -5.173 10.564 -39.167 207 HZ2 LYS 22 1HZ LYS 22 -6.178 9.281 -39.620 208 HZ3 LYS 22 2HZ LYS 22 -4.918 9.768 -40.638 209 H GLY 23 H GLY 23 -2.329 5.475 -34.153 210 HA2 GLY 23 2HA GLY 23 -0.966 4.711 -36.564 211 HA3 GLY 23 3HA GLY 23 0.062 4.598 -35.143 212 H GLY 24 H GLY 24 -1.373 3.563 -33.205 213 HA2 GLY 24 2HA GLY 24 -3.065 1.403 -34.094 214 HA3 GLY 24 3HA GLY 24 -1.469 0.877 -33.579 215 H GLY 25 H GLY 25 -3.454 -0.184 -32.204 216 HA2 GLY 25 2HA GLY 25 -3.924 1.476 -29.832 217 HA3 GLY 25 3HA GLY 25 -4.754 -0.023 -30.222 218 H GLY 26 H GLY 26 -2.476 1.365 -28.250 219 HA2 GLY 26 2HA GLY 26 -1.906 -0.766 -26.683 220 HA3 GLY 26 3HA GLY 26 -0.729 -0.921 -27.979 221 H GLY 27 H GLY 27 -1.009 0.094 -24.935 222 HA2 GLY 27 2HA GLY 27 0.269 2.655 -25.041 223 HA3 GLY 27 3HA GLY 27 0.048 1.659 -23.610 224 H GLY 28 H GLY 28 2.334 3.072 -25.429 225 HA2 GLY 28 2HA GLY 28 4.544 2.073 -24.230 226 HA3 GLY 28 3HA GLY 28 4.264 0.925 -25.531 227 H GLY 29 H GLY 29 6.253 3.251 -24.837 228 HA2 GLY 29 2HA GLY 29 7.527 3.813 -27.019 229 HA3 GLY 29 3HA GLY 29 6.050 4.688 -27.394 230 H GLY 30 H GLY 30 7.414 6.583 -27.544 231 HA2 GLY 30 2HA GLY 30 7.205 8.428 -25.620 232 HA3 GLY 30 3HA GLY 30 8.628 7.547 -25.084 233 H GLY 31 H GLY 31 7.613 10.174 -26.794 234 HA2 GLY 31 2HA GLY 31 10.251 10.685 -27.805 235 HA3 GLY 31 3HA GLY 31 9.091 10.367 -29.087 236 H GLY 32 H GLY 32 8.411 12.189 -29.987 237 HA2 GLY 32 2HA GLY 32 7.951 14.513 -28.219 238 HA3 GLY 32 3HA GLY 32 8.566 14.659 -29.858 239 H VAL 33 H VAL 33 5.796 14.521 -27.888 240 HA VAL 33 HA VAL 33 4.099 14.762 -30.271 241 HB VAL 33 HB VAL 33 2.303 13.499 -28.987 242 HG11 VAL 33 1HG1 VAL 33 3.752 12.655 -30.922 243 HG12 VAL 33 2HG1 VAL 33 4.642 11.755 -29.693 244 HG13 VAL 33 3HG1 VAL 33 2.921 11.452 -29.937 245 HG21 VAL 33 3HG2 VAL 33 4.678 12.468 -27.439 246 HG22 VAL 33 1HG2 VAL 33 3.475 13.591 -26.803 247 HG23 VAL 33 2HG2 VAL 33 2.998 11.959 -27.271 248 H TRP 34 H TRP 34 5.267 16.567 -28.127 249 HA TRP 34 HA TRP 34 4.580 18.170 -26.610 250 HB2 TRP 34 2HB TRP 34 2.775 19.642 -27.754 251 HB3 TRP 34 3HB TRP 34 4.338 19.455 -28.543 252 HD1 TRP 34 HD1 TRP 34 4.405 17.738 -30.685 253 HE1 TRP 34 HE1 TRP 34 2.564 17.156 -32.387 254 HE3 TRP 34 HE3 TRP 34 0.328 19.349 -28.054 255 HZ2 TRP 34 HZ2 TRP 34 -0.245 17.354 -32.588 256 HZ3 TRP 34 HZ3 TRP 34 -1.900 19.117 -29.073 257 HH2 TRP 34 HH2 TRP 34 -2.178 18.141 -31.293 258 HA PRO 35 HA PRO 35 0.908 15.746 -25.041 259 HB2 PRO 35 2HB PRO 35 2.016 15.129 -22.641 260 HB3 PRO 35 3HB PRO 35 2.231 14.130 -24.083 261 HG2 PRO 35 2HG PRO 35 4.080 16.162 -22.895 262 HG3 PRO 35 3HG PRO 35 4.454 14.558 -23.553 263 HD2 PRO 35 2HD PRO 35 4.857 16.839 -24.956 264 HD3 PRO 35 3HD PRO 35 4.415 15.305 -25.733 265 H LEU 36 H LEU 36 0.552 18.305 -25.207 266 HA LEU 36 HA LEU 36 0.652 19.564 -22.582 267 HB2 LEU 36 2HB LEU 36 1.221 21.142 -24.134 268 HB3 LEU 36 3HB LEU 36 0.151 20.473 -25.364 269 HG LEU 36 HG LEU 36 -1.779 21.451 -24.165 270 HD11 LEU 36 1HD1 LEU 36 -1.586 22.173 -22.081 271 HD12 LEU 36 2HD1 LEU 36 -0.413 23.385 -22.596 272 HD13 LEU 36 3HD1 LEU 36 0.134 21.782 -22.103 273 HD21 LEU 36 3HD2 LEU 36 -1.437 23.679 -24.923 274 HD22 LEU 36 1HD2 LEU 36 -0.549 22.618 -26.017 275 HD23 LEU 36 2HD2 LEU 36 0.315 23.528 -24.777 276 H VAL 37 H VAL 37 -1.620 18.074 -24.753 277 HA VAL 37 HA VAL 37 -3.933 19.029 -23.285 278 HB VAL 37 HB VAL 37 -5.246 17.660 -24.850 279 HG11 VAL 37 1HG1 VAL 37 -3.666 19.917 -25.462 280 HG12 VAL 37 2HG1 VAL 37 -3.660 18.876 -26.887 281 HG13 VAL 37 3HG1 VAL 37 -5.190 19.421 -26.198 282 HG21 VAL 37 3HG2 VAL 37 -2.563 16.594 -25.501 283 HG22 VAL 37 1HG2 VAL 37 -4.132 15.789 -25.486 284 HG23 VAL 37 2HG2 VAL 37 -3.680 16.815 -26.848 285 H ILE 38 H ILE 38 -2.114 16.033 -23.704 286 HA ILE 38 HA ILE 38 -3.847 14.344 -22.265 287 HB ILE 38 HB ILE 38 -1.981 12.804 -22.085 288 HG12 ILE 38 2HG1 ILE 38 0.200 13.796 -23.296 289 HG13 ILE 38 3HG1 ILE 38 -0.410 15.279 -22.571 290 HG21 ILE 38 1HG2 ILE 38 -2.088 12.269 -24.254 291 HG22 ILE 38 2HG2 ILE 38 -3.098 13.706 -24.413 292 HG23 ILE 38 3HG2 ILE 38 -1.372 13.799 -24.761 293 HD11 ILE 38 3HD1 ILE 38 0.617 14.688 -20.706 294 HD12 ILE 38 1HD1 ILE 38 -0.540 13.367 -20.549 295 HD13 ILE 38 2HD1 ILE 38 1.003 13.096 -21.359 296 H ARG 39 H ARG 39 -1.318 16.544 -21.255 297 HA ARG 39 HA ARG 39 -1.130 15.578 -18.576 298 HB2 ARG 39 2HB ARG 39 0.069 17.735 -18.165 299 HB3 ARG 39 3HB ARG 39 0.734 16.779 -19.483 300 HG2 ARG 39 2HG ARG 39 -0.315 18.207 -21.112 301 HG3 ARG 39 3HG ARG 39 -1.137 19.110 -19.838 302 HD2 ARG 39 2HD ARG 39 0.834 20.302 -20.680 303 HD3 ARG 39 3HD ARG 39 0.998 19.881 -18.976 304 HE ARG 39 HE ARG 39 2.175 17.830 -20.407 305 HH11 ARG 39 1HH1 ARG 39 2.639 21.254 -19.985 306 HH12 ARG 39 2HH1 ARG 39 4.348 21.188 -20.258 307 HH21 ARG 39 1HH2 ARG 39 4.425 17.730 -20.768 308 HH22 ARG 39 2HH2 ARG 39 5.363 19.184 -20.704 309 H THR 40 H THR 40 -3.355 17.565 -20.240 310 HA THR 40 HA THR 40 -4.254 19.351 -18.347 311 HB THR 40 HB THR 40 -6.089 17.793 -20.171 312 HG1 THR 40 HG1 THR 40 -5.578 19.404 -21.719 313 HG21 THR 40 3HG2 THR 40 -6.636 19.753 -18.299 314 HG22 THR 40 1HG2 THR 40 -7.668 19.293 -19.652 315 HG23 THR 40 2HG2 THR 40 -6.548 20.644 -19.818 316 H VAL 41 H VAL 41 -5.631 16.104 -18.911 317 HA VAL 41 HA VAL 41 -7.276 16.111 -16.629 318 HB VAL 41 HB VAL 41 -7.246 13.583 -16.923 319 HG11 VAL 41 1HG1 VAL 41 -8.095 15.556 -18.994 320 HG12 VAL 41 2HG1 VAL 41 -8.324 13.831 -19.291 321 HG13 VAL 41 3HG1 VAL 41 -9.075 14.594 -17.889 322 HG21 VAL 41 3HG2 VAL 41 -5.654 14.286 -19.387 323 HG22 VAL 41 1HG2 VAL 41 -5.001 13.485 -17.958 324 HG23 VAL 41 2HG2 VAL 41 -6.240 12.688 -18.927 325 H ILE 42 H ILE 42 -3.965 15.021 -17.148 326 HA ILE 42 HA ILE 42 -3.563 13.627 -14.768 327 HB ILE 42 HB ILE 42 -1.555 15.294 -16.290 328 HG12 ILE 42 2HG1 ILE 42 -2.595 12.501 -16.604 329 HG13 ILE 42 3HG1 ILE 42 -2.277 13.716 -17.838 330 HG21 ILE 42 1HG2 ILE 42 -1.138 13.079 -14.287 331 HG22 ILE 42 2HG2 ILE 42 0.129 13.868 -15.225 332 HG23 ILE 42 3HG2 ILE 42 -0.791 14.790 -14.036 333 HD11 ILE 42 3HD1 ILE 42 0.197 13.392 -17.174 334 HD12 ILE 42 1HD1 ILE 42 -0.370 11.886 -16.453 335 HD13 ILE 42 2HD1 ILE 42 -0.595 12.178 -18.178 336 H ALA 43 H ALA 43 -4.046 16.965 -15.284 337 HA ALA 43 HA ALA 43 -2.597 18.242 -13.343 338 HB1 ALA 43 1HB ALA 43 -5.405 18.708 -14.303 339 HB2 ALA 43 2HB ALA 43 -4.624 19.771 -13.131 340 HB3 ALA 43 3HB ALA 43 -3.932 19.574 -14.741 341 H GLY 44 H GLY 44 -5.128 15.936 -12.910 342 HA2 GLY 44 2HA GLY 44 -5.471 16.654 -10.091 343 HA3 GLY 44 3HA GLY 44 -6.437 15.492 -10.988 344 H TYR 45 H TYR 45 -4.034 14.182 -12.098 345 HA TYR 45 HA TYR 45 -3.757 12.081 -10.349 346 HB2 TYR 45 2HB TYR 45 -3.033 11.880 -12.638 347 HB3 TYR 45 3HB TYR 45 -1.796 13.111 -12.406 348 HD1 TYR 45 HD2 TYR 45 0.177 12.603 -10.949 349 HD2 TYR 45 HD1 TYR 45 -2.621 9.609 -12.095 350 HE1 TYR 45 HE2 TYR 45 1.806 10.859 -10.351 351 HE2 TYR 45 HE1 TYR 45 -1.000 7.858 -11.500 352 HH TYR 45 HH TYR 45 2.092 8.229 -11.229 353 H ASN 46 H ASN 46 -1.622 14.904 -10.676 354 HA ASN 46 HA ASN 46 0.348 14.258 -8.876 355 HB2 ASN 46 2HB ASN 46 -0.297 16.495 -10.309 356 HB3 ASN 46 3HB ASN 46 -0.570 17.047 -8.659 357 HD21 ASN 46 1HD2 ASN 46 1.811 14.945 -10.247 358 HD22 ASN 46 2HD2 ASN 46 3.199 15.757 -9.614 359 H LEU 47 H LEU 47 -2.952 15.094 -8.237 360 HA LEU 47 HA LEU 47 -2.472 15.511 -5.398 361 HB2 LEU 47 2HB LEU 47 -4.571 16.131 -7.283 362 HB3 LEU 47 3HB LEU 47 -5.222 15.356 -5.841 363 HG LEU 47 HG LEU 47 -5.241 17.842 -5.767 364 HD11 LEU 47 1HD1 LEU 47 -3.369 16.885 -3.648 365 HD12 LEU 47 2HD1 LEU 47 -4.988 16.197 -3.763 366 HD13 LEU 47 3HD1 LEU 47 -4.784 17.930 -3.513 367 HD21 LEU 47 3HD2 LEU 47 -2.704 17.638 -6.805 368 HD22 LEU 47 1HD2 LEU 47 -2.409 18.057 -5.117 369 HD23 LEU 47 2HD2 LEU 47 -3.426 19.094 -6.118 370 H TYR 48 H TYR 48 -3.750 13.083 -7.572 371 HA TYR 48 HA TYR 48 -5.170 11.412 -5.971 372 HB2 TYR 48 2HB TYR 48 -4.047 11.202 -8.464 373 HB3 TYR 48 3HB TYR 48 -3.181 9.958 -7.570 374 HD1 TYR 48 HD2 TYR 48 -5.333 9.069 -5.706 375 HD2 TYR 48 HD1 TYR 48 -5.451 9.957 -9.866 376 HE1 TYR 48 HE2 TYR 48 -7.245 7.545 -5.971 377 HE2 TYR 48 HE1 TYR 48 -7.364 8.436 -10.142 378 HH TYR 48 HH TYR 48 -8.891 6.883 -7.367 379 H ARG 49 H ARG 49 -1.623 11.430 -6.265 380 HA ARG 49 HA ARG 49 -1.313 9.503 -4.148 381 HB2 ARG 49 2HB ARG 49 0.335 10.640 -6.199 382 HB3 ARG 49 3HB ARG 49 1.143 10.823 -4.648 383 HG2 ARG 49 2HG ARG 49 1.413 8.581 -4.364 384 HG3 ARG 49 3HG ARG 49 -0.031 8.177 -5.294 385 HD2 ARG 49 2HD ARG 49 1.901 7.485 -6.538 386 HD3 ARG 49 3HD ARG 49 1.169 8.866 -7.354 387 HE ARG 49 HE ARG 49 3.110 10.011 -7.022 388 HH11 ARG 49 1HH1 ARG 49 2.961 7.397 -4.727 389 HH12 ARG 49 2HH1 ARG 49 4.550 7.685 -4.100 390 HH21 ARG 49 1HH2 ARG 49 5.203 10.400 -6.204 391 HH22 ARG 49 2HH2 ARG 49 5.824 9.394 -4.940 392 H ALA 50 H ALA 50 -1.416 12.949 -4.433 393 HA ALA 50 HA ALA 50 0.031 13.833 -2.268 394 HB1 ALA 50 1HB ALA 50 -1.184 15.247 -3.937 395 HB2 ALA 50 2HB ALA 50 -2.668 14.925 -3.040 396 HB3 ALA 50 3HB ALA 50 -1.339 15.785 -2.264 397 H ILE 51 H ILE 51 -3.183 12.383 -2.303 398 HA ILE 51 HA ILE 51 -3.545 12.769 0.542 399 HB ILE 51 HB ILE 51 -5.210 11.209 -1.437 400 HG12 ILE 51 2HG1 ILE 51 -5.143 13.624 -1.902 401 HG13 ILE 51 3HG1 ILE 51 -6.734 13.125 -1.339 402 HG21 ILE 51 1HG2 ILE 51 -5.320 11.474 1.466 403 HG22 ILE 51 2HG2 ILE 51 -6.835 11.885 0.664 404 HG23 ILE 51 3HG2 ILE 51 -6.101 10.303 0.403 405 HD11 ILE 51 3HD1 ILE 51 -6.246 13.997 0.869 406 HD12 ILE 51 1HD1 ILE 51 -4.625 14.453 0.346 407 HD13 ILE 51 2HD1 ILE 51 -6.035 15.245 -0.359 408 H LYS 52 H LYS 52 -2.207 10.400 -1.543 409 HA LYS 52 HA LYS 52 -2.560 8.150 0.196 410 HB2 LYS 52 2HB LYS 52 -0.685 8.576 -2.138 411 HB3 LYS 52 3HB LYS 52 -0.933 7.040 -1.318 412 HG2 LYS 52 2HG LYS 52 -3.120 8.581 -2.694 413 HG3 LYS 52 3HG LYS 52 -2.184 7.291 -3.454 414 HD2 LYS 52 2HD LYS 52 -3.696 5.868 -2.642 415 HD3 LYS 52 3HD LYS 52 -3.028 6.201 -1.043 416 HE2 LYS 52 2HE LYS 52 -5.357 6.559 -0.869 417 HE3 LYS 52 3HE LYS 52 -4.620 8.159 -0.927 418 HZ1 LYS 52 3HZ LYS 52 -5.077 7.735 -3.510 419 HZ2 LYS 52 1HZ LYS 52 -6.189 8.492 -2.483 420 HZ3 LYS 52 2HZ LYS 52 -6.358 6.849 -2.848 421 H LYS 53 H LYS 53 -0.190 10.669 -0.187 422 HA LYS 53 HA LYS 53 1.786 9.338 1.456 423 HB2 LYS 53 2HB LYS 53 2.896 10.660 -0.049 424 HB3 LYS 53 3HB LYS 53 1.630 11.881 -0.075 425 HG2 LYS 53 2HG LYS 53 2.452 12.972 1.775 426 HG3 LYS 53 3HG LYS 53 3.282 11.538 2.383 427 HD2 LYS 53 2HD LYS 53 5.127 12.519 1.559 428 HD3 LYS 53 3HD LYS 53 4.544 11.928 0.001 429 HE2 LYS 53 2HE LYS 53 3.749 14.606 1.114 430 HE3 LYS 53 3HE LYS 53 5.198 14.383 0.134 431 HZ1 LYS 53 3HZ LYS 53 2.820 14.973 -0.885 432 HZ2 LYS 53 1HZ LYS 53 2.740 13.285 -0.958 433 HZ3 LYS 53 2HZ LYS 53 3.998 14.105 -1.734 434 H LYS 54 H LYS 54 -0.543 11.971 1.770 435 HA LYS 54 HA LYS 54 0.245 12.524 4.499 436 HB2 LYS 54 2HB LYS 54 -2.033 13.588 2.821 437 HB3 LYS 54 3HB LYS 54 -1.636 14.151 4.439 438 HG2 LYS 54 2HG LYS 54 0.645 14.745 3.545 439 HG3 LYS 54 3HG LYS 54 -0.004 14.433 1.933 440 HD2 LYS 54 2HD LYS 54 -1.906 16.073 3.053 441 HD3 LYS 54 3HD LYS 54 -0.398 16.719 3.705 442 HE2 LYS 54 2HE LYS 54 0.094 16.199 0.995 443 HE3 LYS 54 3HE LYS 54 -1.498 16.954 1.056 444 HZ1 LYS 54 3HZ LYS 54 -0.590 18.912 1.513 445 HZ2 LYS 54 1HZ LYS 54 0.921 18.235 1.166 446 HZ3 LYS 54 2HZ LYS 54 0.361 18.279 2.761 447 H GLY 55 H GLY 55 -2.934 11.746 3.070 448 HA2 GLY 55 2HA GLY 55 -4.336 9.960 3.731 449 HA3 GLY 55 3HA GLY 55 -3.356 9.757 5.175 450 H GLY 56 H GLY 56 -4.819 12.735 3.933 451 HA2 GLY 56 2HA GLY 56 -6.645 12.727 6.244 452 HA3 GLY 56 3HA GLY 56 -5.621 14.122 5.939 453 H GLY 57 H GLY 57 -7.684 12.031 3.908 454 HA2 GLY 57 2HA GLY 57 -8.553 14.303 2.363 455 HA3 GLY 57 3HA GLY 57 -9.078 12.638 2.159 456 H GLY 58 H GLY 58 -11.159 12.315 2.545 457 HA2 GLY 58 2HA GLY 58 -13.233 12.454 3.529 458 HA3 GLY 58 3HA GLY 58 -12.461 13.247 4.893 459 H GLY 59 H GLY 59 -14.718 13.636 2.534 460 HA2 GLY 59 2HA GLY 59 -14.273 16.536 2.292 461 HA3 GLY 59 3HA GLY 59 -15.312 15.575 1.250 462 H GLY 60 H GLY 60 -17.342 16.230 1.502 463 HA2 GLY 60 2HA GLY 60 -18.302 17.488 3.867 464 HA3 GLY 60 3HA GLY 60 -19.278 16.975 2.498 465 H GLY 61 H GLY 61 -20.950 16.088 3.659 466 HA2 GLY 61 2HA GLY 61 -20.255 13.653 5.179 467 HA3 GLY 61 3HA GLY 61 -21.472 14.781 5.759 468 H GLY 62 H GLY 62 -23.116 15.315 3.829 469 HA2 GLY 62 2HA GLY 62 -23.732 13.154 2.074 470 HA3 GLY 62 3HA GLY 62 -24.735 13.099 3.516 471 H GLY 63 H GLY 63 -25.840 13.411 0.996 472 HA2 GLY 63 2HA GLY 63 -27.729 14.719 0.409 473 HA3 GLY 63 3HA GLY 63 -27.041 16.067 1.303 474 H GLY 64 H GLY 64 -24.409 15.844 0.099 475 HA2 GLY 64 2HA GLY 64 -24.504 15.937 -2.708 476 HA3 GLY 64 3HA GLY 64 -24.760 17.563 -2.092 477 H VAL 65 H VAL 65 -23.057 17.231 0.224 478 HA VAL 65 HA VAL 65 -20.491 17.578 -1.127 479 HB VAL 65 HB VAL 65 -19.731 18.468 1.088 480 HG11 VAL 65 1HG1 VAL 65 -22.183 19.965 0.263 481 HG12 VAL 65 2HG1 VAL 65 -20.586 20.579 0.693 482 HG13 VAL 65 3HG1 VAL 65 -20.837 19.786 -0.862 483 HG21 VAL 65 3HG2 VAL 65 -20.946 18.138 2.917 484 HG22 VAL 65 1HG2 VAL 65 -22.288 19.032 2.202 485 HG23 VAL 65 2HG2 VAL 65 -22.157 17.290 1.956 486 H TRP 66 H TRP 66 -19.079 15.971 -1.195 487 HA TRP 66 HA TRP 66 -18.170 14.511 0.982 488 HB2 TRP 66 2HB TRP 66 -20.051 13.217 1.268 489 HB3 TRP 66 3HB TRP 66 -20.495 13.295 -0.435 490 HD1 TRP 66 HD1 TRP 66 -20.302 11.023 -1.569 491 HE1 TRP 66 HE1 TRP 66 -18.804 8.944 -1.318 492 HE3 TRP 66 HE3 TRP 66 -17.295 12.643 2.236 493 HZ2 TRP 66 HZ2 TRP 66 -16.635 8.103 0.281 494 HZ3 TRP 66 HZ3 TRP 66 -15.534 11.140 3.068 495 HH2 TRP 66 HH2 TRP 66 -15.212 8.917 2.110 496 HA PRO 67 HA PRO 67 -16.616 12.389 -3.072 497 HB2 PRO 67 2HB PRO 67 -17.751 13.183 -5.406 498 HB3 PRO 67 3HB PRO 67 -18.382 11.846 -4.437 499 HG2 PRO 67 2HG PRO 67 -19.315 14.687 -4.580 500 HG3 PRO 67 3HG PRO 67 -20.273 13.195 -4.546 501 HD2 PRO 67 2HD PRO 67 -19.898 14.736 -2.351 502 HD3 PRO 67 3HD PRO 67 -20.076 12.972 -2.260 503 H LEU 68 H LEU 68 -15.278 14.283 -2.036 504 HA LEU 68 HA LEU 68 -14.844 16.485 -3.893 505 HB2 LEU 68 2HB LEU 68 -13.679 15.842 -1.192 506 HB3 LEU 68 3HB LEU 68 -13.197 17.234 -2.159 507 HG LEU 68 HG LEU 68 -15.929 16.727 -0.984 508 HD11 LEU 68 1HD1 LEU 68 -14.245 19.087 -0.339 509 HD12 LEU 68 2HD1 LEU 68 -13.836 17.541 0.405 510 HD13 LEU 68 3HD1 LEU 68 -15.437 18.240 0.648 511 HD21 LEU 68 3HD2 LEU 68 -16.233 17.840 -3.068 512 HD22 LEU 68 1HD2 LEU 68 -14.892 18.939 -2.745 513 HD23 LEU 68 2HD2 LEU 68 -16.375 19.055 -1.797 514 H VAL 69 H VAL 69 -13.528 13.417 -3.121 515 HA VAL 69 HA VAL 69 -10.901 13.972 -4.203 516 HB VAL 69 HB VAL 69 -10.475 11.570 -3.863 517 HG11 VAL 69 1HG1 VAL 69 -10.221 11.727 -1.585 518 HG12 VAL 69 2HG1 VAL 69 -10.461 13.424 -2.009 519 HG13 VAL 69 3HG1 VAL 69 -11.799 12.480 -1.351 520 HG21 VAL 69 3HG2 VAL 69 -12.456 10.508 -2.409 521 HG22 VAL 69 1HG2 VAL 69 -13.406 11.547 -3.472 522 HG23 VAL 69 2HG2 VAL 69 -12.343 10.319 -4.159 523 H ILE 70 H ILE 70 -13.850 12.308 -5.198 524 HA ILE 70 HA ILE 70 -12.819 11.213 -7.595 525 HB ILE 70 HB ILE 70 -15.056 10.711 -8.203 526 HG12 ILE 70 2HG1 ILE 70 -16.847 11.809 -6.495 527 HG13 ILE 70 3HG1 ILE 70 -15.668 13.113 -6.584 528 HG21 ILE 70 1HG2 ILE 70 -15.299 9.225 -6.567 529 HG22 ILE 70 2HG2 ILE 70 -14.017 10.071 -5.702 530 HG23 ILE 70 3HG2 ILE 70 -15.704 10.484 -5.401 531 HD11 ILE 70 3HD1 ILE 70 -16.562 11.909 -9.135 532 HD12 ILE 70 1HD1 ILE 70 -17.707 12.923 -8.257 533 HD13 ILE 70 2HD1 ILE 70 -16.145 13.578 -8.749 534 H ARG 71 H ARG 71 -13.886 14.375 -6.726 535 HA ARG 71 HA ARG 71 -14.297 15.229 -9.466 536 HB2 ARG 71 2HB ARG 71 -14.640 17.480 -8.408 537 HB3 ARG 71 3HB ARG 71 -15.739 16.229 -7.844 538 HG2 ARG 71 2HG ARG 71 -14.600 16.021 -5.785 539 HG3 ARG 71 3HG ARG 71 -13.234 16.976 -6.365 540 HD2 ARG 71 2HD ARG 71 -16.042 17.974 -5.894 541 HD3 ARG 71 3HD ARG 71 -14.639 18.290 -4.873 542 HE ARG 71 HE ARG 71 -13.858 19.224 -7.283 543 HH11 ARG 71 1HH1 ARG 71 -16.690 19.753 -5.329 544 HH12 ARG 71 2HH1 ARG 71 -16.944 21.368 -5.903 545 HH21 ARG 71 1HH2 ARG 71 -14.182 21.349 -8.046 546 HH22 ARG 71 2HH2 ARG 71 -15.518 22.274 -7.449 547 H THR 72 H THR 72 -11.728 15.031 -7.217 548 HA THR 72 HA THR 72 -10.092 17.157 -7.843 549 HB THR 72 HB THR 72 -8.909 14.415 -7.540 550 HG1 THR 72 HG1 THR 72 -10.504 15.823 -5.710 551 HG21 THR 72 3HG2 THR 72 -7.629 16.676 -7.759 552 HG22 THR 72 1HG2 THR 72 -7.126 15.506 -6.540 553 HG23 THR 72 2HG2 THR 72 -8.104 16.898 -6.075 554 H VAL 73 H VAL 73 -9.935 13.932 -9.371 555 HA VAL 73 HA VAL 73 -8.155 14.715 -11.415 556 HB VAL 73 HB VAL 73 -9.035 12.615 -12.583 557 HG11 VAL 73 1HG1 VAL 73 -8.062 12.129 -9.783 558 HG12 VAL 73 2HG1 VAL 73 -7.701 11.214 -11.248 559 HG13 VAL 73 3HG1 VAL 73 -7.029 12.830 -11.027 560 HG21 VAL 73 3HG2 VAL 73 -11.242 12.689 -11.388 561 HG22 VAL 73 1HG2 VAL 73 -10.427 11.126 -11.351 562 HG23 VAL 73 2HG2 VAL 73 -10.394 12.171 -9.931 563 H ILE 74 H ILE 74 -11.668 14.630 -11.218 564 HA ILE 74 HA ILE 74 -12.301 14.990 -13.905 565 HB ILE 74 HB ILE 74 -13.779 16.153 -11.542 566 HG12 ILE 74 2HG1 ILE 74 -13.219 13.497 -11.989 567 HG13 ILE 74 3HG1 ILE 74 -14.578 14.105 -11.050 568 HG21 ILE 74 1HG2 ILE 74 -14.624 15.561 -14.372 569 HG22 ILE 74 2HG2 ILE 74 -15.749 15.924 -13.064 570 HG23 ILE 74 3HG2 ILE 74 -14.569 17.132 -13.572 571 HD11 ILE 74 3HD1 ILE 74 -14.710 13.545 -13.999 572 HD12 ILE 74 1HD1 ILE 74 -15.155 12.380 -12.752 573 HD13 ILE 74 2HD1 ILE 74 -16.048 13.893 -12.905 574 H ALA 75 H ALA 75 -10.810 17.142 -11.704 575 HA ALA 75 HA ALA 75 -11.570 19.652 -12.487 576 HB1 ALA 75 1HB ALA 75 -10.029 19.530 -10.736 577 HB2 ALA 75 2HB ALA 75 -8.889 18.574 -11.683 578 HB3 ALA 75 3HB ALA 75 -9.126 20.282 -12.052 579 H GLY 76 H GLY 76 -9.798 17.301 -14.320 580 HA2 GLY 76 2HA GLY 76 -9.006 19.276 -16.325 581 HA3 GLY 76 3HA GLY 76 -8.542 17.581 -16.298 582 H TYR 77 H TYR 77 -11.306 16.678 -15.873 583 HA TYR 77 HA TYR 77 -12.052 16.150 -18.481 584 HB2 TYR 77 2HB TYR 77 -12.975 14.796 -16.766 585 HB3 TYR 77 3HB TYR 77 -13.654 16.186 -15.927 586 HD1 TYR 77 HD2 TYR 77 -13.892 15.635 -19.570 587 HD2 TYR 77 HD1 TYR 77 -15.911 15.424 -15.830 588 HE1 TYR 77 HE2 TYR 77 -16.025 15.298 -20.747 589 HE2 TYR 77 HE1 TYR 77 -18.049 15.084 -16.997 590 HH TYR 77 HH TYR 77 -19.049 15.488 -19.162 591 H ASN 78 H ASN 78 -13.361 18.642 -16.304 592 HA ASN 78 HA ASN 78 -15.293 19.737 -17.919 593 HB2 ASN 78 2HB ASN 78 -13.431 21.036 -15.934 594 HB3 ASN 78 3HB ASN 78 -14.715 21.933 -16.739 595 HD21 ASN 78 1HD2 ASN 78 -13.907 19.964 -14.145 596 HD22 ASN 78 2HD2 ASN 78 -15.501 19.648 -13.558 597 H LEU 79 H LEU 79 -11.883 19.817 -18.342 598 HA LEU 79 HA LEU 79 -12.002 22.018 -20.252 599 HB2 LEU 79 2HB LEU 79 -10.024 20.968 -18.533 600 HB3 LEU 79 3HB LEU 79 -9.454 20.721 -20.183 601 HG LEU 79 HG LEU 79 -10.458 23.420 -19.420 602 HD11 LEU 79 1HD1 LEU 79 -8.690 24.018 -18.143 603 HD12 LEU 79 2HD1 LEU 79 -7.593 22.883 -18.929 604 HD13 LEU 79 3HD1 LEU 79 -8.729 22.308 -17.709 605 HD21 LEU 79 3HD2 LEU 79 -8.202 23.746 -20.863 606 HD22 LEU 79 1HD2 LEU 79 -9.808 23.570 -21.572 607 HD23 LEU 79 2HD2 LEU 79 -8.736 22.174 -21.459 608 H TYR 80 H TYR 80 -11.619 18.541 -20.142 609 HA TYR 80 HA TYR 80 -10.603 17.890 -22.575 610 HB2 TYR 80 2HB TYR 80 -11.926 16.514 -20.603 611 HB3 TYR 80 3HB TYR 80 -13.029 16.351 -21.965 612 HD1 TYR 80 HD2 TYR 80 -11.408 16.023 -24.274 613 HD2 TYR 80 HD1 TYR 80 -10.690 14.589 -20.333 614 HE1 TYR 80 HE2 TYR 80 -10.014 14.216 -25.192 615 HE2 TYR 80 HE1 TYR 80 -9.293 12.779 -21.240 616 HH TYR 80 HH TYR 80 -9.197 11.530 -23.592 617 H ARG 81 H ARG 81 -14.022 18.646 -21.930 618 HA ARG 81 HA ARG 81 -14.699 18.575 -24.725 619 HB2 ARG 81 2HB ARG 81 -16.269 19.509 -22.316 620 HB3 ARG 81 3HB ARG 81 -16.921 19.374 -23.943 621 HG2 ARG 81 2HG ARG 81 -16.879 17.063 -23.912 622 HG3 ARG 81 3HG ARG 81 -15.670 17.003 -22.628 623 HD2 ARG 81 2HD ARG 81 -17.975 16.355 -21.915 624 HD3 ARG 81 3HD ARG 81 -17.268 17.681 -20.992 625 HE ARG 81 HE ARG 81 -18.898 19.076 -21.802 626 HH11 ARG 81 1HH1 ARG 81 -18.868 16.132 -23.659 627 HH12 ARG 81 2HH1 ARG 81 -20.329 16.502 -24.513 628 HH21 ARG 81 1HH2 ARG 81 -20.822 19.575 -22.920 629 HH22 ARG 81 2HH2 ARG 81 -21.439 18.461 -24.093 630 H ALA 82 H ALA 82 -13.657 20.960 -22.446 631 HA ALA 82 HA ALA 82 -14.632 23.319 -23.474 632 HB1 ALA 82 1HB ALA 82 -11.804 22.959 -22.503 633 HB2 ALA 82 2HB ALA 82 -12.787 24.423 -22.450 634 HB3 ALA 82 3HB ALA 82 -13.204 23.043 -21.434 635 H ILE 83 H ILE 83 -11.890 21.404 -24.621 636 HA ILE 83 HA ILE 83 -11.221 23.300 -26.687 637 HB ILE 83 HB ILE 83 -10.249 20.471 -26.267 638 HG12 ILE 83 2HG1 ILE 83 -9.684 21.992 -24.412 639 HG13 ILE 83 3HG1 ILE 83 -8.252 21.514 -25.317 640 HG21 ILE 83 1HG2 ILE 83 -9.738 22.484 -28.346 641 HG22 ILE 83 2HG2 ILE 83 -8.300 21.726 -27.664 642 HG23 ILE 83 3HG2 ILE 83 -9.559 20.730 -28.393 643 HD11 ILE 83 3HD1 ILE 83 -7.738 23.635 -25.633 644 HD12 ILE 83 1HD1 ILE 83 -9.272 23.902 -26.460 645 HD13 ILE 83 2HD1 ILE 83 -9.164 24.113 -24.712 646 H LYS 84 H LYS 84 -13.349 20.632 -26.343 647 HA LYS 84 HA LYS 84 -13.492 19.881 -29.092 648 HB2 LYS 84 2HB LYS 84 -14.937 19.222 -26.599 649 HB3 LYS 84 3HB LYS 84 -15.867 19.050 -28.082 650 HG2 LYS 84 2HG LYS 84 -14.923 16.942 -27.676 651 HG3 LYS 84 3HG LYS 84 -13.949 17.654 -28.964 652 HD2 LYS 84 2HD LYS 84 -12.615 18.508 -26.756 653 HD3 LYS 84 3HD LYS 84 -13.216 16.942 -26.208 654 HE2 LYS 84 2HE LYS 84 -12.158 15.821 -28.036 655 HE3 LYS 84 3HE LYS 84 -11.736 17.353 -28.800 656 HZ1 LYS 84 3HZ LYS 84 -10.594 16.159 -26.346 657 HZ2 LYS 84 1HZ LYS 84 -10.399 17.799 -26.714 658 HZ3 LYS 84 2HZ LYS 84 -9.791 16.619 -27.762 659 H LYS 85 H LYS 85 -15.049 22.283 -27.109 660 HA LYS 85 HA LYS 85 -17.086 22.866 -29.084 661 HB2 LYS 85 2HB LYS 85 -17.977 23.292 -27.018 662 HB3 LYS 85 3HB LYS 85 -16.436 23.794 -26.336 663 HG2 LYS 85 2HG LYS 85 -16.659 25.959 -27.070 664 HG3 LYS 85 3HG LYS 85 -17.750 25.514 -28.385 665 HD2 LYS 85 2HD LYS 85 -19.323 26.364 -27.006 666 HD3 LYS 85 3HD LYS 85 -19.232 24.768 -26.257 667 HE2 LYS 85 2HE LYS 85 -17.219 26.053 -24.977 668 HE3 LYS 85 3HE LYS 85 -18.335 27.388 -25.261 669 HZ1 LYS 85 3HZ LYS 85 -19.035 24.826 -23.932 670 HZ2 LYS 85 1HZ LYS 85 -20.075 26.139 -24.169 671 HZ3 LYS 85 2HZ LYS 85 -18.743 26.291 -23.138 672 H LYS 86 H LYS 86 -14.109 24.326 -27.862 673 HA LYS 86 HA LYS 86 -12.748 25.947 -28.693 674 HB2 LYS 86 2HB LYS 86 -12.969 24.421 -30.722 675 HB3 LYS 86 3HB LYS 86 -14.153 25.569 -31.334 676 HG2 LYS 86 2HG LYS 86 -12.165 26.194 -32.365 677 HG3 LYS 86 3HG LYS 86 -12.327 27.334 -31.027 678 HD2 LYS 86 2HD LYS 86 -10.121 26.703 -30.818 679 HD3 LYS 86 3HD LYS 86 -10.910 25.558 -29.731 680 HE2 LYS 86 2HE LYS 86 -10.858 24.549 -32.432 681 HE3 LYS 86 3HE LYS 86 -9.235 24.974 -31.891 682 HZ1 LYS 86 3HZ LYS 86 -9.187 23.259 -30.490 683 HZ2 LYS 86 1HZ LYS 86 -10.524 22.657 -31.334 684 HZ3 LYS 86 2HZ LYS 86 -10.751 23.547 -29.914 685 H GLY 87 H GLY 87 -13.854 27.507 -27.372 686 HA2 GLY 87 2HA GLY 87 -14.925 29.677 -28.953 687 HA3 GLY 87 3HA GLY 87 -16.086 28.960 -27.845 688 H GLY 88 H GLY 88 -14.411 28.400 -25.680 689 HA2 GLY 88 2HA GLY 88 -12.684 29.795 -24.451 690 HA3 GLY 88 3HA GLY 88 -13.749 31.145 -24.818 691 H GLY 89 H GLY 89 -12.813 29.380 -22.344 692 HA2 GLY 89 2HA GLY 89 -14.277 29.995 -20.335 693 HA3 GLY 89 3HA GLY 89 -15.503 29.063 -21.181 694 H GLY 90 H GLY 90 -14.374 28.596 -18.540 695 HA2 GLY 90 2HA GLY 90 -13.470 25.837 -19.005 696 HA3 GLY 90 3HA GLY 90 -12.540 26.870 -17.930 697 H GLY 91 H GLY 91 -14.316 24.352 -17.654 698 HA2 GLY 91 2HA GLY 91 -15.222 23.560 -15.625 699 HA3 GLY 91 3HA GLY 91 -15.505 25.222 -15.129 700 H GLY 92 H GLY 92 -17.007 22.444 -16.019 701 HA2 GLY 92 2HA GLY 92 -19.433 22.423 -15.942 702 HA3 GLY 92 3HA GLY 92 -19.419 23.933 -16.840 703 H GLY 93 H GLY 93 -20.482 23.443 -18.672 704 HA2 GLY 93 2HA GLY 93 -19.201 21.550 -20.480 705 HA3 GLY 93 3HA GLY 93 -20.867 21.199 -20.045 706 H GLY 94 H GLY 94 -21.242 21.393 -22.373 707 HA2 GLY 94 2HA GLY 94 -22.441 23.837 -23.046 708 HA3 GLY 94 3HA GLY 94 -20.852 23.789 -23.797 709 H GLY 95 H GLY 95 -21.108 23.349 -25.886 710 HA2 GLY 95 2HA GLY 95 -23.323 21.895 -26.924 711 HA3 GLY 95 3HA GLY 95 -21.901 22.397 -27.825 712 H GLY 96 H GLY 96 -21.163 20.652 -28.855 713 HA2 GLY 96 2HA GLY 96 -19.633 18.715 -28.243 714 HA3 GLY 96 3HA GLY 96 -21.023 18.117 -27.349 715 H VAL 97 H VAL 97 -19.345 17.634 -30.066 716 HA VAL 97 HA VAL 97 -21.703 16.991 -31.704 717 HB VAL 97 HB VAL 97 -18.815 17.195 -32.570 718 HG11 VAL 97 1HG1 VAL 97 -19.794 15.741 -34.087 719 HG12 VAL 97 2HG1 VAL 97 -21.361 16.548 -34.005 720 HG13 VAL 97 3HG1 VAL 97 -20.018 17.310 -34.860 721 HG21 VAL 97 3HG2 VAL 97 -20.055 19.186 -33.875 722 HG22 VAL 97 1HG2 VAL 97 -21.004 19.169 -32.388 723 HG23 VAL 97 2HG2 VAL 97 -19.257 19.400 -32.317 724 H TRP 98 H TRP 98 -18.952 15.652 -30.064 725 HA TRP 98 HA TRP 98 -19.998 13.025 -30.143 726 HB2 TRP 98 2HB TRP 98 -18.170 11.963 -31.462 727 HB3 TRP 98 3HB TRP 98 -19.219 12.994 -32.432 728 HD1 TRP 98 HD1 TRP 98 -17.023 15.246 -30.593 729 HE1 TRP 98 HE1 TRP 98 -15.029 15.995 -32.037 730 HE3 TRP 98 HE3 TRP 98 -17.408 11.805 -34.355 731 HZ2 TRP 98 HZ2 TRP 98 -13.783 15.228 -34.452 732 HZ3 TRP 98 HZ3 TRP 98 -15.776 11.882 -36.195 733 HH2 TRP 98 HH2 TRP 98 -14.002 13.559 -36.240 734 HA PRO 99 HA PRO 99 -16.845 14.152 -26.875 735 HB2 PRO 99 2HB PRO 99 -18.512 13.785 -24.764 736 HB3 PRO 99 3HB PRO 99 -18.368 15.326 -25.618 737 HG2 PRO 99 2HG PRO 99 -20.445 13.189 -25.902 738 HG3 PRO 99 3HG PRO 99 -20.652 14.949 -25.842 739 HD2 PRO 99 2HD PRO 99 -20.689 13.557 -28.164 740 HD3 PRO 99 3HD PRO 99 -20.075 15.219 -28.057 741 H LEU 100 H LEU 100 -16.556 11.858 -28.135 742 HA LEU 100 HA LEU 100 -17.228 9.638 -26.374 743 HB2 LEU 100 2HB LEU 100 -16.347 8.218 -28.117 744 HB3 LEU 100 3HB LEU 100 -17.491 9.376 -28.793 745 HG LEU 100 HG LEU 100 -14.813 10.408 -28.976 746 HD11 LEU 100 1HD1 LEU 100 -13.968 8.757 -30.617 747 HD12 LEU 100 2HD1 LEU 100 -15.281 7.675 -30.156 748 HD13 LEU 100 3HD1 LEU 100 -14.055 8.127 -28.972 749 HD21 LEU 100 3HD2 LEU 100 -17.107 10.706 -30.316 750 HD22 LEU 100 1HD2 LEU 100 -16.320 9.525 -31.363 751 HD23 LEU 100 2HD2 LEU 100 -15.530 11.065 -31.022 752 H VAL 101 H VAL 101 -14.558 11.684 -27.161 753 HA VAL 101 HA VAL 101 -12.588 9.915 -25.966 754 HB VAL 101 HB VAL 101 -10.974 11.706 -26.450 755 HG11 VAL 101 1HG1 VAL 101 -12.414 10.155 -28.307 756 HG12 VAL 101 2HG1 VAL 101 -12.159 11.733 -29.053 757 HG13 VAL 101 3HG1 VAL 101 -10.781 10.800 -28.468 758 HG21 VAL 101 3HG2 VAL 101 -13.423 13.197 -27.374 759 HG22 VAL 101 1HG2 VAL 101 -12.276 13.672 -26.121 760 HG23 VAL 101 2HG2 VAL 101 -11.778 13.658 -27.813 761 H ILE 102 H ILE 102 -14.241 12.945 -25.219 762 HA ILE 102 HA ILE 102 -12.819 13.652 -22.921 763 HB ILE 102 HB ILE 102 -14.800 14.949 -22.265 764 HG12 ILE 102 2HG1 ILE 102 -16.668 14.836 -24.158 765 HG13 ILE 102 3HG1 ILE 102 -16.088 13.180 -24.292 766 HG21 ILE 102 1HG2 ILE 102 -14.028 16.451 -23.703 767 HG22 ILE 102 2HG2 ILE 102 -13.339 15.165 -24.692 768 HG23 ILE 102 3HG2 ILE 102 -14.989 15.715 -24.986 769 HD11 ILE 102 3HD1 ILE 102 -17.768 14.407 -22.279 770 HD12 ILE 102 1HD1 ILE 102 -17.523 12.705 -22.669 771 HD13 ILE 102 2HD1 ILE 102 -16.407 13.530 -21.580 772 H ARG 103 H ARG 103 -15.107 11.136 -23.454 773 HA ARG 103 HA ARG 103 -15.660 10.779 -20.620 774 HB2 ARG 103 2HB ARG 103 -17.024 8.823 -21.447 775 HB3 ARG 103 3HB ARG 103 -17.537 10.401 -22.032 776 HG2 ARG 103 2HG ARG 103 -16.577 10.007 -24.173 777 HG3 ARG 103 3HG ARG 103 -15.775 8.540 -23.606 778 HD2 ARG 103 2HD ARG 103 -17.657 7.800 -24.809 779 HD3 ARG 103 3HD ARG 103 -18.095 7.642 -23.108 780 HE ARG 103 HE ARG 103 -18.988 10.126 -23.864 781 HH11 ARG 103 1HH1 ARG 103 -19.526 6.845 -24.895 782 HH12 ARG 103 2HH1 ARG 103 -21.149 7.140 -25.426 783 HH21 ARG 103 1HH2 ARG 103 -21.123 10.527 -24.559 784 HH22 ARG 103 2HH2 ARG 103 -22.056 9.235 -25.236 785 H THR 104 H THR 104 -13.433 9.700 -22.961 786 HA THR 104 HA THR 104 -12.848 7.105 -22.234 787 HB THR 104 HB THR 104 -10.780 9.194 -22.937 788 HG1 THR 104 HG1 THR 104 -11.229 8.604 -25.093 789 HG21 THR 104 3HG2 THR 104 -10.641 6.377 -22.420 790 HG22 THR 104 1HG2 THR 104 -9.340 7.497 -22.821 791 HG23 THR 104 2HG2 THR 104 -10.236 6.689 -24.107 792 H VAL 105 H VAL 105 -11.186 10.009 -20.982 793 HA VAL 105 HA VAL 105 -9.729 8.700 -18.989 794 HB VAL 105 HB VAL 105 -9.726 11.011 -17.864 795 HG11 VAL 105 1HG1 VAL 105 -8.790 10.915 -20.725 796 HG12 VAL 105 2HG1 VAL 105 -8.096 11.840 -19.392 797 HG13 VAL 105 3HG1 VAL 105 -7.978 10.080 -19.400 798 HG21 VAL 105 3HG2 VAL 105 -11.033 11.785 -20.470 799 HG22 VAL 105 1HG2 VAL 105 -11.847 11.758 -18.906 800 HG23 VAL 105 2HG2 VAL 105 -10.507 12.871 -19.183 801 H ILE 106 H ILE 106 -12.937 10.187 -18.895 802 HA ILE 106 HA ILE 106 -13.417 10.020 -16.156 803 HB ILE 106 HB ILE 106 -15.652 9.473 -18.056 804 HG12 ILE 106 2HG1 ILE 106 -14.257 11.101 -19.247 805 HG13 ILE 106 3HG1 ILE 106 -15.745 11.849 -18.679 806 HG21 ILE 106 1HG2 ILE 106 -15.302 10.466 -15.380 807 HG22 ILE 106 2HG2 ILE 106 -16.198 11.627 -16.359 808 HG23 ILE 106 3HG2 ILE 106 -16.778 9.968 -16.206 809 HD11 ILE 106 3HD1 ILE 106 -14.602 12.956 -16.914 810 HD12 ILE 106 1HD1 ILE 106 -13.123 12.049 -17.227 811 HD13 ILE 106 2HD1 ILE 106 -13.695 13.234 -18.401 812 H ALA 107 H ALA 107 -13.217 7.537 -18.516 813 HA ALA 107 HA ALA 107 -14.876 5.554 -17.569 814 HB1 ALA 107 1HB ALA 107 -13.521 5.383 -19.616 815 HB2 ALA 107 2HB ALA 107 -12.079 5.160 -18.625 816 HB3 ALA 107 3HB ALA 107 -13.368 3.957 -18.589 817 H GLY 108 H GLY 108 -12.075 6.893 -16.074 818 HA2 GLY 108 2HA GLY 108 -11.774 4.636 -14.244 819 HA3 GLY 108 3HA GLY 108 -10.737 6.053 -14.326 820 H TYR 109 H TYR 109 -13.054 7.886 -14.291 821 HA TYR 109 HA TYR 109 -13.141 8.503 -11.604 822 HB2 TYR 109 2HB TYR 109 -14.222 10.283 -12.411 823 HB3 TYR 109 3HB TYR 109 -14.327 9.486 -13.977 824 HD1 TYR 109 HD2 TYR 109 -16.094 10.031 -10.775 825 HD2 TYR 109 HD1 TYR 109 -16.391 8.635 -14.784 826 HE1 TYR 109 HE2 TYR 109 -18.542 9.934 -10.554 827 HE2 TYR 109 HE1 TYR 109 -18.840 8.535 -14.574 828 HH TYR 109 HH TYR 109 -20.440 8.896 -11.541 829 H ASN 110 H ASN 110 -15.392 6.515 -13.479 830 HA ASN 110 HA ASN 110 -17.384 6.098 -11.629 831 HB2 ASN 110 2HB ASN 110 -16.210 4.157 -13.628 832 HB3 ASN 110 3HB ASN 110 -17.701 3.864 -12.738 833 HD21 ASN 110 1HD2 ASN 110 -19.447 5.401 -13.037 834 HD22 ASN 110 2HD2 ASN 110 -19.617 6.193 -14.563 835 H LEU 111 H LEU 111 -14.130 4.925 -11.594 836 HA LEU 111 HA LEU 111 -14.666 2.921 -9.564 837 HB2 LEU 111 2HB LEU 111 -12.480 3.593 -11.358 838 HB3 LEU 111 3HB LEU 111 -11.924 3.237 -9.724 839 HG LEU 111 HG LEU 111 -11.847 1.266 -11.174 840 HD11 LEU 111 1HD1 LEU 111 -12.630 1.345 -8.625 841 HD12 LEU 111 2HD1 LEU 111 -12.492 -0.158 -9.536 842 HD13 LEU 111 3HD1 LEU 111 -14.067 0.609 -9.334 843 HD21 LEU 111 3HD2 LEU 111 -13.869 2.041 -12.532 844 HD22 LEU 111 1HD2 LEU 111 -14.847 1.316 -11.256 845 HD23 LEU 111 2HD2 LEU 111 -13.732 0.316 -12.187 846 H TYR 112 H TYR 112 -13.311 6.146 -9.821 847 HA TYR 112 HA TYR 112 -11.988 6.482 -7.464 848 HB2 TYR 112 2HB TYR 112 -13.025 8.171 -9.416 849 HB3 TYR 112 3HB TYR 112 -13.784 8.724 -7.927 850 HD1 TYR 112 HD2 TYR 112 -12.029 8.847 -5.872 851 HD2 TYR 112 HD1 TYR 112 -11.047 9.192 -9.997 852 HE1 TYR 112 HE2 TYR 112 -9.979 10.068 -5.276 853 HE2 TYR 112 HE1 TYR 112 -8.994 10.413 -9.413 854 HH TYR 112 HH TYR 112 -8.345 11.457 -6.145 855 H ARG 113 H ARG 113 -15.502 6.744 -7.931 856 HA ARG 113 HA ARG 113 -15.986 7.133 -5.121 857 HB2 ARG 113 2HB ARG 113 -17.624 7.012 -7.590 858 HB3 ARG 113 3HB ARG 113 -18.430 6.562 -6.093 859 HG2 ARG 113 2HG ARG 113 -17.124 8.878 -5.409 860 HG3 ARG 113 3HG ARG 113 -17.628 9.180 -7.073 861 HD2 ARG 113 2HD ARG 113 -19.640 7.948 -5.297 862 HD3 ARG 113 3HD ARG 113 -19.201 9.617 -4.936 863 HE ARG 113 HE ARG 113 -19.733 9.320 -7.696 864 HH11 ARG 113 1HH1 ARG 113 -21.328 9.449 -4.604 865 HH12 ARG 113 2HH1 ARG 113 -22.812 10.067 -5.249 866 HH21 ARG 113 1HH2 ARG 113 -21.682 10.133 -8.557 867 HH22 ARG 113 2HH2 ARG 113 -23.013 10.455 -7.498 868 H ALA 114 H ALA 114 -15.779 4.452 -7.295 869 HA ALA 114 HA ALA 114 -17.337 2.520 -6.110 870 HB1 ALA 114 1HB ALA 114 -15.942 0.891 -7.133 871 HB2 ALA 114 2HB ALA 114 -15.967 2.293 -8.203 872 HB3 ALA 114 3HB ALA 114 -14.569 1.997 -7.170 873 H ILE 115 H ILE 115 -14.116 3.617 -5.149 874 HA ILE 115 HA ILE 115 -13.951 1.710 -2.987 875 HB ILE 115 HB ILE 115 -12.178 4.069 -3.631 876 HG12 ILE 115 2HG1 ILE 115 -12.182 2.360 -5.395 877 HG13 ILE 115 3HG1 ILE 115 -10.641 2.387 -4.545 878 HG21 ILE 115 1HG2 ILE 115 -12.253 2.200 -1.395 879 HG22 ILE 115 2HG2 ILE 115 -10.686 2.268 -2.199 880 HG23 ILE 115 3HG2 ILE 115 -11.412 3.742 -1.557 881 HD11 ILE 115 3HD1 ILE 115 -10.846 0.207 -4.261 882 HD12 ILE 115 1HD1 ILE 115 -12.209 0.521 -3.187 883 HD13 ILE 115 2HD1 ILE 115 -12.488 0.227 -4.904 884 H LYS 116 H LYS 116 -15.184 4.872 -3.453 885 HA LYS 116 HA LYS 116 -14.954 5.779 -0.753 886 HB2 LYS 116 2HB LYS 116 -16.503 6.698 -3.157 887 HB3 LYS 116 3HB LYS 116 -16.796 7.412 -1.577 888 HG2 LYS 116 2HG LYS 116 -14.143 7.348 -3.000 889 HG3 LYS 116 3HG LYS 116 -15.232 8.734 -2.910 890 HD2 LYS 116 2HD LYS 116 -14.392 9.315 -0.935 891 HD3 LYS 116 3HD LYS 116 -14.752 7.717 -0.275 892 HE2 LYS 116 2HE LYS 116 -12.596 7.044 -1.629 893 HE3 LYS 116 3HE LYS 116 -12.231 8.762 -1.474 894 HZ1 LYS 116 3HZ LYS 116 -13.075 7.770 1.017 895 HZ2 LYS 116 1HZ LYS 116 -11.570 8.416 0.595 896 HZ3 LYS 116 2HZ LYS 116 -11.857 6.758 0.421 897 H LYS 117 H LYS 117 -17.310 3.951 -2.572 898 HA LYS 117 HA LYS 117 -19.311 4.116 -0.483 899 HB2 LYS 117 2HB LYS 117 -20.621 2.618 -1.940 900 HB3 LYS 117 3HB LYS 117 -20.053 4.045 -2.797 901 HG2 LYS 117 2HG LYS 117 -18.222 2.710 -3.758 902 HG3 LYS 117 3HG LYS 117 -18.865 1.282 -2.944 903 HD2 LYS 117 2HD LYS 117 -20.914 2.660 -4.454 904 HD3 LYS 117 3HD LYS 117 -19.546 2.214 -5.477 905 HE2 LYS 117 2HE LYS 117 -19.711 -0.098 -4.648 906 HE3 LYS 117 3HE LYS 117 -21.108 0.363 -3.676 907 HZ1 LYS 117 3HZ LYS 117 -21.501 1.157 -6.356 908 HZ2 LYS 117 1HZ LYS 117 -22.414 0.079 -5.424 909 HZ3 LYS 117 2HZ LYS 117 -21.092 -0.484 -6.315 910 H LYS 118 H LYS 118 -17.025 1.749 -1.759 911 HA LYS 118 HA LYS 118 -17.842 -0.201 0.254 912 HB2 LYS 118 2HB LYS 118 -16.180 -0.290 -2.226 913 HB3 LYS 118 3HB LYS 118 -15.890 -1.496 -0.980 914 HG2 LYS 118 2HG LYS 118 -18.249 -2.160 -1.089 915 HG3 LYS 118 3HG LYS 118 -18.510 -0.974 -2.370 916 HD2 LYS 118 2HD LYS 118 -16.307 -2.462 -3.207 917 HD3 LYS 118 3HD LYS 118 -17.425 -3.648 -2.528 918 HE2 LYS 118 2HE LYS 118 -19.194 -2.327 -3.938 919 HE3 LYS 118 3HE LYS 118 -17.779 -1.810 -4.853 920 HZ1 LYS 118 3HZ LYS 118 -18.094 -4.666 -4.289 921 HZ2 LYS 118 1HZ LYS 118 -17.397 -3.901 -5.627 922 HZ3 LYS 118 2HZ LYS 118 -19.080 -3.978 -5.479 Start of MODEL 3 1 H1 VAL 1 H VAL 1 0.212 -3.303 -7.579 2 HA VAL 1 HA VAL 1 2.046 -4.198 -6.094 3 HB VAL 1 HB VAL 1 3.872 -3.307 -7.432 4 HG11 VAL 1 1HG1 VAL 1 2.657 -1.193 -8.050 5 HG12 VAL 1 2HG1 VAL 1 3.110 -0.559 -6.467 6 HG13 VAL 1 3HG1 VAL 1 4.359 -0.992 -7.635 7 HG21 VAL 1 3HG2 VAL 1 5.278 -2.511 -5.656 8 HG22 VAL 1 1HG2 VAL 1 3.876 -2.000 -4.716 9 HG23 VAL 1 2HG2 VAL 1 4.174 -3.716 -4.993 10 H TRP 2 H TRP 2 0.281 -1.316 -6.679 11 HA TRP 2 HA TRP 2 -0.814 -1.158 -4.134 12 HB2 TRP 2 2HB TRP 2 1.082 -0.424 -3.055 13 HB3 TRP 2 3HB TRP 2 1.717 0.379 -4.489 14 HD1 TRP 2 HD1 TRP 2 -1.602 0.997 -2.562 15 HE1 TRP 2 HE1 TRP 2 -1.714 3.500 -1.973 16 HE3 TRP 2 HE3 TRP 2 2.924 2.473 -4.426 17 HZ2 TRP 2 HZ2 TRP 2 -0.099 5.796 -2.262 18 HZ3 TRP 2 HZ3 TRP 2 3.564 4.840 -4.230 19 HH2 TRP 2 HH2 TRP 2 2.083 6.466 -3.171 20 HA PRO 3 HA PRO 3 -1.765 2.948 -6.501 21 HB2 PRO 3 2HB PRO 3 -0.401 3.398 -8.805 22 HB3 PRO 3 3HB PRO 3 0.177 3.941 -7.225 23 HG2 PRO 3 2HG PRO 3 0.975 1.528 -8.808 24 HG3 PRO 3 3HG PRO 3 1.996 2.662 -7.905 25 HD2 PRO 3 2HD PRO 3 1.285 0.242 -6.922 26 HD3 PRO 3 3HD PRO 3 1.540 1.658 -5.881 27 H LEU 4 H LEU 4 -3.249 0.855 -6.753 28 HA LEU 4 HA LEU 4 -3.600 0.111 -9.546 29 HB2 LEU 4 2HB LEU 4 -4.607 -0.877 -6.934 30 HB3 LEU 4 3HB LEU 4 -5.610 -1.155 -8.357 31 HG LEU 4 HG LEU 4 -2.736 -1.964 -8.415 32 HD11 LEU 4 1HD1 LEU 4 -4.721 -3.953 -7.479 33 HD12 LEU 4 2HD1 LEU 4 -4.127 -2.782 -6.302 34 HD13 LEU 4 3HD1 LEU 4 -2.992 -3.830 -7.151 35 HD21 LEU 4 3HD2 LEU 4 -4.730 -2.061 -10.249 36 HD22 LEU 4 1HD2 LEU 4 -4.870 -3.657 -9.511 37 HD23 LEU 4 2HD2 LEU 4 -3.340 -3.148 -10.226 38 H VAL 5 H VAL 5 -4.908 2.280 -7.222 39 HA VAL 5 HA VAL 5 -7.412 2.653 -8.643 40 HB VAL 5 HB VAL 5 -7.884 4.378 -6.952 41 HG11 VAL 5 1HG1 VAL 5 -7.668 1.616 -6.562 42 HG12 VAL 5 2HG1 VAL 5 -7.035 2.357 -5.091 43 HG13 VAL 5 3HG1 VAL 5 -8.660 2.753 -5.650 44 HG21 VAL 5 3HG2 VAL 5 -6.115 4.247 -4.971 45 HG22 VAL 5 1HG2 VAL 5 -5.021 3.932 -6.318 46 HG23 VAL 5 2HG2 VAL 5 -5.972 5.418 -6.282 47 H ILE 6 H ILE 6 -4.394 4.410 -8.084 48 HA ILE 6 HA ILE 6 -5.115 6.796 -9.387 49 HB ILE 6 HB ILE 6 -2.782 7.337 -9.451 50 HG12 ILE 6 2HG1 ILE 6 -1.271 5.305 -8.516 51 HG13 ILE 6 3HG1 ILE 6 -2.474 4.389 -9.417 52 HG21 ILE 6 1HG2 ILE 6 -2.780 7.641 -7.252 53 HG22 ILE 6 2HG2 ILE 6 -4.128 6.511 -7.135 54 HG23 ILE 6 3HG2 ILE 6 -2.472 5.927 -6.974 55 HD11 ILE 6 3HD1 ILE 6 -0.228 5.917 -10.370 56 HD12 ILE 6 1HD1 ILE 6 -1.241 4.749 -11.218 57 HD13 ILE 6 2HD1 ILE 6 -1.730 6.441 -11.129 58 H ARG 7 H ARG 7 -3.971 3.723 -10.583 59 HA ARG 7 HA ARG 7 -3.294 4.652 -13.200 60 HB2 ARG 7 2HB ARG 7 -3.302 2.200 -13.761 61 HB3 ARG 7 3HB ARG 7 -2.235 2.655 -12.439 62 HG2 ARG 7 2HG ARG 7 -3.724 1.769 -10.819 63 HG3 ARG 7 3HG ARG 7 -5.003 1.561 -12.017 64 HD2 ARG 7 2HD ARG 7 -2.380 0.078 -11.894 65 HD3 ARG 7 3HD ARG 7 -3.978 -0.574 -11.531 66 HE ARG 7 HE ARG 7 -4.250 0.278 -14.072 67 HH11 ARG 7 1HH1 ARG 7 -1.883 -1.726 -12.490 68 HH12 ARG 7 2HH1 ARG 7 -1.539 -2.663 -13.906 69 HH21 ARG 7 1HH2 ARG 7 -3.806 -0.950 -15.943 70 HH22 ARG 7 2HH2 ARG 7 -2.633 -2.220 -15.870 71 H THR 8 H THR 8 -6.202 3.623 -11.628 72 HA THR 8 HA THR 8 -7.782 2.744 -13.704 73 HB THR 8 HB THR 8 -8.942 4.640 -11.693 74 HG1 THR 8 HG1 THR 8 -7.722 2.139 -11.206 75 HG21 THR 8 3HG2 THR 8 -10.756 3.784 -12.708 76 HG22 THR 8 1HG2 THR 8 -10.439 2.351 -11.732 77 HG23 THR 8 2HG2 THR 8 -9.853 2.434 -13.394 78 H VAL 9 H VAL 9 -7.540 6.121 -12.569 79 HA VAL 9 HA VAL 9 -9.046 7.199 -14.706 80 HB VAL 9 HB VAL 9 -7.871 9.381 -14.001 81 HG11 VAL 9 1HG1 VAL 9 -9.266 8.143 -11.682 82 HG12 VAL 9 2HG1 VAL 9 -9.494 9.728 -12.422 83 HG13 VAL 9 3HG1 VAL 9 -10.131 8.285 -13.212 84 HG21 VAL 9 3HG2 VAL 9 -5.959 8.089 -12.937 85 HG22 VAL 9 1HG2 VAL 9 -6.647 9.406 -11.987 86 HG23 VAL 9 2HG2 VAL 9 -7.071 7.736 -11.614 87 H ILE 10 H ILE 10 -5.597 6.677 -14.218 88 HA ILE 10 HA ILE 10 -4.601 8.167 -16.354 89 HB ILE 10 HB ILE 10 -3.500 5.557 -15.307 90 HG12 ILE 10 2HG1 ILE 10 -3.885 7.949 -13.927 91 HG13 ILE 10 3HG1 ILE 10 -2.820 6.627 -13.458 92 HG21 ILE 10 1HG2 ILE 10 -2.235 7.797 -16.875 93 HG22 ILE 10 2HG2 ILE 10 -1.335 6.493 -16.102 94 HG23 ILE 10 3HG2 ILE 10 -2.476 6.129 -17.397 95 HD11 ILE 10 3HD1 ILE 10 -1.998 8.937 -15.199 96 HD12 ILE 10 1HD1 ILE 10 -1.730 8.844 -13.459 97 HD13 ILE 10 2HD1 ILE 10 -0.956 7.679 -14.535 98 H ALA 11 H ALA 11 -6.445 5.288 -16.359 99 HA ALA 11 HA ALA 11 -5.646 3.900 -18.580 100 HB1 ALA 11 1HB ALA 11 -8.420 4.467 -17.564 101 HB2 ALA 11 2HB ALA 11 -8.092 3.351 -18.890 102 HB3 ALA 11 3HB ALA 11 -7.427 3.035 -17.287 103 H GLY 12 H GLY 12 -7.051 7.061 -18.447 104 HA2 GLY 12 2HA GLY 12 -7.676 7.073 -21.297 105 HA3 GLY 12 3HA GLY 12 -7.995 8.370 -20.156 106 H TYR 13 H TYR 13 -5.290 8.384 -19.081 107 HA TYR 13 HA TYR 13 -4.132 10.342 -20.650 108 HB2 TYR 13 2HB TYR 13 -3.320 10.226 -18.466 109 HB3 TYR 13 3HB TYR 13 -3.036 8.492 -18.558 110 HD1 TYR 13 HD2 TYR 13 -1.940 11.104 -20.962 111 HD2 TYR 13 HD1 TYR 13 -0.773 8.316 -17.968 112 HE1 TYR 13 HE2 TYR 13 0.423 11.525 -21.500 113 HE2 TYR 13 HE1 TYR 13 1.593 8.729 -18.497 114 HH TYR 13 HH TYR 13 2.824 11.051 -19.730 115 H ASN 14 H ASN 14 -3.285 6.886 -20.518 116 HA ASN 14 HA ASN 14 -1.219 6.823 -22.324 117 HB2 ASN 14 2HB ASN 14 -3.000 4.922 -21.146 118 HB3 ASN 14 3HB ASN 14 -2.834 4.543 -22.858 119 HD21 ASN 14 1HD2 ASN 14 -1.769 3.482 -20.149 120 HD22 ASN 14 2HD2 ASN 14 -0.101 3.185 -20.487 121 H LEU 15 H LEU 15 -4.545 7.465 -22.929 122 HA LEU 15 HA LEU 15 -4.281 7.000 -25.797 123 HB2 LEU 15 2HB LEU 15 -6.420 6.961 -23.943 124 HB3 LEU 15 3HB LEU 15 -6.752 8.243 -25.105 125 HG LEU 15 HG LEU 15 -7.789 6.076 -25.698 126 HD11 LEU 15 1HD1 LEU 15 -6.008 6.214 -27.932 127 HD12 LEU 15 2HD1 LEU 15 -6.338 7.840 -27.335 128 HD13 LEU 15 3HD1 LEU 15 -7.672 6.782 -27.794 129 HD21 LEU 15 3HD2 LEU 15 -5.520 4.920 -24.833 130 HD22 LEU 15 1HD2 LEU 15 -5.205 4.952 -26.568 131 HD23 LEU 15 2HD2 LEU 15 -6.647 4.146 -25.949 132 H TYR 16 H TYR 16 -4.540 9.618 -23.482 133 HA TYR 16 HA TYR 16 -5.183 11.788 -24.979 134 HB2 TYR 16 2HB TYR 16 -4.094 11.418 -22.490 135 HB3 TYR 16 3HB TYR 16 -2.804 12.274 -23.326 136 HD1 TYR 16 HD2 TYR 16 -4.462 14.001 -25.130 137 HD2 TYR 16 HD1 TYR 16 -4.880 13.056 -21.002 138 HE1 TYR 16 HE2 TYR 16 -5.637 16.131 -24.767 139 HE2 TYR 16 HE1 TYR 16 -6.057 15.183 -20.628 140 HH TYR 16 HH TYR 16 -6.131 17.473 -21.779 141 H ARG 17 H ARG 17 -1.920 10.389 -24.720 142 HA ARG 17 HA ARG 17 -0.870 12.152 -26.740 143 HB2 ARG 17 2HB ARG 17 0.187 10.176 -24.861 144 HB3 ARG 17 3HB ARG 17 0.981 10.129 -26.429 145 HG2 ARG 17 2HG ARG 17 0.756 12.844 -25.695 146 HG3 ARG 17 3HG ARG 17 1.351 11.964 -24.286 147 HD2 ARG 17 2HD ARG 17 2.534 11.984 -27.058 148 HD3 ARG 17 3HD ARG 17 3.226 12.695 -25.601 149 HE ARG 17 HE ARG 17 2.993 10.103 -24.926 150 HH11 ARG 17 1HH1 ARG 17 4.347 11.691 -27.712 151 HH12 ARG 17 2HH1 ARG 17 5.531 10.460 -28.002 152 HH21 ARG 17 1HH2 ARG 17 4.548 8.475 -25.296 153 HH22 ARG 17 2HH2 ARG 17 5.644 8.631 -26.627 154 H ALA 18 H ALA 18 -2.295 9.002 -26.628 155 HA ALA 18 HA ALA 18 -1.274 7.742 -28.851 156 HB1 ALA 18 1HB ALA 18 -4.191 7.723 -28.100 157 HB2 ALA 18 2HB ALA 18 -3.283 6.462 -28.935 158 HB3 ALA 18 3HB ALA 18 -2.948 6.814 -27.240 159 H ILE 19 H ILE 19 -3.713 10.288 -28.704 160 HA ILE 19 HA ILE 19 -4.174 10.217 -31.557 161 HB ILE 19 HB ILE 19 -5.115 12.207 -29.487 162 HG12 ILE 19 2HG1 ILE 19 -6.003 9.973 -29.078 163 HG13 ILE 19 3HG1 ILE 19 -7.276 11.023 -29.691 164 HG21 ILE 19 1HG2 ILE 19 -5.310 12.134 -32.393 165 HG22 ILE 19 2HG2 ILE 19 -6.875 12.280 -31.595 166 HG23 ILE 19 3HG2 ILE 19 -5.606 13.461 -31.270 167 HD11 ILE 19 3HD1 ILE 19 -7.716 9.473 -31.202 168 HD12 ILE 19 1HD1 ILE 19 -6.155 9.823 -31.945 169 HD13 ILE 19 2HD1 ILE 19 -6.291 8.543 -30.739 170 H LYS 20 H LYS 20 -2.036 11.789 -29.386 171 HA LYS 20 HA LYS 20 -1.495 14.095 -30.987 172 HB2 LYS 20 2HB LYS 20 -0.867 13.262 -28.404 173 HB3 LYS 20 3HB LYS 20 0.683 13.298 -29.234 174 HG2 LYS 20 2HG LYS 20 -0.341 15.658 -30.035 175 HG3 LYS 20 3HG LYS 20 -1.099 15.502 -28.448 176 HD2 LYS 20 2HD LYS 20 1.051 15.246 -27.392 177 HD3 LYS 20 3HD LYS 20 1.860 15.212 -28.961 178 HE2 LYS 20 2HE LYS 20 0.216 17.572 -28.668 179 HE3 LYS 20 3HE LYS 20 1.390 17.441 -27.359 180 HZ1 LYS 20 3HZ LYS 20 2.321 18.657 -29.204 181 HZ2 LYS 20 1HZ LYS 20 1.997 17.380 -30.266 182 HZ3 LYS 20 2HZ LYS 20 3.137 17.186 -29.032 183 H LYS 21 H LYS 21 -0.242 10.843 -30.802 184 HA LYS 21 HA LYS 21 2.031 11.426 -32.500 185 HB2 LYS 21 2HB LYS 21 2.476 9.006 -32.343 186 HB3 LYS 21 3HB LYS 21 2.280 9.747 -30.760 187 HG2 LYS 21 2HG LYS 21 -0.031 8.911 -30.677 188 HG3 LYS 21 3HG LYS 21 0.218 8.123 -32.237 189 HD2 LYS 21 2HD LYS 21 2.256 7.021 -31.044 190 HD3 LYS 21 3HD LYS 21 1.398 7.468 -29.567 191 HE2 LYS 21 2HE LYS 21 -0.480 6.149 -30.154 192 HE3 LYS 21 3HE LYS 21 0.101 5.929 -31.804 193 HZ1 LYS 21 3HZ LYS 21 1.390 4.835 -29.361 194 HZ2 LYS 21 1HZ LYS 21 1.938 4.618 -30.947 195 HZ3 LYS 21 2HZ LYS 21 0.460 3.951 -30.465 196 H LYS 22 H LYS 22 -1.110 9.837 -32.764 197 HA LYS 22 HA LYS 22 -2.369 9.225 -34.556 198 HB2 LYS 22 2HB LYS 22 -1.658 11.659 -35.162 199 HB3 LYS 22 3HB LYS 22 -0.616 10.879 -36.345 200 HG2 LYS 22 2HG LYS 22 -2.555 11.394 -37.526 201 HG3 LYS 22 3HG LYS 22 -2.722 9.678 -37.146 202 HD2 LYS 22 2HD LYS 22 -4.824 10.698 -36.702 203 HD3 LYS 22 3HD LYS 22 -4.075 10.359 -35.140 204 HE2 LYS 22 2HE LYS 22 -4.381 12.496 -34.609 205 HE3 LYS 22 3HE LYS 22 -3.198 12.917 -35.847 206 HZ1 LYS 22 3HZ LYS 22 -5.163 14.138 -36.288 207 HZ2 LYS 22 1HZ LYS 22 -6.144 12.765 -36.152 208 HZ3 LYS 22 2HZ LYS 22 -5.081 12.920 -37.459 209 H GLY 23 H GLY 23 -1.590 7.066 -34.436 210 HA2 GLY 23 2HA GLY 23 -0.740 5.934 -36.798 211 HA3 GLY 23 3HA GLY 23 0.728 6.220 -35.876 212 H GLY 24 H GLY 24 -2.466 5.290 -34.656 213 HA2 GLY 24 2HA GLY 24 -2.523 2.665 -34.430 214 HA3 GLY 24 3HA GLY 24 -1.209 3.014 -33.316 215 H GLY 25 H GLY 25 -2.041 2.603 -31.355 216 HA2 GLY 25 2HA GLY 25 -4.189 4.323 -30.420 217 HA3 GLY 25 3HA GLY 25 -4.542 2.601 -30.400 218 H GLY 26 H GLY 26 -3.951 1.454 -28.664 219 HA2 GLY 26 2HA GLY 26 -3.087 2.627 -26.312 220 HA3 GLY 26 3HA GLY 26 -2.968 0.908 -26.661 221 H GLY 27 H GLY 27 -1.076 1.877 -25.068 222 HA2 GLY 27 2HA GLY 27 1.320 1.259 -26.392 223 HA3 GLY 27 3HA GLY 27 1.190 3.009 -26.291 224 H GLY 28 H GLY 28 3.220 2.646 -25.023 225 HA2 GLY 28 2HA GLY 28 2.637 2.902 -22.241 226 HA3 GLY 28 3HA GLY 28 3.388 1.352 -22.592 227 H GLY 29 H GLY 29 3.919 4.626 -21.943 228 HA2 GLY 29 2HA GLY 29 6.791 4.224 -22.159 229 HA3 GLY 29 3HA GLY 29 6.126 5.495 -23.173 230 H GLY 30 H GLY 30 6.968 7.278 -22.216 231 HA2 GLY 30 2HA GLY 30 5.934 7.912 -19.553 232 HA3 GLY 30 3HA GLY 30 7.677 7.958 -19.775 233 H GLY 31 H GLY 31 8.412 9.337 -21.678 234 HA2 GLY 31 2HA GLY 31 6.872 11.849 -21.591 235 HA3 GLY 31 3HA GLY 31 8.605 11.734 -21.863 236 H GLY 32 H GLY 32 7.250 13.281 -23.565 237 HA2 GLY 32 2HA GLY 32 7.318 11.691 -26.039 238 HA3 GLY 32 3HA GLY 32 5.938 12.732 -25.724 239 H VAL 33 H VAL 33 6.092 14.356 -27.136 240 HA VAL 33 HA VAL 33 8.704 15.675 -27.463 241 HB VAL 33 HB VAL 33 7.783 16.617 -29.561 242 HG11 VAL 33 1HG1 VAL 33 8.603 14.862 -30.672 243 HG12 VAL 33 2HG1 VAL 33 8.762 14.083 -29.097 244 HG13 VAL 33 3HG1 VAL 33 7.330 13.792 -30.085 245 HG21 VAL 33 3HG2 VAL 33 5.424 16.584 -29.033 246 HG22 VAL 33 1HG2 VAL 33 5.715 15.630 -30.487 247 HG23 VAL 33 2HG2 VAL 33 5.437 14.823 -28.945 248 H TRP 34 H TRP 34 5.313 16.177 -26.730 249 HA TRP 34 HA TRP 34 5.913 18.639 -25.378 250 HB2 TRP 34 2HB TRP 34 5.703 19.369 -27.758 251 HB3 TRP 34 3HB TRP 34 4.050 18.760 -27.758 252 HD1 TRP 34 HD1 TRP 34 5.053 20.458 -24.563 253 HE1 TRP 34 HE1 TRP 34 3.933 22.772 -24.424 254 HE3 TRP 34 HE3 TRP 34 3.283 20.792 -29.348 255 HZ2 TRP 34 HZ2 TRP 34 2.490 24.508 -26.118 256 HZ3 TRP 34 HZ3 TRP 34 2.043 22.812 -30.008 257 HH2 TRP 34 HH2 TRP 34 1.655 24.630 -28.425 258 HA PRO 35 HA PRO 35 2.257 16.063 -23.939 259 HB2 PRO 35 2HB PRO 35 3.277 15.461 -21.496 260 HB3 PRO 35 3HB PRO 35 3.562 14.465 -22.928 261 HG2 PRO 35 2HG PRO 35 5.335 16.522 -21.668 262 HG3 PRO 35 3HG PRO 35 5.756 14.924 -22.310 263 HD2 PRO 35 2HD PRO 35 6.184 17.209 -23.697 264 HD3 PRO 35 3HD PRO 35 5.794 15.670 -24.490 265 H LEU 36 H LEU 36 1.873 18.618 -24.120 266 HA LEU 36 HA LEU 36 1.845 19.872 -21.490 267 HB2 LEU 36 2HB LEU 36 1.443 21.885 -22.561 268 HB3 LEU 36 3HB LEU 36 2.483 21.024 -23.694 269 HG LEU 36 HG LEU 36 -0.505 21.023 -23.995 270 HD11 LEU 36 1HD1 LEU 36 -0.367 23.247 -24.262 271 HD12 LEU 36 2HD1 LEU 36 0.331 22.831 -25.827 272 HD13 LEU 36 3HD1 LEU 36 1.384 23.220 -24.468 273 HD21 LEU 36 3HD2 LEU 36 1.860 20.318 -25.673 274 HD22 LEU 36 1HD2 LEU 36 0.370 20.853 -26.449 275 HD23 LEU 36 2HD2 LEU 36 0.360 19.427 -25.410 276 H VAL 37 H VAL 37 -0.345 18.500 -23.852 277 HA VAL 37 HA VAL 37 -2.697 19.340 -22.364 278 HB VAL 37 HB VAL 37 -3.980 18.180 -24.106 279 HG11 VAL 37 1HG1 VAL 37 -3.393 20.483 -24.497 280 HG12 VAL 37 2HG1 VAL 37 -1.816 20.012 -25.135 281 HG13 VAL 37 3HG1 VAL 37 -3.286 19.596 -26.017 282 HG21 VAL 37 3HG2 VAL 37 -2.566 16.326 -24.618 283 HG22 VAL 37 1HG2 VAL 37 -2.731 17.288 -26.087 284 HG23 VAL 37 2HG2 VAL 37 -1.256 17.392 -25.126 285 H ILE 38 H ILE 38 -0.880 16.394 -23.042 286 HA ILE 38 HA ILE 38 -2.662 14.557 -21.887 287 HB ILE 38 HB ILE 38 -0.828 13.003 -21.801 288 HG12 ILE 38 2HG1 ILE 38 1.463 14.148 -22.642 289 HG13 ILE 38 3HG1 ILE 38 0.784 15.493 -21.733 290 HG21 ILE 38 1HG2 ILE 38 -1.538 14.492 -24.107 291 HG22 ILE 38 2HG2 ILE 38 0.179 14.107 -24.215 292 HG23 ILE 38 3HG2 ILE 38 -1.003 12.815 -24.004 293 HD11 ILE 38 3HD1 ILE 38 0.451 13.350 -20.040 294 HD12 ILE 38 1HD1 ILE 38 2.015 13.044 -20.796 295 HD13 ILE 38 2HD1 ILE 38 1.725 14.566 -19.952 296 H ARG 39 H ARG 39 -0.503 16.842 -20.476 297 HA ARG 39 HA ARG 39 -0.451 15.530 -17.890 298 HB2 ARG 39 2HB ARG 39 0.807 17.579 -17.190 299 HB3 ARG 39 3HB ARG 39 1.547 16.692 -18.516 300 HG2 ARG 39 2HG ARG 39 0.720 18.299 -20.111 301 HG3 ARG 39 3HG ARG 39 -0.159 19.151 -18.840 302 HD2 ARG 39 2HD ARG 39 2.834 18.841 -19.054 303 HD3 ARG 39 3HD ARG 39 1.910 20.310 -19.369 304 HE ARG 39 HE ARG 39 1.285 19.576 -16.792 305 HH11 ARG 39 1HH1 ARG 39 4.175 20.397 -18.552 306 HH12 ARG 39 2HH1 ARG 39 4.986 21.054 -17.170 307 HH21 ARG 39 1HH2 ARG 39 2.343 20.439 -14.965 308 HH22 ARG 39 2HH2 ARG 39 3.944 21.077 -15.130 309 H THR 40 H THR 40 -2.403 17.781 -19.567 310 HA THR 40 HA THR 40 -3.388 19.448 -17.608 311 HB THR 40 HB THR 40 -5.217 18.191 -19.641 312 HG1 THR 40 HG1 THR 40 -4.371 19.887 -21.060 313 HG21 THR 40 3HG2 THR 40 -5.562 20.216 -17.784 314 HG22 THR 40 1HG2 THR 40 -6.578 19.910 -19.192 315 HG23 THR 40 2HG2 THR 40 -5.259 21.076 -19.293 316 H VAL 41 H VAL 41 -4.897 16.367 -18.602 317 HA VAL 41 HA VAL 41 -6.726 16.278 -16.461 318 HB VAL 41 HB VAL 41 -6.893 13.819 -17.024 319 HG11 VAL 41 1HG1 VAL 41 -7.370 16.075 -18.891 320 HG12 VAL 41 2HG1 VAL 41 -7.593 14.438 -19.511 321 HG13 VAL 41 3HG1 VAL 41 -8.518 14.986 -18.112 322 HG21 VAL 41 3HG2 VAL 41 -4.900 14.593 -19.155 323 HG22 VAL 41 1HG2 VAL 41 -4.613 13.487 -17.811 324 HG23 VAL 41 2HG2 VAL 41 -5.772 13.062 -19.071 325 H ILE 42 H ILE 42 -3.473 14.978 -16.855 326 HA ILE 42 HA ILE 42 -3.353 13.313 -14.633 327 HB ILE 42 HB ILE 42 -1.106 15.019 -15.712 328 HG12 ILE 42 2HG1 ILE 42 -2.566 13.141 -17.099 329 HG13 ILE 42 3HG1 ILE 42 -0.918 13.632 -17.476 330 HG21 ILE 42 1HG2 ILE 42 -1.129 12.525 -14.023 331 HG22 ILE 42 2HG2 ILE 42 0.308 13.157 -14.825 332 HG23 ILE 42 3HG2 ILE 42 -0.503 14.115 -13.587 333 HD11 ILE 42 3HD1 ILE 42 -1.598 11.352 -15.641 334 HD12 ILE 42 1HD1 ILE 42 -1.293 11.171 -17.368 335 HD13 ILE 42 2HD1 ILE 42 -0.019 11.770 -16.305 336 H ALA 43 H ALA 43 -3.548 16.728 -14.788 337 HA ALA 43 HA ALA 43 -2.223 17.629 -12.561 338 HB1 ALA 43 1HB ALA 43 -3.275 19.215 -13.958 339 HB2 ALA 43 2HB ALA 43 -4.863 18.487 -13.716 340 HB3 ALA 43 3HB ALA 43 -4.074 19.343 -12.391 341 H GLY 44 H GLY 44 -4.984 15.561 -12.694 342 HA2 GLY 44 2HA GLY 44 -5.622 15.998 -9.873 343 HA3 GLY 44 3HA GLY 44 -6.540 15.016 -11.004 344 H TYR 45 H TYR 45 -4.160 13.601 -11.967 345 HA TYR 45 HA TYR 45 -4.238 11.353 -10.368 346 HB2 TYR 45 2HB TYR 45 -3.345 10.977 -12.478 347 HB3 TYR 45 3HB TYR 45 -2.271 12.368 -12.386 348 HD1 TYR 45 HD2 TYR 45 -2.747 9.422 -10.135 349 HD2 TYR 45 HD1 TYR 45 -0.093 11.632 -12.620 350 HE1 TYR 45 HE2 TYR 45 -0.899 7.944 -9.466 351 HE2 TYR 45 HE1 TYR 45 1.762 10.159 -11.959 352 HH TYR 45 HH TYR 45 1.760 7.512 -11.008 353 H ASN 46 H ASN 46 -1.801 13.944 -10.360 354 HA ASN 46 HA ASN 46 -0.059 12.983 -8.469 355 HB2 ASN 46 2HB ASN 46 -0.219 15.291 -9.824 356 HB3 ASN 46 3HB ASN 46 -0.770 15.862 -8.251 357 HD21 ASN 46 1HD2 ASN 46 1.103 17.151 -8.116 358 HD22 ASN 46 2HD2 ASN 46 2.631 16.462 -7.695 359 H LEU 47 H LEU 47 -3.295 14.113 -8.018 360 HA LEU 47 HA LEU 47 -3.000 14.361 -5.137 361 HB2 LEU 47 2HB LEU 47 -4.813 15.333 -7.109 362 HB3 LEU 47 3HB LEU 47 -5.725 14.419 -5.910 363 HG LEU 47 HG LEU 47 -3.855 16.261 -4.674 364 HD11 LEU 47 1HD1 LEU 47 -5.705 17.274 -6.781 365 HD12 LEU 47 2HD1 LEU 47 -4.081 17.811 -6.353 366 HD13 LEU 47 3HD1 LEU 47 -5.449 18.228 -5.320 367 HD21 LEU 47 3HD2 LEU 47 -6.275 17.020 -3.839 368 HD22 LEU 47 1HD2 LEU 47 -5.453 15.590 -3.214 369 HD23 LEU 47 2HD2 LEU 47 -6.685 15.422 -4.465 370 H TYR 48 H TYR 48 -4.396 12.174 -7.505 371 HA TYR 48 HA TYR 48 -6.001 10.561 -6.001 372 HB2 TYR 48 2HB TYR 48 -4.789 10.394 -8.511 373 HB3 TYR 48 3HB TYR 48 -4.274 8.934 -7.673 374 HD1 TYR 48 HD2 TYR 48 -6.232 7.662 -6.408 375 HD2 TYR 48 HD1 TYR 48 -6.784 10.338 -9.670 376 HE1 TYR 48 HE2 TYR 48 -8.403 6.613 -6.894 377 HE2 TYR 48 HE1 TYR 48 -8.957 9.297 -10.164 378 HH TYR 48 HH TYR 48 -10.711 7.980 -8.835 379 H ARG 49 H ARG 49 -2.469 10.291 -6.312 380 HA ARG 49 HA ARG 49 -2.307 8.145 -4.412 381 HB2 ARG 49 2HB ARG 49 -0.385 9.734 -6.029 382 HB3 ARG 49 3HB ARG 49 0.235 8.967 -4.573 383 HG2 ARG 49 2HG ARG 49 -1.069 6.886 -5.628 384 HG3 ARG 49 3HG ARG 49 -0.685 7.768 -7.107 385 HD2 ARG 49 2HD ARG 49 1.496 7.462 -5.133 386 HD3 ARG 49 3HD ARG 49 0.980 6.002 -5.975 387 HE ARG 49 HE ARG 49 1.304 7.794 -7.977 388 HH11 ARG 49 1HH1 ARG 49 3.336 6.726 -5.360 389 HH12 ARG 49 2HH1 ARG 49 4.813 6.982 -6.229 390 HH21 ARG 49 1HH2 ARG 49 3.241 8.135 -9.132 391 HH22 ARG 49 2HH2 ARG 49 4.758 7.784 -8.374 392 H ALA 50 H ALA 50 -2.224 11.601 -4.288 393 HA ALA 50 HA ALA 50 -0.786 12.146 -2.009 394 HB1 ALA 50 1HB ALA 50 -1.994 14.167 -1.830 395 HB2 ALA 50 2HB ALA 50 -1.942 13.783 -3.551 396 HB3 ALA 50 3HB ALA 50 -3.411 13.478 -2.624 397 H ILE 51 H ILE 51 -4.097 10.942 -2.262 398 HA ILE 51 HA ILE 51 -4.474 10.978 0.606 399 HB ILE 51 HB ILE 51 -6.219 9.793 -1.556 400 HG12 ILE 51 2HG1 ILE 51 -5.991 12.211 -1.799 401 HG13 ILE 51 3HG1 ILE 51 -7.603 11.811 -1.216 402 HG21 ILE 51 1HG2 ILE 51 -6.350 9.739 1.351 403 HG22 ILE 51 2HG2 ILE 51 -7.810 10.387 0.606 404 HG23 ILE 51 3HG2 ILE 51 -7.230 8.782 0.160 405 HD11 ILE 51 3HD1 ILE 51 -5.631 13.520 -0.059 406 HD12 ILE 51 1HD1 ILE 51 -7.305 13.253 0.428 407 HD13 ILE 51 2HD1 ILE 51 -6.025 12.218 1.064 408 H LYS 52 H LYS 52 -3.273 8.808 -1.758 409 HA LYS 52 HA LYS 52 -3.823 6.380 -0.343 410 HB2 LYS 52 2HB LYS 52 -1.906 7.012 -2.592 411 HB3 LYS 52 3HB LYS 52 -2.174 5.394 -1.957 412 HG2 LYS 52 2HG LYS 52 -4.357 7.110 -3.111 413 HG3 LYS 52 3HG LYS 52 -3.430 5.935 -4.046 414 HD2 LYS 52 2HD LYS 52 -4.649 4.238 -3.265 415 HD3 LYS 52 3HD LYS 52 -4.446 4.777 -1.596 416 HE2 LYS 52 2HE LYS 52 -6.302 6.344 -3.283 417 HE3 LYS 52 3HE LYS 52 -6.817 4.715 -2.848 418 HZ1 LYS 52 3HZ LYS 52 -7.622 6.101 -1.162 419 HZ2 LYS 52 1HZ LYS 52 -6.175 6.970 -1.043 420 HZ3 LYS 52 2HZ LYS 52 -6.252 5.374 -0.488 421 H LYS 53 H LYS 53 -1.261 8.740 -0.354 422 HA LYS 53 HA LYS 53 0.553 7.060 1.153 423 HB2 LYS 53 2HB LYS 53 2.012 9.053 1.167 424 HB3 LYS 53 3HB LYS 53 1.494 8.614 -0.455 425 HG2 LYS 53 2HG LYS 53 -0.213 10.375 -0.374 426 HG3 LYS 53 3HG LYS 53 0.349 10.828 1.236 427 HD2 LYS 53 2HD LYS 53 2.678 10.913 -0.111 428 HD3 LYS 53 3HD LYS 53 1.559 11.327 -1.412 429 HE2 LYS 53 2HE LYS 53 1.089 12.716 1.138 430 HE3 LYS 53 3HE LYS 53 2.611 13.111 0.341 431 HZ1 LYS 53 3HZ LYS 53 1.073 13.350 -1.729 432 HZ2 LYS 53 1HZ LYS 53 1.197 14.614 -0.612 433 HZ3 LYS 53 2HZ LYS 53 -0.139 13.579 -0.572 434 H LYS 54 H LYS 54 -1.560 9.828 1.728 435 HA LYS 54 HA LYS 54 -1.407 9.269 4.600 436 HB2 LYS 54 2HB LYS 54 -1.054 11.982 3.321 437 HB3 LYS 54 3HB LYS 54 -1.393 11.749 5.031 438 HG2 LYS 54 2HG LYS 54 0.683 10.747 5.425 439 HG3 LYS 54 3HG LYS 54 0.967 10.460 3.707 440 HD2 LYS 54 2HD LYS 54 1.664 12.590 3.327 441 HD3 LYS 54 3HD LYS 54 0.594 13.274 4.553 442 HE2 LYS 54 2HE LYS 54 2.059 12.563 6.313 443 HE3 LYS 54 3HE LYS 54 3.061 11.658 5.179 444 HZ1 LYS 54 3HZ LYS 54 3.526 14.192 5.996 445 HZ2 LYS 54 1HZ LYS 54 2.777 14.438 4.499 446 HZ3 LYS 54 2HZ LYS 54 4.172 13.487 4.601 447 H GLY 55 H GLY 55 -3.391 8.931 5.342 448 HA2 GLY 55 2HA GLY 55 -5.554 10.234 5.675 449 HA3 GLY 55 3HA GLY 55 -5.646 10.196 3.921 450 H GLY 56 H GLY 56 -5.411 7.877 3.000 451 HA2 GLY 56 2HA GLY 56 -6.023 5.626 3.036 452 HA3 GLY 56 3HA GLY 56 -6.503 5.808 4.716 453 H GLY 57 H GLY 57 -7.498 7.212 1.585 454 HA2 GLY 57 2HA GLY 57 -9.651 6.608 0.630 455 HA3 GLY 57 3HA GLY 57 -10.267 6.451 2.269 456 H GLY 58 H GLY 58 -9.058 8.874 3.264 457 HA2 GLY 58 2HA GLY 58 -9.178 11.235 2.892 458 HA3 GLY 58 3HA GLY 58 -10.394 10.943 1.657 459 H GLY 59 H GLY 59 -12.513 10.990 2.200 460 HA2 GLY 59 2HA GLY 59 -13.384 10.663 4.928 461 HA3 GLY 59 3HA GLY 59 -13.461 12.327 4.367 462 H GLY 60 H GLY 60 -14.607 9.045 3.717 463 HA2 GLY 60 2HA GLY 60 -16.583 9.920 1.818 464 HA3 GLY 60 3HA GLY 60 -16.423 8.304 2.490 465 H GLY 61 H GLY 61 -18.801 10.047 2.065 466 HA2 GLY 61 2HA GLY 61 -20.812 10.319 3.151 467 HA3 GLY 61 3HA GLY 61 -20.134 9.422 4.503 468 H GLY 62 H GLY 62 -21.696 12.083 4.053 469 HA2 GLY 62 2HA GLY 62 -20.732 13.391 6.354 470 HA3 GLY 62 3HA GLY 62 -20.105 14.212 4.933 471 H GLY 63 H GLY 63 -21.539 15.288 3.532 472 HA2 GLY 63 2HA GLY 63 -24.180 15.811 4.748 473 HA3 GLY 63 3HA GLY 63 -23.246 17.012 3.868 474 H GLY 64 H GLY 64 -22.531 14.781 1.900 475 HA2 GLY 64 2HA GLY 64 -23.739 13.540 0.233 476 HA3 GLY 64 3HA GLY 64 -25.135 14.562 0.542 477 H VAL 65 H VAL 65 -23.109 13.873 -1.795 478 HA VAL 65 HA VAL 65 -22.266 14.927 -3.633 479 HB VAL 65 HB VAL 65 -24.350 17.030 -3.043 480 HG11 VAL 65 1HG1 VAL 65 -23.092 17.851 -4.798 481 HG12 VAL 65 2HG1 VAL 65 -22.769 16.245 -5.455 482 HG13 VAL 65 3HG1 VAL 65 -24.366 16.971 -5.642 483 HG21 VAL 65 3HG2 VAL 65 -25.543 15.005 -2.968 484 HG22 VAL 65 1HG2 VAL 65 -25.759 15.601 -4.614 485 HG23 VAL 65 2HG2 VAL 65 -24.606 14.307 -4.289 486 H TRP 66 H TRP 66 -20.342 15.342 -2.214 487 HA TRP 66 HA TRP 66 -19.895 18.245 -1.980 488 HB2 TRP 66 2HB TRP 66 -20.060 17.219 0.248 489 HB3 TRP 66 3HB TRP 66 -18.785 16.081 -0.180 490 HD1 TRP 66 HD1 TRP 66 -18.439 19.753 -1.162 491 HE1 TRP 66 HE1 TRP 66 -16.517 20.796 0.195 492 HE3 TRP 66 HE3 TRP 66 -17.517 15.881 2.047 493 HZ2 TRP 66 HZ2 TRP 66 -14.832 20.073 2.341 494 HZ3 TRP 66 HZ3 TRP 66 -15.733 16.137 3.722 495 HH2 TRP 66 HH2 TRP 66 -14.419 18.190 3.864 496 HA PRO 67 HA PRO 67 -16.830 16.306 -4.910 497 HB2 PRO 67 2HB PRO 67 -17.188 18.132 -6.887 498 HB3 PRO 67 3HB PRO 67 -18.178 16.676 -6.734 499 HG2 PRO 67 2HG PRO 67 -18.787 19.480 -5.879 500 HG3 PRO 67 3HG PRO 67 -19.839 18.303 -6.687 501 HD2 PRO 67 2HD PRO 67 -19.969 18.788 -4.026 502 HD3 PRO 67 3HD PRO 67 -20.316 17.193 -4.724 503 H LEU 68 H LEU 68 -15.597 17.291 -2.977 504 HA LEU 68 HA LEU 68 -14.534 19.949 -3.504 505 HB2 LEU 68 2HB LEU 68 -14.843 19.768 -1.251 506 HB3 LEU 68 3HB LEU 68 -14.486 18.043 -1.232 507 HG LEU 68 HG LEU 68 -12.101 18.521 -1.390 508 HD11 LEU 68 1HD1 LEU 68 -11.817 21.192 -0.813 509 HD12 LEU 68 2HD1 LEU 68 -13.083 21.182 -2.040 510 HD13 LEU 68 3HD1 LEU 68 -11.522 20.434 -2.378 511 HD21 LEU 68 3HD2 LEU 68 -13.114 18.353 0.819 512 HD22 LEU 68 1HD2 LEU 68 -13.479 20.078 0.796 513 HD23 LEU 68 2HD2 LEU 68 -11.802 19.533 0.819 514 H VAL 69 H VAL 69 -13.298 16.635 -3.113 515 HA VAL 69 HA VAL 69 -10.697 17.423 -4.140 516 HB VAL 69 HB VAL 69 -10.052 15.083 -3.757 517 HG11 VAL 69 1HG1 VAL 69 -10.531 15.063 -1.248 518 HG12 VAL 69 2HG1 VAL 69 -9.691 16.471 -1.901 519 HG13 VAL 69 3HG1 VAL 69 -11.412 16.565 -1.527 520 HG21 VAL 69 3HG2 VAL 69 -12.930 14.742 -2.924 521 HG22 VAL 69 1HG2 VAL 69 -12.119 13.964 -4.283 522 HG23 VAL 69 2HG2 VAL 69 -11.653 13.561 -2.631 523 H ILE 70 H ILE 70 -13.525 15.607 -5.170 524 HA ILE 70 HA ILE 70 -12.413 14.466 -7.498 525 HB ILE 70 HB ILE 70 -14.639 13.974 -8.190 526 HG12 ILE 70 2HG1 ILE 70 -16.470 15.072 -6.528 527 HG13 ILE 70 3HG1 ILE 70 -15.288 16.376 -6.584 528 HG21 ILE 70 1HG2 ILE 70 -13.678 13.384 -5.620 529 HG22 ILE 70 2HG2 ILE 70 -15.400 13.715 -5.440 530 HG23 ILE 70 3HG2 ILE 70 -14.854 12.474 -6.569 531 HD11 ILE 70 3HD1 ILE 70 -15.570 15.669 -9.225 532 HD12 ILE 70 1HD1 ILE 70 -17.203 15.508 -8.579 533 HD13 ILE 70 2HD1 ILE 70 -16.339 17.038 -8.422 534 H ARG 71 H ARG 71 -13.689 17.626 -6.795 535 HA ARG 71 HA ARG 71 -14.007 18.421 -9.532 536 HB2 ARG 71 2HB ARG 71 -14.581 20.557 -8.694 537 HB3 ARG 71 3HB ARG 71 -15.232 19.403 -7.538 538 HG2 ARG 71 2HG ARG 71 -14.256 20.690 -6.000 539 HG3 ARG 71 3HG ARG 71 -12.761 19.896 -6.500 540 HD2 ARG 71 2HD ARG 71 -12.475 22.309 -6.461 541 HD3 ARG 71 3HD ARG 71 -12.350 21.697 -8.109 542 HE ARG 71 HE ARG 71 -14.992 22.580 -7.414 543 HH11 ARG 71 1HH1 ARG 71 -11.866 23.569 -8.585 544 HH12 ARG 71 2HH1 ARG 71 -12.470 24.974 -9.399 545 HH21 ARG 71 1HH2 ARG 71 -15.799 24.427 -8.482 546 HH22 ARG 71 2HH2 ARG 71 -14.707 25.462 -9.339 547 H THR 72 H THR 72 -11.418 18.375 -7.238 548 HA THR 72 HA THR 72 -9.780 20.332 -8.526 549 HB THR 72 HB THR 72 -8.478 18.225 -6.896 550 HG1 THR 72 HG1 THR 72 -9.365 19.366 -4.980 551 HG21 THR 72 3HG2 THR 72 -8.430 21.244 -6.908 552 HG22 THR 72 1HG2 THR 72 -7.214 20.164 -7.589 553 HG23 THR 72 2HG2 THR 72 -7.457 20.230 -5.843 554 H VAL 73 H VAL 73 -9.826 16.778 -8.489 555 HA VAL 73 HA VAL 73 -7.646 16.520 -10.316 556 HB VAL 73 HB VAL 73 -8.367 14.133 -10.472 557 HG11 VAL 73 1HG1 VAL 73 -7.012 15.358 -8.517 558 HG12 VAL 73 2HG1 VAL 73 -8.350 14.704 -7.570 559 HG13 VAL 73 3HG1 VAL 73 -7.331 13.623 -8.522 560 HG21 VAL 73 3HG2 VAL 73 -10.111 13.502 -8.680 561 HG22 VAL 73 1HG2 VAL 73 -10.622 15.185 -8.804 562 HG23 VAL 73 2HG2 VAL 73 -10.681 14.138 -10.222 563 H ILE 74 H ILE 74 -11.172 16.178 -10.621 564 HA ILE 74 HA ILE 74 -11.202 15.529 -13.357 565 HB ILE 74 HB ILE 74 -13.116 15.368 -11.643 566 HG12 ILE 74 2HG1 ILE 74 -13.416 16.261 -14.501 567 HG13 ILE 74 3HG1 ILE 74 -13.555 14.637 -13.838 568 HG21 ILE 74 1HG2 ILE 74 -14.098 17.961 -12.657 569 HG22 ILE 74 2HG2 ILE 74 -14.355 17.179 -11.099 570 HG23 ILE 74 3HG2 ILE 74 -12.842 18.025 -11.421 571 HD11 ILE 74 3HD1 ILE 74 -15.520 16.889 -13.715 572 HD12 ILE 74 1HD1 ILE 74 -15.740 15.252 -14.333 573 HD13 ILE 74 2HD1 ILE 74 -15.604 15.529 -12.596 574 H ALA 75 H ALA 75 -10.500 18.450 -11.779 575 HA ALA 75 HA ALA 75 -11.461 20.469 -13.328 576 HB1 ALA 75 1HB ALA 75 -9.418 21.722 -12.803 577 HB2 ALA 75 2HB ALA 75 -10.042 20.858 -11.397 578 HB3 ALA 75 3HB ALA 75 -8.647 20.227 -12.272 579 H GLY 76 H GLY 76 -9.236 18.005 -14.285 580 HA2 GLY 76 2HA GLY 76 -8.474 19.465 -16.708 581 HA3 GLY 76 3HA GLY 76 -7.782 17.948 -16.153 582 H TYR 77 H TYR 77 -10.210 16.547 -15.725 583 HA TYR 77 HA TYR 77 -10.640 15.454 -18.257 584 HB2 TYR 77 2HB TYR 77 -12.068 15.261 -15.634 585 HB3 TYR 77 3HB TYR 77 -12.807 14.557 -17.067 586 HD1 TYR 77 HD1 TYR 77 -9.247 14.694 -15.948 587 HD2 TYR 77 HD2 TYR 77 -12.602 12.256 -16.900 588 HE1 TYR 77 HE1 TYR 77 -7.858 12.683 -15.669 589 HE2 TYR 77 HE2 TYR 77 -11.223 10.239 -16.621 590 HH TYR 77 HH TYR 77 -7.871 10.310 -16.476 591 H ASN 78 H ASN 78 -12.654 17.710 -16.388 592 HA ASN 78 HA ASN 78 -14.803 17.944 -18.103 593 HB2 ASN 78 2HB ASN 78 -14.701 18.983 -15.868 594 HB3 ASN 78 3HB ASN 78 -13.536 20.157 -16.472 595 HD21 ASN 78 1HD2 ASN 78 -16.790 18.913 -17.088 596 HD22 ASN 78 2HD2 ASN 78 -17.464 20.426 -17.579 597 H LEU 79 H LEU 79 -11.571 19.044 -18.533 598 HA LEU 79 HA LEU 79 -12.219 20.985 -20.571 599 HB2 LEU 79 2HB LEU 79 -10.067 20.575 -18.913 600 HB3 LEU 79 3HB LEU 79 -9.463 20.032 -20.477 601 HG LEU 79 HG LEU 79 -10.770 22.714 -20.190 602 HD11 LEU 79 1HD1 LEU 79 -8.252 23.453 -20.059 603 HD12 LEU 79 2HD1 LEU 79 -8.062 21.882 -19.281 604 HD13 LEU 79 3HD1 LEU 79 -9.167 23.075 -18.599 605 HD21 LEU 79 3HD2 LEU 79 -8.539 21.842 -22.005 606 HD22 LEU 79 1HD2 LEU 79 -9.602 23.241 -22.163 607 HD23 LEU 79 2HD2 LEU 79 -10.239 21.616 -22.419 608 H TYR 80 H TYR 80 -11.157 17.650 -20.400 609 HA TYR 80 HA TYR 80 -10.213 17.128 -22.898 610 HB2 TYR 80 2HB TYR 80 -11.138 15.596 -20.775 611 HB3 TYR 80 3HB TYR 80 -12.166 15.110 -22.119 612 HD1 TYR 80 HD2 TYR 80 -10.591 14.974 -24.425 613 HD2 TYR 80 HD1 TYR 80 -9.390 14.143 -20.429 614 HE1 TYR 80 HE2 TYR 80 -8.801 13.516 -25.273 615 HE2 TYR 80 HE1 TYR 80 -7.596 12.684 -21.265 616 HH TYR 80 HH TYR 80 -7.384 11.752 -24.588 617 H ARG 81 H ARG 81 -13.651 17.174 -21.972 618 HA ARG 81 HA ARG 81 -14.540 16.819 -24.676 619 HB2 ARG 81 2HB ARG 81 -16.131 17.716 -22.268 620 HB3 ARG 81 3HB ARG 81 -16.778 17.086 -23.777 621 HG2 ARG 81 2HG ARG 81 -16.375 14.945 -23.213 622 HG3 ARG 81 3HG ARG 81 -14.870 15.335 -22.377 623 HD2 ARG 81 2HD ARG 81 -16.756 14.491 -20.926 624 HD3 ARG 81 3HD ARG 81 -16.018 16.012 -20.426 625 HE ARG 81 HE ARG 81 -18.258 16.491 -22.090 626 HH11 ARG 81 1HH1 ARG 81 -17.391 15.505 -18.866 627 HH12 ARG 81 2HH1 ARG 81 -18.855 16.097 -18.151 628 HH21 ARG 81 1HH2 ARG 81 -20.188 17.274 -21.161 629 HH22 ARG 81 2HH2 ARG 81 -20.445 17.102 -19.458 630 H ALA 82 H ALA 82 -13.783 19.507 -22.634 631 HA ALA 82 HA ALA 82 -15.271 21.573 -23.651 632 HB1 ALA 82 1HB ALA 82 -13.585 23.057 -22.895 633 HB2 ALA 82 2HB ALA 82 -13.566 21.675 -21.800 634 HB3 ALA 82 3HB ALA 82 -12.333 21.824 -23.051 635 H ILE 83 H ILE 83 -12.361 20.119 -25.041 636 HA ILE 83 HA ILE 83 -12.272 21.959 -27.249 637 HB ILE 83 HB ILE 83 -10.729 19.524 -26.471 638 HG12 ILE 83 2HG1 ILE 83 -8.842 21.040 -26.662 639 HG13 ILE 83 3HG1 ILE 83 -9.866 22.277 -27.383 640 HG21 ILE 83 1HG2 ILE 83 -10.918 20.674 -29.235 641 HG22 ILE 83 2HG2 ILE 83 -9.471 19.835 -28.678 642 HG23 ILE 83 3HG2 ILE 83 -11.017 18.988 -28.729 643 HD11 ILE 83 3HD1 ILE 83 -11.094 22.495 -25.304 644 HD12 ILE 83 1HD1 ILE 83 -10.116 21.220 -24.577 645 HD13 ILE 83 2HD1 ILE 83 -9.369 22.748 -25.045 646 H LYS 84 H LYS 84 -13.764 18.905 -26.582 647 HA LYS 84 HA LYS 84 -14.150 18.013 -29.234 648 HB2 LYS 84 2HB LYS 84 -15.005 17.241 -26.577 649 HB3 LYS 84 3HB LYS 84 -16.322 17.085 -27.732 650 HG2 LYS 84 2HG LYS 84 -13.596 15.826 -27.961 651 HG3 LYS 84 3HG LYS 84 -15.099 15.005 -27.537 652 HD2 LYS 84 2HD LYS 84 -15.990 15.823 -29.779 653 HD3 LYS 84 3HD LYS 84 -14.318 16.232 -30.170 654 HE2 LYS 84 2HE LYS 84 -13.658 14.033 -30.248 655 HE3 LYS 84 3HE LYS 84 -14.925 13.502 -29.144 656 HZ1 LYS 84 3HZ LYS 84 -16.534 13.971 -30.969 657 HZ2 LYS 84 1HZ LYS 84 -15.461 12.704 -31.296 658 HZ3 LYS 84 2HZ LYS 84 -15.220 14.220 -32.006 659 H LYS 85 H LYS 85 -15.871 20.275 -27.206 660 HA LYS 85 HA LYS 85 -18.127 20.451 -29.016 661 HB2 LYS 85 2HB LYS 85 -17.429 22.119 -26.592 662 HB3 LYS 85 3HB LYS 85 -18.955 22.169 -27.465 663 HG2 LYS 85 2HG LYS 85 -19.739 20.346 -26.438 664 HG3 LYS 85 3HG LYS 85 -18.197 19.496 -26.560 665 HD2 LYS 85 2HD LYS 85 -17.425 20.333 -24.561 666 HD3 LYS 85 3HD LYS 85 -18.444 21.771 -24.648 667 HE2 LYS 85 2HE LYS 85 -20.173 20.756 -23.630 668 HE3 LYS 85 3HE LYS 85 -19.913 19.237 -24.486 669 HZ1 LYS 85 3HZ LYS 85 -18.456 20.203 -22.088 670 HZ2 LYS 85 1HZ LYS 85 -18.021 18.824 -22.967 671 HZ3 LYS 85 2HZ LYS 85 -19.515 18.887 -22.176 672 H LYS 86 H LYS 86 -15.295 22.364 -28.138 673 HA LYS 86 HA LYS 86 -14.326 24.198 -29.077 674 HB2 LYS 86 2HB LYS 86 -14.287 22.483 -30.971 675 HB3 LYS 86 3HB LYS 86 -15.658 23.354 -31.646 676 HG2 LYS 86 2HG LYS 86 -14.349 24.934 -32.493 677 HG3 LYS 86 3HG LYS 86 -13.485 25.139 -30.968 678 HD2 LYS 86 2HD LYS 86 -12.251 22.988 -31.576 679 HD3 LYS 86 3HD LYS 86 -12.919 23.201 -33.196 680 HE2 LYS 86 2HE LYS 86 -11.652 25.592 -32.051 681 HE3 LYS 86 3HE LYS 86 -10.557 24.241 -32.342 682 HZ1 LYS 86 3HZ LYS 86 -10.620 25.586 -34.287 683 HZ2 LYS 86 1HZ LYS 86 -12.312 25.576 -34.327 684 HZ3 LYS 86 2HZ LYS 86 -11.450 24.155 -34.639 685 H GLY 87 H GLY 87 -16.769 24.711 -27.816 686 HA2 GLY 87 2HA GLY 87 -17.735 26.966 -29.455 687 HA3 GLY 87 3HA GLY 87 -18.867 25.923 -28.607 688 H GLY 88 H GLY 88 -17.422 25.597 -26.203 689 HA2 GLY 88 2HA GLY 88 -16.327 27.292 -24.657 690 HA3 GLY 88 3HA GLY 88 -17.665 28.333 -25.121 691 H GLY 89 H GLY 89 -16.662 26.817 -22.572 692 HA2 GLY 89 2HA GLY 89 -18.681 26.818 -20.920 693 HA3 GLY 89 3HA GLY 89 -19.166 25.442 -21.899 694 H GLY 90 H GLY 90 -18.799 25.130 -19.205 695 HA2 GLY 90 2HA GLY 90 -17.007 22.967 -19.089 696 HA3 GLY 90 3HA GLY 90 -16.223 24.375 -18.387 697 H GLY 91 H GLY 91 -19.024 22.240 -18.133 698 HA2 GLY 91 2HA GLY 91 -19.376 23.153 -15.349 699 HA3 GLY 91 3HA GLY 91 -20.642 22.430 -16.330 700 H GLY 92 H GLY 92 -20.156 20.138 -17.079 701 HA2 GLY 92 2HA GLY 92 -19.176 18.021 -16.664 702 HA3 GLY 92 3HA GLY 92 -18.503 18.654 -15.169 703 H GLY 93 H GLY 93 -19.857 16.185 -15.382 704 HA2 GLY 93 2HA GLY 93 -21.187 15.343 -13.523 705 HA3 GLY 93 3HA GLY 93 -22.205 16.766 -13.690 706 H GLY 94 H GLY 94 -21.148 15.211 -16.580 707 HA2 GLY 94 2HA GLY 94 -22.491 13.202 -17.380 708 HA3 GLY 94 3HA GLY 94 -23.888 14.181 -16.955 709 H GLY 95 H GLY 95 -23.538 13.157 -19.513 710 HA2 GLY 95 2HA GLY 95 -24.290 14.704 -21.369 711 HA3 GLY 95 3HA GLY 95 -22.777 15.548 -21.070 712 H GLY 96 H GLY 96 -23.734 14.272 -23.524 713 HA2 GLY 96 2HA GLY 96 -21.561 13.363 -24.741 714 HA3 GLY 96 3HA GLY 96 -22.007 11.939 -23.814 715 H VAL 97 H VAL 97 -22.536 13.727 -26.652 716 HA VAL 97 HA VAL 97 -24.428 11.723 -27.584 717 HB VAL 97 HB VAL 97 -25.979 13.401 -28.507 718 HG11 VAL 97 1HG1 VAL 97 -27.092 13.976 -26.407 719 HG12 VAL 97 2HG1 VAL 97 -26.490 12.317 -26.381 720 HG13 VAL 97 3HG1 VAL 97 -25.620 13.585 -25.518 721 HG21 VAL 97 3HG2 VAL 97 -25.888 15.709 -27.831 722 HG22 VAL 97 1HG2 VAL 97 -24.484 15.396 -26.811 723 HG23 VAL 97 2HG2 VAL 97 -24.346 15.272 -28.564 724 H TRP 98 H TRP 98 -21.701 12.242 -28.214 725 HA TRP 98 HA TRP 98 -21.739 12.088 -30.988 726 HB2 TRP 98 2HB TRP 98 -22.201 14.293 -31.415 727 HB3 TRP 98 3HB TRP 98 -21.490 14.846 -29.902 728 HD1 TRP 98 HD1 TRP 98 -19.545 16.406 -30.444 729 HE1 TRP 98 HE1 TRP 98 -17.601 16.424 -32.130 730 HE3 TRP 98 HE3 TRP 98 -20.692 12.160 -33.050 731 HZ2 TRP 98 HZ2 TRP 98 -16.676 14.847 -34.281 732 HZ3 TRP 98 HZ3 TRP 98 -19.227 11.484 -34.907 733 HH2 TRP 98 HH2 TRP 98 -17.261 12.802 -35.509 734 HA PRO 99 HA PRO 99 -17.179 12.742 -29.533 735 HB2 PRO 99 2HB PRO 99 -16.791 13.507 -26.957 736 HB3 PRO 99 3HB PRO 99 -16.990 14.660 -28.282 737 HG2 PRO 99 2HG PRO 99 -19.002 13.709 -26.279 738 HG3 PRO 99 3HG PRO 99 -18.711 15.352 -26.879 739 HD2 PRO 99 2HD PRO 99 -20.736 13.804 -27.794 740 HD3 PRO 99 3HD PRO 99 -19.902 14.990 -28.819 741 H LEU 100 H LEU 100 -16.928 10.548 -29.619 742 HA LEU 100 HA LEU 100 -17.700 8.909 -27.339 743 HB2 LEU 100 2HB LEU 100 -17.098 8.465 -30.163 744 HB3 LEU 100 3HB LEU 100 -16.406 7.246 -29.095 745 HG LEU 100 HG LEU 100 -19.238 7.845 -28.596 746 HD11 LEU 100 1HD1 LEU 100 -19.246 8.062 -31.013 747 HD12 LEU 100 2HD1 LEU 100 -20.023 6.556 -30.527 748 HD13 LEU 100 3HD1 LEU 100 -18.382 6.533 -31.172 749 HD21 LEU 100 3HD2 LEU 100 -19.365 5.516 -28.243 750 HD22 LEU 100 1HD2 LEU 100 -17.812 6.019 -27.576 751 HD23 LEU 100 2HD2 LEU 100 -17.879 5.219 -29.147 752 H VAL 101 H VAL 101 -14.920 10.443 -28.636 753 HA VAL 101 HA VAL 101 -12.916 8.744 -27.577 754 HB VAL 101 HB VAL 101 -11.396 10.674 -27.860 755 HG11 VAL 101 1HG1 VAL 101 -12.637 9.189 -29.798 756 HG12 VAL 101 2HG1 VAL 101 -12.874 10.841 -30.373 757 HG13 VAL 101 3HG1 VAL 101 -11.246 10.242 -30.050 758 HG21 VAL 101 3HG2 VAL 101 -12.760 12.591 -29.200 759 HG22 VAL 101 1HG2 VAL 101 -13.961 12.105 -28.005 760 HG23 VAL 101 2HG2 VAL 101 -12.374 12.668 -27.481 761 H ILE 102 H ILE 102 -14.675 11.506 -26.285 762 HA ILE 102 HA ILE 102 -13.119 11.948 -23.991 763 HB ILE 102 HB ILE 102 -15.119 13.038 -23.043 764 HG12 ILE 102 2HG1 ILE 102 -16.988 13.133 -25.022 765 HG13 ILE 102 3HG1 ILE 102 -16.423 11.474 -25.179 766 HG21 ILE 102 1HG2 ILE 102 -14.051 14.609 -24.271 767 HG22 ILE 102 2HG2 ILE 102 -14.053 13.624 -25.733 768 HG23 ILE 102 3HG2 ILE 102 -15.510 14.496 -25.256 769 HD11 ILE 102 3HD1 ILE 102 -18.056 12.722 -23.104 770 HD12 ILE 102 1HD1 ILE 102 -17.965 11.040 -23.626 771 HD13 ILE 102 2HD1 ILE 102 -16.772 11.678 -22.493 772 H ARG 103 H ARG 103 -15.843 9.780 -24.589 773 HA ARG 103 HA ARG 103 -16.299 8.932 -21.969 774 HB2 ARG 103 2HB ARG 103 -17.670 7.329 -22.875 775 HB3 ARG 103 3HB ARG 103 -17.545 8.428 -24.242 776 HG2 ARG 103 2HG ARG 103 -17.110 6.505 -25.338 777 HG3 ARG 103 3HG ARG 103 -15.468 6.850 -24.792 778 HD2 ARG 103 2HD ARG 103 -15.484 5.181 -23.245 779 HD3 ARG 103 3HD ARG 103 -17.217 5.324 -22.952 780 HE ARG 103 HE ARG 103 -16.564 4.284 -25.550 781 HH11 ARG 103 1HH1 ARG 103 -17.104 3.496 -22.202 782 HH12 ARG 103 2HH1 ARG 103 -17.540 1.851 -22.524 783 HH21 ARG 103 1HH2 ARG 103 -17.137 2.119 -25.987 784 HH22 ARG 103 2HH2 ARG 103 -17.558 1.068 -24.678 785 H THR 104 H THR 104 -13.728 8.206 -24.152 786 HA THR 104 HA THR 104 -12.880 5.751 -23.018 787 HB THR 104 HB THR 104 -10.872 7.578 -24.244 788 HG1 THR 104 HG1 THR 104 -11.877 7.681 -26.117 789 HG21 THR 104 3HG2 THR 104 -10.156 5.361 -23.699 790 HG22 THR 104 1HG2 THR 104 -10.314 5.451 -25.452 791 HG23 THR 104 2HG2 THR 104 -11.560 4.652 -24.495 792 H VAL 105 H VAL 105 -11.553 9.047 -22.672 793 HA VAL 105 HA VAL 105 -9.823 8.300 -20.524 794 HB VAL 105 HB VAL 105 -10.681 11.103 -21.234 795 HG11 VAL 105 1HG1 VAL 105 -9.130 10.197 -19.172 796 HG12 VAL 105 2HG1 VAL 105 -7.927 10.577 -20.406 797 HG13 VAL 105 3HG1 VAL 105 -9.059 11.817 -19.865 798 HG21 VAL 105 3HG2 VAL 105 -9.745 10.824 -23.233 799 HG22 VAL 105 1HG2 VAL 105 -8.203 10.587 -22.412 800 HG23 VAL 105 2HG2 VAL 105 -9.209 9.196 -22.818 801 H ILE 106 H ILE 106 -12.913 10.025 -20.740 802 HA ILE 106 HA ILE 106 -13.173 10.733 -18.053 803 HB ILE 106 HB ILE 106 -15.377 10.011 -19.988 804 HG12 ILE 106 2HG1 ILE 106 -13.521 12.110 -20.086 805 HG13 ILE 106 3HG1 ILE 106 -15.010 11.967 -21.013 806 HG21 ILE 106 1HG2 ILE 106 -15.434 11.557 -17.401 807 HG22 ILE 106 2HG2 ILE 106 -16.773 11.459 -18.543 808 HG23 ILE 106 3HG2 ILE 106 -16.203 10.004 -17.726 809 HD11 ILE 106 3HD1 ILE 106 -16.219 13.202 -19.341 810 HD12 ILE 106 1HD1 ILE 106 -14.795 13.254 -18.303 811 HD13 ILE 106 2HD1 ILE 106 -14.798 14.117 -19.842 812 H ALA 107 H ALA 107 -13.394 7.663 -19.567 813 HA ALA 107 HA ALA 107 -15.146 6.227 -18.019 814 HB1 ALA 107 1HB ALA 107 -12.453 5.305 -19.017 815 HB2 ALA 107 2HB ALA 107 -13.774 4.258 -18.498 816 HB3 ALA 107 3HB ALA 107 -13.964 5.276 -19.925 817 H GLY 108 H GLY 108 -12.142 7.643 -17.069 818 HA2 GLY 108 2HA GLY 108 -12.018 6.051 -14.616 819 HA3 GLY 108 3HA GLY 108 -10.799 7.185 -15.178 820 H TYR 109 H TYR 109 -12.866 9.252 -15.708 821 HA TYR 109 HA TYR 109 -12.664 10.734 -13.395 822 HB2 TYR 109 2HB TYR 109 -13.442 12.195 -14.907 823 HB3 TYR 109 3HB TYR 109 -14.147 10.913 -15.884 824 HD1 TYR 109 HD2 TYR 109 -14.765 13.172 -13.022 825 HD2 TYR 109 HD1 TYR 109 -16.477 10.468 -15.826 826 HE1 TYR 109 HE2 TYR 109 -17.014 13.899 -12.341 827 HE2 TYR 109 HE1 TYR 109 -18.731 11.188 -15.153 828 HH TYR 109 HH TYR 109 -19.673 12.312 -12.786 829 H ASN 110 H ASN 110 -15.353 8.654 -14.419 830 HA ASN 110 HA ASN 110 -17.113 9.161 -12.334 831 HB2 ASN 110 2HB ASN 110 -16.985 7.380 -14.489 832 HB3 ASN 110 3HB ASN 110 -17.137 6.356 -13.065 833 HD21 ASN 110 1HD2 ASN 110 -18.797 8.077 -15.343 834 HD22 ASN 110 2HD2 ASN 110 -20.317 8.219 -14.534 835 H LEU 111 H LEU 111 -14.101 7.540 -12.282 836 HA LEU 111 HA LEU 111 -14.623 5.966 -9.929 837 HB2 LEU 111 2HB LEU 111 -12.748 5.881 -11.920 838 HB3 LEU 111 3HB LEU 111 -11.828 6.546 -10.572 839 HG LEU 111 HG LEU 111 -11.624 4.093 -10.784 840 HD11 LEU 111 1HD1 LEU 111 -12.161 5.615 -8.473 841 HD12 LEU 111 2HD1 LEU 111 -11.238 4.118 -8.604 842 HD13 LEU 111 3HD1 LEU 111 -12.969 4.060 -8.269 843 HD21 LEU 111 3HD2 LEU 111 -14.089 3.912 -11.553 844 HD22 LEU 111 1HD2 LEU 111 -14.449 3.852 -9.828 845 HD23 LEU 111 2HD2 LEU 111 -13.405 2.629 -10.554 846 H TYR 112 H TYR 112 -13.248 9.101 -10.665 847 HA TYR 112 HA TYR 112 -11.816 9.813 -8.503 848 HB2 TYR 112 2HB TYR 112 -13.891 11.357 -10.031 849 HB3 TYR 112 3HB TYR 112 -13.034 12.101 -8.686 850 HD1 TYR 112 HD1 TYR 112 -10.337 10.850 -9.089 851 HD2 TYR 112 HD2 TYR 112 -13.064 12.580 -11.860 852 HE1 TYR 112 HE1 TYR 112 -8.462 11.397 -10.583 853 HE2 TYR 112 HE2 TYR 112 -11.196 13.131 -13.362 854 HH TYR 112 HH TYR 112 -8.234 13.402 -12.589 855 H ARG 113 H ARG 113 -15.375 9.923 -8.613 856 HA ARG 113 HA ARG 113 -15.544 10.477 -5.787 857 HB2 ARG 113 2HB ARG 113 -17.594 9.985 -7.939 858 HB3 ARG 113 3HB ARG 113 -18.042 10.149 -6.246 859 HG2 ARG 113 2HG ARG 113 -17.210 12.386 -6.170 860 HG3 ARG 113 3HG ARG 113 -16.510 12.232 -7.783 861 HD2 ARG 113 2HD ARG 113 -18.415 13.202 -8.466 862 HD3 ARG 113 3HD ARG 113 -19.106 11.593 -8.263 863 HE ARG 113 HE ARG 113 -19.183 13.140 -5.857 864 HH11 ARG 113 1HH1 ARG 113 -20.790 12.538 -8.886 865 HH12 ARG 113 2HH1 ARG 113 -22.341 13.060 -8.317 866 HH21 ARG 113 1HH2 ARG 113 -21.219 13.830 -5.096 867 HH22 ARG 113 2HH2 ARG 113 -22.583 13.796 -6.161 868 H ALA 114 H ALA 114 -15.669 7.699 -7.863 869 HA ALA 114 HA ALA 114 -17.073 5.851 -6.394 870 HB1 ALA 114 1HB ALA 114 -16.054 5.471 -8.630 871 HB2 ALA 114 2HB ALA 114 -14.491 5.274 -7.836 872 HB3 ALA 114 3HB ALA 114 -15.801 4.144 -7.496 873 H ILE 115 H ILE 115 -13.714 6.876 -5.949 874 HA ILE 115 HA ILE 115 -13.294 5.069 -3.742 875 HB ILE 115 HB ILE 115 -11.585 7.364 -4.711 876 HG12 ILE 115 2HG1 ILE 115 -11.840 5.632 -6.413 877 HG13 ILE 115 3HG1 ILE 115 -10.211 5.591 -5.746 878 HG21 ILE 115 1HG2 ILE 115 -11.346 5.479 -2.468 879 HG22 ILE 115 2HG2 ILE 115 -9.899 5.660 -3.457 880 HG23 ILE 115 3HG2 ILE 115 -10.627 7.074 -2.696 881 HD11 ILE 115 3HD1 ILE 115 -12.468 3.733 -5.034 882 HD12 ILE 115 1HD1 ILE 115 -11.080 3.354 -6.055 883 HD13 ILE 115 2HD1 ILE 115 -10.847 3.695 -4.340 884 H LYS 116 H LYS 116 -14.521 8.240 -4.168 885 HA LYS 116 HA LYS 116 -13.923 9.210 -1.537 886 HB2 LYS 116 2HB LYS 116 -14.844 10.331 -3.921 887 HB3 LYS 116 3HB LYS 116 -16.196 10.492 -2.808 888 HG2 LYS 116 2HG LYS 116 -14.089 11.300 -1.269 889 HG3 LYS 116 3HG LYS 116 -13.637 11.890 -2.870 890 HD2 LYS 116 2HD LYS 116 -14.918 13.656 -2.303 891 HD3 LYS 116 3HD LYS 116 -16.246 12.602 -2.794 892 HE2 LYS 116 2HE LYS 116 -16.782 12.055 -0.589 893 HE3 LYS 116 3HE LYS 116 -15.214 12.583 0.021 894 HZ1 LYS 116 3HZ LYS 116 -16.559 14.736 -1.229 895 HZ2 LYS 116 1HZ LYS 116 -16.017 14.602 0.367 896 HZ3 LYS 116 2HZ LYS 116 -17.557 14.043 -0.052 897 H LYS 117 H LYS 117 -16.462 7.350 -2.993 898 HA LYS 117 HA LYS 117 -18.363 7.764 -0.878 899 HB2 LYS 117 2HB LYS 117 -18.256 5.742 -3.122 900 HB3 LYS 117 3HB LYS 117 -19.600 5.897 -1.997 901 HG2 LYS 117 2HG LYS 117 -19.841 8.272 -2.760 902 HG3 LYS 117 3HG LYS 117 -18.655 7.914 -4.018 903 HD2 LYS 117 2HD LYS 117 -20.078 6.339 -5.049 904 HD3 LYS 117 3HD LYS 117 -21.155 6.282 -3.652 905 HE2 LYS 117 2HE LYS 117 -21.463 8.829 -4.167 906 HE3 LYS 117 3HE LYS 117 -20.893 8.371 -5.770 907 HZ1 LYS 117 3HZ LYS 117 -23.147 7.002 -4.421 908 HZ2 LYS 117 1HZ LYS 117 -22.698 6.905 -6.049 909 HZ3 LYS 117 2HZ LYS 117 -23.364 8.335 -5.439 910 H LYS 118 H LYS 118 -16.059 5.238 -1.778 911 HA LYS 118 HA LYS 118 -16.799 3.556 0.447 912 HB2 LYS 118 2HB LYS 118 -15.054 3.362 -1.903 913 HB3 LYS 118 3HB LYS 118 -14.393 2.588 -0.468 914 HG2 LYS 118 2HG LYS 118 -16.746 1.499 -0.295 915 HG3 LYS 118 3HG LYS 118 -16.868 1.935 -2.001 916 HD2 LYS 118 2HD LYS 118 -14.318 0.753 -1.558 917 HD3 LYS 118 3HD LYS 118 -15.544 -0.288 -0.832 918 HE2 LYS 118 2HE LYS 118 -15.924 0.806 -3.592 919 HE3 LYS 118 3HE LYS 118 -14.903 -0.607 -3.329 920 HZ1 LYS 118 3HZ LYS 118 -17.061 -1.307 -1.951 921 HZ2 LYS 118 1HZ LYS 118 -16.850 -1.677 -3.589 922 HZ3 LYS 118 2HZ LYS 118 -17.790 -0.345 -3.136 Start of MODEL 4 1 H1 VAL 1 H VAL 1 2.443 -3.480 -3.264 2 HA VAL 1 HA VAL 1 0.731 -1.922 -2.820 3 HB VAL 1 HB VAL 1 0.678 0.243 -4.084 4 HG11 VAL 1 1HG1 VAL 1 1.793 -0.246 -1.777 5 HG12 VAL 1 2HG1 VAL 1 3.292 0.073 -2.652 6 HG13 VAL 1 3HG1 VAL 1 2.040 1.312 -2.564 7 HG21 VAL 1 3HG2 VAL 1 2.226 0.828 -5.617 8 HG22 VAL 1 1HG2 VAL 1 3.536 0.020 -4.756 9 HG23 VAL 1 2HG2 VAL 1 2.440 -0.916 -5.773 10 H TRP 2 H TRP 2 -1.211 -1.353 -4.040 11 HA TRP 2 HA TRP 2 -1.342 -2.758 -6.628 12 HB2 TRP 2 2HB TRP 2 -3.799 -3.142 -5.968 13 HB3 TRP 2 3HB TRP 2 -2.574 -4.115 -5.158 14 HD1 TRP 2 HD1 TRP 2 -1.909 -3.283 -2.597 15 HE1 TRP 2 HE1 TRP 2 -3.414 -2.227 -0.795 16 HE3 TRP 2 HE3 TRP 2 -5.748 -1.692 -5.575 17 HZ2 TRP 2 HZ2 TRP 2 -5.899 -0.896 -0.655 18 HZ3 TRP 2 HZ3 TRP 2 -7.652 -0.536 -4.529 19 HH2 TRP 2 HH2 TRP 2 -7.724 -0.148 -2.119 20 HA PRO 3 HA PRO 3 -2.604 1.709 -7.144 21 HB2 PRO 3 2HB PRO 3 -0.987 2.186 -9.271 22 HB3 PRO 3 3HB PRO 3 -0.456 2.387 -7.597 23 HG2 PRO 3 2HG PRO 3 0.011 0.099 -9.470 24 HG3 PRO 3 3HG PRO 3 1.144 0.878 -8.351 25 HD2 PRO 3 2HD PRO 3 -0.088 -1.464 -7.779 26 HD3 PRO 3 3HD PRO 3 0.336 -0.278 -6.528 27 H LEU 4 H LEU 4 -4.394 -0.066 -7.798 28 HA LEU 4 HA LEU 4 -4.648 -0.281 -10.692 29 HB2 LEU 4 2HB LEU 4 -6.319 -1.845 -10.329 30 HB3 LEU 4 3HB LEU 4 -5.198 -2.127 -8.999 31 HG LEU 4 HG LEU 4 -6.875 -0.467 -7.760 32 HD11 LEU 4 1HD1 LEU 4 -8.939 -1.953 -9.226 33 HD12 LEU 4 2HD1 LEU 4 -8.168 -0.651 -10.131 34 HD13 LEU 4 3HD1 LEU 4 -8.954 -0.308 -8.590 35 HD21 LEU 4 3HD2 LEU 4 -7.647 -2.310 -6.619 36 HD22 LEU 4 1HD2 LEU 4 -6.195 -2.959 -7.381 37 HD23 LEU 4 2HD2 LEU 4 -7.780 -3.294 -8.077 38 H VAL 5 H VAL 5 -5.770 1.667 -8.092 39 HA VAL 5 HA VAL 5 -8.103 2.655 -9.486 40 HB VAL 5 HB VAL 5 -8.331 4.211 -7.596 41 HG11 VAL 5 1HG1 VAL 5 -9.363 2.076 -7.342 42 HG12 VAL 5 2HG1 VAL 5 -7.831 1.325 -6.891 43 HG13 VAL 5 3HG1 VAL 5 -8.600 2.482 -5.805 44 HG21 VAL 5 3HG2 VAL 5 -6.767 3.948 -5.662 45 HG22 VAL 5 1HG2 VAL 5 -5.714 3.003 -6.715 46 HG23 VAL 5 2HG2 VAL 5 -6.045 4.696 -7.086 47 H ILE 6 H ILE 6 -4.824 3.743 -8.785 48 HA ILE 6 HA ILE 6 -5.090 6.383 -9.720 49 HB ILE 6 HB ILE 6 -2.652 6.405 -9.909 50 HG12 ILE 6 2HG1 ILE 6 -1.698 4.034 -8.987 51 HG13 ILE 6 3HG1 ILE 6 -3.057 3.478 -9.958 52 HG21 ILE 6 1HG2 ILE 6 -4.066 5.408 -7.528 53 HG22 ILE 6 2HG2 ILE 6 -2.311 5.243 -7.498 54 HG23 ILE 6 3HG2 ILE 6 -3.043 6.830 -7.731 55 HD11 ILE 6 3HD1 ILE 6 -2.103 4.891 -11.831 56 HD12 ILE 6 1HD1 ILE 6 -0.650 5.031 -10.841 57 HD13 ILE 6 2HD1 ILE 6 -1.200 3.444 -11.383 58 H ARG 7 H ARG 7 -4.420 3.353 -11.363 59 HA ARG 7 HA ARG 7 -3.708 4.547 -13.859 60 HB2 ARG 7 2HB ARG 7 -4.046 2.210 -14.741 61 HB3 ARG 7 3HB ARG 7 -2.882 2.355 -13.430 62 HG2 ARG 7 2HG ARG 7 -4.425 1.457 -11.856 63 HG3 ARG 7 3HG ARG 7 -5.745 1.532 -13.024 64 HD2 ARG 7 2HD ARG 7 -5.177 -0.685 -13.167 65 HD3 ARG 7 3HD ARG 7 -4.163 -0.005 -14.440 66 HE ARG 7 HE ARG 7 -2.882 -0.143 -11.866 67 HH11 ARG 7 1HH1 ARG 7 -3.575 -1.836 -14.828 68 HH12 ARG 7 2HH1 ARG 7 -2.224 -2.911 -14.682 69 HH21 ARG 7 1HH2 ARG 7 -1.100 -1.553 -11.663 70 HH22 ARG 7 2HH2 ARG 7 -0.818 -2.750 -12.881 71 H THR 8 H THR 8 -6.675 3.742 -12.296 72 HA THR 8 HA THR 8 -8.422 3.309 -14.380 73 HB THR 8 HB THR 8 -9.195 5.099 -12.091 74 HG1 THR 8 HG1 THR 8 -9.601 2.866 -11.095 75 HG21 THR 8 3HG2 THR 8 -11.263 4.643 -12.780 76 HG22 THR 8 1HG2 THR 8 -10.961 2.912 -12.637 77 HG23 THR 8 2HG2 THR 8 -10.589 3.751 -14.143 78 H VAL 9 H VAL 9 -7.682 6.481 -12.916 79 HA VAL 9 HA VAL 9 -9.102 8.001 -14.808 80 HB VAL 9 HB VAL 9 -7.683 9.915 -14.014 81 HG11 VAL 9 1HG1 VAL 9 -9.815 9.095 -12.920 82 HG12 VAL 9 2HG1 VAL 9 -8.785 8.306 -11.724 83 HG13 VAL 9 3HG1 VAL 9 -8.741 10.060 -11.908 84 HG21 VAL 9 3HG2 VAL 9 -6.247 9.446 -12.019 85 HG22 VAL 9 1HG2 VAL 9 -6.404 7.727 -12.383 86 HG23 VAL 9 2HG2 VAL 9 -5.620 8.805 -13.537 87 H ILE 10 H ILE 10 -5.703 7.025 -14.650 88 HA ILE 10 HA ILE 10 -4.708 8.507 -16.779 89 HB ILE 10 HB ILE 10 -3.887 5.724 -15.939 90 HG12 ILE 10 2HG1 ILE 10 -3.795 8.043 -14.456 91 HG13 ILE 10 3HG1 ILE 10 -2.767 6.635 -14.210 92 HG21 ILE 10 1HG2 ILE 10 -2.495 7.787 -17.636 93 HG22 ILE 10 2HG2 ILE 10 -1.703 6.363 -16.962 94 HG23 ILE 10 3HG2 ILE 10 -3.019 6.174 -18.121 95 HD11 ILE 10 3HD1 ILE 10 -1.565 8.812 -14.310 96 HD12 ILE 10 1HD1 ILE 10 -1.005 7.610 -15.473 97 HD13 ILE 10 2HD1 ILE 10 -2.043 8.935 -16.003 98 H ALA 11 H ALA 11 -6.879 5.855 -16.794 99 HA ALA 11 HA ALA 11 -6.449 4.569 -19.172 100 HB1 ALA 11 1HB ALA 11 -8.900 4.211 -19.268 101 HB2 ALA 11 2HB ALA 11 -8.206 3.881 -17.681 102 HB3 ALA 11 3HB ALA 11 -9.088 5.382 -17.963 103 H GLY 12 H GLY 12 -7.501 7.838 -18.685 104 HA2 GLY 12 2HA GLY 12 -8.296 8.129 -21.485 105 HA3 GLY 12 3HA GLY 12 -8.479 9.338 -20.223 106 H TYR 13 H TYR 13 -5.703 9.032 -19.313 107 HA TYR 13 HA TYR 13 -4.502 11.073 -20.750 108 HB2 TYR 13 2HB TYR 13 -3.671 10.598 -18.578 109 HB3 TYR 13 3HB TYR 13 -3.330 8.921 -18.992 110 HD1 TYR 13 HD2 TYR 13 -2.470 11.929 -20.989 111 HD2 TYR 13 HD1 TYR 13 -1.031 8.783 -18.512 112 HE1 TYR 13 HE2 TYR 13 -0.158 12.545 -21.560 113 HE2 TYR 13 HE1 TYR 13 1.285 9.391 -19.075 114 HH TYR 13 HH TYR 13 2.334 11.965 -20.014 115 H ASN 14 H ASN 14 -3.859 7.576 -20.974 116 HA ASN 14 HA ASN 14 -1.909 7.555 -22.898 117 HB2 ASN 14 2HB ASN 14 -2.745 5.315 -23.540 118 HB3 ASN 14 3HB ASN 14 -2.666 5.520 -21.792 119 HD21 ASN 14 1HD2 ASN 14 -4.294 4.550 -20.847 120 HD22 ASN 14 2HD2 ASN 14 -5.928 4.514 -21.408 121 H LEU 15 H LEU 15 -5.207 8.466 -23.251 122 HA LEU 15 HA LEU 15 -5.108 8.272 -26.163 123 HB2 LEU 15 2HB LEU 15 -7.125 7.760 -24.508 124 HB3 LEU 15 3HB LEU 15 -7.421 9.480 -24.749 125 HG LEU 15 HG LEU 15 -7.182 8.688 -27.311 126 HD11 LEU 15 1HD1 LEU 15 -8.703 6.560 -27.298 127 HD12 LEU 15 2HD1 LEU 15 -7.962 6.291 -25.720 128 HD13 LEU 15 3HD1 LEU 15 -6.951 6.410 -27.160 129 HD21 LEU 15 3HD2 LEU 15 -9.140 9.733 -27.173 130 HD22 LEU 15 1HD2 LEU 15 -9.321 9.303 -25.472 131 HD23 LEU 15 2HD2 LEU 15 -9.857 8.184 -26.726 132 H TYR 16 H TYR 16 -5.213 10.661 -23.585 133 HA TYR 16 HA TYR 16 -5.729 12.973 -24.985 134 HB2 TYR 16 2HB TYR 16 -4.511 12.282 -22.456 135 HB3 TYR 16 3HB TYR 16 -3.697 13.665 -23.178 136 HD1 TYR 16 HD2 TYR 16 -5.243 15.586 -24.021 137 HD2 TYR 16 HD1 TYR 16 -6.460 12.608 -21.237 138 HE1 TYR 16 HE2 TYR 16 -7.050 17.061 -23.242 139 HE2 TYR 16 HE1 TYR 16 -8.272 14.075 -20.451 140 HH TYR 16 HH TYR 16 -8.890 17.210 -21.977 141 H ARG 17 H ARG 17 -2.617 11.321 -24.584 142 HA ARG 17 HA ARG 17 -1.194 13.246 -26.170 143 HB2 ARG 17 2HB ARG 17 -0.548 10.782 -24.681 144 HB3 ARG 17 3HB ARG 17 0.454 11.085 -26.095 145 HG2 ARG 17 2HG ARG 17 0.299 13.531 -24.751 146 HG3 ARG 17 3HG ARG 17 0.538 12.308 -23.501 147 HD2 ARG 17 2HD ARG 17 2.678 13.128 -24.299 148 HD3 ARG 17 3HD ARG 17 2.467 11.435 -24.741 149 HE ARG 17 HE ARG 17 1.667 13.300 -26.786 150 HH11 ARG 17 1HH1 ARG 17 4.292 11.454 -25.436 151 HH12 ARG 17 2HH1 ARG 17 5.213 11.446 -26.903 152 HH21 ARG 17 1HH2 ARG 17 2.871 13.297 -28.723 153 HH22 ARG 17 2HH2 ARG 17 4.404 12.495 -28.772 154 H ALA 18 H ALA 18 -2.990 10.369 -26.777 155 HA ALA 18 HA ALA 18 -1.871 9.363 -29.085 156 HB1 ALA 18 1HB ALA 18 -3.878 8.275 -29.473 157 HB2 ALA 18 2HB ALA 18 -3.940 8.586 -27.738 158 HB3 ALA 18 3HB ALA 18 -4.842 9.614 -28.850 159 H ILE 19 H ILE 19 -3.973 12.171 -28.705 160 HA ILE 19 HA ILE 19 -4.102 12.649 -31.553 161 HB ILE 19 HB ILE 19 -5.022 14.367 -29.245 162 HG12 ILE 19 2HG1 ILE 19 -6.218 12.231 -29.394 163 HG13 ILE 19 3HG1 ILE 19 -7.268 13.570 -29.843 164 HG21 ILE 19 1HG2 ILE 19 -4.890 14.826 -32.128 165 HG22 ILE 19 2HG2 ILE 19 -6.486 15.102 -31.433 166 HG23 ILE 19 3HG2 ILE 19 -5.088 15.973 -30.803 167 HD11 ILE 19 3HD1 ILE 19 -6.545 11.241 -31.340 168 HD12 ILE 19 1HD1 ILE 19 -7.757 12.472 -31.696 169 HD13 ILE 19 2HD1 ILE 19 -6.089 12.698 -32.222 170 H LYS 20 H LYS 20 -2.044 13.500 -28.948 171 HA LYS 20 HA LYS 20 -1.032 15.940 -30.044 172 HB2 LYS 20 2HB LYS 20 -0.814 14.591 -27.611 173 HB3 LYS 20 3HB LYS 20 0.813 14.559 -28.277 174 HG2 LYS 20 2HG LYS 20 -0.277 17.174 -28.612 175 HG3 LYS 20 3HG LYS 20 -0.478 16.667 -26.933 176 HD2 LYS 20 2HD LYS 20 1.646 17.786 -27.183 177 HD3 LYS 20 3HD LYS 20 1.924 16.072 -26.868 178 HE2 LYS 20 2HE LYS 20 3.389 16.967 -28.639 179 HE3 LYS 20 3HE LYS 20 2.343 15.667 -29.211 180 HZ1 LYS 20 3HZ LYS 20 1.035 17.134 -30.404 181 HZ2 LYS 20 1HZ LYS 20 2.586 17.769 -30.635 182 HZ3 LYS 20 2HZ LYS 20 1.536 18.487 -29.520 183 H LYS 21 H LYS 21 -0.246 12.556 -30.355 184 HA LYS 21 HA LYS 21 2.268 13.075 -31.697 185 HB2 LYS 21 2HB LYS 21 2.367 10.621 -31.955 186 HB3 LYS 21 3HB LYS 21 2.104 11.108 -30.286 187 HG2 LYS 21 2HG LYS 21 -0.289 10.623 -30.537 188 HG3 LYS 21 3HG LYS 21 0.007 10.092 -32.194 189 HD2 LYS 21 2HD LYS 21 -0.047 8.122 -30.902 190 HD3 LYS 21 3HD LYS 21 1.663 8.435 -31.208 191 HE2 LYS 21 2HE LYS 21 0.999 9.809 -28.841 192 HE3 LYS 21 3HE LYS 21 0.278 8.206 -28.709 193 HZ1 LYS 21 3HZ LYS 21 2.407 7.934 -27.869 194 HZ2 LYS 21 1HZ LYS 21 3.121 8.927 -29.039 195 HZ3 LYS 21 2HZ LYS 21 2.565 7.386 -29.461 196 H LYS 22 H LYS 22 -1.000 12.037 -32.535 197 HA LYS 22 HA LYS 22 -1.946 11.543 -34.580 198 HB2 LYS 22 2HB LYS 22 -2.037 13.495 -36.009 199 HB3 LYS 22 3HB LYS 22 -2.111 14.001 -34.326 200 HG2 LYS 22 2HG LYS 22 0.556 13.922 -35.618 201 HG3 LYS 22 3HG LYS 22 -0.558 15.203 -36.101 202 HD2 LYS 22 2HD LYS 22 -0.632 14.993 -33.269 203 HD3 LYS 22 3HD LYS 22 1.060 15.042 -33.769 204 HE2 LYS 22 2HE LYS 22 0.854 17.136 -34.719 205 HE3 LYS 22 3HE LYS 22 -0.885 16.971 -34.958 206 HZ1 LYS 22 3HZ LYS 22 -0.532 16.840 -32.245 207 HZ2 LYS 22 1HZ LYS 22 -1.110 18.168 -33.120 208 HZ3 LYS 22 2HZ LYS 22 0.534 18.057 -32.740 209 H GLY 23 H GLY 23 0.413 10.117 -34.384 210 HA2 GLY 23 2HA GLY 23 1.181 10.004 -37.203 211 HA3 GLY 23 3HA GLY 23 2.471 10.230 -36.030 212 H GLY 24 H GLY 24 1.437 8.568 -33.978 213 HA2 GLY 24 2HA GLY 24 1.469 5.922 -35.287 214 HA3 GLY 24 3HA GLY 24 2.513 6.275 -33.918 215 H GLY 25 H GLY 25 1.736 4.948 -32.372 216 HA2 GLY 25 2HA GLY 25 -0.639 5.637 -31.011 217 HA3 GLY 25 3HA GLY 25 -0.935 4.214 -31.999 218 H GLY 26 H GLY 26 -1.341 3.070 -30.016 219 HA2 GLY 26 2HA GLY 26 -0.318 1.215 -28.876 220 HA3 GLY 26 3HA GLY 26 1.169 2.147 -28.784 221 H GLY 27 H GLY 27 0.506 1.047 -26.504 222 HA2 GLY 27 2HA GLY 27 -0.663 3.267 -24.947 223 HA3 GLY 27 3HA GLY 27 -1.056 1.592 -24.592 224 H GLY 28 H GLY 28 -0.282 2.080 -22.429 225 HA2 GLY 28 2HA GLY 28 1.365 1.485 -20.884 226 HA3 GLY 28 3HA GLY 28 2.538 1.429 -22.192 227 H GLY 29 H GLY 29 4.068 2.603 -21.003 228 HA2 GLY 29 2HA GLY 29 3.514 5.490 -20.947 229 HA3 GLY 29 3HA GLY 29 4.149 4.716 -19.503 230 H GLY 30 H GLY 30 5.180 6.768 -21.551 231 HA2 GLY 30 2HA GLY 30 7.788 6.740 -21.313 232 HA3 GLY 30 3HA GLY 30 7.615 5.392 -22.427 233 H GLY 31 H GLY 31 7.554 8.828 -22.052 234 HA2 GLY 31 2HA GLY 31 8.394 9.856 -24.244 235 HA3 GLY 31 3HA GLY 31 6.931 9.150 -24.916 236 H GLY 32 H GLY 32 7.461 11.868 -25.099 237 HA2 GLY 32 2HA GLY 32 5.096 13.052 -24.379 238 HA3 GLY 32 3HA GLY 32 6.151 13.315 -22.998 239 H VAL 33 H VAL 33 5.589 14.044 -26.369 240 HA VAL 33 HA VAL 33 7.887 15.673 -26.751 241 HB VAL 33 HB VAL 33 5.256 15.727 -28.237 242 HG11 VAL 33 1HG1 VAL 33 7.967 16.830 -28.963 243 HG12 VAL 33 2HG1 VAL 33 6.580 16.750 -30.051 244 HG13 VAL 33 3HG1 VAL 33 6.512 17.760 -28.607 245 HG21 VAL 33 3HG2 VAL 33 6.409 13.525 -28.231 246 HG22 VAL 33 1HG2 VAL 33 6.287 14.254 -29.833 247 HG23 VAL 33 2HG2 VAL 33 7.816 14.303 -28.955 248 H TRP 34 H TRP 34 4.480 16.722 -26.690 249 HA TRP 34 HA TRP 34 5.318 19.070 -25.126 250 HB2 TRP 34 2HB TRP 34 4.958 19.601 -27.562 251 HB3 TRP 34 3HB TRP 34 3.270 19.145 -27.347 252 HD1 TRP 34 HD1 TRP 34 5.055 21.128 -24.617 253 HE1 TRP 34 HE1 TRP 34 4.025 23.484 -24.499 254 HE3 TRP 34 HE3 TRP 34 2.072 20.919 -28.764 255 HZ2 TRP 34 HZ2 TRP 34 2.191 25.047 -25.969 256 HZ3 TRP 34 HZ3 TRP 34 0.711 22.887 -29.338 257 HH2 TRP 34 HH2 TRP 34 0.771 24.907 -27.969 258 HA PRO 35 HA PRO 35 1.689 16.787 -23.231 259 HB2 PRO 35 2HB PRO 35 2.838 16.421 -20.798 260 HB3 PRO 35 3HB PRO 35 3.022 15.273 -22.130 261 HG2 PRO 35 2HG PRO 35 4.901 17.409 -21.196 262 HG3 PRO 35 3HG PRO 35 5.256 15.743 -21.687 263 HD2 PRO 35 2HD PRO 35 5.643 17.860 -23.330 264 HD3 PRO 35 3HD PRO 35 5.181 16.255 -23.933 265 H LEU 36 H LEU 36 1.345 19.319 -23.661 266 HA LEU 36 HA LEU 36 1.497 20.848 -21.188 267 HB2 LEU 36 2HB LEU 36 1.597 21.496 -23.901 268 HB3 LEU 36 3HB LEU 36 0.056 22.135 -23.333 269 HG LEU 36 HG LEU 36 2.823 22.853 -22.393 270 HD11 LEU 36 1HD1 LEU 36 0.992 23.955 -24.266 271 HD12 LEU 36 2HD1 LEU 36 2.578 24.558 -23.784 272 HD13 LEU 36 3HD1 LEU 36 1.137 25.067 -22.904 273 HD21 LEU 36 3HD2 LEU 36 1.267 24.486 -20.960 274 HD22 LEU 36 1HD2 LEU 36 1.853 22.939 -20.348 275 HD23 LEU 36 2HD2 LEU 36 0.220 23.066 -21.003 276 H VAL 37 H VAL 37 -0.931 19.507 -23.381 277 HA VAL 37 HA VAL 37 -3.109 20.422 -21.695 278 HB VAL 37 HB VAL 37 -4.578 19.324 -23.333 279 HG11 VAL 37 1HG1 VAL 37 -2.446 21.166 -24.380 280 HG12 VAL 37 2HG1 VAL 37 -3.847 20.694 -25.342 281 HG13 VAL 37 3HG1 VAL 37 -4.071 21.571 -23.829 282 HG21 VAL 37 3HG2 VAL 37 -2.028 18.130 -24.186 283 HG22 VAL 37 1HG2 VAL 37 -3.671 17.498 -24.291 284 HG23 VAL 37 2HG2 VAL 37 -3.092 18.653 -25.491 285 H ILE 38 H ILE 38 -1.435 17.428 -22.476 286 HA ILE 38 HA ILE 38 -3.213 15.649 -21.209 287 HB ILE 38 HB ILE 38 -1.473 14.015 -21.299 288 HG12 ILE 38 2HG1 ILE 38 0.838 15.077 -22.220 289 HG13 ILE 38 3HG1 ILE 38 0.277 16.404 -21.207 290 HG21 ILE 38 1HG2 ILE 38 -2.283 15.525 -23.506 291 HG22 ILE 38 2HG2 ILE 38 -0.554 15.263 -23.723 292 HG23 ILE 38 3HG2 ILE 38 -1.634 13.886 -23.511 293 HD11 ILE 38 3HD1 ILE 38 1.277 15.332 -19.540 294 HD12 ILE 38 1HD1 ILE 38 -0.084 14.212 -19.599 295 HD13 ILE 38 2HD1 ILE 38 1.406 13.836 -20.464 296 H ARG 39 H ARG 39 -0.671 17.701 -19.992 297 HA ARG 39 HA ARG 39 -0.503 16.422 -17.427 298 HB2 ARG 39 2HB ARG 39 0.880 18.376 -16.807 299 HB3 ARG 39 3HB ARG 39 1.425 17.608 -18.292 300 HG2 ARG 39 2HG ARG 39 0.363 19.346 -19.610 301 HG3 ARG 39 3HG ARG 39 -0.259 20.100 -18.141 302 HD2 ARG 39 2HD ARG 39 2.517 19.764 -17.779 303 HD3 ARG 39 3HD ARG 39 2.290 20.423 -19.399 304 HE ARG 39 HE ARG 39 0.695 21.963 -17.812 305 HH11 ARG 39 1HH1 ARG 39 4.068 21.101 -17.806 306 HH12 ARG 39 2HH1 ARG 39 4.580 22.586 -17.076 307 HH21 ARG 39 1HH2 ARG 39 1.357 23.923 -16.851 308 HH22 ARG 39 2HH2 ARG 39 3.038 24.190 -16.532 309 H THR 40 H THR 40 -2.567 18.731 -18.881 310 HA THR 40 HA THR 40 -3.350 20.217 -16.616 311 HB THR 40 HB THR 40 -5.372 19.669 -18.726 312 HG1 THR 40 HG1 THR 40 -2.805 20.733 -19.188 313 HG21 THR 40 3HG2 THR 40 -5.272 21.457 -16.751 314 HG22 THR 40 1HG2 THR 40 -6.055 21.801 -18.293 315 HG23 THR 40 2HG2 THR 40 -4.418 22.381 -17.987 316 H VAL 41 H VAL 41 -4.819 17.363 -18.158 317 HA VAL 41 HA VAL 41 -6.865 17.086 -16.194 318 HB VAL 41 HB VAL 41 -7.260 14.866 -17.204 319 HG11 VAL 41 1HG1 VAL 41 -6.858 16.717 -19.505 320 HG12 VAL 41 2HG1 VAL 41 -8.244 15.701 -19.103 321 HG13 VAL 41 3HG1 VAL 41 -7.951 17.191 -18.206 322 HG21 VAL 41 3HG2 VAL 41 -4.743 15.529 -18.713 323 HG22 VAL 41 1HG2 VAL 41 -5.093 14.099 -17.742 324 HG23 VAL 41 2HG2 VAL 41 -5.910 14.338 -19.287 325 H ILE 42 H ILE 42 -3.734 15.515 -16.725 326 HA ILE 42 HA ILE 42 -3.900 13.590 -14.707 327 HB ILE 42 HB ILE 42 -1.530 14.999 -15.916 328 HG12 ILE 42 2HG1 ILE 42 -2.883 12.341 -16.279 329 HG13 ILE 42 3HG1 ILE 42 -2.465 13.543 -17.496 330 HG21 ILE 42 1HG2 ILE 42 -1.509 12.743 -13.916 331 HG22 ILE 42 2HG2 ILE 42 -0.108 13.324 -14.813 332 HG23 ILE 42 3HG2 ILE 42 -0.912 14.381 -13.654 333 HD11 ILE 42 3HD1 ILE 42 -0.023 12.980 -16.836 334 HD12 ILE 42 1HD1 ILE 42 -0.734 11.510 -16.171 335 HD13 ILE 42 2HD1 ILE 42 -0.922 11.884 -17.885 336 H ALA 43 H ALA 43 -3.606 16.982 -14.487 337 HA ALA 43 HA ALA 43 -2.127 17.465 -12.236 338 HB1 ALA 43 1HB ALA 43 -3.731 19.360 -11.801 339 HB2 ALA 43 2HB ALA 43 -3.037 19.302 -13.422 340 HB3 ALA 43 3HB ALA 43 -4.689 18.749 -13.151 341 H GLY 44 H GLY 44 -5.112 15.752 -12.464 342 HA2 GLY 44 2HA GLY 44 -5.590 15.938 -9.581 343 HA3 GLY 44 3HA GLY 44 -6.673 15.224 -10.766 344 H TYR 45 H TYR 45 -4.550 13.640 -12.013 345 HA TYR 45 HA TYR 45 -4.859 11.250 -10.659 346 HB2 TYR 45 2HB TYR 45 -4.155 11.061 -12.882 347 HB3 TYR 45 3HB TYR 45 -2.835 12.204 -12.662 348 HD1 TYR 45 HD2 TYR 45 -0.761 11.496 -11.519 349 HD2 TYR 45 HD1 TYR 45 -3.875 8.733 -12.397 350 HE1 TYR 45 HE2 TYR 45 0.802 9.631 -11.161 351 HE2 TYR 45 HE1 TYR 45 -2.321 6.860 -12.041 352 HH TYR 45 HH TYR 45 1.108 7.398 -11.485 353 H ASN 46 H ASN 46 -2.106 13.496 -10.542 354 HA ASN 46 HA ASN 46 -0.402 12.102 -8.895 355 HB2 ASN 46 2HB ASN 46 0.012 14.344 -9.992 356 HB3 ASN 46 3HB ASN 46 -0.884 15.076 -8.664 357 HD21 ASN 46 1HD2 ASN 46 2.078 13.702 -9.686 358 HD22 ASN 46 2HD2 ASN 46 2.952 13.933 -8.213 359 H LEU 47 H LEU 47 -3.435 13.545 -8.108 360 HA LEU 47 HA LEU 47 -2.968 13.560 -5.255 361 HB2 LEU 47 2HB LEU 47 -4.449 15.186 -6.496 362 HB3 LEU 47 3HB LEU 47 -5.597 13.863 -6.688 363 HG LEU 47 HG LEU 47 -5.108 13.912 -3.966 364 HD11 LEU 47 1HD1 LEU 47 -4.684 15.970 -3.233 365 HD12 LEU 47 2HD1 LEU 47 -5.845 16.692 -4.347 366 HD13 LEU 47 3HD1 LEU 47 -4.201 16.352 -4.887 367 HD21 LEU 47 3HD2 LEU 47 -7.269 14.479 -5.820 368 HD22 LEU 47 1HD2 LEU 47 -7.398 15.413 -4.329 369 HD23 LEU 47 2HD2 LEU 47 -7.302 13.654 -4.261 370 H TYR 48 H TYR 48 -4.680 11.577 -7.615 371 HA TYR 48 HA TYR 48 -6.148 9.921 -5.985 372 HB2 TYR 48 2HB TYR 48 -5.189 9.863 -8.682 373 HB3 TYR 48 3HB TYR 48 -4.989 8.263 -7.975 374 HD1 TYR 48 HD2 TYR 48 -7.060 7.260 -6.784 375 HD2 TYR 48 HD1 TYR 48 -7.259 10.509 -9.524 376 HE1 TYR 48 HE2 TYR 48 -9.447 6.796 -7.153 377 HE2 TYR 48 HE1 TYR 48 -9.647 10.055 -9.899 378 HH TYR 48 HH TYR 48 -11.543 8.542 -8.053 379 H ARG 49 H ARG 49 -2.715 9.663 -6.817 380 HA ARG 49 HA ARG 49 -2.330 7.266 -5.287 381 HB2 ARG 49 2HB ARG 49 -0.810 8.846 -7.141 382 HB3 ARG 49 3HB ARG 49 0.154 8.551 -5.700 383 HG2 ARG 49 2HG ARG 49 -0.944 6.086 -6.228 384 HG3 ARG 49 3HG ARG 49 -0.615 6.739 -7.834 385 HD2 ARG 49 2HD ARG 49 1.696 7.343 -6.890 386 HD3 ARG 49 3HD ARG 49 1.297 6.233 -5.579 387 HE ARG 49 HE ARG 49 0.918 5.066 -8.162 388 HH11 ARG 49 1HH1 ARG 49 3.285 5.817 -5.722 389 HH12 ARG 49 2HH1 ARG 49 4.372 4.556 -6.203 390 HH21 ARG 49 1HH2 ARG 49 2.341 3.403 -8.805 391 HH22 ARG 49 2HH2 ARG 49 3.835 3.184 -7.957 392 H ALA 50 H ALA 50 -2.258 10.658 -4.650 393 HA ALA 50 HA ALA 50 -0.534 10.898 -2.520 394 HB1 ALA 50 1HB ALA 50 -3.168 12.263 -2.313 395 HB2 ALA 50 2HB ALA 50 -1.540 12.901 -2.079 396 HB3 ALA 50 3HB ALA 50 -2.148 12.614 -3.709 397 H ILE 51 H ILE 51 -3.801 9.578 -2.554 398 HA ILE 51 HA ILE 51 -3.840 9.216 0.318 399 HB ILE 51 HB ILE 51 -5.782 8.261 -1.789 400 HG12 ILE 51 2HG1 ILE 51 -5.696 10.691 -1.673 401 HG13 ILE 51 3HG1 ILE 51 -7.198 10.116 -0.958 402 HG21 ILE 51 1HG2 ILE 51 -5.576 7.779 1.084 403 HG22 ILE 51 2HG2 ILE 51 -7.147 8.399 0.578 404 HG23 ILE 51 3HG2 ILE 51 -6.506 6.925 -0.147 405 HD11 ILE 51 3HD1 ILE 51 -6.726 11.366 0.803 406 HD12 ILE 51 1HD1 ILE 51 -5.406 10.253 1.162 407 HD13 ILE 51 2HD1 ILE 51 -5.102 11.702 0.203 408 H LYS 52 H LYS 52 -2.852 7.448 -2.447 409 HA LYS 52 HA LYS 52 -3.120 4.832 -1.295 410 HB2 LYS 52 2HB LYS 52 -1.737 5.904 -3.744 411 HB3 LYS 52 3HB LYS 52 -1.568 4.224 -3.254 412 HG2 LYS 52 2HG LYS 52 -4.193 5.582 -3.829 413 HG3 LYS 52 3HG LYS 52 -3.300 4.581 -4.977 414 HD2 LYS 52 2HD LYS 52 -4.567 2.915 -4.153 415 HD3 LYS 52 3HD LYS 52 -3.408 2.934 -2.821 416 HE2 LYS 52 2HE LYS 52 -4.998 3.538 -1.392 417 HE3 LYS 52 3HE LYS 52 -5.410 4.935 -2.384 418 HZ1 LYS 52 3HZ LYS 52 -7.356 3.682 -2.275 419 HZ2 LYS 52 1HZ LYS 52 -6.549 2.210 -2.491 420 HZ3 LYS 52 2HZ LYS 52 -6.710 3.284 -3.787 421 H LYS 53 H LYS 53 -0.717 7.332 -1.309 422 HA LYS 53 HA LYS 53 1.424 5.612 -0.419 423 HB2 LYS 53 2HB LYS 53 1.140 8.580 -0.815 424 HB3 LYS 53 3HB LYS 53 2.551 7.901 -0.014 425 HG2 LYS 53 2HG LYS 53 3.437 7.161 -1.931 426 HG3 LYS 53 3HG LYS 53 1.878 6.627 -2.564 427 HD2 LYS 53 2HD LYS 53 2.650 8.386 -3.973 428 HD3 LYS 53 3HD LYS 53 1.334 9.040 -2.993 429 HE2 LYS 53 2HE LYS 53 2.673 10.540 -2.019 430 HE3 LYS 53 3HE LYS 53 3.937 9.345 -1.729 431 HZ1 LYS 53 3HZ LYS 53 3.699 11.283 -3.840 432 HZ2 LYS 53 1HZ LYS 53 4.064 9.730 -4.403 433 HZ3 LYS 53 2HZ LYS 53 5.069 10.474 -3.264 434 H LYS 54 H LYS 54 -0.781 7.967 1.015 435 HA LYS 54 HA LYS 54 0.292 7.331 3.674 436 HB2 LYS 54 2HB LYS 54 0.195 9.706 3.159 437 HB3 LYS 54 3HB LYS 54 -1.512 9.577 2.755 438 HG2 LYS 54 2HG LYS 54 -2.055 9.059 5.051 439 HG3 LYS 54 3HG LYS 54 -0.343 9.059 5.482 440 HD2 LYS 54 2HD LYS 54 -1.076 11.513 4.150 441 HD3 LYS 54 3HD LYS 54 -2.105 11.225 5.555 442 HE2 LYS 54 2HE LYS 54 0.779 10.740 5.941 443 HE3 LYS 54 3HE LYS 54 0.310 12.418 5.677 444 HZ1 LYS 54 3HZ LYS 54 -1.317 12.154 7.495 445 HZ2 LYS 54 1HZ LYS 54 0.283 11.955 8.008 446 HZ3 LYS 54 2HZ LYS 54 -0.711 10.603 7.792 447 H GLY 55 H GLY 55 -2.960 8.247 2.544 448 HA2 GLY 55 2HA GLY 55 -4.778 6.631 2.520 449 HA3 GLY 55 3HA GLY 55 -3.998 5.823 3.872 450 H GLY 56 H GLY 56 -4.687 9.272 3.358 451 HA2 GLY 56 2HA GLY 56 -6.776 9.225 5.370 452 HA3 GLY 56 3HA GLY 56 -5.303 10.054 5.851 453 H GLY 57 H GLY 57 -4.880 12.080 5.084 454 HA2 GLY 57 2HA GLY 57 -5.162 13.801 3.403 455 HA3 GLY 57 3HA GLY 57 -6.780 13.180 3.114 456 H GLY 58 H GLY 58 -6.197 15.893 3.616 457 HA2 GLY 58 2HA GLY 58 -6.811 16.458 6.383 458 HA3 GLY 58 3HA GLY 58 -6.629 17.635 5.090 459 H GLY 59 H GLY 59 -8.483 18.751 5.842 460 HA2 GLY 59 2HA GLY 59 -10.922 17.800 4.644 461 HA3 GLY 59 3HA GLY 59 -10.979 17.815 6.401 462 H GLY 60 H GLY 60 -12.242 19.441 4.091 463 HA2 GLY 60 2HA GLY 60 -11.523 22.111 5.127 464 HA3 GLY 60 3HA GLY 60 -12.162 21.808 3.518 465 H GLY 61 H GLY 61 -14.128 22.655 3.358 466 HA2 GLY 61 2HA GLY 61 -15.872 22.672 5.714 467 HA3 GLY 61 3HA GLY 61 -16.097 23.625 4.255 468 H GLY 62 H GLY 62 -18.247 22.345 5.280 469 HA2 GLY 62 2HA GLY 62 -19.723 21.223 3.513 470 HA3 GLY 62 3HA GLY 62 -18.553 19.917 3.635 471 H GLY 63 H GLY 63 -19.303 18.273 4.782 472 HA2 GLY 63 2HA GLY 63 -20.132 18.489 7.458 473 HA3 GLY 63 3HA GLY 63 -21.564 18.391 6.443 474 H GLY 64 H GLY 64 -18.485 16.743 7.107 475 HA2 GLY 64 2HA GLY 64 -18.056 14.491 7.358 476 HA3 GLY 64 3HA GLY 64 -19.787 14.202 7.277 477 H VAL 65 H VAL 65 -17.416 15.540 4.976 478 HA VAL 65 HA VAL 65 -17.387 13.313 3.262 479 HB VAL 65 HB VAL 65 -19.662 13.744 2.717 480 HG11 VAL 65 1HG1 VAL 65 -18.929 16.607 2.124 481 HG12 VAL 65 2HG1 VAL 65 -20.537 15.883 2.072 482 HG13 VAL 65 3HG1 VAL 65 -19.700 16.065 3.614 483 HG21 VAL 65 3HG2 VAL 65 -17.992 13.352 0.842 484 HG22 VAL 65 1HG2 VAL 65 -19.551 14.037 0.382 485 HG23 VAL 65 2HG2 VAL 65 -18.130 15.076 0.498 486 H TRP 66 H TRP 66 -17.343 16.861 3.321 487 HA TRP 66 HA TRP 66 -16.051 18.347 2.109 488 HB2 TRP 66 2HB TRP 66 -13.546 17.826 2.638 489 HB3 TRP 66 3HB TRP 66 -14.648 18.223 3.953 490 HD1 TRP 66 HD1 TRP 66 -15.521 16.106 5.468 491 HE1 TRP 66 HE1 TRP 66 -14.342 13.891 6.039 492 HE3 TRP 66 HE3 TRP 66 -11.974 16.103 1.787 493 HZ2 TRP 66 HZ2 TRP 66 -12.193 12.346 5.058 494 HZ3 TRP 66 HZ3 TRP 66 -10.394 14.220 1.673 495 HH2 TRP 66 HH2 TRP 66 -10.503 12.382 3.276 496 HA PRO 67 HA PRO 67 -15.378 15.595 -1.561 497 HB2 PRO 67 2HB PRO 67 -16.757 17.176 -3.284 498 HB3 PRO 67 3HB PRO 67 -17.530 15.938 -2.288 499 HG2 PRO 67 2HG PRO 67 -17.351 18.892 -1.839 500 HG3 PRO 67 3HG PRO 67 -18.738 17.809 -1.620 501 HD2 PRO 67 2HD PRO 67 -17.213 18.659 0.450 502 HD3 PRO 67 3HD PRO 67 -17.994 17.065 0.431 503 H LEU 68 H LEU 68 -13.240 16.842 -0.762 504 HA LEU 68 HA LEU 68 -12.574 19.033 -2.564 505 HB2 LEU 68 2HB LEU 68 -11.506 17.945 -0.055 506 HB3 LEU 68 3HB LEU 68 -10.283 18.494 -1.200 507 HG LEU 68 HG LEU 68 -12.104 20.579 -1.130 508 HD11 LEU 68 1HD1 LEU 68 -11.867 19.280 1.560 509 HD12 LEU 68 2HD1 LEU 68 -13.303 19.902 0.747 510 HD13 LEU 68 3HD1 LEU 68 -12.105 21.020 1.398 511 HD21 LEU 68 3HD2 LEU 68 -10.310 21.713 0.181 512 HD22 LEU 68 1HD2 LEU 68 -9.736 20.879 -1.263 513 HD23 LEU 68 2HD2 LEU 68 -9.500 20.152 0.327 514 H VAL 69 H VAL 69 -12.165 15.637 -2.289 515 HA VAL 69 HA VAL 69 -9.837 15.479 -3.985 516 HB VAL 69 HB VAL 69 -10.236 13.040 -3.944 517 HG11 VAL 69 1HG1 VAL 69 -9.457 14.701 -1.841 518 HG12 VAL 69 2HG1 VAL 69 -10.510 13.487 -1.110 519 HG13 VAL 69 3HG1 VAL 69 -9.094 12.987 -2.037 520 HG21 VAL 69 3HG2 VAL 69 -12.477 12.607 -3.825 521 HG22 VAL 69 1HG2 VAL 69 -12.052 12.423 -2.123 522 HG23 VAL 69 2HG2 VAL 69 -12.784 13.923 -2.692 523 H ILE 70 H ILE 70 -13.310 14.837 -4.316 524 HA ILE 70 HA ILE 70 -13.416 13.795 -6.851 525 HB ILE 70 HB ILE 70 -15.642 15.021 -7.064 526 HG12 ILE 70 2HG1 ILE 70 -16.113 15.674 -4.410 527 HG13 ILE 70 3HG1 ILE 70 -14.508 16.330 -4.714 528 HG21 ILE 70 1HG2 ILE 70 -15.526 12.751 -6.278 529 HG22 ILE 70 2HG2 ILE 70 -15.079 13.292 -4.661 530 HG23 ILE 70 3HG2 ILE 70 -16.689 13.638 -5.293 531 HD11 ILE 70 3HD1 ILE 70 -15.401 18.063 -5.745 532 HD12 ILE 70 1HD1 ILE 70 -16.184 16.995 -6.909 533 HD13 ILE 70 2HD1 ILE 70 -17.009 17.422 -5.409 534 H ARG 71 H ARG 71 -13.431 17.247 -5.980 535 HA ARG 71 HA ARG 71 -13.565 18.276 -8.572 536 HB2 ARG 71 2HB ARG 71 -12.540 20.333 -7.572 537 HB3 ARG 71 3HB ARG 71 -13.946 19.727 -6.707 538 HG2 ARG 71 2HG ARG 71 -12.481 18.691 -5.048 539 HG3 ARG 71 3HG ARG 71 -11.072 19.303 -5.916 540 HD2 ARG 71 2HD ARG 71 -13.164 21.256 -5.134 541 HD3 ARG 71 3HD ARG 71 -12.148 20.593 -3.855 542 HE ARG 71 HE ARG 71 -10.570 21.487 -6.032 543 HH11 ARG 71 1HH1 ARG 71 -12.431 22.637 -3.324 544 HH12 ARG 71 2HH1 ARG 71 -11.515 24.097 -3.146 545 HH21 ARG 71 1HH2 ARG 71 -9.356 23.406 -5.808 546 HH22 ARG 71 2HH2 ARG 71 -9.767 24.533 -4.561 547 H THR 72 H THR 72 -10.785 17.313 -6.618 548 HA THR 72 HA THR 72 -8.704 18.293 -8.136 549 HB THR 72 HB THR 72 -8.354 15.522 -7.140 550 HG1 THR 72 HG1 THR 72 -8.847 17.702 -5.368 551 HG21 THR 72 3HG2 THR 72 -6.749 17.767 -7.697 552 HG22 THR 72 1HG2 THR 72 -6.237 16.213 -7.039 553 HG23 THR 72 2HG2 THR 72 -6.681 17.529 -5.951 554 H VAL 73 H VAL 73 -10.368 15.170 -8.527 555 HA VAL 73 HA VAL 73 -8.881 14.428 -10.845 556 HB VAL 73 HB VAL 73 -11.583 13.332 -10.090 557 HG11 VAL 73 1HG1 VAL 73 -9.219 11.928 -11.314 558 HG12 VAL 73 2HG1 VAL 73 -10.889 11.367 -11.216 559 HG13 VAL 73 3HG1 VAL 73 -10.471 12.716 -12.273 560 HG21 VAL 73 3HG2 VAL 73 -10.302 13.290 -8.065 561 HG22 VAL 73 1HG2 VAL 73 -10.330 11.657 -8.731 562 HG23 VAL 73 2HG2 VAL 73 -8.890 12.659 -8.912 563 H ILE 74 H ILE 74 -12.098 15.815 -10.314 564 HA ILE 74 HA ILE 74 -13.008 15.772 -12.951 565 HB ILE 74 HB ILE 74 -13.615 17.881 -10.876 566 HG12 ILE 74 2HG1 ILE 74 -14.011 15.209 -10.560 567 HG13 ILE 74 3HG1 ILE 74 -15.026 16.449 -9.831 568 HG21 ILE 74 1HG2 ILE 74 -14.963 17.057 -13.430 569 HG22 ILE 74 2HG2 ILE 74 -15.814 17.930 -12.158 570 HG23 ILE 74 3HG2 ILE 74 -14.414 18.660 -12.943 571 HD11 ILE 74 3HD1 ILE 74 -16.255 14.602 -10.967 572 HD12 ILE 74 1HD1 ILE 74 -16.662 16.221 -11.535 573 HD13 ILE 74 2HD1 ILE 74 -15.602 15.189 -12.496 574 H ALA 75 H ALA 75 -10.661 17.793 -11.416 575 HA ALA 75 HA ALA 75 -10.661 20.111 -12.859 576 HB1 ALA 75 1HB ALA 75 -8.172 20.107 -12.583 577 HB2 ALA 75 2HB ALA 75 -9.083 19.813 -11.101 578 HB3 ALA 75 3HB ALA 75 -8.310 18.469 -11.942 579 H GLY 76 H GLY 76 -9.843 16.919 -13.978 580 HA2 GLY 76 2HA GLY 76 -8.775 17.980 -16.493 581 HA3 GLY 76 3HA GLY 76 -8.718 16.302 -15.971 582 H TYR 77 H TYR 77 -11.591 16.378 -15.209 583 HA TYR 77 HA TYR 77 -12.706 15.265 -17.474 584 HB2 TYR 77 2HB TYR 77 -13.723 14.938 -15.313 585 HB3 TYR 77 3HB TYR 77 -14.064 16.658 -15.160 586 HD1 TYR 77 HD2 TYR 77 -14.570 14.806 -18.297 587 HD2 TYR 77 HD1 TYR 77 -16.427 16.383 -14.808 588 HE1 TYR 77 HE2 TYR 77 -16.778 14.456 -19.321 589 HE2 TYR 77 HE1 TYR 77 -18.641 16.036 -15.823 590 HH TYR 77 HH TYR 77 -19.746 15.493 -17.691 591 H ASN 78 H ASN 78 -13.198 18.579 -16.258 592 HA ASN 78 HA ASN 78 -14.844 19.524 -18.268 593 HB2 ASN 78 2HB ASN 78 -13.899 20.645 -16.066 594 HB3 ASN 78 3HB ASN 78 -12.724 21.331 -17.185 595 HD21 ASN 78 1HD2 ASN 78 -13.309 22.977 -18.479 596 HD22 ASN 78 2HD2 ASN 78 -14.886 23.683 -18.508 597 H LEU 79 H LEU 79 -11.548 18.641 -18.443 598 HA LEU 79 HA LEU 79 -11.066 20.190 -20.868 599 HB2 LEU 79 2HB LEU 79 -9.426 18.828 -18.869 600 HB3 LEU 79 3HB LEU 79 -8.875 18.578 -20.524 601 HG LEU 79 HG LEU 79 -7.729 20.448 -19.406 602 HD11 LEU 79 1HD1 LEU 79 -8.853 20.391 -21.958 603 HD12 LEU 79 2HD1 LEU 79 -7.507 21.387 -21.404 604 HD13 LEU 79 3HD1 LEU 79 -9.152 22.021 -21.353 605 HD21 LEU 79 3HD2 LEU 79 -10.120 22.174 -19.577 606 HD22 LEU 79 1HD2 LEU 79 -8.774 22.204 -18.438 607 HD23 LEU 79 2HD2 LEU 79 -10.071 21.026 -18.239 608 H TYR 80 H TYR 80 -11.707 16.922 -19.826 609 HA TYR 80 HA TYR 80 -10.885 15.341 -21.862 610 HB2 TYR 80 2HB TYR 80 -13.543 15.291 -20.429 611 HB3 TYR 80 3HB TYR 80 -13.005 14.007 -21.505 612 HD1 TYR 80 HD2 TYR 80 -10.137 15.237 -19.993 613 HD2 TYR 80 HD1 TYR 80 -13.574 12.887 -19.116 614 HE1 TYR 80 HE2 TYR 80 -8.931 14.180 -18.128 615 HE2 TYR 80 HE1 TYR 80 -12.378 11.824 -17.248 616 HH TYR 80 HH TYR 80 -8.988 12.226 -16.771 617 H ARG 81 H ARG 81 -13.925 17.198 -21.871 618 HA ARG 81 HA ARG 81 -14.408 16.573 -24.649 619 HB2 ARG 81 2HB ARG 81 -15.844 18.202 -22.573 620 HB3 ARG 81 3HB ARG 81 -16.305 18.299 -24.268 621 HG2 ARG 81 2HG ARG 81 -17.260 16.259 -24.265 622 HG3 ARG 81 3HG ARG 81 -16.065 15.582 -23.156 623 HD2 ARG 81 2HD ARG 81 -17.203 16.290 -21.285 624 HD3 ARG 81 3HD ARG 81 -18.000 17.609 -22.141 625 HE ARG 81 HE ARG 81 -18.949 14.928 -21.844 626 HH11 ARG 81 1HH1 ARG 81 -18.996 17.728 -23.913 627 HH12 ARG 81 2HH1 ARG 81 -20.518 17.328 -24.639 628 HH21 ARG 81 1HH2 ARG 81 -20.953 14.390 -22.792 629 HH22 ARG 81 2HH2 ARG 81 -21.630 15.429 -24.000 630 H ALA 82 H ALA 82 -12.904 19.092 -22.828 631 HA ALA 82 HA ALA 82 -13.135 21.299 -24.466 632 HB1 ALA 82 1HB ALA 82 -11.097 22.110 -23.486 633 HB2 ALA 82 2HB ALA 82 -12.017 21.251 -22.251 634 HB3 ALA 82 3HB ALA 82 -10.626 20.478 -23.012 635 H ILE 83 H ILE 83 -11.095 18.466 -24.856 636 HA ILE 83 HA ILE 83 -9.692 19.588 -27.125 637 HB ILE 83 HB ILE 83 -9.662 16.783 -26.004 638 HG12 ILE 83 2HG1 ILE 83 -8.746 18.373 -24.423 639 HG13 ILE 83 3HG1 ILE 83 -7.426 17.456 -25.141 640 HG21 ILE 83 1HG2 ILE 83 -8.548 17.934 -28.430 641 HG22 ILE 83 2HG2 ILE 83 -7.325 17.178 -27.410 642 HG23 ILE 83 3HG2 ILE 83 -8.719 16.245 -27.953 643 HD11 ILE 83 3HD1 ILE 83 -6.986 19.338 -26.661 644 HD12 ILE 83 1HD1 ILE 83 -8.259 20.256 -25.858 645 HD13 ILE 83 2HD1 ILE 83 -6.818 19.776 -24.961 646 H LYS 84 H LYS 84 -12.532 17.736 -26.546 647 HA LYS 84 HA LYS 84 -12.676 16.616 -29.204 648 HB2 LYS 84 2HB LYS 84 -14.893 16.776 -27.162 649 HB3 LYS 84 3HB LYS 84 -14.760 15.662 -28.516 650 HG2 LYS 84 2HG LYS 84 -13.228 15.676 -25.943 651 HG3 LYS 84 3HG LYS 84 -14.207 14.386 -26.646 652 HD2 LYS 84 2HD LYS 84 -12.524 14.302 -28.527 653 HD3 LYS 84 3HD LYS 84 -11.508 15.367 -27.554 654 HE2 LYS 84 2HE LYS 84 -12.584 12.893 -26.299 655 HE3 LYS 84 3HE LYS 84 -11.260 12.738 -27.452 656 HZ1 LYS 84 3HZ LYS 84 -11.263 13.856 -24.776 657 HZ2 LYS 84 1HZ LYS 84 -10.370 14.727 -25.919 658 HZ3 LYS 84 2HZ LYS 84 -10.017 13.098 -25.633 659 H LYS 85 H LYS 85 -13.625 19.523 -27.632 660 HA LYS 85 HA LYS 85 -15.635 20.214 -29.601 661 HB2 LYS 85 2HB LYS 85 -15.725 22.375 -28.355 662 HB3 LYS 85 3HB LYS 85 -16.026 20.963 -27.350 663 HG2 LYS 85 2HG LYS 85 -13.786 21.067 -26.460 664 HG3 LYS 85 3HG LYS 85 -13.389 22.405 -27.542 665 HD2 LYS 85 2HD LYS 85 -15.490 23.506 -26.378 666 HD3 LYS 85 3HD LYS 85 -15.079 22.372 -25.089 667 HE2 LYS 85 2HE LYS 85 -13.021 23.363 -24.700 668 HE3 LYS 85 3HE LYS 85 -12.958 24.096 -26.302 669 HZ1 LYS 85 3HZ LYS 85 -15.188 25.132 -24.997 670 HZ2 LYS 85 1HZ LYS 85 -13.766 25.942 -25.423 671 HZ3 LYS 85 2HZ LYS 85 -13.900 25.214 -23.903 672 H LYS 86 H LYS 86 -12.302 21.039 -28.831 673 HA LYS 86 HA LYS 86 -10.809 22.460 -29.854 674 HB2 LYS 86 2HB LYS 86 -10.389 21.839 -32.171 675 HB3 LYS 86 3HB LYS 86 -10.732 20.406 -31.211 676 HG2 LYS 86 2HG LYS 86 -12.834 20.116 -32.173 677 HG3 LYS 86 3HG LYS 86 -12.884 21.771 -32.784 678 HD2 LYS 86 2HD LYS 86 -12.214 20.911 -34.735 679 HD3 LYS 86 3HD LYS 86 -10.630 20.728 -33.977 680 HE2 LYS 86 2HE LYS 86 -10.876 18.482 -33.688 681 HE3 LYS 86 3HE LYS 86 -12.626 18.587 -33.503 682 HZ1 LYS 86 3HZ LYS 86 -11.272 17.777 -35.739 683 HZ2 LYS 86 1HZ LYS 86 -11.794 19.340 -36.123 684 HZ3 LYS 86 2HZ LYS 86 -12.915 18.166 -35.649 685 H GLY 87 H GLY 87 -13.159 23.849 -29.288 686 HA2 GLY 87 2HA GLY 87 -12.920 26.038 -31.092 687 HA3 GLY 87 3HA GLY 87 -14.422 25.167 -31.366 688 H GLY 88 H GLY 88 -15.788 24.808 -29.387 689 HA2 GLY 88 2HA GLY 88 -15.411 26.555 -27.144 690 HA3 GLY 88 3HA GLY 88 -16.614 27.169 -28.268 691 H GLY 89 H GLY 89 -17.363 26.614 -25.711 692 HA2 GLY 89 2HA GLY 89 -19.532 25.618 -25.199 693 HA3 GLY 89 3HA GLY 89 -19.008 24.190 -26.080 694 H GLY 90 H GLY 90 -20.024 24.291 -23.387 695 HA2 GLY 90 2HA GLY 90 -17.613 23.557 -21.850 696 HA3 GLY 90 3HA GLY 90 -19.125 24.100 -21.138 697 H GLY 91 H GLY 91 -19.776 22.420 -19.927 698 HA2 GLY 91 2HA GLY 91 -19.812 19.755 -21.197 699 HA3 GLY 91 3HA GLY 91 -19.726 20.033 -19.464 700 H GLY 92 H GLY 92 -21.578 18.305 -20.174 701 HA2 GLY 92 2HA GLY 92 -23.929 19.092 -19.089 702 HA3 GLY 92 3HA GLY 92 -24.101 19.580 -20.769 703 H GLY 93 H GLY 93 -25.223 18.169 -21.922 704 HA2 GLY 93 2HA GLY 93 -24.762 15.296 -21.428 705 HA3 GLY 93 3HA GLY 93 -26.392 15.933 -21.591 706 H GLY 94 H GLY 94 -25.979 14.006 -23.260 707 HA2 GLY 94 2HA GLY 94 -25.896 15.323 -25.841 708 HA3 GLY 94 3HA GLY 94 -24.623 14.140 -25.579 709 H GLY 95 H GLY 95 -25.888 13.353 -27.588 710 HA2 GLY 95 2HA GLY 95 -27.341 11.029 -26.784 711 HA3 GLY 95 3HA GLY 95 -28.403 12.233 -27.499 712 H GLY 96 H GLY 96 -28.060 9.708 -28.617 713 HA2 GLY 96 2HA GLY 96 -27.852 8.854 -30.751 714 HA3 GLY 96 3HA GLY 96 -27.298 10.436 -31.280 715 H VAL 97 H VAL 97 -25.518 9.947 -32.434 716 HA VAL 97 HA VAL 97 -23.382 8.474 -31.032 717 HB VAL 97 HB VAL 97 -22.560 7.845 -33.345 718 HG11 VAL 97 1HG1 VAL 97 -23.982 5.912 -33.490 719 HG12 VAL 97 2HG1 VAL 97 -23.723 6.299 -31.787 720 HG13 VAL 97 3HG1 VAL 97 -25.247 6.722 -32.568 721 HG21 VAL 97 3HG2 VAL 97 -24.298 7.791 -35.118 722 HG22 VAL 97 1HG2 VAL 97 -25.331 8.776 -34.082 723 HG23 VAL 97 2HG2 VAL 97 -23.800 9.423 -34.672 724 H TRP 98 H TRP 98 -21.612 9.626 -30.665 725 HA TRP 98 HA TRP 98 -20.286 11.245 -32.491 726 HB2 TRP 98 2HB TRP 98 -21.781 12.983 -32.511 727 HB3 TRP 98 3HB TRP 98 -22.370 12.636 -30.887 728 HD1 TRP 98 HD1 TRP 98 -21.892 14.654 -29.401 729 HE1 TRP 98 HE1 TRP 98 -19.923 16.274 -29.055 730 HE3 TRP 98 HE3 TRP 98 -18.746 12.890 -33.024 731 HZ2 TRP 98 HZ2 TRP 98 -17.373 16.743 -30.172 732 HZ3 TRP 98 HZ3 TRP 98 -16.560 13.981 -33.321 733 HH2 TRP 98 HH2 TRP 98 -15.890 15.868 -31.924 734 HA PRO 99 HA PRO 99 -18.499 12.093 -28.083 735 HB2 PRO 99 2HB PRO 99 -19.905 11.143 -25.964 736 HB3 PRO 99 3HB PRO 99 -20.162 12.755 -26.643 737 HG2 PRO 99 2HG PRO 99 -21.726 10.241 -27.086 738 HG3 PRO 99 3HG PRO 99 -22.314 11.893 -26.819 739 HD2 PRO 99 2HD PRO 99 -22.189 10.771 -29.280 740 HD3 PRO 99 3HD PRO 99 -21.954 12.510 -29.010 741 H LEU 100 H LEU 100 -17.792 10.063 -29.607 742 HA LEU 100 HA LEU 100 -17.830 7.587 -28.070 743 HB2 LEU 100 2HB LEU 100 -17.260 8.356 -30.851 744 HB3 LEU 100 3HB LEU 100 -16.257 7.057 -30.211 745 HG LEU 100 HG LEU 100 -19.272 7.014 -30.212 746 HD11 LEU 100 1HD1 LEU 100 -17.345 6.460 -32.329 747 HD12 LEU 100 2HD1 LEU 100 -19.090 6.695 -32.413 748 HD13 LEU 100 3HD1 LEU 100 -18.433 5.113 -31.994 749 HD21 LEU 100 3HD2 LEU 100 -17.124 5.078 -29.444 750 HD22 LEU 100 1HD2 LEU 100 -18.691 4.497 -30.009 751 HD23 LEU 100 2HD2 LEU 100 -18.595 5.522 -28.576 752 H VAL 101 H VAL 101 -15.802 10.290 -28.640 753 HA VAL 101 HA VAL 101 -13.369 8.908 -27.842 754 HB VAL 101 HB VAL 101 -12.308 11.154 -28.071 755 HG11 VAL 101 1HG1 VAL 101 -12.855 9.379 -29.971 756 HG12 VAL 101 2HG1 VAL 101 -13.779 10.739 -30.612 757 HG13 VAL 101 3HG1 VAL 101 -12.048 10.907 -30.317 758 HG21 VAL 101 3HG2 VAL 101 -14.094 12.634 -27.576 759 HG22 VAL 101 1HG2 VAL 101 -13.691 12.888 -29.274 760 HG23 VAL 101 2HG2 VAL 101 -15.112 11.939 -28.837 761 H ILE 102 H ILE 102 -15.523 11.440 -26.605 762 HA ILE 102 HA ILE 102 -14.186 12.168 -24.312 763 HB ILE 102 HB ILE 102 -16.462 12.588 -23.311 764 HG12 ILE 102 2HG1 ILE 102 -18.136 12.413 -25.489 765 HG13 ILE 102 3HG1 ILE 102 -17.201 10.927 -25.614 766 HG21 ILE 102 1HG2 ILE 102 -15.277 14.283 -24.594 767 HG22 ILE 102 2HG2 ILE 102 -15.952 13.639 -26.091 768 HG23 ILE 102 3HG2 ILE 102 -17.013 14.377 -24.891 769 HD11 ILE 102 3HD1 ILE 102 -19.395 11.507 -23.923 770 HD12 ILE 102 1HD1 ILE 102 -18.485 10.005 -24.076 771 HD13 ILE 102 2HD1 ILE 102 -17.978 11.230 -22.912 772 H ARG 103 H ARG 103 -16.425 9.444 -24.742 773 HA ARG 103 HA ARG 103 -16.565 8.507 -22.159 774 HB2 ARG 103 2HB ARG 103 -16.953 6.267 -23.149 775 HB3 ARG 103 3HB ARG 103 -17.895 7.533 -23.926 776 HG2 ARG 103 2HG ARG 103 -17.159 6.575 -25.813 777 HG3 ARG 103 3HG ARG 103 -15.701 7.519 -25.499 778 HD2 ARG 103 2HD ARG 103 -14.592 5.587 -25.539 779 HD3 ARG 103 3HD ARG 103 -15.343 5.237 -23.983 780 HE ARG 103 HE ARG 103 -16.979 4.504 -26.222 781 HH11 ARG 103 1HH1 ARG 103 -14.384 3.488 -24.136 782 HH12 ARG 103 2HH1 ARG 103 -14.661 1.798 -24.398 783 HH21 ARG 103 1HH2 ARG 103 -17.354 2.282 -26.575 784 HH22 ARG 103 2HH2 ARG 103 -16.350 1.113 -25.786 785 H THR 104 H THR 104 -14.051 7.881 -24.573 786 HA THR 104 HA THR 104 -12.551 5.972 -23.275 787 HB THR 104 HB THR 104 -11.016 8.154 -24.581 788 HG1 THR 104 HG1 THR 104 -11.848 7.105 -26.648 789 HG21 THR 104 3HG2 THR 104 -10.334 5.953 -25.887 790 HG22 THR 104 1HG2 THR 104 -11.022 5.179 -24.461 791 HG23 THR 104 2HG2 THR 104 -9.682 6.313 -24.289 792 H VAL 105 H VAL 105 -12.357 9.501 -22.902 793 HA VAL 105 HA VAL 105 -10.352 9.303 -20.837 794 HB VAL 105 HB VAL 105 -11.866 11.829 -21.206 795 HG11 VAL 105 1HG1 VAL 105 -9.633 12.795 -21.034 796 HG12 VAL 105 2HG1 VAL 105 -9.942 11.682 -19.700 797 HG13 VAL 105 3HG1 VAL 105 -8.924 11.181 -21.050 798 HG21 VAL 105 3HG2 VAL 105 -10.323 12.260 -23.237 799 HG22 VAL 105 1HG2 VAL 105 -10.265 10.502 -23.360 800 HG23 VAL 105 2HG2 VAL 105 -11.810 11.343 -23.478 801 H ILE 106 H ILE 106 -13.820 9.619 -21.031 802 HA ILE 106 HA ILE 106 -14.273 10.482 -18.370 803 HB ILE 106 HB ILE 106 -16.106 8.969 -20.235 804 HG12 ILE 106 2HG1 ILE 106 -15.178 11.690 -20.192 805 HG13 ILE 106 3HG1 ILE 106 -16.251 10.906 -21.347 806 HG21 ILE 106 1HG2 ILE 106 -16.720 10.470 -17.692 807 HG22 ILE 106 2HG2 ILE 106 -17.918 9.798 -18.797 808 HG23 ILE 106 3HG2 ILE 106 -16.821 8.725 -17.928 809 HD11 ILE 106 3HD1 ILE 106 -17.298 12.858 -20.375 810 HD12 ILE 106 1HD1 ILE 106 -18.155 11.393 -19.897 811 HD13 ILE 106 2HD1 ILE 106 -17.074 12.195 -18.756 812 H ALA 107 H ALA 107 -13.366 7.473 -19.701 813 HA ALA 107 HA ALA 107 -14.517 5.574 -18.094 814 HB1 ALA 107 1HB ALA 107 -12.135 4.469 -18.270 815 HB2 ALA 107 2HB ALA 107 -13.165 4.650 -19.691 816 HB3 ALA 107 3HB ALA 107 -11.853 5.793 -19.401 817 H GLY 108 H GLY 108 -12.304 8.053 -17.178 818 HA2 GLY 108 2HA GLY 108 -11.625 6.736 -14.660 819 HA3 GLY 108 3HA GLY 108 -10.971 8.258 -15.246 820 H TYR 109 H TYR 109 -13.647 9.319 -15.869 821 HA TYR 109 HA TYR 109 -14.148 10.786 -13.599 822 HB2 TYR 109 2HB TYR 109 -15.437 11.786 -15.132 823 HB3 TYR 109 3HB TYR 109 -15.459 10.339 -16.134 824 HD1 TYR 109 HD2 TYR 109 -17.201 12.172 -13.464 825 HD2 TYR 109 HD1 TYR 109 -17.319 8.816 -16.077 826 HE1 TYR 109 HE2 TYR 109 -19.576 11.840 -12.920 827 HE2 TYR 109 HE1 TYR 109 -19.695 8.475 -15.541 828 HH TYR 109 HH TYR 109 -21.407 10.653 -13.315 829 H ASN 110 H ASN 110 -15.786 7.806 -14.637 830 HA ASN 110 HA ASN 110 -17.660 7.577 -12.627 831 HB2 ASN 110 2HB ASN 110 -16.548 5.878 -14.630 832 HB3 ASN 110 3HB ASN 110 -16.613 4.971 -13.122 833 HD21 ASN 110 1HD2 ASN 110 -18.323 5.976 -15.804 834 HD22 ASN 110 2HD2 ASN 110 -19.918 5.593 -15.260 835 H LEU 111 H LEU 111 -14.252 7.349 -12.395 836 HA LEU 111 HA LEU 111 -14.330 5.926 -9.852 837 HB2 LEU 111 2HB LEU 111 -12.483 6.074 -11.918 838 HB3 LEU 111 3HB LEU 111 -11.755 7.016 -10.619 839 HG LEU 111 HG LEU 111 -11.018 4.662 -10.645 840 HD11 LEU 111 1HD1 LEU 111 -10.675 5.094 -8.498 841 HD12 LEU 111 2HD1 LEU 111 -12.252 4.386 -8.154 842 HD13 LEU 111 3HD1 LEU 111 -12.106 6.123 -8.421 843 HD21 LEU 111 3HD2 LEU 111 -13.790 3.919 -9.764 844 HD22 LEU 111 1HD2 LEU 111 -12.463 2.863 -10.246 845 HD23 LEU 111 2HD2 LEU 111 -13.296 3.839 -11.456 846 H TYR 112 H TYR 112 -13.799 9.136 -11.140 847 HA TYR 112 HA TYR 112 -12.575 10.486 -9.128 848 HB2 TYR 112 2HB TYR 112 -13.258 12.339 -10.213 849 HB3 TYR 112 3HB TYR 112 -13.970 11.220 -11.369 850 HD1 TYR 112 HD2 TYR 112 -14.809 12.910 -8.143 851 HD2 TYR 112 HD1 TYR 112 -16.206 11.466 -11.893 852 HE1 TYR 112 HE2 TYR 112 -17.034 13.843 -7.667 853 HE2 TYR 112 HE1 TYR 112 -18.435 12.396 -11.428 854 HH TYR 112 HH TYR 112 -19.088 14.652 -9.351 855 H ARG 113 H ARG 113 -15.988 9.546 -9.234 856 HA ARG 113 HA ARG 113 -16.460 10.646 -6.588 857 HB2 ARG 113 2HB ARG 113 -18.072 9.981 -8.845 858 HB3 ARG 113 3HB ARG 113 -18.647 9.050 -7.468 859 HG2 ARG 113 2HG ARG 113 -18.118 11.850 -6.843 860 HG3 ARG 113 3HG ARG 113 -19.366 11.614 -8.069 861 HD2 ARG 113 2HD ARG 113 -19.299 10.306 -5.351 862 HD3 ARG 113 3HD ARG 113 -20.301 11.685 -5.800 863 HE ARG 113 HE ARG 113 -20.839 9.625 -7.597 864 HH11 ARG 113 1HH1 ARG 113 -21.203 10.305 -4.202 865 HH12 ARG 113 2HH1 ARG 113 -22.606 9.306 -4.019 866 HH21 ARG 113 1HH2 ARG 113 -22.685 8.306 -7.368 867 HH22 ARG 113 2HH2 ARG 113 -23.448 8.168 -5.820 868 H ALA 114 H ALA 114 -15.732 7.606 -8.068 869 HA ALA 114 HA ALA 114 -16.739 5.758 -6.295 870 HB1 ALA 114 1HB ALA 114 -15.004 4.266 -7.014 871 HB2 ALA 114 2HB ALA 114 -15.505 5.247 -8.392 872 HB3 ALA 114 3HB ALA 114 -14.001 5.616 -7.548 873 H ILE 115 H ILE 115 -13.896 7.808 -5.945 874 HA ILE 115 HA ILE 115 -13.030 6.558 -3.508 875 HB ILE 115 HB ILE 115 -12.215 9.181 -4.764 876 HG12 ILE 115 2HG1 ILE 115 -11.621 7.271 -6.144 877 HG13 ILE 115 3HG1 ILE 115 -10.170 7.923 -5.391 878 HG21 ILE 115 1HG2 ILE 115 -11.552 7.940 -2.197 879 HG22 ILE 115 2HG2 ILE 115 -10.152 8.424 -3.153 880 HG23 ILE 115 3HG2 ILE 115 -11.383 9.613 -2.728 881 HD11 ILE 115 3HD1 ILE 115 -11.126 5.967 -3.637 882 HD12 ILE 115 1HD1 ILE 115 -11.261 5.282 -5.256 883 HD13 ILE 115 2HD1 ILE 115 -9.706 5.885 -4.680 884 H LYS 116 H LYS 116 -15.270 9.021 -4.360 885 HA LYS 116 HA LYS 116 -15.258 10.443 -1.889 886 HB2 LYS 116 2HB LYS 116 -16.401 10.821 -4.380 887 HB3 LYS 116 3HB LYS 116 -17.787 10.483 -3.351 888 HG2 LYS 116 2HG LYS 116 -15.712 12.595 -2.804 889 HG3 LYS 116 3HG LYS 116 -17.289 12.885 -3.544 890 HD2 LYS 116 2HD LYS 116 -16.831 11.727 -0.794 891 HD3 LYS 116 3HD LYS 116 -17.283 13.399 -1.139 892 HE2 LYS 116 2HE LYS 116 -18.899 10.926 -1.745 893 HE3 LYS 116 3HE LYS 116 -19.245 12.134 -0.509 894 HZ1 LYS 116 3HZ LYS 116 -20.457 13.165 -2.035 895 HZ2 LYS 116 1HZ LYS 116 -19.906 12.153 -3.274 896 HZ3 LYS 116 2HZ LYS 116 -19.028 13.539 -2.861 897 H LYS 117 H LYS 117 -17.198 7.795 -3.207 898 HA LYS 117 HA LYS 117 -18.977 7.636 -0.992 899 HB2 LYS 117 2HB LYS 117 -19.577 5.414 -1.958 900 HB3 LYS 117 3HB LYS 117 -19.672 6.739 -3.110 901 HG2 LYS 117 2HG LYS 117 -17.544 6.091 -4.074 902 HG3 LYS 117 3HG LYS 117 -17.377 4.801 -2.880 903 HD2 LYS 117 2HD LYS 117 -19.772 4.148 -3.870 904 HD3 LYS 117 3HD LYS 117 -19.100 4.960 -5.287 905 HE2 LYS 117 2HE LYS 117 -17.007 3.431 -4.648 906 HE3 LYS 117 3HE LYS 117 -18.290 2.428 -3.974 907 HZ1 LYS 117 3HZ LYS 117 -18.849 1.757 -5.996 908 HZ2 LYS 117 1HZ LYS 117 -17.494 2.564 -6.611 909 HZ3 LYS 117 2HZ LYS 117 -18.993 3.345 -6.562 910 H LYS 118 H LYS 118 -15.959 6.023 -1.843 911 HA LYS 118 HA LYS 118 -16.050 4.297 0.472 912 HB2 LYS 118 2HB LYS 118 -14.466 4.514 -1.954 913 HB3 LYS 118 3HB LYS 118 -13.454 4.243 -0.541 914 HG2 LYS 118 2HG LYS 118 -15.168 2.356 -0.015 915 HG3 LYS 118 3HG LYS 118 -15.552 2.491 -1.732 916 HD2 LYS 118 2HD LYS 118 -12.682 2.381 -1.102 917 HD3 LYS 118 3HD LYS 118 -13.588 0.917 -0.712 918 HE2 LYS 118 2HE LYS 118 -14.292 0.638 -2.943 919 HE3 LYS 118 3HE LYS 118 -13.819 2.278 -3.382 920 HZ1 LYS 118 3HZ LYS 118 -12.294 0.452 -4.141 921 HZ2 LYS 118 1HZ LYS 118 -11.862 0.228 -2.521 922 HZ3 LYS 118 2HZ LYS 118 -11.552 1.706 -3.282 Start of MODEL 5 1 H1 VAL 1 H VAL 1 3.704 -0.044 -2.505 2 HA VAL 1 HA VAL 1 2.264 2.452 -3.044 3 HB VAL 1 HB VAL 1 3.063 2.488 -5.369 4 HG11 VAL 1 1HG1 VAL 1 5.019 3.633 -4.926 5 HG12 VAL 1 2HG1 VAL 1 4.227 3.647 -3.349 6 HG13 VAL 1 3HG1 VAL 1 5.524 2.497 -3.676 7 HG21 VAL 1 3HG2 VAL 1 3.836 0.520 -6.130 8 HG22 VAL 1 1HG2 VAL 1 5.375 1.058 -5.458 9 HG23 VAL 1 2HG2 VAL 1 4.334 -0.018 -4.526 10 H TRP 2 H TRP 2 0.343 2.184 -4.053 11 HA TRP 2 HA TRP 2 -0.259 -0.326 -5.401 12 HB2 TRP 2 2HB TRP 2 -0.837 -0.656 -2.987 13 HB3 TRP 2 3HB TRP 2 -1.987 0.671 -3.128 14 HD1 TRP 2 HD1 TRP 2 -1.893 -1.528 -6.158 15 HE1 TRP 2 HE1 TRP 2 -3.979 -3.035 -6.207 16 HE3 TRP 2 HE3 TRP 2 -3.636 -0.655 -1.432 17 HZ2 TRP 2 HZ2 TRP 2 -6.085 -3.758 -4.471 18 HZ3 TRP 2 HZ3 TRP 2 -5.692 -1.793 -0.704 19 HH2 TRP 2 HH2 TRP 2 -6.890 -3.312 -2.194 20 HA PRO 3 HA PRO 3 -2.146 3.590 -7.185 21 HB2 PRO 3 2HB PRO 3 -0.923 3.418 -9.603 22 HB3 PRO 3 3HB PRO 3 -0.206 4.256 -8.222 23 HG2 PRO 3 2HG PRO 3 0.341 1.502 -9.259 24 HG3 PRO 3 3HG PRO 3 1.486 2.732 -8.695 25 HD2 PRO 3 2HD PRO 3 0.709 0.648 -7.150 26 HD3 PRO 3 3HD PRO 3 1.116 2.239 -6.474 27 H LEU 4 H LEU 4 -3.718 1.538 -6.864 28 HA LEU 4 HA LEU 4 -4.332 0.285 -9.422 29 HB2 LEU 4 2HB LEU 4 -5.667 -1.209 -8.259 30 HB3 LEU 4 3HB LEU 4 -4.346 -0.886 -7.138 31 HG LEU 4 HG LEU 4 -6.961 0.578 -6.945 32 HD11 LEU 4 1HD1 LEU 4 -7.891 -1.447 -6.594 33 HD12 LEU 4 2HD1 LEU 4 -7.167 -1.257 -4.997 34 HD13 LEU 4 3HD1 LEU 4 -6.347 -2.217 -6.229 35 HD21 LEU 4 3HD2 LEU 4 -6.113 0.447 -4.470 36 HD22 LEU 4 1HD2 LEU 4 -5.456 1.649 -5.580 37 HD23 LEU 4 2HD2 LEU 4 -4.548 0.176 -5.238 38 H VAL 5 H VAL 5 -5.608 2.690 -7.218 39 HA VAL 5 HA VAL 5 -8.066 2.989 -8.734 40 HB VAL 5 HB VAL 5 -8.623 4.752 -7.120 41 HG11 VAL 5 1HG1 VAL 5 -9.250 2.520 -6.530 42 HG12 VAL 5 2HG1 VAL 5 -7.627 2.167 -5.933 43 HG13 VAL 5 3HG1 VAL 5 -8.652 3.320 -5.077 44 HG21 VAL 5 3HG2 VAL 5 -7.105 5.115 -5.178 45 HG22 VAL 5 1HG2 VAL 5 -5.869 4.192 -6.032 46 HG23 VAL 5 2HG2 VAL 5 -6.461 5.709 -6.708 47 H ILE 6 H ILE 6 -5.027 4.692 -8.237 48 HA ILE 6 HA ILE 6 -5.707 7.081 -9.567 49 HB ILE 6 HB ILE 6 -3.344 7.537 -9.700 50 HG12 ILE 6 2HG1 ILE 6 -1.904 5.512 -8.658 51 HG13 ILE 6 3HG1 ILE 6 -3.152 4.584 -9.482 52 HG21 ILE 6 1HG2 ILE 6 -4.672 6.705 -7.297 53 HG22 ILE 6 2HG2 ILE 6 -2.941 6.393 -7.172 54 HG23 ILE 6 3HG2 ILE 6 -3.520 8.018 -7.539 55 HD11 ILE 6 3HD1 ILE 6 -0.846 5.876 -10.560 56 HD12 ILE 6 1HD1 ILE 6 -2.001 4.804 -11.353 57 HD13 ILE 6 2HD1 ILE 6 -2.302 6.542 -11.299 58 H ARG 7 H ARG 7 -4.616 3.964 -10.716 59 HA ARG 7 HA ARG 7 -3.980 4.837 -13.363 60 HB2 ARG 7 2HB ARG 7 -3.969 2.391 -13.881 61 HB3 ARG 7 3HB ARG 7 -2.926 2.845 -12.540 62 HG2 ARG 7 2HG ARG 7 -4.547 2.035 -10.949 63 HG3 ARG 7 3HG ARG 7 -5.689 1.686 -12.248 64 HD2 ARG 7 2HD ARG 7 -3.472 0.325 -13.068 65 HD3 ARG 7 3HD ARG 7 -3.362 0.166 -11.315 66 HE ARG 7 HE ARG 7 -5.103 -1.300 -11.404 67 HH11 ARG 7 1HH1 ARG 7 -5.156 0.654 -14.285 68 HH12 ARG 7 2HH1 ARG 7 -6.464 -0.221 -15.011 69 HH21 ARG 7 1HH2 ARG 7 -6.825 -2.459 -12.349 70 HH22 ARG 7 2HH2 ARG 7 -7.413 -1.990 -13.908 71 H THR 8 H THR 8 -6.866 3.874 -11.719 72 HA THR 8 HA THR 8 -8.486 2.948 -13.745 73 HB THR 8 HB THR 8 -9.609 4.904 -11.772 74 HG1 THR 8 HG1 THR 8 -8.645 2.285 -11.183 75 HG21 THR 8 3HG2 THR 8 -11.443 4.010 -12.710 76 HG22 THR 8 1HG2 THR 8 -11.091 2.599 -11.715 77 HG23 THR 8 2HG2 THR 8 -10.545 2.654 -13.391 78 H VAL 9 H VAL 9 -8.192 6.351 -12.705 79 HA VAL 9 HA VAL 9 -9.728 7.382 -14.848 80 HB VAL 9 HB VAL 9 -7.639 8.923 -13.319 81 HG11 VAL 9 1HG1 VAL 9 -8.551 10.762 -14.203 82 HG12 VAL 9 2HG1 VAL 9 -9.305 9.673 -15.370 83 HG13 VAL 9 3HG1 VAL 9 -10.194 10.182 -13.934 84 HG21 VAL 9 3HG2 VAL 9 -9.984 9.418 -12.016 85 HG22 VAL 9 1HG2 VAL 9 -10.122 7.696 -12.370 86 HG23 VAL 9 2HG2 VAL 9 -8.736 8.301 -11.462 87 H ILE 10 H ILE 10 -6.281 6.836 -14.392 88 HA ILE 10 HA ILE 10 -5.305 8.277 -16.577 89 HB ILE 10 HB ILE 10 -4.189 5.692 -15.484 90 HG12 ILE 10 2HG1 ILE 10 -4.603 8.044 -14.095 91 HG13 ILE 10 3HG1 ILE 10 -3.435 6.795 -13.675 92 HG21 ILE 10 1HG2 ILE 10 -2.966 7.910 -17.114 93 HG22 ILE 10 2HG2 ILE 10 -2.029 6.661 -16.295 94 HG23 ILE 10 3HG2 ILE 10 -3.162 6.218 -17.571 95 HD11 ILE 10 3HD1 ILE 10 -1.683 7.966 -14.786 96 HD12 ILE 10 1HD1 ILE 10 -2.820 9.133 -15.462 97 HD13 ILE 10 2HD1 ILE 10 -2.516 9.101 -13.724 98 H ALA 11 H ALA 11 -7.116 5.367 -16.465 99 HA ALA 11 HA ALA 11 -6.346 3.937 -18.668 100 HB1 ALA 11 1HB ALA 11 -8.824 3.395 -18.924 101 HB2 ALA 11 2HB ALA 11 -8.078 3.043 -17.364 102 HB3 ALA 11 3HB ALA 11 -9.082 4.481 -17.557 103 H GLY 12 H GLY 12 -7.825 7.072 -18.585 104 HA2 GLY 12 2HA GLY 12 -8.428 6.995 -21.447 105 HA3 GLY 12 3HA GLY 12 -8.864 8.280 -20.330 106 H TYR 13 H TYR 13 -6.146 8.417 -19.210 107 HA TYR 13 HA TYR 13 -5.102 10.476 -20.731 108 HB2 TYR 13 2HB TYR 13 -4.345 10.280 -18.499 109 HB3 TYR 13 3HB TYR 13 -3.818 8.618 -18.737 110 HD1 TYR 13 HD2 TYR 13 -3.121 11.476 -20.990 111 HD2 TYR 13 HD1 TYR 13 -1.557 8.795 -18.081 112 HE1 TYR 13 HE2 TYR 13 -0.848 12.273 -21.487 113 HE2 TYR 13 HE1 TYR 13 0.721 9.585 -18.568 114 HH TYR 13 HH TYR 13 1.402 12.363 -20.154 115 H ASN 14 H ASN 14 -4.116 7.058 -20.704 116 HA ASN 14 HA ASN 14 -2.015 7.114 -22.460 117 HB2 ASN 14 2HB ASN 14 -4.160 4.983 -22.494 118 HB3 ASN 14 3HB ASN 14 -2.464 4.799 -22.934 119 HD21 ASN 14 1HD2 ASN 14 -4.612 4.084 -20.635 120 HD22 ASN 14 2HD2 ASN 14 -3.583 4.022 -19.249 121 H LEU 15 H LEU 15 -5.326 7.752 -23.127 122 HA LEU 15 HA LEU 15 -4.977 7.428 -26.006 123 HB2 LEU 15 2HB LEU 15 -7.175 7.303 -24.206 124 HB3 LEU 15 3HB LEU 15 -7.485 8.595 -25.364 125 HG LEU 15 HG LEU 15 -8.502 6.580 -26.164 126 HD11 LEU 15 1HD1 LEU 15 -7.612 6.496 -28.335 127 HD12 LEU 15 2HD1 LEU 15 -5.987 6.888 -27.775 128 HD13 LEU 15 3HD1 LEU 15 -7.249 8.120 -27.750 129 HD21 LEU 15 3HD2 LEU 15 -6.100 5.364 -25.123 130 HD22 LEU 15 1HD2 LEU 15 -6.412 4.848 -26.780 131 HD23 LEU 15 2HD2 LEU 15 -7.647 4.625 -25.540 132 H TYR 16 H TYR 16 -5.426 9.933 -23.581 133 HA TYR 16 HA TYR 16 -5.971 12.136 -25.133 134 HB2 TYR 16 2HB TYR 16 -4.988 11.649 -22.488 135 HB3 TYR 16 3HB TYR 16 -4.066 12.967 -23.202 136 HD1 TYR 16 HD2 TYR 16 -5.273 14.995 -24.035 137 HD2 TYR 16 HD1 TYR 16 -7.235 11.957 -21.793 138 HE1 TYR 16 HE2 TYR 16 -7.112 16.552 -23.544 139 HE2 TYR 16 HE1 TYR 16 -9.080 13.506 -21.297 140 HH TYR 16 HH TYR 16 -9.697 16.211 -22.929 141 H ARG 17 H ARG 17 -2.803 10.701 -24.438 142 HA ARG 17 HA ARG 17 -1.410 12.626 -26.067 143 HB2 ARG 17 2HB ARG 17 -0.696 10.406 -24.280 144 HB3 ARG 17 3HB ARG 17 0.369 10.581 -25.669 145 HG2 ARG 17 2HG ARG 17 0.298 13.126 -24.905 146 HG3 ARG 17 3HG ARG 17 -0.035 12.368 -23.347 147 HD2 ARG 17 2HD ARG 17 2.188 12.187 -23.166 148 HD3 ARG 17 3HD ARG 17 2.027 10.848 -24.302 149 HE ARG 17 HE ARG 17 2.267 13.329 -25.664 150 HH11 ARG 17 1HH1 ARG 17 4.100 10.925 -23.938 151 HH12 ARG 17 2HH1 ARG 17 5.583 11.277 -24.762 152 HH21 ARG 17 1HH2 ARG 17 4.213 13.801 -26.756 153 HH22 ARG 17 2HH2 ARG 17 5.646 12.913 -26.364 154 H ALA 18 H ALA 18 -2.964 9.603 -26.552 155 HA ALA 18 HA ALA 18 -1.609 8.433 -28.630 156 HB1 ALA 18 1HB ALA 18 -3.694 7.596 -27.497 157 HB2 ALA 18 2HB ALA 18 -4.608 8.666 -28.561 158 HB3 ALA 18 3HB ALA 18 -3.634 7.364 -29.244 159 H ILE 19 H ILE 19 -3.816 11.189 -28.764 160 HA ILE 19 HA ILE 19 -3.672 11.394 -31.632 161 HB ILE 19 HB ILE 19 -4.970 12.984 -29.465 162 HG12 ILE 19 2HG1 ILE 19 -6.960 12.594 -30.804 163 HG13 ILE 19 3HG1 ILE 19 -5.987 11.936 -32.116 164 HG21 ILE 19 1HG2 ILE 19 -4.305 13.991 -32.213 165 HG22 ILE 19 2HG2 ILE 19 -5.685 14.604 -31.304 166 HG23 ILE 19 3HG2 ILE 19 -4.055 14.782 -30.657 167 HD11 ILE 19 3HD1 ILE 19 -5.346 10.059 -30.711 168 HD12 ILE 19 1HD1 ILE 19 -6.290 10.724 -29.378 169 HD13 ILE 19 2HD1 ILE 19 -7.100 10.183 -30.849 170 H LYS 20 H LYS 20 -1.933 12.661 -28.917 171 HA LYS 20 HA LYS 20 -0.798 14.940 -30.134 172 HB2 LYS 20 2HB LYS 20 0.272 13.198 -27.905 173 HB3 LYS 20 3HB LYS 20 0.906 14.780 -28.339 174 HG2 LYS 20 2HG LYS 20 -1.869 14.202 -27.323 175 HG3 LYS 20 3HG LYS 20 -0.547 14.922 -26.401 176 HD2 LYS 20 2HD LYS 20 -1.324 16.905 -27.067 177 HD3 LYS 20 3HD LYS 20 -0.717 16.498 -28.674 178 HE2 LYS 20 2HE LYS 20 -3.034 15.230 -28.829 179 HE3 LYS 20 3HE LYS 20 -3.491 16.413 -27.604 180 HZ1 LYS 20 3HZ LYS 20 -2.551 16.920 -30.364 181 HZ2 LYS 20 1HZ LYS 20 -2.581 18.133 -29.186 182 HZ3 LYS 20 2HZ LYS 20 -4.018 17.378 -29.659 183 H LYS 21 H LYS 21 0.032 11.547 -30.202 184 HA LYS 21 HA LYS 21 2.588 12.019 -31.482 185 HB2 LYS 21 2HB LYS 21 1.097 9.435 -30.982 186 HB3 LYS 21 3HB LYS 21 2.756 9.567 -31.552 187 HG2 LYS 21 2HG LYS 21 3.566 10.013 -29.503 188 HG3 LYS 21 3HG LYS 21 2.165 10.983 -29.042 189 HD2 LYS 21 2HD LYS 21 0.862 8.927 -28.721 190 HD3 LYS 21 3HD LYS 21 2.278 7.968 -29.161 191 HE2 LYS 21 2HE LYS 21 2.238 9.920 -26.867 192 HE3 LYS 21 3HE LYS 21 1.850 8.209 -26.691 193 HZ1 LYS 21 3HZ LYS 21 4.001 7.775 -26.546 194 HZ2 LYS 21 1HZ LYS 21 4.373 9.417 -26.719 195 HZ3 LYS 21 2HZ LYS 21 4.267 8.425 -28.085 196 H LYS 22 H LYS 22 -0.633 10.882 -32.367 197 HA LYS 22 HA LYS 22 -1.632 10.503 -34.377 198 HB2 LYS 22 2HB LYS 22 -0.875 12.983 -34.481 199 HB3 LYS 22 3HB LYS 22 0.342 12.403 -35.610 200 HG2 LYS 22 2HG LYS 22 -1.177 12.723 -37.197 201 HG3 LYS 22 3HG LYS 22 -1.988 11.287 -36.565 202 HD2 LYS 22 2HD LYS 22 -3.378 12.655 -35.135 203 HD3 LYS 22 3HD LYS 22 -2.507 14.109 -35.629 204 HE2 LYS 22 2HE LYS 22 -3.657 12.495 -37.812 205 HE3 LYS 22 3HE LYS 22 -4.821 13.278 -36.745 206 HZ1 LYS 22 3HZ LYS 22 -2.624 14.636 -38.212 207 HZ2 LYS 22 1HZ LYS 22 -3.721 15.394 -37.169 208 HZ3 LYS 22 2HZ LYS 22 -4.268 14.696 -38.609 209 H GLY 23 H GLY 23 0.442 8.695 -33.691 210 HA2 GLY 23 2HA GLY 23 1.043 7.686 -36.353 211 HA3 GLY 23 3HA GLY 23 2.435 8.053 -35.346 212 H GLY 24 H GLY 24 1.431 7.235 -32.856 213 HA2 GLY 24 2HA GLY 24 0.479 5.256 -31.832 214 HA3 GLY 24 3HA GLY 24 0.899 4.366 -33.288 215 H GLY 25 H GLY 25 1.606 3.366 -30.844 216 HA2 GLY 25 2HA GLY 25 3.667 2.216 -30.385 217 HA3 GLY 25 3HA GLY 25 4.537 3.630 -30.962 218 H GLY 26 H GLY 26 3.327 2.001 -28.250 219 HA2 GLY 26 2HA GLY 26 4.532 3.896 -26.468 220 HA3 GLY 26 3HA GLY 26 2.777 3.923 -26.376 221 H GLY 27 H GLY 27 3.717 3.323 -24.084 222 HA2 GLY 27 2HA GLY 27 2.734 1.125 -23.064 223 HA3 GLY 27 3HA GLY 27 4.128 0.427 -23.876 224 H GLY 28 H GLY 28 3.244 2.956 -21.535 225 HA2 GLY 28 2HA GLY 28 4.180 3.202 -19.394 226 HA3 GLY 28 3HA GLY 28 5.477 2.112 -19.859 227 H GLY 29 H GLY 29 5.604 4.734 -18.539 228 HA2 GLY 29 2HA GLY 29 7.080 6.501 -18.570 229 HA3 GLY 29 3HA GLY 29 7.793 5.801 -20.015 230 H GLY 30 H GLY 30 7.453 8.567 -19.616 231 HA2 GLY 30 2HA GLY 30 6.080 9.231 -22.038 232 HA3 GLY 30 3HA GLY 30 5.193 9.766 -20.618 233 H GLY 31 H GLY 31 5.633 11.865 -21.820 234 HA2 GLY 31 2HA GLY 31 7.768 13.218 -20.442 235 HA3 GLY 31 3HA GLY 31 8.043 13.085 -22.172 236 H GLY 32 H GLY 32 7.991 15.409 -22.237 237 HA2 GLY 32 2HA GLY 32 5.476 16.430 -23.025 238 HA3 GLY 32 3HA GLY 32 5.853 16.998 -21.405 239 H VAL 33 H VAL 33 6.162 17.643 -24.660 240 HA VAL 33 HA VAL 33 7.940 19.871 -24.113 241 HB VAL 33 HB VAL 33 9.358 19.339 -26.124 242 HG11 VAL 33 1HG1 VAL 33 10.845 17.845 -24.915 243 HG12 VAL 33 2HG1 VAL 33 10.154 19.043 -23.819 244 HG13 VAL 33 3HG1 VAL 33 9.533 17.392 -23.827 245 HG21 VAL 33 3HG2 VAL 33 8.428 16.506 -25.769 246 HG22 VAL 33 1HG2 VAL 33 7.682 17.590 -26.943 247 HG23 VAL 33 2HG2 VAL 33 9.396 17.196 -27.071 248 H TRP 34 H TRP 34 5.125 19.354 -24.950 249 HA TRP 34 HA TRP 34 4.766 21.488 -26.685 250 HB2 TRP 34 2HB TRP 34 5.599 20.471 -28.573 251 HB3 TRP 34 3HB TRP 34 5.152 18.856 -28.030 252 HD1 TRP 34 HD1 TRP 34 2.895 21.950 -28.691 253 HE1 TRP 34 HE1 TRP 34 1.047 21.239 -30.336 254 HE3 TRP 34 HE3 TRP 34 4.373 17.130 -29.537 255 HZ2 TRP 34 HZ2 TRP 34 0.313 18.939 -31.798 256 HZ3 TRP 34 HZ3 TRP 34 3.043 15.741 -31.072 257 HH2 TRP 34 HH2 TRP 34 1.055 16.628 -32.177 258 HA PRO 35 HA PRO 35 0.647 18.973 -26.440 259 HB2 PRO 35 2HB PRO 35 0.758 16.514 -25.295 260 HB3 PRO 35 3HB PRO 35 0.995 16.779 -27.026 261 HG2 PRO 35 2HG PRO 35 3.037 16.391 -24.872 262 HG3 PRO 35 3HG PRO 35 2.987 15.699 -26.504 263 HD2 PRO 35 2HD PRO 35 4.540 17.825 -25.869 264 HD3 PRO 35 3HD PRO 35 3.818 17.617 -27.477 265 H LEU 36 H LEU 36 0.368 20.621 -24.854 266 HA LEU 36 HA LEU 36 0.875 19.952 -22.071 267 HB2 LEU 36 2HB LEU 36 0.104 22.218 -21.601 268 HB3 LEU 36 3HB LEU 36 1.373 22.201 -22.824 269 HG LEU 36 HG LEU 36 -1.155 22.142 -24.140 270 HD11 LEU 36 1HD1 LEU 36 -0.879 24.484 -22.272 271 HD12 LEU 36 2HD1 LEU 36 -1.940 23.111 -21.957 272 HD13 LEU 36 3HD1 LEU 36 -2.207 24.124 -23.376 273 HD21 LEU 36 3HD2 LEU 36 -0.188 24.549 -24.719 274 HD22 LEU 36 1HD2 LEU 36 0.498 23.071 -25.393 275 HD23 LEU 36 2HD2 LEU 36 1.267 23.848 -24.009 276 H VAL 37 H VAL 37 -1.752 20.045 -24.331 277 HA VAL 37 HA VAL 37 -3.971 20.294 -22.717 278 HB VAL 37 HB VAL 37 -5.134 18.776 -24.353 279 HG11 VAL 37 1HG1 VAL 37 -3.846 20.514 -26.231 280 HG12 VAL 37 2HG1 VAL 37 -5.455 20.640 -25.517 281 HG13 VAL 37 3HG1 VAL 37 -4.067 21.353 -24.696 282 HG21 VAL 37 3HG2 VAL 37 -3.378 17.272 -24.943 283 HG22 VAL 37 1HG2 VAL 37 -3.803 18.184 -26.392 284 HG23 VAL 37 2HG2 VAL 37 -2.347 18.597 -25.485 285 H ILE 38 H ILE 38 -2.006 17.414 -23.314 286 HA ILE 38 HA ILE 38 -3.624 15.578 -21.929 287 HB ILE 38 HB ILE 38 -1.501 14.231 -21.709 288 HG12 ILE 38 2HG1 ILE 38 0.006 15.776 -23.616 289 HG13 ILE 38 3HG1 ILE 38 -0.324 16.750 -22.188 290 HG21 ILE 38 1HG2 ILE 38 -1.584 14.997 -24.546 291 HG22 ILE 38 2HG2 ILE 38 -1.833 13.426 -23.784 292 HG23 ILE 38 3HG2 ILE 38 -3.145 14.604 -23.824 293 HD11 ILE 38 3HD1 ILE 38 1.794 15.164 -22.395 294 HD12 ILE 38 1HD1 ILE 38 0.994 15.487 -20.857 295 HD13 ILE 38 2HD1 ILE 38 0.647 13.997 -21.736 296 H ARG 39 H ARG 39 -1.205 17.860 -20.850 297 HA ARG 39 HA ARG 39 -0.844 16.779 -18.248 298 HB2 ARG 39 2HB ARG 39 0.627 18.474 -17.945 299 HB3 ARG 39 3HB ARG 39 0.457 18.657 -19.686 300 HG2 ARG 39 2HG ARG 39 -1.497 20.258 -19.043 301 HG3 ARG 39 3HG ARG 39 -0.667 20.324 -17.487 302 HD2 ARG 39 2HD ARG 39 0.667 20.866 -20.134 303 HD3 ARG 39 3HD ARG 39 -0.017 22.122 -19.103 304 HE ARG 39 HE ARG 39 1.753 20.605 -17.565 305 HH11 ARG 39 1HH1 ARG 39 1.814 22.790 -20.275 306 HH12 ARG 39 2HH1 ARG 39 3.413 23.368 -19.941 307 HH21 ARG 39 1HH2 ARG 39 3.858 21.358 -17.114 308 HH22 ARG 39 2HH2 ARG 39 4.575 22.552 -18.143 309 H THR 40 H THR 40 -3.251 18.798 -19.694 310 HA THR 40 HA THR 40 -4.275 20.212 -17.564 311 HB THR 40 HB THR 40 -6.087 18.850 -19.544 312 HG1 THR 40 HG1 THR 40 -4.476 21.164 -19.979 313 HG21 THR 40 3HG2 THR 40 -6.724 21.549 -19.245 314 HG22 THR 40 1HG2 THR 40 -6.318 20.997 -17.621 315 HG23 THR 40 2HG2 THR 40 -7.578 20.175 -18.542 316 H VAL 41 H VAL 41 -5.385 16.990 -18.630 317 HA VAL 41 HA VAL 41 -7.037 16.558 -16.374 318 HB VAL 41 HB VAL 41 -5.818 14.473 -18.187 319 HG11 VAL 41 1HG1 VAL 41 -7.592 13.038 -17.483 320 HG12 VAL 41 2HG1 VAL 41 -6.816 13.679 -16.033 321 HG13 VAL 41 3HG1 VAL 41 -8.359 14.340 -16.575 322 HG21 VAL 41 3HG2 VAL 41 -7.877 14.640 -19.488 323 HG22 VAL 41 1HG2 VAL 41 -8.436 15.948 -18.446 324 HG23 VAL 41 2HG2 VAL 41 -7.017 16.179 -19.467 325 H ILE 42 H ILE 42 -3.736 15.545 -17.162 326 HA ILE 42 HA ILE 42 -3.264 13.868 -14.993 327 HB ILE 42 HB ILE 42 -1.212 15.708 -16.221 328 HG12 ILE 42 2HG1 ILE 42 -2.796 13.896 -17.596 329 HG13 ILE 42 3HG1 ILE 42 -1.242 14.525 -18.131 330 HG21 ILE 42 1HG2 ILE 42 -1.014 13.054 -14.809 331 HG22 ILE 42 2HG2 ILE 42 0.320 13.823 -15.668 332 HG23 ILE 42 3HG2 ILE 42 -0.391 14.609 -14.259 333 HD11 ILE 42 3HD1 ILE 42 -0.099 12.623 -17.248 334 HD12 ILE 42 1HD1 ILE 42 -1.576 12.031 -16.487 335 HD13 ILE 42 2HD1 ILE 42 -1.439 12.059 -18.245 336 H ALA 43 H ALA 43 -3.394 17.338 -15.166 337 HA ALA 43 HA ALA 43 -1.945 18.164 -12.993 338 HB1 ALA 43 1HB ALA 43 -3.251 19.594 -14.602 339 HB2 ALA 43 2HB ALA 43 -4.680 19.245 -13.628 340 HB3 ALA 43 3HB ALA 43 -3.312 20.098 -12.913 341 H GLY 44 H GLY 44 -4.871 16.305 -13.019 342 HA2 GLY 44 2HA GLY 44 -5.303 16.730 -10.155 343 HA3 GLY 44 3HA GLY 44 -6.379 15.875 -11.249 344 H TYR 45 H TYR 45 -4.157 14.292 -12.379 345 HA TYR 45 HA TYR 45 -4.378 12.005 -10.834 346 HB2 TYR 45 2HB TYR 45 -3.660 11.658 -13.031 347 HB3 TYR 45 3HB TYR 45 -2.396 12.877 -12.914 348 HD1 TYR 45 HD2 TYR 45 -3.173 9.960 -10.720 349 HD2 TYR 45 HD1 TYR 45 -0.388 11.804 -13.355 350 HE1 TYR 45 HE2 TYR 45 -1.532 8.202 -10.206 351 HE2 TYR 45 HE1 TYR 45 1.261 10.050 -12.849 352 HH TYR 45 HH TYR 45 1.434 7.881 -11.983 353 H ASN 46 H ASN 46 -1.689 14.334 -10.932 354 HA ASN 46 HA ASN 46 0.044 13.155 -9.156 355 HB2 ASN 46 2HB ASN 46 0.131 15.445 -10.488 356 HB3 ASN 46 3HB ASN 46 -0.378 16.104 -8.935 357 HD21 ASN 46 1HD2 ASN 46 1.136 16.535 -7.493 358 HD22 ASN 46 2HD2 ASN 46 2.769 15.976 -7.547 359 H LEU 47 H LEU 47 -3.026 14.594 -8.510 360 HA LEU 47 HA LEU 47 -2.541 14.783 -5.648 361 HB2 LEU 47 2HB LEU 47 -4.556 15.756 -7.535 362 HB3 LEU 47 3HB LEU 47 -5.218 15.217 -5.993 363 HG LEU 47 HG LEU 47 -4.736 17.666 -6.140 364 HD11 LEU 47 1HD1 LEU 47 -3.913 15.799 -4.063 365 HD12 LEU 47 2HD1 LEU 47 -4.841 17.294 -3.944 366 HD13 LEU 47 3HD1 LEU 47 -3.078 17.350 -3.973 367 HD21 LEU 47 3HD2 LEU 47 -1.848 17.087 -5.753 368 HD22 LEU 47 1HD2 LEU 47 -2.640 18.517 -6.417 369 HD23 LEU 47 2HD2 LEU 47 -2.486 17.058 -7.397 370 H TYR 48 H TYR 48 -4.318 12.796 -7.943 371 HA TYR 48 HA TYR 48 -5.961 11.332 -6.315 372 HB2 TYR 48 2HB TYR 48 -4.928 11.077 -8.936 373 HB3 TYR 48 3HB TYR 48 -4.688 9.523 -8.145 374 HD1 TYR 48 HD2 TYR 48 -6.913 8.947 -6.583 375 HD2 TYR 48 HD1 TYR 48 -6.836 11.164 -10.214 376 HE1 TYR 48 HE2 TYR 48 -9.274 8.378 -6.974 377 HE2 TYR 48 HE1 TYR 48 -9.197 10.603 -10.614 378 HH TYR 48 HH TYR 48 -11.125 8.943 -8.200 379 H ARG 49 H ARG 49 -2.518 10.746 -6.948 380 HA ARG 49 HA ARG 49 -2.406 8.502 -5.156 381 HB2 ARG 49 2HB ARG 49 -0.531 9.927 -6.943 382 HB3 ARG 49 3HB ARG 49 0.193 9.168 -5.531 383 HG2 ARG 49 2HG ARG 49 -1.247 7.108 -6.322 384 HG3 ARG 49 3HG ARG 49 -1.138 7.933 -7.879 385 HD2 ARG 49 2HD ARG 49 0.665 6.318 -7.629 386 HD3 ARG 49 3HD ARG 49 1.301 7.962 -7.690 387 HE ARG 49 HE ARG 49 0.939 7.305 -5.011 388 HH11 ARG 49 1HH1 ARG 49 2.873 6.270 -7.714 389 HH12 ARG 49 2HH1 ARG 49 4.201 5.748 -6.732 390 HH21 ARG 49 1HH2 ARG 49 2.680 6.621 -3.707 391 HH22 ARG 49 2HH2 ARG 49 4.090 5.947 -4.452 392 H ALA 50 H ALA 50 -2.016 11.922 -4.905 393 HA ALA 50 HA ALA 50 -0.320 12.237 -2.758 394 HB1 ALA 50 1HB ALA 50 -1.499 14.022 -4.139 395 HB2 ALA 50 2HB ALA 50 -2.855 13.826 -3.026 396 HB3 ALA 50 3HB ALA 50 -1.284 14.350 -2.419 397 H ILE 51 H ILE 51 -3.727 11.312 -2.745 398 HA ILE 51 HA ILE 51 -3.863 11.279 0.141 399 HB ILE 51 HB ILE 51 -5.847 10.284 -1.908 400 HG12 ILE 51 2HG1 ILE 51 -5.461 12.704 -2.043 401 HG13 ILE 51 3HG1 ILE 51 -7.066 12.358 -1.408 402 HG21 ILE 51 1HG2 ILE 51 -5.755 10.118 1.001 403 HG22 ILE 51 2HG2 ILE 51 -7.233 10.857 0.387 404 HG23 ILE 51 3HG2 ILE 51 -6.763 9.246 -0.154 405 HD11 ILE 51 3HD1 ILE 51 -5.013 13.943 -0.276 406 HD12 ILE 51 1HD1 ILE 51 -6.632 13.623 0.346 407 HD13 ILE 51 2HD1 ILE 51 -5.293 12.564 0.787 408 H LYS 52 H LYS 52 -3.002 9.102 -2.362 409 HA LYS 52 HA LYS 52 -3.601 6.673 -0.977 410 HB2 LYS 52 2HB LYS 52 -2.828 7.365 -3.565 411 HB3 LYS 52 3HB LYS 52 -1.465 6.450 -2.933 412 HG2 LYS 52 2HG LYS 52 -4.298 5.457 -2.795 413 HG3 LYS 52 3HG LYS 52 -3.225 5.128 -4.158 414 HD2 LYS 52 2HD LYS 52 -2.500 4.475 -1.309 415 HD3 LYS 52 3HD LYS 52 -3.341 3.340 -2.368 416 HE2 LYS 52 2HE LYS 52 -1.357 2.695 -3.135 417 HE3 LYS 52 3HE LYS 52 -1.176 4.291 -3.860 418 HZ1 LYS 52 3HZ LYS 52 0.705 3.725 -2.445 419 HZ2 LYS 52 1HZ LYS 52 -0.324 3.545 -1.114 420 HZ3 LYS 52 2HZ LYS 52 -0.129 5.064 -1.832 421 H LYS 53 H LYS 53 -0.879 8.852 -1.122 422 HA LYS 53 HA LYS 53 0.896 7.016 0.245 423 HB2 LYS 53 2HB LYS 53 2.503 8.889 0.177 424 HB3 LYS 53 3HB LYS 53 1.843 8.520 -1.410 425 HG2 LYS 53 2HG LYS 53 0.286 10.406 -1.183 426 HG3 LYS 53 3HG LYS 53 1.003 10.789 0.384 427 HD2 LYS 53 2HD LYS 53 2.022 12.235 -1.196 428 HD3 LYS 53 3HD LYS 53 3.216 10.993 -0.813 429 HE2 LYS 53 2HE LYS 53 3.025 9.984 -2.872 430 HE3 LYS 53 3HE LYS 53 1.385 10.578 -3.129 431 HZ1 LYS 53 3HZ LYS 53 3.385 11.606 -4.417 432 HZ2 LYS 53 1HZ LYS 53 3.585 12.515 -3.004 433 HZ3 LYS 53 2HZ LYS 53 2.130 12.594 -3.862 434 H LYS 54 H LYS 54 -0.954 9.930 0.983 435 HA LYS 54 HA LYS 54 0.033 10.297 3.607 436 HB2 LYS 54 2HB LYS 54 -2.297 11.292 2.043 437 HB3 LYS 54 3HB LYS 54 -2.363 11.455 3.793 438 HG2 LYS 54 2HG LYS 54 -0.070 12.557 3.605 439 HG3 LYS 54 3HG LYS 54 -0.404 12.668 1.875 440 HD2 LYS 54 2HD LYS 54 -2.698 13.583 3.284 441 HD3 LYS 54 3HD LYS 54 -1.279 14.384 3.963 442 HE2 LYS 54 2HE LYS 54 -0.723 15.383 1.947 443 HE3 LYS 54 3HE LYS 54 -1.630 14.207 0.998 444 HZ1 LYS 54 3HZ LYS 54 -2.754 16.332 1.032 445 HZ2 LYS 54 1HZ LYS 54 -2.798 16.324 2.724 446 HZ3 LYS 54 2HZ LYS 54 -3.683 15.178 1.849 447 H GLY 55 H GLY 55 -3.007 8.835 2.441 448 HA2 GLY 55 2HA GLY 55 -3.718 6.712 3.400 449 HA3 GLY 55 3HA GLY 55 -3.062 7.258 4.936 450 H GLY 56 H GLY 56 -4.883 9.424 2.906 451 HA2 GLY 56 2HA GLY 56 -6.809 9.812 5.020 452 HA3 GLY 56 3HA GLY 56 -6.741 10.681 3.494 453 H GLY 57 H GLY 57 -6.773 8.297 1.843 454 HA2 GLY 57 2HA GLY 57 -9.260 6.943 2.489 455 HA3 GLY 57 3HA GLY 57 -9.334 8.028 1.108 456 H GLY 58 H GLY 58 -9.445 4.986 1.531 457 HA2 GLY 58 2HA GLY 58 -8.581 4.135 -0.916 458 HA3 GLY 58 3HA GLY 58 -7.160 3.983 0.107 459 H GLY 59 H GLY 59 -10.454 2.875 -0.418 460 HA2 GLY 59 2HA GLY 59 -11.242 0.700 -0.124 461 HA3 GLY 59 3HA GLY 59 -9.746 0.296 0.705 462 H GLY 60 H GLY 60 -12.724 2.202 1.123 463 HA2 GLY 60 2HA GLY 60 -14.185 1.778 2.988 464 HA3 GLY 60 3HA GLY 60 -12.781 1.283 3.920 465 H GLY 61 H GLY 61 -14.109 2.875 5.356 466 HA2 GLY 61 2HA GLY 61 -13.429 4.787 6.609 467 HA3 GLY 61 3HA GLY 61 -12.733 5.462 5.142 468 H GLY 62 H GLY 62 -14.723 6.499 7.157 469 HA2 GLY 62 2HA GLY 62 -17.123 6.810 5.524 470 HA3 GLY 62 3HA GLY 62 -16.911 7.363 7.179 471 H GLY 63 H GLY 63 -18.001 9.291 6.179 472 HA2 GLY 63 2HA GLY 63 -16.012 11.303 5.690 473 HA3 GLY 63 3HA GLY 63 -16.975 10.950 4.263 474 H GLY 64 H GLY 64 -16.738 13.345 6.106 475 HA2 GLY 64 2HA GLY 64 -19.572 13.539 6.903 476 HA3 GLY 64 3HA GLY 64 -18.267 14.486 7.603 477 H VAL 65 H VAL 65 -19.297 13.834 4.253 478 HA VAL 65 HA VAL 65 -19.731 15.225 2.504 479 HB VAL 65 HB VAL 65 -20.538 17.240 4.603 480 HG11 VAL 65 1HG1 VAL 65 -22.104 17.980 2.798 481 HG12 VAL 65 2HG1 VAL 65 -20.396 18.244 2.439 482 HG13 VAL 65 3HG1 VAL 65 -21.256 16.894 1.697 483 HG21 VAL 65 3HG2 VAL 65 -21.736 15.261 5.123 484 HG22 VAL 65 1HG2 VAL 65 -22.844 16.288 4.213 485 HG23 VAL 65 2HG2 VAL 65 -22.055 14.924 3.422 486 H TRP 66 H TRP 66 -17.691 15.553 1.697 487 HA TRP 66 HA TRP 66 -16.647 18.207 1.899 488 HB2 TRP 66 2HB TRP 66 -14.368 17.500 2.668 489 HB3 TRP 66 3HB TRP 66 -15.614 17.385 3.908 490 HD1 TRP 66 HD1 TRP 66 -16.625 14.787 4.274 491 HE1 TRP 66 HE1 TRP 66 -15.326 12.565 4.252 492 HE3 TRP 66 HE3 TRP 66 -12.448 16.311 1.750 493 HZ2 TRP 66 HZ2 TRP 66 -12.858 11.587 3.293 494 HZ3 TRP 66 HZ3 TRP 66 -10.665 14.671 1.322 495 HH2 TRP 66 HH2 TRP 66 -10.867 12.359 2.079 496 HA PRO 67 HA PRO 67 -15.903 15.821 -2.044 497 HB2 PRO 67 2HB PRO 67 -17.139 17.617 -3.662 498 HB3 PRO 67 3HB PRO 67 -17.997 16.295 -2.862 499 HG2 PRO 67 2HG PRO 67 -17.797 19.176 -2.073 500 HG3 PRO 67 3HG PRO 67 -19.214 18.110 -2.065 501 HD2 PRO 67 2HD PRO 67 -17.813 18.687 0.179 502 HD3 PRO 67 3HD PRO 67 -18.618 17.124 -0.069 503 H LEU 68 H LEU 68 -13.835 17.003 -0.903 504 HA LEU 68 HA LEU 68 -13.003 19.303 -2.490 505 HB2 LEU 68 2HB LEU 68 -12.201 18.078 0.052 506 HB3 LEU 68 3HB LEU 68 -10.863 18.677 -0.926 507 HG LEU 68 HG LEU 68 -13.222 20.402 -0.219 508 HD11 LEU 68 1HD1 LEU 68 -10.673 20.603 1.291 509 HD12 LEU 68 2HD1 LEU 68 -11.814 19.338 1.744 510 HD13 LEU 68 3HD1 LEU 68 -12.315 21.028 1.775 511 HD21 LEU 68 3HD2 LEU 68 -11.094 20.743 -1.955 512 HD22 LEU 68 1HD2 LEU 68 -10.609 21.624 -0.505 513 HD23 LEU 68 2HD2 LEU 68 -12.132 22.013 -1.304 514 H VAL 69 H VAL 69 -12.608 15.897 -2.376 515 HA VAL 69 HA VAL 69 -10.141 15.894 -3.905 516 HB VAL 69 HB VAL 69 -10.367 13.441 -3.885 517 HG11 VAL 69 1HG1 VAL 69 -10.123 13.129 -1.452 518 HG12 VAL 69 2HG1 VAL 69 -9.214 14.520 -2.048 519 HG13 VAL 69 3HG1 VAL 69 -10.741 14.761 -1.198 520 HG21 VAL 69 3HG2 VAL 69 -13.051 14.125 -2.802 521 HG22 VAL 69 1HG2 VAL 69 -12.574 12.851 -3.924 522 HG23 VAL 69 2HG2 VAL 69 -12.254 12.671 -2.199 523 H ILE 70 H ILE 70 -13.558 15.101 -4.397 524 HA ILE 70 HA ILE 70 -13.543 14.026 -6.907 525 HB ILE 70 HB ILE 70 -15.750 15.275 -7.262 526 HG12 ILE 70 2HG1 ILE 70 -16.338 15.934 -4.625 527 HG13 ILE 70 3HG1 ILE 70 -14.728 16.599 -4.876 528 HG21 ILE 70 1HG2 ILE 70 -15.679 13.004 -6.459 529 HG22 ILE 70 2HG2 ILE 70 -15.331 13.556 -4.821 530 HG23 ILE 70 3HG2 ILE 70 -16.898 13.900 -5.554 531 HD11 ILE 70 3HD1 ILE 70 -16.165 17.308 -7.151 532 HD12 ILE 70 1HD1 ILE 70 -17.273 17.556 -5.802 533 HD13 ILE 70 2HD1 ILE 70 -15.699 18.352 -5.809 534 H ARG 71 H ARG 71 -13.674 17.509 -6.159 535 HA ARG 71 HA ARG 71 -13.705 18.521 -8.720 536 HB2 ARG 71 2HB ARG 71 -12.571 20.529 -7.762 537 HB3 ARG 71 3HB ARG 71 -13.959 19.983 -6.831 538 HG2 ARG 71 2HG ARG 71 -12.582 20.205 -5.083 539 HG3 ARG 71 3HG ARG 71 -11.954 18.639 -5.601 540 HD2 ARG 71 2HD ARG 71 -10.011 19.850 -5.438 541 HD3 ARG 71 3HD ARG 71 -10.420 20.106 -7.134 542 HE ARG 71 HE ARG 71 -11.518 22.126 -5.444 543 HH11 ARG 71 1HH1 ARG 71 -8.614 21.087 -7.059 544 HH12 ARG 71 2HH1 ARG 71 -7.944 22.681 -7.160 545 HH21 ARG 71 1HH2 ARG 71 -10.646 24.230 -5.571 546 HH22 ARG 71 2HH2 ARG 71 -9.100 24.468 -6.312 547 H THR 72 H THR 72 -10.897 17.531 -6.797 548 HA THR 72 HA THR 72 -8.834 18.357 -8.410 549 HB THR 72 HB THR 72 -8.566 15.609 -7.325 550 HG1 THR 72 HG1 THR 72 -8.504 16.487 -5.170 551 HG21 THR 72 3HG2 THR 72 -6.968 18.134 -7.427 552 HG22 THR 72 1HG2 THR 72 -6.529 16.510 -7.952 553 HG23 THR 72 2HG2 THR 72 -6.573 16.899 -6.232 554 H VAL 73 H VAL 73 -10.724 15.365 -8.696 555 HA VAL 73 HA VAL 73 -9.300 14.425 -10.986 556 HB VAL 73 HB VAL 73 -12.067 13.580 -10.139 557 HG11 VAL 73 1HG1 VAL 73 -11.202 11.379 -11.079 558 HG12 VAL 73 2HG1 VAL 73 -11.551 12.660 -12.242 559 HG13 VAL 73 3HG1 VAL 73 -9.884 12.321 -11.775 560 HG21 VAL 73 3HG2 VAL 73 -9.385 12.753 -9.052 561 HG22 VAL 73 1HG2 VAL 73 -10.771 13.392 -8.167 562 HG23 VAL 73 2HG2 VAL 73 -10.840 11.774 -8.865 563 H ILE 74 H ILE 74 -12.451 15.992 -10.508 564 HA ILE 74 HA ILE 74 -13.331 15.967 -13.147 565 HB ILE 74 HB ILE 74 -13.845 18.243 -11.242 566 HG12 ILE 74 2HG1 ILE 74 -14.613 15.405 -11.061 567 HG13 ILE 74 3HG1 ILE 74 -14.543 16.637 -9.805 568 HG21 ILE 74 1HG2 ILE 74 -14.619 18.240 -13.694 569 HG22 ILE 74 2HG2 ILE 74 -15.773 17.013 -13.177 570 HG23 ILE 74 3HG2 ILE 74 -15.805 18.617 -12.445 571 HD11 ILE 74 3HD1 ILE 74 -16.795 15.991 -9.976 572 HD12 ILE 74 1HD1 ILE 74 -16.681 17.559 -10.774 573 HD13 ILE 74 2HD1 ILE 74 -16.769 16.084 -11.737 574 H ALA 75 H ALA 75 -10.902 17.903 -11.619 575 HA ALA 75 HA ALA 75 -10.761 20.177 -13.123 576 HB1 ALA 75 1HB ALA 75 -8.510 18.446 -12.120 577 HB2 ALA 75 2HB ALA 75 -8.280 20.058 -12.798 578 HB3 ALA 75 3HB ALA 75 -9.230 19.847 -11.327 579 H GLY 76 H GLY 76 -10.089 16.920 -14.143 580 HA2 GLY 76 2HA GLY 76 -8.900 17.845 -16.653 581 HA3 GLY 76 3HA GLY 76 -8.985 16.179 -16.099 582 H TYR 77 H TYR 77 -11.862 16.484 -15.417 583 HA TYR 77 HA TYR 77 -13.007 15.404 -17.676 584 HB2 TYR 77 2HB TYR 77 -14.183 15.177 -15.636 585 HB3 TYR 77 3HB TYR 77 -14.222 16.916 -15.370 586 HD1 TYR 77 HD2 TYR 77 -15.111 14.983 -18.427 587 HD2 TYR 77 HD1 TYR 77 -16.489 17.443 -15.240 588 HE1 TYR 77 HE2 TYR 77 -17.333 15.090 -19.477 589 HE2 TYR 77 HE1 TYR 77 -18.714 17.556 -16.281 590 HH TYR 77 HH TYR 77 -19.761 15.504 -18.608 591 H ASN 78 H ASN 78 -13.130 18.800 -16.617 592 HA ASN 78 HA ASN 78 -14.699 19.871 -18.601 593 HB2 ASN 78 2HB ASN 78 -12.656 20.879 -16.765 594 HB3 ASN 78 3HB ASN 78 -12.773 21.818 -18.251 595 HD21 ASN 78 1HD2 ASN 78 -14.971 20.250 -15.943 596 HD22 ASN 78 2HD2 ASN 78 -16.061 21.585 -15.817 597 H LEU 79 H LEU 79 -11.556 18.527 -18.888 598 HA LEU 79 HA LEU 79 -11.055 19.805 -21.462 599 HB2 LEU 79 2HB LEU 79 -9.389 19.032 -19.446 600 HB3 LEU 79 3HB LEU 79 -9.235 17.686 -20.573 601 HG LEU 79 HG LEU 79 -7.483 19.385 -20.876 602 HD11 LEU 79 1HD1 LEU 79 -9.054 18.168 -22.831 603 HD12 LEU 79 2HD1 LEU 79 -7.428 18.823 -23.021 604 HD13 LEU 79 3HD1 LEU 79 -8.832 19.829 -23.381 605 HD21 LEU 79 3HD2 LEU 79 -9.485 21.273 -22.017 606 HD22 LEU 79 1HD2 LEU 79 -7.879 21.589 -21.358 607 HD23 LEU 79 2HD2 LEU 79 -9.227 21.254 -20.271 608 H TYR 80 H TYR 80 -11.939 16.705 -20.095 609 HA TYR 80 HA TYR 80 -11.476 14.901 -22.052 610 HB2 TYR 80 2HB TYR 80 -13.953 15.262 -20.370 611 HB3 TYR 80 3HB TYR 80 -13.729 13.875 -21.431 612 HD1 TYR 80 HD2 TYR 80 -10.557 14.735 -20.332 613 HD2 TYR 80 HD1 TYR 80 -14.153 12.944 -18.929 614 HE1 TYR 80 HE2 TYR 80 -9.289 13.587 -18.564 615 HE2 TYR 80 HE1 TYR 80 -12.895 11.793 -17.156 616 HH TYR 80 HH TYR 80 -10.255 11.041 -16.965 617 H ARG 81 H ARG 81 -14.307 17.064 -21.974 618 HA ARG 81 HA ARG 81 -15.087 16.295 -24.644 619 HB2 ARG 81 2HB ARG 81 -16.178 18.105 -22.535 620 HB3 ARG 81 3HB ARG 81 -16.697 18.347 -24.198 621 HG2 ARG 81 2HG ARG 81 -17.346 15.923 -24.244 622 HG3 ARG 81 3HG ARG 81 -17.040 15.887 -22.506 623 HD2 ARG 81 2HD ARG 81 -18.874 17.142 -22.018 624 HD3 ARG 81 3HD ARG 81 -18.791 18.046 -23.529 625 HE ARG 81 HE ARG 81 -20.209 16.521 -24.466 626 HH11 ARG 81 1HH1 ARG 81 -18.819 15.144 -21.586 627 HH12 ARG 81 2HH1 ARG 81 -19.816 13.727 -21.626 628 HH21 ARG 81 1HH2 ARG 81 -21.526 14.660 -24.529 629 HH22 ARG 81 2HH2 ARG 81 -21.354 13.452 -23.300 630 H ALA 82 H ALA 82 -13.187 18.770 -23.162 631 HA ALA 82 HA ALA 82 -13.329 20.859 -24.953 632 HB1 ALA 82 1HB ALA 82 -11.134 21.507 -24.214 633 HB2 ALA 82 2HB ALA 82 -12.033 20.860 -22.841 634 HB3 ALA 82 3HB ALA 82 -10.804 19.874 -23.634 635 H ILE 83 H ILE 83 -11.533 17.837 -25.234 636 HA ILE 83 HA ILE 83 -10.182 18.588 -27.644 637 HB ILE 83 HB ILE 83 -10.604 15.867 -26.403 638 HG12 ILE 83 2HG1 ILE 83 -9.283 17.351 -24.995 639 HG13 ILE 83 3HG1 ILE 83 -8.243 16.121 -25.705 640 HG21 ILE 83 1HG2 ILE 83 -9.427 16.698 -28.946 641 HG22 ILE 83 2HG2 ILE 83 -8.370 15.684 -27.965 642 HG23 ILE 83 3HG2 ILE 83 -9.975 15.108 -28.414 643 HD11 ILE 83 3HD1 ILE 83 -6.913 17.733 -26.413 644 HD12 ILE 83 1HD1 ILE 83 -8.205 18.292 -27.476 645 HD13 ILE 83 2HD1 ILE 83 -8.045 18.965 -25.853 646 H LYS 84 H LYS 84 -13.267 17.250 -26.873 647 HA LYS 84 HA LYS 84 -13.799 15.989 -29.364 648 HB2 LYS 84 2HB LYS 84 -15.052 16.079 -26.924 649 HB3 LYS 84 3HB LYS 84 -16.120 17.060 -27.918 650 HG2 LYS 84 2HG LYS 84 -15.211 14.390 -28.895 651 HG3 LYS 84 3HG LYS 84 -16.523 14.509 -27.720 652 HD2 LYS 84 2HD LYS 84 -17.763 14.617 -29.622 653 HD3 LYS 84 3HD LYS 84 -17.378 16.332 -29.467 654 HE2 LYS 84 2HE LYS 84 -16.667 16.122 -31.589 655 HE3 LYS 84 3HE LYS 84 -15.221 15.443 -30.844 656 HZ1 LYS 84 3HZ LYS 84 -17.205 14.164 -32.469 657 HZ2 LYS 84 1HZ LYS 84 -16.900 13.318 -31.036 658 HZ3 LYS 84 2HZ LYS 84 -15.631 13.668 -32.098 659 H LYS 85 H LYS 85 -14.480 19.210 -28.063 660 HA LYS 85 HA LYS 85 -15.920 20.098 -30.361 661 HB2 LYS 85 2HB LYS 85 -15.647 22.357 -29.346 662 HB3 LYS 85 3HB LYS 85 -16.328 21.168 -28.244 663 HG2 LYS 85 2HG LYS 85 -14.167 20.900 -27.166 664 HG3 LYS 85 3HG LYS 85 -13.448 22.050 -28.296 665 HD2 LYS 85 2HD LYS 85 -15.326 23.641 -27.427 666 HD3 LYS 85 3HD LYS 85 -15.365 22.534 -26.053 667 HE2 LYS 85 2HE LYS 85 -13.359 23.220 -25.278 668 HE3 LYS 85 3HE LYS 85 -12.687 23.423 -26.895 669 HZ1 LYS 85 3HZ LYS 85 -12.878 25.545 -25.798 670 HZ2 LYS 85 1HZ LYS 85 -14.529 25.301 -25.516 671 HZ3 LYS 85 2HZ LYS 85 -13.959 25.488 -27.098 672 H LYS 86 H LYS 86 -12.573 20.339 -29.278 673 HA LYS 86 HA LYS 86 -10.657 20.947 -30.342 674 HB2 LYS 86 2HB LYS 86 -11.647 19.239 -31.983 675 HB3 LYS 86 3HB LYS 86 -12.134 20.627 -32.948 676 HG2 LYS 86 2HG LYS 86 -10.145 20.306 -33.934 677 HG3 LYS 86 3HG LYS 86 -9.536 21.215 -32.549 678 HD2 LYS 86 2HD LYS 86 -9.713 18.571 -31.669 679 HD3 LYS 86 3HD LYS 86 -9.054 18.471 -33.304 680 HE2 LYS 86 2HE LYS 86 -7.944 20.485 -31.404 681 HE3 LYS 86 3HE LYS 86 -7.474 18.794 -31.234 682 HZ1 LYS 86 3HZ LYS 86 -6.650 18.791 -33.469 683 HZ2 LYS 86 1HZ LYS 86 -5.953 20.094 -32.645 684 HZ3 LYS 86 2HZ LYS 86 -7.213 20.363 -33.741 685 H GLY 87 H GLY 87 -10.898 23.104 -29.517 686 HA2 GLY 87 2HA GLY 87 -10.732 25.085 -31.549 687 HA3 GLY 87 3HA GLY 87 -12.275 25.191 -30.714 688 H GLY 88 H GLY 88 -11.796 24.827 -28.149 689 HA2 GLY 88 2HA GLY 88 -9.557 26.602 -27.431 690 HA3 GLY 88 3HA GLY 88 -11.180 26.971 -26.867 691 H GLY 89 H GLY 89 -10.303 26.847 -24.710 692 HA2 GLY 89 2HA GLY 89 -9.388 24.253 -23.776 693 HA3 GLY 89 3HA GLY 89 -9.521 25.720 -22.819 694 H GLY 90 H GLY 90 -10.436 24.260 -21.194 695 HA2 GLY 90 2HA GLY 90 -12.848 22.859 -21.579 696 HA3 GLY 90 3HA GLY 90 -12.210 23.388 -20.029 697 H GLY 91 H GLY 91 -14.649 23.573 -19.734 698 HA2 GLY 91 2HA GLY 91 -15.411 26.177 -19.378 699 HA3 GLY 91 3HA GLY 91 -15.969 25.785 -20.998 700 H GLY 92 H GLY 92 -17.171 23.579 -21.080 701 HA2 GLY 92 2HA GLY 92 -18.452 22.154 -19.322 702 HA3 GLY 92 3HA GLY 92 -19.204 23.702 -18.964 703 H GLY 93 H GLY 93 -19.718 20.904 -20.515 704 HA2 GLY 93 2HA GLY 93 -21.876 21.993 -22.068 705 HA3 GLY 93 3HA GLY 93 -20.572 21.370 -23.067 706 H GLY 94 H GLY 94 -22.670 20.085 -23.652 707 HA2 GLY 94 2HA GLY 94 -22.253 17.423 -22.779 708 HA3 GLY 94 3HA GLY 94 -23.679 18.087 -21.995 709 H GLY 95 H GLY 95 -22.916 16.099 -24.343 710 HA2 GLY 95 2HA GLY 95 -24.943 17.131 -26.226 711 HA3 GLY 95 3HA GLY 95 -23.635 16.046 -26.673 712 H GLY 96 H GLY 96 -24.698 14.286 -27.397 713 HA2 GLY 96 2HA GLY 96 -26.269 12.805 -25.418 714 HA3 GLY 96 3HA GLY 96 -27.038 13.175 -26.955 715 H VAL 97 H VAL 97 -26.833 11.731 -28.533 716 HA VAL 97 HA VAL 97 -24.898 9.558 -28.169 717 HB VAL 97 HB VAL 97 -27.294 9.715 -30.004 718 HG11 VAL 97 1HG1 VAL 97 -26.467 7.946 -31.057 719 HG12 VAL 97 2HG1 VAL 97 -25.028 7.997 -30.037 720 HG13 VAL 97 3HG1 VAL 97 -26.433 7.056 -29.535 721 HG21 VAL 97 3HG2 VAL 97 -27.825 7.725 -28.247 722 HG22 VAL 97 1HG2 VAL 97 -26.931 8.845 -27.218 723 HG23 VAL 97 2HG2 VAL 97 -28.384 9.387 -28.059 724 H TRP 98 H TRP 98 -23.000 10.205 -29.048 725 HA TRP 98 HA TRP 98 -22.590 10.090 -31.790 726 HB2 TRP 98 2HB TRP 98 -23.558 12.110 -32.313 727 HB3 TRP 98 3HB TRP 98 -23.181 12.818 -30.745 728 HD1 TRP 98 HD1 TRP 98 -20.796 11.403 -33.469 729 HE1 TRP 98 HE1 TRP 98 -19.056 13.221 -34.011 730 HE3 TRP 98 HE3 TRP 98 -22.546 15.130 -30.439 731 HZ2 TRP 98 HZ2 TRP 98 -18.498 15.882 -33.253 732 HZ3 TRP 98 HZ3 TRP 98 -21.351 17.281 -30.405 733 HH2 TRP 98 HH2 TRP 98 -19.370 17.647 -31.784 734 HA PRO 99 HA PRO 99 -18.618 11.874 -29.693 735 HB2 PRO 99 2HB PRO 99 -18.824 12.653 -27.101 736 HB3 PRO 99 3HB PRO 99 -19.118 13.746 -28.459 737 HG2 PRO 99 2HG PRO 99 -21.087 12.262 -26.762 738 HG3 PRO 99 3HG PRO 99 -21.146 13.938 -27.338 739 HD2 PRO 99 2HD PRO 99 -22.544 11.941 -28.518 740 HD3 PRO 99 3HD PRO 99 -21.903 13.325 -29.427 741 H LEU 100 H LEU 100 -18.098 9.656 -29.831 742 HA LEU 100 HA LEU 100 -18.559 7.978 -27.496 743 HB2 LEU 100 2HB LEU 100 -17.824 7.555 -30.312 744 HB3 LEU 100 3HB LEU 100 -17.053 6.461 -29.164 745 HG LEU 100 HG LEU 100 -19.662 6.324 -28.384 746 HD11 LEU 100 1HD1 LEU 100 -21.135 6.611 -30.054 747 HD12 LEU 100 2HD1 LEU 100 -20.019 6.017 -31.283 748 HD13 LEU 100 3HD1 LEU 100 -19.898 7.681 -30.713 749 HD21 LEU 100 3HD2 LEU 100 -19.538 4.263 -30.109 750 HD22 LEU 100 1HD2 LEU 100 -18.716 4.282 -28.549 751 HD23 LEU 100 2HD2 LEU 100 -17.828 4.691 -30.018 752 H VAL 101 H VAL 101 -16.124 9.977 -28.815 753 HA VAL 101 HA VAL 101 -13.837 8.669 -27.749 754 HB VAL 101 HB VAL 101 -12.678 10.821 -28.110 755 HG11 VAL 101 1HG1 VAL 101 -14.069 10.762 -30.629 756 HG12 VAL 101 2HG1 VAL 101 -12.439 10.212 -30.235 757 HG13 VAL 101 3HG1 VAL 101 -13.813 9.126 -30.022 758 HG21 VAL 101 3HG2 VAL 101 -15.446 11.789 -28.235 759 HG22 VAL 101 1HG2 VAL 101 -13.964 12.637 -27.795 760 HG23 VAL 101 2HG2 VAL 101 -14.386 12.421 -29.494 761 H ILE 102 H ILE 102 -16.062 11.100 -26.519 762 HA ILE 102 HA ILE 102 -14.631 11.960 -24.287 763 HB ILE 102 HB ILE 102 -16.824 12.531 -23.291 764 HG12 ILE 102 2HG1 ILE 102 -18.693 12.105 -25.228 765 HG13 ILE 102 3HG1 ILE 102 -17.733 10.635 -25.360 766 HG21 ILE 102 1HG2 ILE 102 -15.831 14.108 -24.790 767 HG22 ILE 102 2HG2 ILE 102 -16.423 13.223 -26.194 768 HG23 ILE 102 3HG2 ILE 102 -17.560 14.048 -25.128 769 HD11 ILE 102 3HD1 ILE 102 -19.283 9.983 -23.828 770 HD12 ILE 102 1HD1 ILE 102 -18.032 10.604 -22.751 771 HD13 ILE 102 2HD1 ILE 102 -19.440 11.596 -23.132 772 H ARG 103 H ARG 103 -16.770 9.171 -24.691 773 HA ARG 103 HA ARG 103 -16.926 8.331 -22.048 774 HB2 ARG 103 2HB ARG 103 -17.770 6.335 -22.859 775 HB3 ARG 103 3HB ARG 103 -18.067 7.419 -24.211 776 HG2 ARG 103 2HG ARG 103 -17.159 5.684 -25.347 777 HG3 ARG 103 3HG ARG 103 -15.672 6.545 -24.944 778 HD2 ARG 103 2HD ARG 103 -14.946 4.873 -23.658 779 HD3 ARG 103 3HD ARG 103 -16.496 4.742 -22.828 780 HE ARG 103 HE ARG 103 -16.500 3.615 -25.472 781 HH11 ARG 103 1HH1 ARG 103 -15.815 3.029 -22.110 782 HH12 ARG 103 2HH1 ARG 103 -16.012 1.313 -22.234 783 HH21 ARG 103 1HH2 ARG 103 -16.762 1.356 -25.649 784 HH22 ARG 103 2HH2 ARG 103 -16.550 0.362 -24.248 785 H THR 104 H THR 104 -14.374 7.890 -24.416 786 HA THR 104 HA THR 104 -12.875 5.903 -23.180 787 HB THR 104 HB THR 104 -11.403 8.158 -24.454 788 HG1 THR 104 HG1 THR 104 -12.136 7.255 -26.531 789 HG21 THR 104 3HG2 THR 104 -9.959 6.415 -24.182 790 HG22 THR 104 1HG2 THR 104 -10.631 5.953 -25.745 791 HG23 THR 104 2HG2 THR 104 -11.235 5.200 -24.269 792 H VAL 105 H VAL 105 -12.455 9.435 -22.878 793 HA VAL 105 HA VAL 105 -10.558 9.191 -20.753 794 HB VAL 105 HB VAL 105 -10.972 11.686 -20.500 795 HG11 VAL 105 1HG1 VAL 105 -9.075 11.143 -21.713 796 HG12 VAL 105 2HG1 VAL 105 -9.997 10.376 -23.007 797 HG13 VAL 105 3HG1 VAL 105 -9.984 12.134 -22.854 798 HG21 VAL 105 3HG2 VAL 105 -13.256 11.687 -21.412 799 HG22 VAL 105 1HG2 VAL 105 -12.197 12.804 -22.273 800 HG23 VAL 105 2HG2 VAL 105 -12.613 11.249 -22.995 801 H ILE 106 H ILE 106 -14.016 9.850 -20.956 802 HA ILE 106 HA ILE 106 -14.462 10.606 -18.299 803 HB ILE 106 HB ILE 106 -16.295 9.183 -20.229 804 HG12 ILE 106 2HG1 ILE 106 -15.335 11.847 -20.092 805 HG13 ILE 106 3HG1 ILE 106 -16.559 11.191 -21.174 806 HG21 ILE 106 1HG2 ILE 106 -17.026 8.777 -17.945 807 HG22 ILE 106 2HG2 ILE 106 -16.954 10.505 -17.600 808 HG23 ILE 106 3HG2 ILE 106 -18.128 9.886 -18.761 809 HD11 ILE 106 3HD1 ILE 106 -17.075 12.320 -18.433 810 HD12 ILE 106 1HD1 ILE 106 -17.356 13.152 -19.962 811 HD13 ILE 106 2HD1 ILE 106 -18.290 11.711 -19.558 812 H ALA 107 H ALA 107 -13.623 7.574 -19.620 813 HA ALA 107 HA ALA 107 -14.819 5.686 -18.057 814 HB1 ALA 107 1HB ALA 107 -13.367 4.866 -19.673 815 HB2 ALA 107 2HB ALA 107 -12.029 5.878 -19.128 816 HB3 ALA 107 3HB ALA 107 -12.535 4.492 -18.163 817 H GLY 108 H GLY 108 -12.592 8.130 -17.046 818 HA2 GLY 108 2HA GLY 108 -12.067 6.810 -14.494 819 HA3 GLY 108 3HA GLY 108 -11.354 8.317 -15.052 820 H TYR 109 H TYR 109 -14.036 9.363 -15.812 821 HA TYR 109 HA TYR 109 -14.599 10.907 -13.612 822 HB2 TYR 109 2HB TYR 109 -15.513 10.947 -16.091 823 HB3 TYR 109 3HB TYR 109 -16.873 10.092 -15.371 824 HD1 TYR 109 HD1 TYR 109 -14.807 13.166 -14.921 825 HD2 TYR 109 HD2 TYR 109 -18.598 11.307 -14.401 826 HE1 TYR 109 HE1 TYR 109 -15.750 15.311 -14.174 827 HE2 TYR 109 HE2 TYR 109 -19.552 13.447 -13.654 828 HH TYR 109 HH TYR 109 -18.913 15.992 -14.070 829 H ASN 110 H ASN 110 -16.273 7.918 -14.586 830 HA ASN 110 HA ASN 110 -18.145 7.742 -12.584 831 HB2 ASN 110 2HB ASN 110 -16.870 5.898 -14.431 832 HB3 ASN 110 3HB ASN 110 -17.260 5.114 -12.903 833 HD21 ASN 110 1HD2 ASN 110 -19.444 5.126 -12.190 834 HD22 ASN 110 2HD2 ASN 110 -20.736 5.278 -13.327 835 H LEU 111 H LEU 111 -14.727 7.431 -12.329 836 HA LEU 111 HA LEU 111 -14.861 6.146 -9.718 837 HB2 LEU 111 2HB LEU 111 -13.122 5.641 -11.520 838 HB3 LEU 111 3HB LEU 111 -12.391 7.182 -11.077 839 HG LEU 111 HG LEU 111 -12.565 5.966 -8.652 840 HD11 LEU 111 1HD1 LEU 111 -13.171 3.828 -9.096 841 HD12 LEU 111 2HD1 LEU 111 -11.437 3.663 -9.372 842 HD13 LEU 111 3HD1 LEU 111 -12.532 3.867 -10.740 843 HD21 LEU 111 3HD2 LEU 111 -10.106 5.150 -9.692 844 HD22 LEU 111 1HD2 LEU 111 -10.459 6.649 -8.833 845 HD23 LEU 111 2HD2 LEU 111 -10.537 6.604 -10.594 846 H TYR 112 H TYR 112 -14.221 9.273 -11.156 847 HA TYR 112 HA TYR 112 -12.968 10.688 -9.214 848 HB2 TYR 112 2HB TYR 112 -13.601 12.493 -10.399 849 HB3 TYR 112 3HB TYR 112 -14.383 11.343 -11.478 850 HD1 TYR 112 HD2 TYR 112 -15.076 13.235 -8.330 851 HD2 TYR 112 HD1 TYR 112 -16.622 11.644 -11.961 852 HE1 TYR 112 HE2 TYR 112 -17.253 14.277 -7.853 853 HE2 TYR 112 HE1 TYR 112 -18.802 12.683 -11.495 854 HH TYR 112 HH TYR 112 -19.995 13.907 -10.084 855 H ARG 113 H ARG 113 -16.409 9.842 -9.264 856 HA ARG 113 HA ARG 113 -16.834 11.068 -6.667 857 HB2 ARG 113 2HB ARG 113 -18.478 10.330 -8.885 858 HB3 ARG 113 3HB ARG 113 -19.073 9.503 -7.451 859 HG2 ARG 113 2HG ARG 113 -18.449 12.315 -6.995 860 HG3 ARG 113 3HG ARG 113 -19.710 12.051 -8.201 861 HD2 ARG 113 2HD ARG 113 -19.670 10.927 -5.402 862 HD3 ARG 113 3HD ARG 113 -20.652 12.282 -5.957 863 HE ARG 113 HE ARG 113 -21.360 10.277 -7.630 864 HH11 ARG 113 1HH1 ARG 113 -21.184 10.556 -4.164 865 HH12 ARG 113 2HH1 ARG 113 -22.474 9.436 -3.878 866 HH21 ARG 113 1HH2 ARG 113 -23.060 8.800 -7.266 867 HH22 ARG 113 2HH2 ARG 113 -23.540 8.437 -5.643 868 H ALA 114 H ALA 114 -16.220 7.940 -8.019 869 HA ALA 114 HA ALA 114 -17.259 6.209 -6.148 870 HB1 ALA 114 1HB ALA 114 -15.605 4.624 -6.832 871 HB2 ALA 114 2HB ALA 114 -16.062 5.578 -8.244 872 HB3 ALA 114 3HB ALA 114 -14.541 5.906 -7.413 873 H ILE 115 H ILE 115 -14.385 8.219 -5.915 874 HA ILE 115 HA ILE 115 -13.499 7.039 -3.446 875 HB ILE 115 HB ILE 115 -12.645 9.596 -4.808 876 HG12 ILE 115 2HG1 ILE 115 -12.135 7.622 -6.139 877 HG13 ILE 115 3HG1 ILE 115 -10.652 8.271 -5.449 878 HG21 ILE 115 1HG2 ILE 115 -11.979 8.433 -2.214 879 HG22 ILE 115 2HG2 ILE 115 -10.571 8.803 -3.209 880 HG23 ILE 115 3HG2 ILE 115 -11.734 10.071 -2.820 881 HD11 ILE 115 3HD1 ILE 115 -10.725 6.554 -3.709 882 HD12 ILE 115 1HD1 ILE 115 -12.191 5.895 -4.434 883 HD13 ILE 115 2HD1 ILE 115 -10.671 5.858 -5.328 884 H LYS 116 H LYS 116 -15.685 9.529 -4.370 885 HA LYS 116 HA LYS 116 -15.608 11.026 -1.941 886 HB2 LYS 116 2HB LYS 116 -16.722 11.397 -4.438 887 HB3 LYS 116 3HB LYS 116 -18.129 11.118 -3.422 888 HG2 LYS 116 2HG LYS 116 -15.998 13.150 -2.805 889 HG3 LYS 116 3HG LYS 116 -17.483 13.511 -3.689 890 HD2 LYS 116 2HD LYS 116 -18.319 13.980 -1.656 891 HD3 LYS 116 3HD LYS 116 -18.457 12.227 -1.494 892 HE2 LYS 116 2HE LYS 116 -16.253 12.161 -0.426 893 HE3 LYS 116 3HE LYS 116 -16.123 13.911 -0.586 894 HZ1 LYS 116 3HZ LYS 116 -18.299 13.940 0.737 895 HZ2 LYS 116 1HZ LYS 116 -16.864 13.610 1.572 896 HZ3 LYS 116 2HZ LYS 116 -17.913 12.349 1.161 897 H LYS 117 H LYS 117 -17.579 8.370 -3.166 898 HA LYS 117 HA LYS 117 -19.403 8.355 -0.976 899 HB2 LYS 117 2HB LYS 117 -20.366 7.274 -2.738 900 HB3 LYS 117 3HB LYS 117 -18.836 6.630 -3.318 901 HG2 LYS 117 2HG LYS 117 -18.925 4.795 -1.919 902 HG3 LYS 117 3HG LYS 117 -20.034 5.579 -0.792 903 HD2 LYS 117 2HD LYS 117 -20.985 5.135 -3.568 904 HD3 LYS 117 3HD LYS 117 -20.834 3.720 -2.523 905 HE2 LYS 117 2HE LYS 117 -22.326 4.658 -0.916 906 HE3 LYS 117 3HE LYS 117 -22.319 6.220 -1.735 907 HZ1 LYS 117 3HZ LYS 117 -24.260 5.350 -2.512 908 HZ2 LYS 117 1HZ LYS 117 -23.716 3.748 -2.457 909 HZ3 LYS 117 2HZ LYS 117 -23.211 4.770 -3.707 910 H LYS 118 H LYS 118 -16.424 6.622 -1.728 911 HA LYS 118 HA LYS 118 -16.578 5.167 0.801 912 HB2 LYS 118 2HB LYS 118 -14.890 4.929 -1.663 913 HB3 LYS 118 3HB LYS 118 -14.329 4.223 -0.153 914 HG2 LYS 118 2HG LYS 118 -16.148 2.737 -0.049 915 HG3 LYS 118 3HG LYS 118 -17.037 3.616 -1.296 916 HD2 LYS 118 2HD LYS 118 -14.508 2.837 -2.356 917 HD3 LYS 118 3HD LYS 118 -15.265 1.427 -1.609 918 HE2 LYS 118 2HE LYS 118 -16.893 1.328 -3.160 919 HE3 LYS 118 3HE LYS 118 -17.069 3.080 -3.232 920 HZ1 LYS 118 3HZ LYS 118 -14.864 1.556 -4.509 921 HZ2 LYS 118 1HZ LYS 118 -15.155 3.216 -4.651 922 HZ3 LYS 118 2HZ LYS 118 -16.244 2.107 -5.316 Start of MODEL 6 1 H1 VAL 1 H VAL 1 3.500 1.786 -0.434 2 HA VAL 1 HA VAL 1 3.150 3.900 -2.360 3 HB VAL 1 HB VAL 1 5.346 1.876 -2.813 4 HG11 VAL 1 1HG1 VAL 1 5.671 3.610 -4.798 5 HG12 VAL 1 2HG1 VAL 1 4.609 2.208 -4.941 6 HG13 VAL 1 3HG1 VAL 1 3.932 3.796 -4.577 7 HG21 VAL 1 3HG2 VAL 1 5.416 4.825 -2.217 8 HG22 VAL 1 1HG2 VAL 1 6.180 3.514 -1.318 9 HG23 VAL 1 2HG2 VAL 1 6.779 3.953 -2.917 10 H TRP 2 H TRP 2 1.041 2.972 -2.350 11 HA TRP 2 HA TRP 2 0.875 0.464 -3.889 12 HB2 TRP 2 2HB TRP 2 0.127 0.195 -1.526 13 HB3 TRP 2 3HB TRP 2 -1.109 1.417 -1.812 14 HD1 TRP 2 HD1 TRP 2 -0.566 -0.973 -4.668 15 HE1 TRP 2 HE1 TRP 2 -2.543 -2.616 -4.802 16 HE3 TRP 2 HE3 TRP 2 -2.849 0.141 -0.232 17 HZ2 TRP 2 HZ2 TRP 2 -4.775 -3.343 -3.234 18 HZ3 TRP 2 HZ3 TRP 2 -4.901 -1.073 0.376 19 HH2 TRP 2 HH2 TRP 2 -5.843 -2.778 -1.095 20 HA PRO 3 HA PRO 3 -1.170 3.989 -6.173 21 HB2 PRO 3 2HB PRO 3 0.117 3.550 -8.523 22 HB3 PRO 3 3HB PRO 3 0.774 4.581 -7.246 23 HG2 PRO 3 2HG PRO 3 1.428 1.736 -7.909 24 HG3 PRO 3 3HG PRO 3 2.522 3.065 -7.483 25 HD2 PRO 3 2HD PRO 3 1.769 1.171 -5.701 26 HD3 PRO 3 3HD PRO 3 2.112 2.847 -5.226 27 H LEU 4 H LEU 4 -2.702 1.965 -5.629 28 HA LEU 4 HA LEU 4 -3.209 0.365 -8.012 29 HB2 LEU 4 2HB LEU 4 -3.451 -1.009 -6.206 30 HB3 LEU 4 3HB LEU 4 -4.055 0.281 -5.169 31 HG LEU 4 HG LEU 4 -6.243 0.132 -6.232 32 HD11 LEU 4 1HD1 LEU 4 -6.522 -0.778 -8.232 33 HD12 LEU 4 2HD1 LEU 4 -5.970 -2.339 -7.626 34 HD13 LEU 4 3HD1 LEU 4 -4.807 -1.184 -8.275 35 HD21 LEU 4 3HD2 LEU 4 -6.780 -2.245 -5.527 36 HD22 LEU 4 1HD2 LEU 4 -6.024 -1.215 -4.311 37 HD23 LEU 4 2HD2 LEU 4 -5.062 -2.421 -5.168 38 H VAL 5 H VAL 5 -4.745 2.872 -6.057 39 HA VAL 5 HA VAL 5 -7.071 2.956 -7.791 40 HB VAL 5 HB VAL 5 -7.855 4.767 -6.323 41 HG11 VAL 5 1HG1 VAL 5 -6.912 2.205 -5.078 42 HG12 VAL 5 2HG1 VAL 5 -7.852 3.386 -4.164 43 HG13 VAL 5 3HG1 VAL 5 -8.534 2.644 -5.612 44 HG21 VAL 5 3HG2 VAL 5 -6.261 4.832 -4.138 45 HG22 VAL 5 1HG2 VAL 5 -5.058 4.665 -5.417 46 HG23 VAL 5 2HG2 VAL 5 -6.195 6.013 -5.446 47 H ILE 6 H ILE 6 -4.179 4.849 -7.137 48 HA ILE 6 HA ILE 6 -4.843 7.155 -8.584 49 HB ILE 6 HB ILE 6 -2.478 7.651 -8.655 50 HG12 ILE 6 2HG1 ILE 6 -1.058 5.691 -7.464 51 HG13 ILE 6 3HG1 ILE 6 -2.252 4.713 -8.311 52 HG21 ILE 6 1HG2 ILE 6 -3.419 8.105 -6.551 53 HG22 ILE 6 2HG2 ILE 6 -3.471 6.398 -6.113 54 HG23 ILE 6 3HG2 ILE 6 -1.923 7.238 -6.205 55 HD11 ILE 6 3HD1 ILE 6 -0.719 4.818 -9.951 56 HD12 ILE 6 1HD1 ILE 6 -1.529 6.345 -10.302 57 HD13 ILE 6 2HD1 ILE 6 -0.033 6.334 -9.366 58 H ARG 7 H ARG 7 -4.049 3.995 -9.644 59 HA ARG 7 HA ARG 7 -3.333 4.894 -12.328 60 HB2 ARG 7 2HB ARG 7 -2.982 2.444 -12.749 61 HB3 ARG 7 3HB ARG 7 -1.955 3.129 -11.496 62 HG2 ARG 7 2HG ARG 7 -3.387 2.189 -9.776 63 HG3 ARG 7 3HG ARG 7 -4.471 1.548 -11.012 64 HD2 ARG 7 2HD ARG 7 -1.770 0.729 -11.541 65 HD3 ARG 7 3HD ARG 7 -2.217 0.309 -9.888 66 HE ARG 7 HE ARG 7 -4.222 -0.419 -11.794 67 HH11 ARG 7 1HH1 ARG 7 -1.211 -1.394 -10.344 68 HH12 ARG 7 2HH1 ARG 7 -1.468 -3.083 -10.635 69 HH21 ARG 7 1HH2 ARG 7 -4.572 -2.640 -12.182 70 HH22 ARG 7 2HH2 ARG 7 -3.379 -3.790 -11.681 71 H THR 8 H THR 8 -6.034 3.784 -10.554 72 HA THR 8 HA THR 8 -7.570 2.412 -12.375 73 HB THR 8 HB THR 8 -8.650 4.528 -10.505 74 HG1 THR 8 HG1 THR 8 -8.077 1.779 -9.998 75 HG21 THR 8 3HG2 THR 8 -10.159 2.064 -10.847 76 HG22 THR 8 1HG2 THR 8 -9.960 2.949 -12.359 77 HG23 THR 8 2HG2 THR 8 -10.694 3.740 -10.964 78 H VAL 9 H VAL 9 -7.819 5.932 -11.818 79 HA VAL 9 HA VAL 9 -9.372 6.420 -14.123 80 HB VAL 9 HB VAL 9 -7.596 8.449 -12.776 81 HG11 VAL 9 1HG1 VAL 9 -9.284 8.644 -14.951 82 HG12 VAL 9 2HG1 VAL 9 -10.259 9.254 -13.612 83 HG13 VAL 9 3HG1 VAL 9 -8.693 9.983 -13.967 84 HG21 VAL 9 3HG2 VAL 9 -10.261 7.358 -11.900 85 HG22 VAL 9 1HG2 VAL 9 -8.757 7.432 -10.982 86 HG23 VAL 9 2HG2 VAL 9 -9.636 8.915 -11.356 87 H ILE 10 H ILE 10 -5.920 6.324 -13.558 88 HA ILE 10 HA ILE 10 -4.993 7.664 -15.811 89 HB ILE 10 HB ILE 10 -3.758 5.243 -14.492 90 HG12 ILE 10 2HG1 ILE 10 -4.307 7.436 -13.151 91 HG13 ILE 10 3HG1 ILE 10 -2.745 6.647 -12.957 92 HG21 ILE 10 1HG2 ILE 10 -2.630 7.310 -16.367 93 HG22 ILE 10 2HG2 ILE 10 -1.634 6.226 -15.397 94 HG23 ILE 10 3HG2 ILE 10 -2.728 5.566 -16.612 95 HD11 ILE 10 3HD1 ILE 10 -2.769 9.173 -13.229 96 HD12 ILE 10 1HD1 ILE 10 -1.648 8.260 -14.240 97 HD13 ILE 10 2HD1 ILE 10 -3.156 8.869 -14.922 98 H ALA 11 H ALA 11 -6.560 4.610 -15.548 99 HA ALA 11 HA ALA 11 -5.657 3.137 -17.661 100 HB1 ALA 11 1HB ALA 11 -8.197 2.538 -17.932 101 HB2 ALA 11 2HB ALA 11 -7.310 2.072 -16.480 102 HB3 ALA 11 3HB ALA 11 -8.359 3.489 -16.455 103 H GLY 12 H GLY 12 -7.405 6.136 -17.772 104 HA2 GLY 12 2HA GLY 12 -7.896 5.857 -20.647 105 HA3 GLY 12 3HA GLY 12 -8.522 7.130 -19.609 106 H TYR 13 H TYR 13 -5.872 7.607 -18.400 107 HA TYR 13 HA TYR 13 -5.007 9.732 -19.914 108 HB2 TYR 13 2HB TYR 13 -4.239 9.605 -17.684 109 HB3 TYR 13 3HB TYR 13 -3.555 8.001 -17.923 110 HD1 TYR 13 HD2 TYR 13 -3.084 10.756 -20.317 111 HD2 TYR 13 HD1 TYR 13 -1.365 8.552 -17.109 112 HE1 TYR 13 HE2 TYR 13 -0.895 11.766 -20.804 113 HE2 TYR 13 HE1 TYR 13 0.829 9.557 -17.586 114 HH TYR 13 HH TYR 13 1.694 10.887 -20.285 115 H ASN 14 H ASN 14 -3.675 6.434 -19.896 116 HA ASN 14 HA ASN 14 -1.605 6.748 -21.684 117 HB2 ASN 14 2HB ASN 14 -3.461 4.366 -21.466 118 HB3 ASN 14 3HB ASN 14 -1.857 4.355 -22.192 119 HD21 ASN 14 1HD2 ASN 14 -0.072 4.290 -20.905 120 HD22 ASN 14 2HD2 ASN 14 -0.141 4.077 -19.192 121 H LEU 15 H LEU 15 -4.953 7.026 -22.278 122 HA LEU 15 HA LEU 15 -4.699 6.560 -25.142 123 HB2 LEU 15 2HB LEU 15 -6.773 6.293 -23.300 124 HB3 LEU 15 3HB LEU 15 -7.225 7.679 -24.291 125 HG LEU 15 HG LEU 15 -8.188 5.555 -25.094 126 HD11 LEU 15 1HD1 LEU 15 -6.827 7.529 -26.583 127 HD12 LEU 15 2HD1 LEU 15 -8.179 6.517 -27.089 128 HD13 LEU 15 3HD1 LEU 15 -6.523 5.979 -27.368 129 HD21 LEU 15 3HD2 LEU 15 -6.842 3.819 -25.996 130 HD22 LEU 15 1HD2 LEU 15 -6.220 4.164 -24.382 131 HD23 LEU 15 2HD2 LEU 15 -5.369 4.770 -25.803 132 H TYR 16 H TYR 16 -5.117 9.194 -22.862 133 HA TYR 16 HA TYR 16 -5.916 11.303 -24.339 134 HB2 TYR 16 2HB TYR 16 -3.803 11.077 -22.226 135 HB3 TYR 16 3HB TYR 16 -4.070 12.623 -23.025 136 HD1 TYR 16 HD1 TYR 16 -7.162 11.917 -23.348 137 HD2 TYR 16 HD2 TYR 16 -4.449 12.078 -20.075 138 HE1 TYR 16 HE1 TYR 16 -9.037 12.380 -21.824 139 HE2 TYR 16 HE2 TYR 16 -6.316 12.540 -18.542 140 HH TYR 16 HH TYR 16 -9.237 13.588 -19.468 141 H ARG 17 H ARG 17 -2.556 10.124 -24.233 142 HA ARG 17 HA ARG 17 -1.753 11.897 -26.359 143 HB2 ARG 17 2HB ARG 17 -0.392 9.821 -24.688 144 HB3 ARG 17 3HB ARG 17 0.374 10.365 -26.175 145 HG2 ARG 17 2HG ARG 17 -0.041 12.741 -25.201 146 HG3 ARG 17 3HG ARG 17 -0.180 11.880 -23.667 147 HD2 ARG 17 2HD ARG 17 2.171 11.845 -25.556 148 HD3 ARG 17 3HD ARG 17 2.096 12.632 -23.980 149 HE ARG 17 HE ARG 17 1.531 9.933 -23.599 150 HH11 ARG 17 1HH1 ARG 17 4.187 11.927 -24.644 151 HH12 ARG 17 2HH1 ARG 17 5.403 10.829 -24.081 152 HH21 ARG 17 1HH2 ARG 17 3.123 8.479 -22.854 153 HH22 ARG 17 2HH2 ARG 17 4.797 8.868 -23.064 154 H ALA 18 H ALA 18 -2.861 8.627 -26.051 155 HA ALA 18 HA ALA 18 -1.862 7.387 -28.291 156 HB1 ALA 18 1HB ALA 18 -4.708 7.133 -27.333 157 HB2 ALA 18 2HB ALA 18 -3.767 5.936 -28.225 158 HB3 ALA 18 3HB ALA 18 -3.326 6.346 -26.567 159 H ILE 19 H ILE 19 -4.580 9.640 -28.080 160 HA ILE 19 HA ILE 19 -5.182 9.432 -30.891 161 HB ILE 19 HB ILE 19 -6.172 11.422 -28.846 162 HG12 ILE 19 2HG1 ILE 19 -6.787 9.102 -28.310 163 HG13 ILE 19 3HG1 ILE 19 -8.197 10.041 -28.790 164 HG21 ILE 19 1HG2 ILE 19 -6.551 11.183 -31.724 165 HG22 ILE 19 2HG2 ILE 19 -8.066 11.225 -30.824 166 HG23 ILE 19 3HG2 ILE 19 -6.897 12.533 -30.644 167 HD11 ILE 19 3HD1 ILE 19 -7.127 7.631 -29.923 168 HD12 ILE 19 1HD1 ILE 19 -8.671 8.428 -30.225 169 HD13 ILE 19 2HD1 ILE 19 -7.241 8.899 -31.144 170 H LYS 20 H LYS 20 -3.077 11.294 -28.922 171 HA LYS 20 HA LYS 20 -2.856 13.575 -30.622 172 HB2 LYS 20 2HB LYS 20 -1.479 12.535 -28.221 173 HB3 LYS 20 3HB LYS 20 -0.516 13.579 -29.259 174 HG2 LYS 20 2HG LYS 20 -1.634 14.808 -27.453 175 HG3 LYS 20 3HG LYS 20 -2.140 15.352 -29.054 176 HD2 LYS 20 2HD LYS 20 -3.796 13.200 -27.978 177 HD3 LYS 20 3HD LYS 20 -3.817 14.663 -26.991 178 HE2 LYS 20 2HE LYS 20 -4.190 15.883 -29.243 179 HE3 LYS 20 3HE LYS 20 -4.651 14.291 -29.844 180 HZ1 LYS 20 3HZ LYS 20 -5.892 15.094 -27.349 181 HZ2 LYS 20 1HZ LYS 20 -6.564 14.316 -28.693 182 HZ3 LYS 20 2HZ LYS 20 -6.352 15.994 -28.705 183 H LYS 21 H LYS 21 -1.258 10.467 -30.428 184 HA LYS 21 HA LYS 21 0.775 11.201 -32.355 185 HB2 LYS 21 2HB LYS 21 1.495 8.848 -32.140 186 HB3 LYS 21 3HB LYS 21 1.373 9.655 -30.582 187 HG2 LYS 21 2HG LYS 21 -0.807 8.590 -30.215 188 HG3 LYS 21 3HG LYS 21 -0.641 7.751 -31.760 189 HD2 LYS 21 2HD LYS 21 1.713 7.125 -30.541 190 HD3 LYS 21 3HD LYS 21 0.612 7.198 -29.163 191 HE2 LYS 21 2HE LYS 21 -0.715 5.813 -31.244 192 HE3 LYS 21 3HE LYS 21 0.910 5.141 -31.117 193 HZ1 LYS 21 3HZ LYS 21 -1.075 5.392 -28.923 194 HZ2 LYS 21 1HZ LYS 21 0.518 4.858 -28.719 195 HZ3 LYS 21 2HZ LYS 21 -0.561 3.959 -29.661 196 H LYS 22 H LYS 22 -2.178 9.270 -32.253 197 HA LYS 22 HA LYS 22 -3.506 8.414 -33.889 198 HB2 LYS 22 2HB LYS 22 -3.481 10.770 -34.659 199 HB3 LYS 22 3HB LYS 22 -2.080 10.409 -35.658 200 HG2 LYS 22 2HG LYS 22 -3.754 10.241 -37.200 201 HG3 LYS 22 3HG LYS 22 -3.651 8.565 -36.655 202 HD2 LYS 22 2HD LYS 22 -5.421 9.928 -34.911 203 HD3 LYS 22 3HD LYS 22 -5.880 10.339 -36.565 204 HE2 LYS 22 2HE LYS 22 -5.942 7.947 -37.124 205 HE3 LYS 22 3HE LYS 22 -5.518 7.555 -35.458 206 HZ1 LYS 22 3HZ LYS 22 -7.917 7.391 -35.917 207 HZ2 LYS 22 1HZ LYS 22 -7.956 9.047 -36.263 208 HZ3 LYS 22 2HZ LYS 22 -7.565 8.518 -34.705 209 H GLY 23 H GLY 23 -1.933 6.543 -33.484 210 HA2 GLY 23 2HA GLY 23 -0.983 5.653 -36.107 211 HA3 GLY 23 3HA GLY 23 0.172 5.654 -34.782 212 H GLY 24 H GLY 24 -0.142 4.216 -33.020 213 HA2 GLY 24 2HA GLY 24 -2.186 2.493 -32.510 214 HA3 GLY 24 3HA GLY 24 -1.324 1.718 -33.831 215 H GLY 25 H GLY 25 -1.707 1.305 -30.761 216 HA2 GLY 25 2HA GLY 25 0.063 -0.353 -29.939 217 HA3 GLY 25 3HA GLY 25 1.150 1.019 -30.093 218 H GLY 26 H GLY 26 1.484 0.439 -27.762 219 HA2 GLY 26 2HA GLY 26 -0.644 1.545 -26.050 220 HA3 GLY 26 3HA GLY 26 0.618 0.448 -25.511 221 H GLY 27 H GLY 27 2.029 1.404 -24.217 222 HA2 GLY 27 2HA GLY 27 3.889 3.160 -24.473 223 HA3 GLY 27 3HA GLY 27 2.540 4.281 -24.586 224 H GLY 28 H GLY 28 3.929 5.131 -22.705 225 HA2 GLY 28 2HA GLY 28 2.550 4.380 -20.267 226 HA3 GLY 28 3HA GLY 28 4.281 4.076 -20.258 227 H GLY 29 H GLY 29 5.718 5.790 -20.142 228 HA2 GLY 29 2HA GLY 29 4.760 8.515 -20.256 229 HA3 GLY 29 3HA GLY 29 5.155 7.964 -18.634 230 H GLY 30 H GLY 30 6.537 10.065 -19.468 231 HA2 GLY 30 2HA GLY 30 8.917 10.364 -19.102 232 HA3 GLY 30 3HA GLY 30 9.191 8.921 -20.067 233 H GLY 31 H GLY 31 8.183 12.299 -20.192 234 HA2 GLY 31 2HA GLY 31 9.577 13.326 -22.158 235 HA3 GLY 31 3HA GLY 31 8.508 12.301 -23.105 236 H GLY 32 H GLY 32 8.203 14.665 -23.930 237 HA2 GLY 32 2HA GLY 32 5.641 15.465 -23.673 238 HA3 GLY 32 3HA GLY 32 6.412 16.265 -22.312 239 H VAL 33 H VAL 33 6.471 15.939 -25.829 240 HA VAL 33 HA VAL 33 7.472 18.702 -25.978 241 HB VAL 33 HB VAL 33 8.731 18.064 -28.042 242 HG11 VAL 33 1HG1 VAL 33 10.603 17.771 -26.828 243 HG12 VAL 33 2HG1 VAL 33 9.520 17.993 -25.453 244 HG13 VAL 33 3HG1 VAL 33 9.958 16.367 -25.979 245 HG21 VAL 33 3HG2 VAL 33 7.664 16.040 -28.686 246 HG22 VAL 33 1HG2 VAL 33 9.320 15.626 -28.241 247 HG23 VAL 33 2HG2 VAL 33 7.997 15.291 -27.124 248 H TRP 34 H TRP 34 4.769 17.785 -26.105 249 HA TRP 34 HA TRP 34 3.819 19.204 -28.297 250 HB2 TRP 34 2HB TRP 34 4.366 17.674 -29.915 251 HB3 TRP 34 3HB TRP 34 4.294 16.310 -28.802 252 HD1 TRP 34 HD1 TRP 34 2.480 14.704 -29.601 253 HE1 TRP 34 HE1 TRP 34 0.090 14.925 -30.530 254 HE3 TRP 34 HE3 TRP 34 2.145 19.802 -29.776 255 HZ2 TRP 34 HZ2 TRP 34 -1.701 16.987 -31.243 256 HZ3 TRP 34 HZ3 TRP 34 0.059 20.820 -30.594 257 HH2 TRP 34 HH2 TRP 34 -1.822 19.439 -31.313 258 HA PRO 35 HA PRO 35 0.165 16.700 -26.368 259 HB2 PRO 35 2HB PRO 35 0.793 14.758 -24.577 260 HB3 PRO 35 3HB PRO 35 0.654 14.456 -26.313 261 HG2 PRO 35 2HG PRO 35 3.109 14.897 -24.657 262 HG3 PRO 35 3HG PRO 35 2.825 13.710 -25.944 263 HD2 PRO 35 2HD PRO 35 4.204 16.003 -26.356 264 HD3 PRO 35 3HD PRO 35 3.213 15.245 -27.619 265 H LEU 36 H LEU 36 0.417 18.922 -25.422 266 HA LEU 36 HA LEU 36 1.266 19.010 -22.643 267 HB2 LEU 36 2HB LEU 36 0.683 21.419 -22.819 268 HB3 LEU 36 3HB LEU 36 1.902 20.879 -23.971 269 HG LEU 36 HG LEU 36 -0.736 20.745 -25.132 270 HD11 LEU 36 1HD1 LEU 36 -1.136 22.567 -23.469 271 HD12 LEU 36 2HD1 LEU 36 -1.315 23.056 -25.154 272 HD13 LEU 36 3HD1 LEU 36 0.142 23.490 -24.260 273 HD21 LEU 36 3HD2 LEU 36 1.288 22.694 -26.048 274 HD22 LEU 36 1HD2 LEU 36 0.361 21.503 -26.960 275 HD23 LEU 36 2HD2 LEU 36 1.772 20.998 -26.031 276 H VAL 37 H VAL 37 -1.619 18.651 -24.473 277 HA VAL 37 HA VAL 37 -3.461 19.632 -22.535 278 HB VAL 37 HB VAL 37 -5.172 18.407 -23.836 279 HG11 VAL 37 1HG1 VAL 37 -4.438 20.665 -24.491 280 HG12 VAL 37 2HG1 VAL 37 -3.238 19.945 -25.567 281 HG13 VAL 37 3HG1 VAL 37 -4.958 19.701 -25.872 282 HG21 VAL 37 3HG2 VAL 37 -2.772 17.096 -24.917 283 HG22 VAL 37 1HG2 VAL 37 -4.424 16.497 -24.761 284 HG23 VAL 37 2HG2 VAL 37 -3.989 17.541 -26.114 285 H ILE 38 H ILE 38 -2.042 16.482 -23.215 286 HA ILE 38 HA ILE 38 -3.666 14.869 -21.637 287 HB ILE 38 HB ILE 38 -1.897 13.265 -21.599 288 HG12 ILE 38 2HG1 ILE 38 0.368 14.256 -22.694 289 HG13 ILE 38 3HG1 ILE 38 -0.192 15.678 -21.820 290 HG21 ILE 38 1HG2 ILE 38 -2.865 14.404 -23.905 291 HG22 ILE 38 2HG2 ILE 38 -1.124 14.369 -24.179 292 HG23 ILE 38 3HG2 ILE 38 -1.985 12.879 -23.796 293 HD11 ILE 38 3HD1 ILE 38 -0.473 13.732 -19.942 294 HD12 ILE 38 1HD1 ILE 38 0.952 13.183 -20.824 295 HD13 ILE 38 2HD1 ILE 38 0.925 14.794 -20.105 296 H ARG 39 H ARG 39 -1.151 17.101 -20.728 297 HA ARG 39 HA ARG 39 -0.956 16.115 -18.021 298 HB2 ARG 39 2HB ARG 39 0.810 17.551 -17.764 299 HB3 ARG 39 3HB ARG 39 0.829 17.379 -19.513 300 HG2 ARG 39 2HG ARG 39 0.933 19.628 -19.425 301 HG3 ARG 39 3HG ARG 39 -0.821 19.471 -19.310 302 HD2 ARG 39 2HD ARG 39 -0.753 20.544 -17.368 303 HD3 ARG 39 3HD ARG 39 0.176 19.205 -16.695 304 HE ARG 39 HE ARG 39 2.002 20.773 -18.019 305 HH11 ARG 39 1HH1 ARG 39 -0.283 21.218 -15.431 306 HH12 ARG 39 2HH1 ARG 39 0.653 22.441 -14.639 307 HH21 ARG 39 1HH2 ARG 39 3.245 22.383 -16.986 308 HH22 ARG 39 2HH2 ARG 39 2.660 23.104 -15.525 309 H THR 40 H THR 40 -2.915 18.324 -19.753 310 HA THR 40 HA THR 40 -3.589 20.245 -17.893 311 HB THR 40 HB THR 40 -5.540 18.900 -19.771 312 HG1 THR 40 HG1 THR 40 -3.963 21.211 -20.285 313 HG21 THR 40 3HG2 THR 40 -6.674 21.079 -19.739 314 HG22 THR 40 1HG2 THR 40 -5.503 21.668 -18.561 315 HG23 THR 40 2HG2 THR 40 -6.606 20.361 -18.130 316 H VAL 41 H VAL 41 -5.366 17.194 -18.433 317 HA VAL 41 HA VAL 41 -6.987 17.463 -16.133 318 HB VAL 41 HB VAL 41 -6.286 14.865 -17.497 319 HG11 VAL 41 1HG1 VAL 41 -8.265 14.014 -16.604 320 HG12 VAL 41 2HG1 VAL 41 -7.587 14.966 -15.282 321 HG13 VAL 41 3HG1 VAL 41 -8.908 15.618 -16.253 322 HG21 VAL 41 3HG2 VAL 41 -8.308 16.957 -18.284 323 HG22 VAL 41 1HG2 VAL 41 -6.942 16.373 -19.234 324 HG23 VAL 41 2HG2 VAL 41 -8.305 15.305 -18.902 325 H ILE 42 H ILE 42 -4.057 15.553 -16.764 326 HA ILE 42 HA ILE 42 -3.866 14.259 -14.311 327 HB ILE 42 HB ILE 42 -1.622 15.225 -16.088 328 HG12 ILE 42 2HG1 ILE 42 -3.592 13.294 -16.543 329 HG13 ILE 42 3HG1 ILE 42 -2.093 13.502 -17.441 330 HG21 ILE 42 1HG2 ILE 42 -0.804 14.763 -13.851 331 HG22 ILE 42 2HG2 ILE 42 -1.598 13.189 -13.865 332 HG23 ILE 42 3HG2 ILE 42 -0.262 13.512 -14.970 333 HD11 ILE 42 3HD1 ILE 42 -2.462 11.195 -16.667 334 HD12 ILE 42 1HD1 ILE 42 -0.977 11.906 -16.035 335 HD13 ILE 42 2HD1 ILE 42 -2.400 11.770 -15.001 336 H ALA 43 H ALA 43 -3.276 17.564 -15.128 337 HA ALA 43 HA ALA 43 -1.481 18.452 -13.273 338 HB1 ALA 43 1HB ALA 43 -2.464 20.596 -13.445 339 HB2 ALA 43 2HB ALA 43 -2.721 19.810 -15.003 340 HB3 ALA 43 3HB ALA 43 -4.044 19.920 -13.842 341 H GLY 44 H GLY 44 -4.655 17.193 -12.692 342 HA2 GLY 44 2HA GLY 44 -4.643 18.157 -9.924 343 HA3 GLY 44 3HA GLY 44 -5.994 17.390 -10.745 344 H TYR 45 H TYR 45 -4.336 15.205 -11.782 345 HA TYR 45 HA TYR 45 -4.751 13.317 -9.783 346 HB2 TYR 45 2HB TYR 45 -3.947 13.266 -12.435 347 HB3 TYR 45 3HB TYR 45 -2.561 12.604 -11.575 348 HD1 TYR 45 HD2 TYR 45 -4.114 11.290 -9.312 349 HD2 TYR 45 HD1 TYR 45 -4.693 11.300 -13.527 350 HE1 TYR 45 HE2 TYR 45 -5.248 9.113 -9.156 351 HE2 TYR 45 HE1 TYR 45 -5.829 9.124 -13.383 352 HH TYR 45 HH TYR 45 -6.485 7.598 -10.262 353 H ASN 46 H ASN 46 -1.858 15.168 -10.592 354 HA ASN 46 HA ASN 46 0.075 13.912 -9.124 355 HB2 ASN 46 2HB ASN 46 -0.294 16.506 -10.256 356 HB3 ASN 46 3HB ASN 46 0.385 16.703 -8.642 357 HD21 ASN 46 1HD2 ASN 46 0.803 14.494 -11.393 358 HD22 ASN 46 2HD2 ASN 46 2.529 14.562 -11.400 359 H LEU 47 H LEU 47 -2.679 15.644 -7.949 360 HA LEU 47 HA LEU 47 -1.641 15.821 -5.240 361 HB2 LEU 47 2HB LEU 47 -3.724 17.084 -6.757 362 HB3 LEU 47 3HB LEU 47 -4.388 16.416 -5.268 363 HG LEU 47 HG LEU 47 -3.791 18.733 -4.944 364 HD11 LEU 47 1HD1 LEU 47 -1.561 17.620 -3.445 365 HD12 LEU 47 2HD1 LEU 47 -3.025 16.643 -3.330 366 HD13 LEU 47 3HD1 LEU 47 -3.064 18.346 -2.874 367 HD21 LEU 47 3HD2 LEU 47 -1.157 19.090 -4.961 368 HD22 LEU 47 1HD2 LEU 47 -2.156 19.379 -6.385 369 HD23 LEU 47 2HD2 LEU 47 -1.262 17.866 -6.227 370 H TYR 48 H TYR 48 -4.047 14.004 -7.069 371 HA TYR 48 HA TYR 48 -5.404 12.700 -5.070 372 HB2 TYR 48 2HB TYR 48 -5.037 12.364 -7.868 373 HB3 TYR 48 3HB TYR 48 -4.830 10.786 -7.116 374 HD1 TYR 48 HD2 TYR 48 -6.685 10.181 -5.322 375 HD2 TYR 48 HD1 TYR 48 -7.172 13.033 -8.442 376 HE1 TYR 48 HE2 TYR 48 -9.127 9.935 -5.158 377 HE2 TYR 48 HE1 TYR 48 -9.615 12.796 -8.286 378 HH TYR 48 HH TYR 48 -11.096 10.512 -6.004 379 H ARG 49 H ARG 49 -2.316 11.737 -6.543 380 HA ARG 49 HA ARG 49 -1.992 9.461 -4.843 381 HB2 ARG 49 2HB ARG 49 0.199 10.858 -6.370 382 HB3 ARG 49 3HB ARG 49 0.121 9.168 -5.890 383 HG2 ARG 49 2HG ARG 49 -0.674 8.712 -7.904 384 HG3 ARG 49 3HG ARG 49 -2.144 9.584 -7.463 385 HD2 ARG 49 2HD ARG 49 -1.595 10.790 -9.302 386 HD3 ARG 49 3HD ARG 49 -0.610 11.663 -8.129 387 HE ARG 49 HE ARG 49 0.989 9.637 -9.074 388 HH11 ARG 49 1HH1 ARG 49 -0.729 12.337 -10.444 389 HH12 ARG 49 2HH1 ARG 49 0.394 12.559 -11.745 390 HH21 ARG 49 1HH2 ARG 49 2.474 9.919 -10.783 391 HH22 ARG 49 2HH2 ARG 49 2.215 11.182 -11.937 392 H ALA 50 H ALA 50 -1.271 12.824 -4.591 393 HA ALA 50 HA ALA 50 0.875 12.908 -2.863 394 HB1 ALA 50 1HB ALA 50 -1.447 14.728 -2.401 395 HB2 ALA 50 2HB ALA 50 0.280 15.085 -2.391 396 HB3 ALA 50 3HB ALA 50 -0.555 14.811 -3.920 397 H ILE 51 H ILE 51 -2.499 12.192 -2.153 398 HA ILE 51 HA ILE 51 -2.031 12.078 0.700 399 HB ILE 51 HB ILE 51 -4.472 11.281 -0.890 400 HG12 ILE 51 2HG1 ILE 51 -3.949 13.669 -1.099 401 HG13 ILE 51 3HG1 ILE 51 -5.401 13.426 -0.133 402 HG21 ILE 51 1HG2 ILE 51 -3.793 11.158 1.969 403 HG22 ILE 51 2HG2 ILE 51 -5.368 11.856 1.593 404 HG23 ILE 51 3HG2 ILE 51 -4.969 10.230 1.039 405 HD11 ILE 51 3HD1 ILE 51 -4.496 14.706 1.421 406 HD12 ILE 51 1HD1 ILE 51 -3.279 13.457 1.684 407 HD13 ILE 51 2HD1 ILE 51 -2.966 14.768 0.546 408 H LYS 52 H LYS 52 -1.887 9.942 -1.977 409 HA LYS 52 HA LYS 52 -2.343 7.512 -0.531 410 HB2 LYS 52 2HB LYS 52 -1.621 8.282 -3.277 411 HB3 LYS 52 3HB LYS 52 -0.933 6.753 -2.747 412 HG2 LYS 52 2HG LYS 52 -2.877 5.935 -3.525 413 HG3 LYS 52 3HG LYS 52 -3.468 6.414 -1.932 414 HD2 LYS 52 2HD LYS 52 -3.574 8.672 -3.675 415 HD3 LYS 52 3HD LYS 52 -4.350 7.301 -4.471 416 HE2 LYS 52 2HE LYS 52 -6.080 8.298 -3.267 417 HE3 LYS 52 3HE LYS 52 -5.573 6.957 -2.241 418 HZ1 LYS 52 3HZ LYS 52 -4.142 9.384 -1.702 419 HZ2 LYS 52 1HZ LYS 52 -4.948 8.346 -0.636 420 HZ3 LYS 52 2HZ LYS 52 -5.809 9.545 -1.460 421 H LYS 53 H LYS 53 0.383 9.563 -1.137 422 HA LYS 53 HA LYS 53 2.331 7.562 -0.371 423 HB2 LYS 53 2HB LYS 53 2.690 10.530 -0.827 424 HB3 LYS 53 3HB LYS 53 3.977 9.341 -0.674 425 HG2 LYS 53 2HG LYS 53 3.613 8.472 -2.764 426 HG3 LYS 53 3HG LYS 53 1.923 8.980 -2.799 427 HD2 LYS 53 2HD LYS 53 3.273 11.367 -2.625 428 HD3 LYS 53 3HD LYS 53 4.327 10.398 -3.656 429 HE2 LYS 53 2HE LYS 53 1.813 9.863 -4.645 430 HE3 LYS 53 3HE LYS 53 1.718 11.570 -4.215 431 HZ1 LYS 53 3HZ LYS 53 2.779 10.559 -6.507 432 HZ2 LYS 53 1HZ LYS 53 4.149 10.907 -5.576 433 HZ3 LYS 53 2HZ LYS 53 3.023 12.124 -5.912 434 H LYS 54 H LYS 54 0.841 10.447 1.018 435 HA LYS 54 HA LYS 54 2.375 10.290 3.448 436 HB2 LYS 54 2HB LYS 54 -0.089 11.912 2.781 437 HB3 LYS 54 3HB LYS 54 0.898 12.110 4.223 438 HG2 LYS 54 2HG LYS 54 2.812 12.718 2.810 439 HG3 LYS 54 3HG LYS 54 1.787 12.563 1.381 440 HD2 LYS 54 2HD LYS 54 0.343 14.234 3.042 441 HD3 LYS 54 3HD LYS 54 2.013 14.749 3.286 442 HE2 LYS 54 2HE LYS 54 2.264 14.908 0.820 443 HE3 LYS 54 3HE LYS 54 0.550 14.530 0.658 444 HZ1 LYS 54 3HZ LYS 54 1.728 17.021 1.100 445 HZ2 LYS 54 1HZ LYS 54 0.836 16.637 2.485 446 HZ3 LYS 54 2HZ LYS 54 0.081 16.655 0.972 447 H GLY 55 H GLY 55 -1.056 9.775 2.615 448 HA2 GLY 55 2HA GLY 55 -1.197 7.799 4.782 449 HA3 GLY 55 3HA GLY 55 -2.357 9.118 4.772 450 H GLY 56 H GLY 56 -1.291 6.212 3.127 451 HA2 GLY 56 2HA GLY 56 -3.045 6.193 0.965 452 HA3 GLY 56 3HA GLY 56 -2.413 4.756 1.754 453 H GLY 57 H GLY 57 -5.102 5.428 0.611 454 HA2 GLY 57 2HA GLY 57 -6.661 4.100 2.574 455 HA3 GLY 57 3HA GLY 57 -7.027 5.819 2.579 456 H GLY 58 H GLY 58 -7.909 6.779 0.670 457 HA2 GLY 58 2HA GLY 58 -8.649 5.135 -1.567 458 HA3 GLY 58 3HA GLY 58 -10.002 5.466 -0.495 459 H GLY 59 H GLY 59 -9.213 8.109 0.255 460 HA2 GLY 59 2HA GLY 59 -8.630 9.840 -1.830 461 HA3 GLY 59 3HA GLY 59 -10.362 9.553 -1.908 462 H GLY 60 H GLY 60 -8.414 9.688 1.031 463 HA2 GLY 60 2HA GLY 60 -8.187 11.647 2.410 464 HA3 GLY 60 3HA GLY 60 -9.655 12.279 1.681 465 H GLY 61 H GLY 61 -11.603 10.679 2.023 466 HA2 GLY 61 2HA GLY 61 -11.606 10.022 4.902 467 HA3 GLY 61 3HA GLY 61 -13.013 10.583 4.012 468 H GLY 62 H GLY 62 -13.676 9.120 2.147 469 HA2 GLY 62 2HA GLY 62 -14.101 7.005 1.274 470 HA3 GLY 62 3HA GLY 62 -12.978 6.326 2.444 471 H GLY 63 H GLY 63 -15.619 8.431 3.365 472 HA2 GLY 63 2HA GLY 63 -17.539 6.428 3.905 473 HA3 GLY 63 3HA GLY 63 -16.584 6.723 5.351 474 H GLY 64 H GLY 64 -17.485 9.121 2.922 475 HA2 GLY 64 2HA GLY 64 -19.526 10.231 4.683 476 HA3 GLY 64 3HA GLY 64 -18.105 11.229 4.416 477 H VAL 65 H VAL 65 -19.617 12.784 3.521 478 HA VAL 65 HA VAL 65 -20.237 12.179 0.705 479 HB VAL 65 HB VAL 65 -22.161 13.835 0.975 480 HG11 VAL 65 1HG1 VAL 65 -21.993 11.028 1.795 481 HG12 VAL 65 2HG1 VAL 65 -23.416 11.880 2.398 482 HG13 VAL 65 3HG1 VAL 65 -23.092 11.818 0.665 483 HG21 VAL 65 3HG2 VAL 65 -22.406 13.103 3.809 484 HG22 VAL 65 1HG2 VAL 65 -21.117 14.251 3.446 485 HG23 VAL 65 2HG2 VAL 65 -22.780 14.620 2.991 486 H TRP 66 H TRP 66 -18.487 13.213 -0.169 487 HA TRP 66 HA TRP 66 -18.632 15.986 -0.562 488 HB2 TRP 66 2HB TRP 66 -16.522 16.653 0.619 489 HB3 TRP 66 3HB TRP 66 -17.858 16.254 1.697 490 HD1 TRP 66 HD1 TRP 66 -17.727 13.660 2.770 491 HE1 TRP 66 HE1 TRP 66 -15.645 12.388 3.591 492 HE3 TRP 66 HE3 TRP 66 -14.122 16.340 0.328 493 HZ2 TRP 66 HZ2 TRP 66 -12.845 12.507 3.250 494 HZ3 TRP 66 HZ3 TRP 66 -11.767 15.696 0.630 495 HH2 TRP 66 HH2 TRP 66 -11.143 13.819 2.061 496 HA PRO 67 HA PRO 67 -16.034 13.403 -3.452 497 HB2 PRO 67 2HB PRO 67 -17.484 13.980 -5.674 498 HB3 PRO 67 3HB PRO 67 -17.873 12.634 -4.596 499 HG2 PRO 67 2HG PRO 67 -19.092 15.365 -4.733 500 HG3 PRO 67 3HG PRO 67 -19.889 13.792 -4.543 501 HD2 PRO 67 2HD PRO 67 -19.438 15.458 -2.457 502 HD3 PRO 67 3HD PRO 67 -19.430 13.691 -2.287 503 H LEU 68 H LEU 68 -14.912 15.576 -2.561 504 HA LEU 68 HA LEU 68 -14.827 17.632 -4.623 505 HB2 LEU 68 2HB LEU 68 -13.413 17.417 -1.969 506 HB3 LEU 68 3HB LEU 68 -13.312 18.798 -3.060 507 HG LEU 68 HG LEU 68 -15.773 17.846 -1.596 508 HD11 LEU 68 1HD1 LEU 68 -13.637 19.504 -0.795 509 HD12 LEU 68 2HD1 LEU 68 -15.157 19.201 0.044 510 HD13 LEU 68 3HD1 LEU 68 -15.028 20.549 -1.085 511 HD21 LEU 68 3HD2 LEU 68 -16.551 20.176 -2.509 512 HD22 LEU 68 1HD2 LEU 68 -16.690 18.728 -3.506 513 HD23 LEU 68 2HD2 LEU 68 -15.353 19.850 -3.763 514 H VAL 69 H VAL 69 -13.072 14.860 -3.600 515 HA VAL 69 HA VAL 69 -10.570 15.621 -4.810 516 HB VAL 69 HB VAL 69 -9.874 13.304 -4.353 517 HG11 VAL 69 1HG1 VAL 69 -9.323 14.335 -2.446 518 HG12 VAL 69 2HG1 VAL 69 -10.869 15.181 -2.352 519 HG13 VAL 69 3HG1 VAL 69 -10.731 13.526 -1.758 520 HG21 VAL 69 3HG2 VAL 69 -12.741 12.977 -3.487 521 HG22 VAL 69 1HG2 VAL 69 -11.882 12.084 -4.742 522 HG23 VAL 69 2HG2 VAL 69 -11.454 11.855 -3.046 523 H ILE 70 H ILE 70 -13.330 13.591 -5.661 524 HA ILE 70 HA ILE 70 -12.261 12.419 -7.975 525 HB ILE 70 HB ILE 70 -14.634 12.098 -8.677 526 HG12 ILE 70 2HG1 ILE 70 -15.997 12.794 -6.324 527 HG13 ILE 70 3HG1 ILE 70 -15.020 14.201 -6.727 528 HG21 ILE 70 1HG2 ILE 70 -15.066 11.103 -6.100 529 HG22 ILE 70 2HG2 ILE 70 -14.346 10.257 -7.469 530 HG23 ILE 70 3HG2 ILE 70 -13.316 11.111 -6.320 531 HD11 ILE 70 3HD1 ILE 70 -16.014 14.306 -8.921 532 HD12 ILE 70 1HD1 ILE 70 -16.928 12.832 -8.606 533 HD13 ILE 70 2HD1 ILE 70 -17.273 14.297 -7.687 534 H ARG 71 H ARG 71 -13.615 15.571 -7.386 535 HA ARG 71 HA ARG 71 -13.843 16.194 -10.211 536 HB2 ARG 71 2HB ARG 71 -14.495 18.467 -9.352 537 HB3 ARG 71 3HB ARG 71 -15.531 17.148 -8.822 538 HG2 ARG 71 2HG ARG 71 -14.521 17.140 -6.653 539 HG3 ARG 71 3HG ARG 71 -13.301 18.306 -7.168 540 HD2 ARG 71 2HD ARG 71 -15.876 19.381 -7.731 541 HD3 ARG 71 3HD ARG 71 -15.867 18.800 -6.066 542 HE ARG 71 HE ARG 71 -13.529 20.248 -6.433 543 HH11 ARG 71 1HH1 ARG 71 -16.963 20.818 -6.496 544 HH12 ARG 71 2HH1 ARG 71 -16.830 22.469 -5.989 545 HH21 ARG 71 1HH2 ARG 71 -13.341 22.421 -5.765 546 HH22 ARG 71 2HH2 ARG 71 -14.770 23.380 -5.574 547 H THR 72 H THR 72 -11.495 16.389 -7.739 548 HA THR 72 HA THR 72 -10.019 18.633 -8.352 549 HB THR 72 HB THR 72 -8.908 15.923 -7.593 550 HG1 THR 72 HG1 THR 72 -10.119 18.008 -6.144 551 HG21 THR 72 3HG2 THR 72 -7.626 18.409 -8.200 552 HG22 THR 72 1HG2 THR 72 -6.900 16.881 -7.704 553 HG23 THR 72 2HG2 THR 72 -7.415 18.049 -6.487 554 H VAL 73 H VAL 73 -9.394 15.361 -9.642 555 HA VAL 73 HA VAL 73 -7.515 16.199 -11.566 556 HB VAL 73 HB VAL 73 -8.121 13.962 -12.682 557 HG11 VAL 73 1HG1 VAL 73 -7.233 12.792 -10.419 558 HG12 VAL 73 2HG1 VAL 73 -6.203 13.704 -11.524 559 HG13 VAL 73 3HG1 VAL 73 -6.848 14.478 -10.077 560 HG21 VAL 73 3HG2 VAL 73 -9.413 12.405 -11.380 561 HG22 VAL 73 1HG2 VAL 73 -9.635 13.598 -10.101 562 HG23 VAL 73 2HG2 VAL 73 -10.389 13.844 -11.676 563 H ILE 74 H ILE 74 -11.001 15.614 -11.764 564 HA ILE 74 HA ILE 74 -11.323 15.902 -14.519 565 HB ILE 74 HB ILE 74 -13.287 16.758 -12.391 566 HG12 ILE 74 2HG1 ILE 74 -12.266 14.320 -12.433 567 HG13 ILE 74 3HG1 ILE 74 -13.986 14.574 -12.159 568 HG21 ILE 74 1HG2 ILE 74 -13.554 16.140 -15.317 569 HG22 ILE 74 2HG2 ILE 74 -14.930 16.083 -14.217 570 HG23 ILE 74 3HG2 ILE 74 -14.049 17.593 -14.449 571 HD11 ILE 74 3HD1 ILE 74 -14.568 13.790 -14.234 572 HD12 ILE 74 1HD1 ILE 74 -12.992 14.159 -14.935 573 HD13 ILE 74 2HD1 ILE 74 -13.175 12.779 -13.851 574 H ALA 75 H ALA 75 -10.575 18.241 -12.125 575 HA ALA 75 HA ALA 75 -11.637 20.592 -13.028 576 HB1 ALA 75 1HB ALA 75 -10.226 20.393 -11.031 577 HB2 ALA 75 2HB ALA 75 -8.805 20.209 -12.061 578 HB3 ALA 75 3HB ALA 75 -9.711 21.722 -12.070 579 H GLY 76 H GLY 76 -9.204 18.640 -14.557 580 HA2 GLY 76 2HA GLY 76 -8.587 20.765 -16.482 581 HA3 GLY 76 3HA GLY 76 -7.721 19.245 -16.309 582 H TYR 77 H TYR 77 -10.201 17.668 -16.261 583 HA TYR 77 HA TYR 77 -10.379 17.015 -18.961 584 HB2 TYR 77 2HB TYR 77 -11.285 15.895 -16.645 585 HB3 TYR 77 3HB TYR 77 -12.792 16.443 -17.371 586 HD1 TYR 77 HD2 TYR 77 -12.028 16.057 -20.271 587 HD2 TYR 77 HD1 TYR 77 -11.531 13.558 -16.863 588 HE1 TYR 77 HE2 TYR 77 -12.049 14.075 -21.728 589 HE2 TYR 77 HE1 TYR 77 -11.550 11.570 -18.311 590 HH TYR 77 HH TYR 77 -11.323 11.781 -21.724 591 H ASN 78 H ASN 78 -12.376 19.160 -16.997 592 HA ASN 78 HA ASN 78 -14.512 19.636 -18.638 593 HB2 ASN 78 2HB ASN 78 -14.375 20.672 -16.465 594 HB3 ASN 78 3HB ASN 78 -12.964 21.609 -16.949 595 HD21 ASN 78 1HD2 ASN 78 -13.657 23.641 -16.832 596 HD22 ASN 78 2HD2 ASN 78 -15.031 24.274 -17.666 597 H LEU 79 H LEU 79 -11.214 20.477 -19.181 598 HA LEU 79 HA LEU 79 -11.858 22.376 -21.291 599 HB2 LEU 79 2HB LEU 79 -9.568 21.783 -19.644 600 HB3 LEU 79 3HB LEU 79 -9.119 21.817 -21.348 601 HG LEU 79 HG LEU 79 -10.659 24.075 -20.113 602 HD11 LEU 79 1HD1 LEU 79 -7.670 23.689 -20.096 603 HD12 LEU 79 2HD1 LEU 79 -8.731 23.812 -18.693 604 HD13 LEU 79 3HD1 LEU 79 -8.494 25.208 -19.745 605 HD21 LEU 79 3HD2 LEU 79 -8.708 23.967 -22.410 606 HD22 LEU 79 1HD2 LEU 79 -9.697 25.343 -21.920 607 HD23 LEU 79 2HD2 LEU 79 -10.463 23.896 -22.574 608 H TYR 80 H TYR 80 -10.576 19.122 -20.894 609 HA TYR 80 HA TYR 80 -9.632 18.562 -23.408 610 HB2 TYR 80 2HB TYR 80 -10.488 17.056 -21.135 611 HB3 TYR 80 3HB TYR 80 -11.130 16.291 -22.585 612 HD1 TYR 80 HD1 TYR 80 -8.074 17.224 -20.777 613 HD2 TYR 80 HD2 TYR 80 -9.660 15.265 -24.205 614 HE1 TYR 80 HE1 TYR 80 -5.882 16.189 -21.192 615 HE2 TYR 80 HE2 TYR 80 -7.473 14.224 -24.629 616 HH TYR 80 HH TYR 80 -5.279 14.260 -24.081 617 H ARG 81 H ARG 81 -12.999 18.339 -22.293 618 HA ARG 81 HA ARG 81 -14.002 17.560 -24.854 619 HB2 ARG 81 2HB ARG 81 -15.673 18.797 -22.683 620 HB3 ARG 81 3HB ARG 81 -16.134 17.585 -23.871 621 HG2 ARG 81 2HG ARG 81 -15.829 16.079 -22.271 622 HG3 ARG 81 3HG ARG 81 -14.098 16.371 -22.453 623 HD2 ARG 81 2HD ARG 81 -14.316 16.762 -20.216 624 HD3 ARG 81 3HD ARG 81 -14.629 18.385 -20.829 625 HE ARG 81 HE ARG 81 -17.095 17.338 -20.734 626 HH11 ARG 81 1HH1 ARG 81 -14.507 17.411 -18.407 627 HH12 ARG 81 2HH1 ARG 81 -15.566 17.414 -17.035 628 HH21 ARG 81 1HH2 ARG 81 -18.499 17.341 -18.936 629 HH22 ARG 81 2HH2 ARG 81 -17.836 17.373 -17.338 630 H ALA 82 H ALA 82 -13.313 20.569 -23.301 631 HA ALA 82 HA ALA 82 -15.008 22.353 -24.527 632 HB1 ALA 82 1HB ALA 82 -13.075 22.719 -22.824 633 HB2 ALA 82 2HB ALA 82 -12.113 23.041 -24.267 634 HB3 ALA 82 3HB ALA 82 -13.536 24.022 -23.919 635 H ILE 83 H ILE 83 -12.097 20.850 -25.843 636 HA ILE 83 HA ILE 83 -12.284 22.333 -28.320 637 HB ILE 83 HB ILE 83 -10.489 20.015 -27.592 638 HG12 ILE 83 2HG1 ILE 83 -10.102 21.973 -26.170 639 HG13 ILE 83 3HG1 ILE 83 -8.757 21.734 -27.281 640 HG21 ILE 83 1HG2 ILE 83 -10.946 21.466 -30.068 641 HG22 ILE 83 2HG2 ILE 83 -9.258 21.501 -29.560 642 HG23 ILE 83 3HG2 ILE 83 -10.079 19.957 -29.785 643 HD11 ILE 83 3HD1 ILE 83 -9.328 24.081 -27.083 644 HD12 ILE 83 1HD1 ILE 83 -9.635 23.498 -28.719 645 HD13 ILE 83 2HD1 ILE 83 -10.979 23.737 -27.601 646 H LYS 84 H LYS 84 -13.485 19.391 -27.035 647 HA LYS 84 HA LYS 84 -13.816 18.010 -29.521 648 HB2 LYS 84 2HB LYS 84 -15.109 17.577 -26.823 649 HB3 LYS 84 3HB LYS 84 -15.265 16.486 -28.193 650 HG2 LYS 84 2HG LYS 84 -12.652 17.207 -26.884 651 HG3 LYS 84 3HG LYS 84 -13.595 15.761 -26.516 652 HD2 LYS 84 2HD LYS 84 -12.501 16.475 -29.237 653 HD3 LYS 84 3HD LYS 84 -11.766 15.326 -28.116 654 HE2 LYS 84 2HE LYS 84 -14.070 14.160 -28.166 655 HE3 LYS 84 3HE LYS 84 -14.346 15.108 -29.627 656 HZ1 LYS 84 3HZ LYS 84 -12.813 13.935 -30.792 657 HZ2 LYS 84 1HZ LYS 84 -13.261 12.723 -29.699 658 HZ3 LYS 84 2HZ LYS 84 -11.844 13.611 -29.444 659 H LYS 85 H LYS 85 -15.692 20.276 -27.654 660 HA LYS 85 HA LYS 85 -18.108 19.833 -29.187 661 HB2 LYS 85 2HB LYS 85 -19.028 21.680 -27.832 662 HB3 LYS 85 3HB LYS 85 -18.319 20.414 -26.838 663 HG2 LYS 85 2HG LYS 85 -16.294 21.777 -26.572 664 HG3 LYS 85 3HG LYS 85 -17.047 23.055 -27.529 665 HD2 LYS 85 2HD LYS 85 -18.882 23.145 -25.851 666 HD3 LYS 85 3HD LYS 85 -17.990 21.979 -24.872 667 HE2 LYS 85 2HE LYS 85 -16.112 23.921 -25.424 668 HE3 LYS 85 3HE LYS 85 -17.595 24.847 -25.194 669 HZ1 LYS 85 3HZ LYS 85 -17.901 23.745 -23.060 670 HZ2 LYS 85 1HZ LYS 85 -16.417 24.557 -23.113 671 HZ3 LYS 85 2HZ LYS 85 -16.466 22.875 -23.280 672 H LYS 86 H LYS 86 -15.548 22.252 -28.955 673 HA LYS 86 HA LYS 86 -14.907 23.938 -30.340 674 HB2 LYS 86 2HB LYS 86 -14.976 22.058 -32.004 675 HB3 LYS 86 3HB LYS 86 -16.607 22.562 -32.425 676 HG2 LYS 86 2HG LYS 86 -15.588 23.769 -34.006 677 HG3 LYS 86 3HG LYS 86 -15.254 24.899 -32.691 678 HD2 LYS 86 2HD LYS 86 -13.402 22.647 -33.449 679 HD3 LYS 86 3HD LYS 86 -13.274 24.275 -34.121 680 HE2 LYS 86 2HE LYS 86 -12.992 25.177 -31.861 681 HE3 LYS 86 3HE LYS 86 -13.116 23.550 -31.195 682 HZ1 LYS 86 3HZ LYS 86 -10.898 24.824 -32.581 683 HZ2 LYS 86 1HZ LYS 86 -11.160 23.192 -32.942 684 HZ3 LYS 86 2HZ LYS 86 -10.884 23.670 -31.344 685 H GLY 87 H GLY 87 -16.183 25.380 -29.011 686 HA2 GLY 87 2HA GLY 87 -18.208 26.743 -30.608 687 HA3 GLY 87 3HA GLY 87 -18.730 26.133 -29.045 688 H GLY 88 H GLY 88 -16.542 26.657 -27.464 689 HA2 GLY 88 2HA GLY 88 -15.069 28.510 -26.896 690 HA3 GLY 88 3HA GLY 88 -16.203 29.579 -27.708 691 H GLY 89 H GLY 89 -15.096 29.462 -24.900 692 HA2 GLY 89 2HA GLY 89 -16.251 30.552 -23.088 693 HA3 GLY 89 3HA GLY 89 -17.710 29.693 -23.561 694 H GLY 90 H GLY 90 -16.143 29.877 -20.985 695 HA2 GLY 90 2HA GLY 90 -15.207 27.156 -20.591 696 HA3 GLY 90 3HA GLY 90 -15.198 28.448 -19.399 697 H GLY 91 H GLY 91 -17.761 26.860 -21.309 698 HA2 GLY 91 2HA GLY 91 -18.934 25.309 -19.397 699 HA3 GLY 91 3HA GLY 91 -19.555 26.918 -19.062 700 H GLY 92 H GLY 92 -19.075 24.730 -21.841 701 HA2 GLY 92 2HA GLY 92 -21.031 23.904 -23.029 702 HA3 GLY 92 3HA GLY 92 -21.802 25.450 -22.711 703 H GLY 93 H GLY 93 -21.567 24.231 -25.268 704 HA2 GLY 93 2HA GLY 93 -20.333 26.435 -26.681 705 HA3 GLY 93 3HA GLY 93 -19.549 24.883 -26.939 706 H GLY 94 H GLY 94 -20.065 24.433 -29.010 707 HA2 GLY 94 2HA GLY 94 -22.531 23.346 -29.676 708 HA3 GLY 94 3HA GLY 94 -22.580 25.026 -30.188 709 H GLY 95 H GLY 95 -22.075 22.030 -31.305 710 HA2 GLY 95 2HA GLY 95 -21.295 22.588 -33.824 711 HA3 GLY 95 3HA GLY 95 -19.760 22.535 -32.969 712 H GLY 96 H GLY 96 -18.816 20.688 -33.583 713 HA2 GLY 96 2HA GLY 96 -20.305 18.309 -34.162 714 HA3 GLY 96 3HA GLY 96 -18.554 18.458 -34.116 715 H VAL 97 H VAL 97 -21.437 17.829 -32.236 716 HA VAL 97 HA VAL 97 -20.001 17.340 -29.789 717 HB VAL 97 HB VAL 97 -22.323 18.146 -29.742 718 HG11 VAL 97 1HG1 VAL 97 -24.171 16.731 -30.363 719 HG12 VAL 97 2HG1 VAL 97 -23.090 16.906 -31.747 720 HG13 VAL 97 3HG1 VAL 97 -23.072 15.421 -30.794 721 HG21 VAL 97 3HG2 VAL 97 -22.321 15.390 -28.559 722 HG22 VAL 97 1HG2 VAL 97 -21.254 16.653 -27.942 723 HG23 VAL 97 2HG2 VAL 97 -23.003 16.879 -27.904 724 H TRP 98 H TRP 98 -19.163 15.477 -29.088 725 HA TRP 98 HA TRP 98 -20.118 12.911 -29.750 726 HB2 TRP 98 2HB TRP 98 -19.108 13.527 -31.954 727 HB3 TRP 98 3HB TRP 98 -17.545 13.658 -31.153 728 HD1 TRP 98 HD1 TRP 98 -19.785 10.803 -30.069 729 HE1 TRP 98 HE1 TRP 98 -18.800 8.584 -30.924 730 HE3 TRP 98 HE3 TRP 98 -16.146 12.660 -33.142 731 HZ2 TRP 98 HZ2 TRP 98 -16.751 7.733 -32.669 732 HZ3 TRP 98 HZ3 TRP 98 -14.716 11.077 -34.368 733 HH2 TRP 98 HH2 TRP 98 -15.013 8.665 -34.135 734 HA PRO 99 HA PRO 99 -17.223 13.410 -26.118 735 HB2 PRO 99 2HB PRO 99 -19.005 12.560 -24.254 736 HB3 PRO 99 3HB PRO 99 -18.877 14.248 -24.760 737 HG2 PRO 99 2HG PRO 99 -20.832 12.153 -25.627 738 HG3 PRO 99 3HG PRO 99 -21.122 13.855 -25.222 739 HD2 PRO 99 2HD PRO 99 -20.946 12.975 -27.777 740 HD3 PRO 99 3HD PRO 99 -20.416 14.597 -27.287 741 H LEU 100 H LEU 100 -16.637 11.469 -27.719 742 HA LEU 100 HA LEU 100 -17.382 8.891 -26.582 743 HB2 LEU 100 2HB LEU 100 -17.373 8.652 -28.850 744 HB3 LEU 100 3HB LEU 100 -16.075 9.823 -29.077 745 HG LEU 100 HG LEU 100 -14.436 8.159 -28.373 746 HD11 LEU 100 1HD1 LEU 100 -16.671 6.877 -27.251 747 HD12 LEU 100 2HD1 LEU 100 -14.988 6.354 -27.214 748 HD13 LEU 100 3HD1 LEU 100 -16.053 5.804 -28.507 749 HD21 LEU 100 3HD2 LEU 100 -14.813 6.521 -30.268 750 HD22 LEU 100 1HD2 LEU 100 -14.798 8.230 -30.703 751 HD23 LEU 100 2HD2 LEU 100 -16.331 7.368 -30.571 752 H VAL 101 H VAL 101 -14.442 10.793 -27.195 753 HA VAL 101 HA VAL 101 -12.775 8.950 -25.741 754 HB VAL 101 HB VAL 101 -10.985 10.603 -26.089 755 HG11 VAL 101 1HG1 VAL 101 -11.204 9.057 -27.841 756 HG12 VAL 101 2HG1 VAL 101 -12.678 9.818 -28.443 757 HG13 VAL 101 3HG1 VAL 101 -11.123 10.629 -28.636 758 HG21 VAL 101 3HG2 VAL 101 -12.223 12.655 -25.874 759 HG22 VAL 101 1HG2 VAL 101 -11.468 12.611 -27.467 760 HG23 VAL 101 2HG2 VAL 101 -13.190 12.269 -27.298 761 H ILE 102 H ILE 102 -14.340 12.036 -25.120 762 HA ILE 102 HA ILE 102 -13.039 12.715 -22.736 763 HB ILE 102 HB ILE 102 -14.900 14.168 -22.260 764 HG12 ILE 102 2HG1 ILE 102 -16.814 13.941 -24.148 765 HG13 ILE 102 3HG1 ILE 102 -16.349 12.250 -23.997 766 HG21 ILE 102 1HG2 ILE 102 -13.510 15.062 -23.927 767 HG22 ILE 102 2HG2 ILE 102 -14.142 13.969 -25.158 768 HG23 ILE 102 3HG2 ILE 102 -15.149 15.278 -24.540 769 HD11 ILE 102 3HD1 ILE 102 -16.602 13.121 -21.382 770 HD12 ILE 102 1HD1 ILE 102 -17.935 13.896 -22.237 771 HD13 ILE 102 2HD1 ILE 102 -17.754 12.142 -22.289 772 H ARG 103 H ARG 103 -15.518 10.379 -23.407 773 HA ARG 103 HA ARG 103 -16.110 10.001 -20.576 774 HB2 ARG 103 2HB ARG 103 -17.789 8.378 -21.373 775 HB3 ARG 103 3HB ARG 103 -17.995 9.962 -22.107 776 HG2 ARG 103 2HG ARG 103 -16.915 9.175 -24.142 777 HG3 ARG 103 3HG ARG 103 -16.670 7.591 -23.406 778 HD2 ARG 103 2HD ARG 103 -19.160 7.450 -23.120 779 HD3 ARG 103 3HD ARG 103 -19.286 8.915 -24.093 780 HE ARG 103 HE ARG 103 -18.830 7.676 -25.970 781 HH11 ARG 103 1HH1 ARG 103 -18.117 5.792 -23.130 782 HH12 ARG 103 2HH1 ARG 103 -17.878 4.318 -24.009 783 HH21 ARG 103 1HH2 ARG 103 -18.518 5.741 -27.138 784 HH22 ARG 103 2HH2 ARG 103 -18.105 4.290 -26.288 785 H THR 104 H THR 104 -14.116 8.707 -23.038 786 HA THR 104 HA THR 104 -13.868 6.039 -22.226 787 HB THR 104 HB THR 104 -11.674 7.746 -23.414 788 HG1 THR 104 HG1 THR 104 -13.871 6.390 -24.601 789 HG21 THR 104 3HG2 THR 104 -11.109 5.451 -22.489 790 HG22 THR 104 1HG2 THR 104 -10.713 5.723 -24.185 791 HG23 THR 104 2HG2 THR 104 -12.146 4.791 -23.753 792 H VAL 105 H VAL 105 -11.713 8.783 -21.463 793 HA VAL 105 HA VAL 105 -10.174 7.372 -19.564 794 HB VAL 105 HB VAL 105 -10.579 10.359 -19.589 795 HG11 VAL 105 1HG1 VAL 105 -9.127 8.782 -17.897 796 HG12 VAL 105 2HG1 VAL 105 -7.923 9.232 -19.106 797 HG13 VAL 105 3HG1 VAL 105 -8.803 10.483 -18.228 798 HG21 VAL 105 3HG2 VAL 105 -9.794 10.396 -21.673 799 HG22 VAL 105 1HG2 VAL 105 -8.272 9.773 -21.035 800 HG23 VAL 105 2HG2 VAL 105 -9.490 8.659 -21.655 801 H ILE 106 H ILE 106 -12.995 9.483 -19.252 802 HA ILE 106 HA ILE 106 -13.078 9.699 -16.477 803 HB ILE 106 HB ILE 106 -15.215 9.781 -18.579 804 HG12 ILE 106 2HG1 ILE 106 -13.751 11.729 -16.844 805 HG13 ILE 106 3HG1 ILE 106 -14.071 11.796 -18.574 806 HG21 ILE 106 1HG2 ILE 106 -15.652 10.054 -15.608 807 HG22 ILE 106 2HG2 ILE 106 -16.842 10.416 -16.857 808 HG23 ILE 106 3HG2 ILE 106 -16.269 8.763 -16.639 809 HD11 ILE 106 3HD1 ILE 106 -16.500 12.161 -17.960 810 HD12 ILE 106 1HD1 ILE 106 -15.934 12.427 -16.312 811 HD13 ILE 106 2HD1 ILE 106 -15.383 13.481 -17.614 812 H ALA 107 H ALA 107 -13.686 6.991 -18.490 813 HA ALA 107 HA ALA 107 -15.528 5.471 -17.166 814 HB1 ALA 107 1HB ALA 107 -14.504 4.703 -19.202 815 HB2 ALA 107 2HB ALA 107 -12.938 4.552 -18.405 816 HB3 ALA 107 3HB ALA 107 -14.266 3.485 -17.948 817 H GLY 108 H GLY 108 -12.384 6.402 -16.057 818 HA2 GLY 108 2HA GLY 108 -12.454 4.443 -13.878 819 HA3 GLY 108 3HA GLY 108 -11.095 5.477 -14.296 820 H TYR 109 H TYR 109 -12.768 7.883 -14.454 821 HA TYR 109 HA TYR 109 -12.424 8.872 -11.888 822 HB2 TYR 109 2HB TYR 109 -12.675 10.593 -13.370 823 HB3 TYR 109 3HB TYR 109 -13.912 9.755 -14.301 824 HD1 TYR 109 HD2 TYR 109 -16.262 9.866 -13.629 825 HD2 TYR 109 HD1 TYR 109 -13.259 11.982 -11.482 826 HE1 TYR 109 HE2 TYR 109 -18.003 11.221 -12.542 827 HE2 TYR 109 HE1 TYR 109 -14.992 13.342 -10.388 828 HH TYR 109 HH TYR 109 -18.285 13.294 -11.412 829 H ASN 110 H ASN 110 -15.425 7.723 -13.418 830 HA ASN 110 HA ASN 110 -17.189 8.168 -11.342 831 HB2 ASN 110 2HB ASN 110 -17.542 7.185 -13.753 832 HB3 ASN 110 3HB ASN 110 -17.401 5.636 -12.927 833 HD21 ASN 110 1HD2 ASN 110 -19.581 5.259 -13.580 834 HD22 ASN 110 2HD2 ASN 110 -20.889 5.944 -12.682 835 H LEU 111 H LEU 111 -14.627 5.884 -11.539 836 HA LEU 111 HA LEU 111 -15.621 4.036 -9.602 837 HB2 LEU 111 2HB LEU 111 -13.587 4.011 -11.410 838 HB3 LEU 111 3HB LEU 111 -12.710 4.261 -9.902 839 HG LEU 111 HG LEU 111 -12.804 1.899 -10.512 840 HD11 LEU 111 1HD1 LEU 111 -14.534 2.461 -8.110 841 HD12 LEU 111 2HD1 LEU 111 -12.777 2.611 -8.134 842 HD13 LEU 111 3HD1 LEU 111 -13.531 1.039 -8.395 843 HD21 LEU 111 3HD2 LEU 111 -15.280 2.396 -11.470 844 HD22 LEU 111 1HD2 LEU 111 -15.677 1.647 -9.923 845 HD23 LEU 111 2HD2 LEU 111 -14.673 0.783 -11.089 846 H TYR 112 H TYR 112 -13.323 6.739 -9.494 847 HA TYR 112 HA TYR 112 -12.481 6.536 -6.872 848 HB2 TYR 112 2HB TYR 112 -12.623 8.664 -8.884 849 HB3 TYR 112 3HB TYR 112 -12.667 9.257 -7.228 850 HD1 TYR 112 HD2 TYR 112 -10.916 7.258 -5.895 851 HD2 TYR 112 HD1 TYR 112 -10.487 9.269 -9.620 852 HE1 TYR 112 HE2 TYR 112 -8.474 7.012 -5.740 853 HE2 TYR 112 HE1 TYR 112 -8.044 9.028 -9.476 854 HH TYR 112 HH TYR 112 -6.530 6.990 -7.194 855 H ARG 113 H ARG 113 -15.455 7.926 -8.147 856 HA ARG 113 HA ARG 113 -16.319 8.930 -5.595 857 HB2 ARG 113 2HB ARG 113 -17.339 8.919 -8.361 858 HB3 ARG 113 3HB ARG 113 -18.578 8.884 -7.114 859 HG2 ARG 113 2HG ARG 113 -17.092 10.847 -6.122 860 HG3 ARG 113 3HG ARG 113 -16.655 11.019 -7.823 861 HD2 ARG 113 2HD ARG 113 -18.564 12.435 -7.222 862 HD3 ARG 113 3HD ARG 113 -18.999 11.223 -8.427 863 HE ARG 113 HE ARG 113 -19.532 10.432 -5.709 864 HH11 ARG 113 1HH1 ARG 113 -20.763 12.058 -8.531 865 HH12 ARG 113 2HH1 ARG 113 -22.425 11.836 -8.094 866 HH21 ARG 113 1HH2 ARG 113 -21.716 10.134 -5.123 867 HH22 ARG 113 2HH2 ARG 113 -22.966 10.742 -6.155 868 H ALA 114 H ALA 114 -16.553 5.953 -7.322 869 HA ALA 114 HA ALA 114 -18.870 4.816 -6.353 870 HB1 ALA 114 1HB ALA 114 -16.555 3.005 -6.387 871 HB2 ALA 114 2HB ALA 114 -18.096 2.900 -7.240 872 HB3 ALA 114 3HB ALA 114 -16.808 3.930 -7.867 873 H ILE 115 H ILE 115 -15.767 5.212 -4.741 874 HA ILE 115 HA ILE 115 -16.607 3.696 -2.423 875 HB ILE 115 HB ILE 115 -14.134 5.380 -2.837 876 HG12 ILE 115 2HG1 ILE 115 -14.196 3.513 -4.393 877 HG13 ILE 115 3HG1 ILE 115 -13.004 3.192 -3.138 878 HG21 ILE 115 1HG2 ILE 115 -15.209 3.944 -0.533 879 HG22 ILE 115 2HG2 ILE 115 -13.547 3.509 -0.929 880 HG23 ILE 115 3HG2 ILE 115 -13.967 5.193 -0.613 881 HD11 ILE 115 3HD1 ILE 115 -14.309 1.211 -3.680 882 HD12 ILE 115 1HD1 ILE 115 -14.569 1.717 -2.011 883 HD13 ILE 115 2HD1 ILE 115 -15.789 2.061 -3.238 884 H LYS 116 H LYS 116 -16.727 6.947 -3.508 885 HA LYS 116 HA LYS 116 -16.895 8.144 -0.894 886 HB2 LYS 116 2HB LYS 116 -16.799 10.132 -1.976 887 HB3 LYS 116 3HB LYS 116 -16.255 9.137 -3.321 888 HG2 LYS 116 2HG LYS 116 -17.872 10.327 -4.376 889 HG3 LYS 116 3HG LYS 116 -18.855 8.985 -3.786 890 HD2 LYS 116 2HD LYS 116 -18.852 10.770 -1.675 891 HD3 LYS 116 3HD LYS 116 -18.947 11.810 -3.098 892 HE2 LYS 116 2HE LYS 116 -21.032 11.136 -3.601 893 HE3 LYS 116 3HE LYS 116 -20.693 9.455 -3.189 894 HZ1 LYS 116 3HZ LYS 116 -22.236 10.139 -1.611 895 HZ2 LYS 116 1HZ LYS 116 -21.517 11.656 -1.400 896 HZ3 LYS 116 2HZ LYS 116 -20.763 10.271 -0.790 897 H LYS 117 H LYS 117 -19.058 6.613 -3.069 898 HA LYS 117 HA LYS 117 -21.440 7.875 -2.027 899 HB2 LYS 117 2HB LYS 117 -20.792 6.401 -4.331 900 HB3 LYS 117 3HB LYS 117 -21.945 5.412 -3.445 901 HG2 LYS 117 2HG LYS 117 -23.008 7.978 -3.354 902 HG3 LYS 117 3HG LYS 117 -22.375 7.807 -4.993 903 HD2 LYS 117 2HD LYS 117 -24.139 5.747 -3.682 904 HD3 LYS 117 3HD LYS 117 -24.767 7.076 -4.660 905 HE2 LYS 117 2HE LYS 117 -23.290 6.279 -6.521 906 HE3 LYS 117 3HE LYS 117 -22.917 4.865 -5.537 907 HZ1 LYS 117 3HZ LYS 117 -24.724 3.930 -6.378 908 HZ2 LYS 117 1HZ LYS 117 -25.187 5.359 -7.157 909 HZ3 LYS 117 2HZ LYS 117 -25.668 5.072 -5.561 910 H LYS 118 H LYS 118 -19.791 4.764 -1.712 911 HA LYS 118 HA LYS 118 -21.745 3.898 0.283 912 HB2 LYS 118 2HB LYS 118 -19.432 2.435 -1.003 913 HB3 LYS 118 3HB LYS 118 -20.531 1.730 0.175 914 HG2 LYS 118 2HG LYS 118 -22.405 2.226 -1.410 915 HG3 LYS 118 3HG LYS 118 -21.184 2.679 -2.602 916 HD2 LYS 118 2HD LYS 118 -21.033 0.536 -3.180 917 HD3 LYS 118 3HD LYS 118 -20.385 0.190 -1.576 918 HE2 LYS 118 2HE LYS 118 -22.681 -0.105 -0.739 919 HE3 LYS 118 3HE LYS 118 -23.297 0.190 -2.364 920 HZ1 LYS 118 3HZ LYS 118 -22.115 -1.764 -3.136 921 HZ2 LYS 118 1HZ LYS 118 -23.160 -2.174 -1.870 922 HZ3 LYS 118 2HZ LYS 118 -21.499 -2.041 -1.585 Start of MODEL 7 1 H1 VAL 1 H VAL 1 6.524 0.242 -6.272 2 HA VAL 1 HA VAL 1 4.154 0.907 -7.873 3 HB VAL 1 HB VAL 1 3.664 -1.474 -8.215 4 HG11 VAL 1 1HG1 VAL 1 6.360 -0.606 -9.252 5 HG12 VAL 1 2HG1 VAL 1 5.388 -1.920 -9.917 6 HG13 VAL 1 3HG1 VAL 1 4.793 -0.261 -9.983 7 HG21 VAL 1 3HG2 VAL 1 5.787 -2.987 -7.903 8 HG22 VAL 1 1HG2 VAL 1 6.191 -1.795 -6.668 9 HG23 VAL 1 2HG2 VAL 1 4.681 -2.700 -6.559 10 H TRP 2 H TRP 2 2.265 0.839 -6.782 11 HA TRP 2 HA TRP 2 1.622 -0.765 -4.609 12 HB2 TRP 2 2HB TRP 2 3.050 0.187 -3.087 13 HB3 TRP 2 3HB TRP 2 3.063 1.743 -3.912 14 HD1 TRP 2 HD1 TRP 2 2.124 3.511 -2.329 15 HE1 TRP 2 HE1 TRP 2 0.160 3.657 -0.673 16 HE3 TRP 2 HE3 TRP 2 0.360 -1.270 -2.738 17 HZ2 TRP 2 HZ2 TRP 2 -1.869 1.970 0.328 18 HZ3 TRP 2 HZ3 TRP 2 -1.597 -1.924 -1.396 19 HH2 TRP 2 HH2 TRP 2 -2.686 -0.336 0.105 20 HA PRO 3 HA PRO 3 -1.515 2.903 -4.811 21 HB2 PRO 3 2HB PRO 3 -0.891 4.988 -6.433 22 HB3 PRO 3 3HB PRO 3 -0.418 4.920 -4.732 23 HG2 PRO 3 2HG PRO 3 1.195 4.287 -7.174 24 HG3 PRO 3 3HG PRO 3 1.669 5.190 -5.723 25 HD2 PRO 3 2HD PRO 3 2.358 2.601 -6.118 26 HD3 PRO 3 3HD PRO 3 2.054 3.272 -4.503 27 H LEU 4 H LEU 4 -2.686 1.338 -5.959 28 HA LEU 4 HA LEU 4 -2.481 1.261 -8.857 29 HB2 LEU 4 2HB LEU 4 -4.326 -0.239 -7.003 30 HB3 LEU 4 3HB LEU 4 -4.105 -0.548 -8.724 31 HG LEU 4 HG LEU 4 -1.554 -0.745 -7.549 32 HD11 LEU 4 1HD1 LEU 4 -1.712 -1.972 -5.651 33 HD12 LEU 4 2HD1 LEU 4 -3.258 -2.687 -6.105 34 HD13 LEU 4 3HD1 LEU 4 -3.200 -1.042 -5.474 35 HD21 LEU 4 3HD2 LEU 4 -1.512 -2.709 -8.676 36 HD22 LEU 4 1HD2 LEU 4 -2.957 -2.032 -9.428 37 HD23 LEU 4 2HD2 LEU 4 -3.111 -3.197 -8.112 38 H VAL 5 H VAL 5 -4.600 2.494 -6.368 39 HA VAL 5 HA VAL 5 -6.936 2.944 -7.775 40 HB VAL 5 HB VAL 5 -7.273 4.918 -6.256 41 HG11 VAL 5 1HG1 VAL 5 -6.678 3.200 -4.166 42 HG12 VAL 5 2HG1 VAL 5 -8.187 3.260 -5.080 43 HG13 VAL 5 3HG1 VAL 5 -6.915 2.131 -5.548 44 HG21 VAL 5 3HG2 VAL 5 -5.070 5.737 -5.960 45 HG22 VAL 5 1HG2 VAL 5 -5.577 5.105 -4.393 46 HG23 VAL 5 2HG2 VAL 5 -4.484 4.167 -5.411 47 H ILE 6 H ILE 6 -4.029 4.967 -7.617 48 HA ILE 6 HA ILE 6 -4.961 7.152 -9.074 49 HB ILE 6 HB ILE 6 -2.704 7.787 -9.414 50 HG12 ILE 6 2HG1 ILE 6 -0.999 5.800 -8.649 51 HG13 ILE 6 3HG1 ILE 6 -2.257 4.872 -9.458 52 HG21 ILE 6 1HG2 ILE 6 -1.952 7.874 -7.242 53 HG22 ILE 6 2HG2 ILE 6 -3.646 7.448 -7.001 54 HG23 ILE 6 3HG2 ILE 6 -2.402 6.202 -6.906 55 HD11 ILE 6 3HD1 ILE 6 -1.686 7.070 -11.114 56 HD12 ILE 6 1HD1 ILE 6 -0.140 6.405 -10.589 57 HD13 ILE 6 2HD1 ILE 6 -1.319 5.368 -11.393 58 H ARG 7 H ARG 7 -4.150 3.973 -10.111 59 HA ARG 7 HA ARG 7 -3.827 4.734 -12.895 60 HB2 ARG 7 2HB ARG 7 -2.874 2.713 -13.181 61 HB3 ARG 7 3HB ARG 7 -2.812 2.676 -11.424 62 HG2 ARG 7 2HG ARG 7 -5.158 1.611 -11.595 63 HG3 ARG 7 3HG ARG 7 -4.710 1.297 -13.273 64 HD2 ARG 7 2HD ARG 7 -2.736 0.566 -11.190 65 HD3 ARG 7 3HD ARG 7 -4.198 -0.414 -11.284 66 HE ARG 7 HE ARG 7 -3.344 -0.293 -13.856 67 HH11 ARG 7 1HH1 ARG 7 -1.838 -1.198 -10.851 68 HH12 ARG 7 2HH1 ARG 7 -0.763 -2.342 -11.583 69 HH21 ARG 7 1HH2 ARG 7 -1.934 -1.796 -14.832 70 HH22 ARG 7 2HH2 ARG 7 -0.817 -2.680 -13.848 71 H THR 8 H THR 8 -6.334 3.807 -10.766 72 HA THR 8 HA THR 8 -8.124 2.428 -12.334 73 HB THR 8 HB THR 8 -8.981 4.658 -10.494 74 HG1 THR 8 HG1 THR 8 -7.841 2.140 -9.924 75 HG21 THR 8 3HG2 THR 8 -10.473 2.245 -10.239 76 HG22 THR 8 1HG2 THR 8 -10.361 2.651 -11.951 77 HG23 THR 8 2HG2 THR 8 -11.020 3.822 -10.809 78 H VAL 9 H VAL 9 -8.085 5.976 -11.932 79 HA VAL 9 HA VAL 9 -9.936 6.469 -14.008 80 HB VAL 9 HB VAL 9 -9.124 8.825 -13.891 81 HG11 VAL 9 1HG1 VAL 9 -10.898 7.991 -12.412 82 HG12 VAL 9 2HG1 VAL 9 -9.680 7.544 -11.216 83 HG13 VAL 9 3HG1 VAL 9 -9.926 9.240 -11.634 84 HG21 VAL 9 3HG2 VAL 9 -6.820 8.587 -13.420 85 HG22 VAL 9 1HG2 VAL 9 -7.534 9.317 -11.982 86 HG23 VAL 9 2HG2 VAL 9 -7.136 7.599 -11.994 87 H ILE 10 H ILE 10 -6.394 6.536 -13.908 88 HA ILE 10 HA ILE 10 -5.907 7.520 -16.464 89 HB ILE 10 HB ILE 10 -4.338 5.666 -14.697 90 HG12 ILE 10 2HG1 ILE 10 -4.140 8.549 -15.546 91 HG13 ILE 10 3HG1 ILE 10 -4.278 7.894 -13.918 92 HG21 ILE 10 1HG2 ILE 10 -3.836 4.999 -16.980 93 HG22 ILE 10 2HG2 ILE 10 -3.514 6.677 -17.416 94 HG23 ILE 10 3HG2 ILE 10 -2.463 5.846 -16.269 95 HD11 ILE 10 3HD1 ILE 10 -1.978 6.819 -14.434 96 HD12 ILE 10 1HD1 ILE 10 -1.894 8.043 -15.701 97 HD13 ILE 10 2HD1 ILE 10 -2.071 8.530 -14.015 98 H ALA 11 H ALA 11 -7.201 4.503 -15.496 99 HA ALA 11 HA ALA 11 -6.433 2.682 -17.364 100 HB1 ALA 11 1HB ALA 11 -9.229 3.177 -16.351 101 HB2 ALA 11 2HB ALA 11 -8.712 1.724 -17.207 102 HB3 ALA 11 3HB ALA 11 -8.012 2.118 -15.637 103 H GLY 12 H GLY 12 -8.320 5.554 -17.896 104 HA2 GLY 12 2HA GLY 12 -8.981 4.715 -20.627 105 HA3 GLY 12 3HA GLY 12 -9.625 6.123 -19.795 106 H TYR 13 H TYR 13 -6.973 6.992 -18.884 107 HA TYR 13 HA TYR 13 -6.336 8.760 -20.933 108 HB2 TYR 13 2HB TYR 13 -5.499 9.497 -18.931 109 HB3 TYR 13 3HB TYR 13 -5.009 7.886 -18.418 110 HD1 TYR 13 HD2 TYR 13 -2.889 6.910 -19.283 111 HD2 TYR 13 HD1 TYR 13 -3.985 10.947 -20.061 112 HE1 TYR 13 HE2 TYR 13 -0.563 7.417 -19.898 113 HE2 TYR 13 HE1 TYR 13 -1.662 11.465 -20.680 114 HH TYR 13 HH TYR 13 0.880 9.739 -19.887 115 H ASN 14 H ASN 14 -4.774 5.700 -20.037 116 HA ASN 14 HA ASN 14 -2.636 5.677 -21.750 117 HB2 ASN 14 2HB ASN 14 -4.094 3.742 -20.240 118 HB3 ASN 14 3HB ASN 14 -3.776 3.069 -21.836 119 HD21 ASN 14 1HD2 ASN 14 -2.302 1.577 -21.123 120 HD22 ASN 14 2HD2 ASN 14 -0.736 2.008 -20.534 121 H LEU 15 H LEU 15 -5.966 5.592 -22.559 122 HA LEU 15 HA LEU 15 -5.484 4.565 -25.242 123 HB2 LEU 15 2HB LEU 15 -8.049 5.557 -24.010 124 HB3 LEU 15 3HB LEU 15 -7.883 4.670 -25.524 125 HG LEU 15 HG LEU 15 -6.860 3.316 -23.106 126 HD11 LEU 15 1HD1 LEU 15 -9.770 3.058 -23.476 127 HD12 LEU 15 2HD1 LEU 15 -9.218 4.561 -22.739 128 HD13 LEU 15 3HD1 LEU 15 -8.800 3.014 -22.003 129 HD21 LEU 15 3HD2 LEU 15 -7.684 2.681 -25.761 130 HD22 LEU 15 1HD2 LEU 15 -8.677 1.774 -24.621 131 HD23 LEU 15 2HD2 LEU 15 -6.919 1.642 -24.559 132 H TYR 16 H TYR 16 -6.403 7.560 -23.621 133 HA TYR 16 HA TYR 16 -7.058 9.136 -25.794 134 HB2 TYR 16 2HB TYR 16 -6.320 9.560 -23.042 135 HB3 TYR 16 3HB TYR 16 -5.578 10.791 -24.058 136 HD1 TYR 16 HD2 TYR 16 -7.190 11.937 -25.785 137 HD2 TYR 16 HD1 TYR 16 -8.490 9.874 -22.298 138 HE1 TYR 16 HE2 TYR 16 -9.321 13.163 -25.861 139 HE2 TYR 16 HE1 TYR 16 -10.625 11.094 -22.365 140 HH TYR 16 HH TYR 16 -11.171 13.768 -23.799 141 H ARG 17 H ARG 17 -3.857 8.409 -24.468 142 HA ARG 17 HA ARG 17 -2.474 10.081 -26.337 143 HB2 ARG 17 2HB ARG 17 -1.799 8.408 -24.059 144 HB3 ARG 17 3HB ARG 17 -0.643 8.219 -25.370 145 HG2 ARG 17 2HG ARG 17 -0.868 10.908 -25.299 146 HG3 ARG 17 3HG ARG 17 -1.141 10.509 -23.602 147 HD2 ARG 17 2HD ARG 17 1.214 9.625 -25.266 148 HD3 ARG 17 3HD ARG 17 1.228 10.923 -24.072 149 HE ARG 17 HE ARG 17 0.362 8.773 -22.665 150 HH11 ARG 17 1HH1 ARG 17 3.122 9.371 -24.701 151 HH12 ARG 17 2HH1 ARG 17 4.155 8.275 -23.845 152 HH21 ARG 17 1HH2 ARG 17 1.712 7.327 -21.530 153 HH22 ARG 17 2HH2 ARG 17 3.352 7.112 -22.042 154 H ALA 18 H ALA 18 -3.675 6.852 -26.349 155 HA ALA 18 HA ALA 18 -2.010 5.528 -28.098 156 HB1 ALA 18 1HB ALA 18 -4.887 5.124 -28.585 157 HB2 ALA 18 2HB ALA 18 -3.623 3.956 -28.194 158 HB3 ALA 18 3HB ALA 18 -4.355 4.925 -26.915 159 H ILE 19 H ILE 19 -4.522 7.894 -28.823 160 HA ILE 19 HA ILE 19 -4.177 7.597 -31.680 161 HB ILE 19 HB ILE 19 -5.778 9.624 -30.115 162 HG12 ILE 19 2HG1 ILE 19 -6.602 7.349 -29.796 163 HG13 ILE 19 3HG1 ILE 19 -7.719 8.262 -30.805 164 HG21 ILE 19 1HG2 ILE 19 -5.194 9.316 -32.970 165 HG22 ILE 19 2HG2 ILE 19 -6.905 9.495 -32.585 166 HG23 ILE 19 3HG2 ILE 19 -5.752 10.726 -32.070 167 HD11 ILE 19 3HD1 ILE 19 -6.009 7.070 -32.617 168 HD12 ILE 19 1HD1 ILE 19 -6.258 5.837 -31.381 169 HD13 ILE 19 2HD1 ILE 19 -7.643 6.549 -32.209 170 H LYS 20 H LYS 20 -2.818 9.463 -29.149 171 HA LYS 20 HA LYS 20 -1.987 11.692 -30.750 172 HB2 LYS 20 2HB LYS 20 -0.939 10.764 -28.069 173 HB3 LYS 20 3HB LYS 20 -0.668 12.341 -28.800 174 HG2 LYS 20 2HG LYS 20 -3.470 11.453 -28.369 175 HG3 LYS 20 3HG LYS 20 -2.522 11.968 -26.972 176 HD2 LYS 20 2HD LYS 20 -2.914 14.090 -27.502 177 HD3 LYS 20 3HD LYS 20 -2.085 13.852 -29.042 178 HE2 LYS 20 2HE LYS 20 -4.060 13.424 -30.182 179 HE3 LYS 20 3HE LYS 20 -4.931 12.988 -28.712 180 HZ1 LYS 20 3HZ LYS 20 -5.610 15.069 -28.484 181 HZ2 LYS 20 1HZ LYS 20 -4.924 15.438 -29.986 182 HZ3 LYS 20 2HZ LYS 20 -4.030 15.668 -28.569 183 H LYS 21 H LYS 21 -0.696 8.563 -29.957 184 HA LYS 21 HA LYS 21 1.983 9.170 -30.826 185 HB2 LYS 21 2HB LYS 21 0.543 6.737 -29.866 186 HB3 LYS 21 3HB LYS 21 2.036 6.522 -30.772 187 HG2 LYS 21 2HG LYS 21 3.294 7.129 -29.040 188 HG3 LYS 21 3HG LYS 21 2.275 8.525 -28.679 189 HD2 LYS 21 2HD LYS 21 2.242 7.008 -26.803 190 HD3 LYS 21 3HD LYS 21 0.657 7.005 -27.580 191 HE2 LYS 21 2HE LYS 21 0.816 4.843 -28.151 192 HE3 LYS 21 3HE LYS 21 2.499 5.004 -28.651 193 HZ1 LYS 21 3HZ LYS 21 3.198 4.192 -26.720 194 HZ2 LYS 21 1HZ LYS 21 1.599 3.734 -26.411 195 HZ3 LYS 21 2HZ LYS 21 2.187 5.205 -25.818 196 H LYS 22 H LYS 22 -0.850 7.537 -32.161 197 HA LYS 22 HA LYS 22 0.480 6.762 -34.583 198 HB2 LYS 22 2HB LYS 22 -1.619 5.896 -35.280 199 HB3 LYS 22 3HB LYS 22 -1.505 5.580 -33.553 200 HG2 LYS 22 2HG LYS 22 -3.587 6.411 -33.528 201 HG3 LYS 22 3HG LYS 22 -2.754 7.968 -33.521 202 HD2 LYS 22 2HD LYS 22 -3.828 8.474 -35.404 203 HD3 LYS 22 3HD LYS 22 -2.908 7.202 -36.211 204 HE2 LYS 22 2HE LYS 22 -4.780 5.676 -35.120 205 HE3 LYS 22 3HE LYS 22 -5.696 7.181 -35.182 206 HZ1 LYS 22 3HZ LYS 22 -5.540 5.447 -37.203 207 HZ2 LYS 22 1HZ LYS 22 -4.276 6.494 -37.612 208 HZ3 LYS 22 2HZ LYS 22 -5.842 7.099 -37.406 209 H GLY 23 H GLY 23 0.365 7.696 -36.598 210 HA2 GLY 23 2HA GLY 23 -0.372 9.252 -38.206 211 HA3 GLY 23 3HA GLY 23 -1.195 10.143 -36.934 212 H GLY 24 H GLY 24 1.401 9.893 -35.323 213 HA2 GLY 24 2HA GLY 24 3.557 11.100 -36.500 214 HA3 GLY 24 3HA GLY 24 2.462 12.428 -36.147 215 H GLY 25 H GLY 25 4.017 9.622 -34.606 216 HA2 GLY 25 2HA GLY 25 5.169 11.075 -32.519 217 HA3 GLY 25 3HA GLY 25 3.608 10.501 -31.952 218 H GLY 26 H GLY 26 5.267 9.480 -30.406 219 HA2 GLY 26 2HA GLY 26 5.544 6.706 -31.220 220 HA3 GLY 26 3HA GLY 26 7.053 7.537 -30.871 221 H GLY 27 H GLY 27 5.989 5.261 -29.481 222 HA2 GLY 27 2HA GLY 27 4.874 6.171 -26.989 223 HA3 GLY 27 3HA GLY 27 5.404 4.538 -27.362 224 H GLY 28 H GLY 28 6.089 4.940 -24.996 225 HA2 GLY 28 2HA GLY 28 7.983 4.823 -23.660 226 HA3 GLY 28 3HA GLY 28 8.948 5.335 -25.037 227 H GLY 29 H GLY 29 10.035 6.608 -23.310 228 HA2 GLY 29 2HA GLY 29 8.850 8.669 -21.877 229 HA3 GLY 29 3HA GLY 29 10.524 8.662 -22.411 230 H GLY 30 H GLY 30 8.364 10.787 -22.248 231 HA2 GLY 30 2HA GLY 30 8.783 11.805 -24.982 232 HA3 GLY 30 3HA GLY 30 7.186 11.873 -24.251 233 H GLY 31 H GLY 31 7.566 14.214 -24.811 234 HA2 GLY 31 2HA GLY 31 8.871 15.528 -22.511 235 HA3 GLY 31 3HA GLY 31 9.063 16.144 -24.146 236 H GLY 32 H GLY 32 7.757 17.751 -24.711 237 HA2 GLY 32 2HA GLY 32 4.983 17.804 -24.056 238 HA3 GLY 32 3HA GLY 32 5.889 18.924 -23.049 239 H VAL 33 H VAL 33 4.420 18.409 -26.070 240 HA VAL 33 HA VAL 33 4.637 21.110 -26.838 241 HB VAL 33 HB VAL 33 6.983 20.331 -27.345 242 HG11 VAL 33 1HG1 VAL 33 5.687 18.169 -28.481 243 HG12 VAL 33 2HG1 VAL 33 6.247 19.104 -29.869 244 HG13 VAL 33 3HG1 VAL 33 7.397 18.567 -28.643 245 HG21 VAL 33 3HG2 VAL 33 7.148 21.756 -29.134 246 HG22 VAL 33 1HG2 VAL 33 5.702 21.117 -29.915 247 HG23 VAL 33 2HG2 VAL 33 5.550 22.196 -28.529 248 H TRP 34 H TRP 34 2.694 18.962 -26.609 249 HA TRP 34 HA TRP 34 1.075 19.515 -28.801 250 HB2 TRP 34 2HB TRP 34 2.233 18.277 -30.347 251 HB3 TRP 34 3HB TRP 34 2.870 17.165 -29.139 252 HD1 TRP 34 HD1 TRP 34 2.013 14.815 -29.638 253 HE1 TRP 34 HE1 TRP 34 -0.220 13.778 -30.387 254 HE3 TRP 34 HE3 TRP 34 -0.718 19.098 -30.215 255 HZ2 TRP 34 HZ2 TRP 34 -2.798 14.659 -31.126 256 HZ3 TRP 34 HZ3 TRP 34 -3.060 18.914 -30.946 257 HH2 TRP 34 HH2 TRP 34 -4.076 16.740 -31.393 258 HA PRO 35 HA PRO 35 -0.806 15.782 -26.378 259 HB2 PRO 35 2HB PRO 35 0.766 14.587 -24.515 260 HB3 PRO 35 3HB PRO 35 0.718 14.071 -26.205 261 HG2 PRO 35 2HG PRO 35 2.714 15.815 -24.812 262 HG3 PRO 35 3HG PRO 35 2.991 14.508 -25.978 263 HD2 PRO 35 2HD PRO 35 3.056 17.123 -26.678 264 HD3 PRO 35 3HD PRO 35 2.508 15.851 -27.788 265 H LEU 36 H LEU 36 -1.327 18.190 -25.689 266 HA LEU 36 HA LEU 36 -0.697 18.690 -22.890 267 HB2 LEU 36 2HB LEU 36 -1.926 20.256 -25.104 268 HB3 LEU 36 3HB LEU 36 -2.289 20.714 -23.441 269 HG LEU 36 HG LEU 36 0.514 20.444 -23.618 270 HD11 LEU 36 1HD1 LEU 36 -0.639 22.073 -25.878 271 HD12 LEU 36 2HD1 LEU 36 0.328 20.607 -26.034 272 HD13 LEU 36 3HD1 LEU 36 1.049 22.072 -25.369 273 HD21 LEU 36 3HD2 LEU 36 -0.895 23.077 -23.698 274 HD22 LEU 36 1HD2 LEU 36 0.510 22.581 -22.754 275 HD23 LEU 36 2HD2 LEU 36 -1.098 22.014 -22.305 276 H VAL 37 H VAL 37 -3.198 17.343 -24.806 277 HA VAL 37 HA VAL 37 -5.317 17.776 -22.901 278 HB VAL 37 HB VAL 37 -6.640 16.272 -24.336 279 HG11 VAL 37 1HG1 VAL 37 -6.652 18.593 -24.901 280 HG12 VAL 37 2HG1 VAL 37 -5.105 18.453 -25.739 281 HG13 VAL 37 3HG1 VAL 37 -6.543 17.675 -26.402 282 HG21 VAL 37 3HG2 VAL 37 -5.342 15.789 -26.607 283 HG22 VAL 37 1HG2 VAL 37 -3.966 15.742 -25.504 284 HG23 VAL 37 2HG2 VAL 37 -5.332 14.653 -25.258 285 H ILE 38 H ILE 38 -3.210 15.096 -23.845 286 HA ILE 38 HA ILE 38 -4.399 13.115 -22.242 287 HB ILE 38 HB ILE 38 -2.339 11.857 -22.497 288 HG12 ILE 38 2HG1 ILE 38 -0.594 13.244 -24.025 289 HG13 ILE 38 3HG1 ILE 38 -1.236 14.554 -23.039 290 HG21 ILE 38 1HG2 ILE 38 -3.801 13.049 -24.671 291 HG22 ILE 38 2HG2 ILE 38 -2.148 12.679 -25.158 292 HG23 ILE 38 3HG2 ILE 38 -3.179 11.407 -24.504 293 HD11 ILE 38 3HD1 ILE 38 -0.498 13.535 -21.044 294 HD12 ILE 38 1HD1 ILE 38 -0.148 12.014 -21.866 295 HD13 ILE 38 2HD1 ILE 38 0.845 13.438 -22.183 296 H ARG 39 H ARG 39 -2.290 15.744 -21.477 297 HA ARG 39 HA ARG 39 -1.560 14.632 -18.889 298 HB2 ARG 39 2HB ARG 39 -0.314 16.790 -18.627 299 HB3 ARG 39 3HB ARG 39 0.185 15.825 -20.010 300 HG2 ARG 39 2HG ARG 39 -0.973 17.254 -21.523 301 HG3 ARG 39 3HG ARG 39 -1.749 18.120 -20.195 302 HD2 ARG 39 2HD ARG 39 -0.066 19.586 -20.587 303 HD3 ARG 39 3HD ARG 39 0.804 18.496 -19.508 304 HE ARG 39 HE ARG 39 1.291 17.423 -21.923 305 HH11 ARG 39 1HH1 ARG 39 1.541 20.676 -20.709 306 HH12 ARG 39 2HH1 ARG 39 2.843 21.110 -21.766 307 HH21 ARG 39 1HH2 ARG 39 3.005 17.982 -23.321 308 HH22 ARG 39 2HH2 ARG 39 3.675 19.577 -23.252 309 H THR 40 H THR 40 -3.968 16.627 -20.260 310 HA THR 40 HA THR 40 -4.614 18.410 -18.257 311 HB THR 40 HB THR 40 -6.618 16.880 -19.925 312 HG1 THR 40 HG1 THR 40 -4.860 18.990 -20.514 313 HG21 THR 40 3HG2 THR 40 -6.846 19.690 -18.876 314 HG22 THR 40 1HG2 THR 40 -7.421 18.297 -17.961 315 HG23 THR 40 2HG2 THR 40 -8.114 18.662 -19.541 316 H VAL 41 H VAL 41 -6.085 15.184 -18.688 317 HA VAL 41 HA VAL 41 -7.508 15.140 -16.294 318 HB VAL 41 HB VAL 41 -7.102 12.537 -16.564 319 HG11 VAL 41 1HG1 VAL 41 -9.234 13.612 -16.898 320 HG12 VAL 41 2HG1 VAL 41 -8.715 14.233 -18.466 321 HG13 VAL 41 3HG1 VAL 41 -8.930 12.498 -18.230 322 HG21 VAL 41 3HG2 VAL 41 -6.537 13.457 -19.368 323 HG22 VAL 41 1HG2 VAL 41 -5.247 13.038 -18.241 324 HG23 VAL 41 2HG2 VAL 41 -6.441 11.826 -18.704 325 H ILE 42 H ILE 42 -4.243 13.939 -17.005 326 HA ILE 42 HA ILE 42 -3.639 12.772 -14.572 327 HB ILE 42 HB ILE 42 -1.497 14.369 -15.877 328 HG12 ILE 42 2HG1 ILE 42 -2.841 13.630 -17.787 329 HG13 ILE 42 3HG1 ILE 42 -1.319 12.749 -17.721 330 HG21 ILE 42 1HG2 ILE 42 -1.769 11.991 -14.255 331 HG22 ILE 42 2HG2 ILE 42 -0.783 11.694 -15.685 332 HG23 ILE 42 3HG2 ILE 42 -0.347 12.986 -14.566 333 HD11 ILE 42 3HD1 ILE 42 -3.435 11.388 -16.287 334 HD12 ILE 42 1HD1 ILE 42 -3.834 11.663 -17.982 335 HD13 ILE 42 2HD1 ILE 42 -2.358 10.797 -17.552 336 H ALA 43 H ALA 43 -3.926 16.128 -15.384 337 HA ALA 43 HA ALA 43 -2.397 17.404 -13.495 338 HB1 ALA 43 1HB ALA 43 -3.948 19.252 -13.629 339 HB2 ALA 43 2HB ALA 43 -3.736 18.538 -15.228 340 HB3 ALA 43 3HB ALA 43 -5.194 18.197 -14.297 341 H GLY 44 H GLY 44 -5.241 15.483 -13.005 342 HA2 GLY 44 2HA GLY 44 -5.562 16.440 -10.259 343 HA3 GLY 44 3HA GLY 44 -6.642 15.344 -11.108 344 H TYR 45 H TYR 45 -4.325 13.703 -12.018 345 HA TYR 45 HA TYR 45 -4.399 11.689 -10.149 346 HB2 TYR 45 2HB TYR 45 -3.220 10.649 -11.735 347 HB3 TYR 45 3HB TYR 45 -3.024 12.187 -12.568 348 HD1 TYR 45 HD2 TYR 45 -1.479 9.933 -10.068 349 HD2 TYR 45 HD1 TYR 45 -0.923 13.268 -12.651 350 HE1 TYR 45 HE2 TYR 45 0.944 9.840 -9.657 351 HE2 TYR 45 HE1 TYR 45 1.502 13.184 -12.248 352 HH TYR 45 HH TYR 45 2.966 12.123 -10.053 353 H ASN 46 H ASN 46 -2.119 14.378 -10.368 354 HA ASN 46 HA ASN 46 -0.226 13.653 -8.519 355 HB2 ASN 46 2HB ASN 46 -1.108 16.093 -9.742 356 HB3 ASN 46 3HB ASN 46 -0.776 16.391 -8.038 357 HD21 ASN 46 1HD2 ASN 46 0.543 16.273 -11.059 358 HD22 ASN 46 2HD2 ASN 46 2.210 16.115 -10.633 359 H LEU 47 H LEU 47 -3.530 14.548 -7.969 360 HA LEU 47 HA LEU 47 -3.142 14.883 -5.107 361 HB2 LEU 47 2HB LEU 47 -5.034 15.770 -6.994 362 HB3 LEU 47 3HB LEU 47 -5.897 14.710 -5.880 363 HG LEU 47 HG LEU 47 -6.031 17.080 -5.236 364 HD11 LEU 47 1HD1 LEU 47 -5.273 14.882 -3.605 365 HD12 LEU 47 2HD1 LEU 47 -6.257 16.282 -3.183 366 HD13 LEU 47 3HD1 LEU 47 -4.508 16.338 -2.967 367 HD21 LEU 47 3HD2 LEU 47 -4.216 18.409 -4.786 368 HD22 LEU 47 1HD2 LEU 47 -3.583 17.436 -6.113 369 HD23 LEU 47 2HD2 LEU 47 -3.156 17.040 -4.449 370 H TYR 48 H TYR 48 -4.393 12.526 -7.376 371 HA TYR 48 HA TYR 48 -5.873 10.840 -5.839 372 HB2 TYR 48 2HB TYR 48 -4.696 10.681 -8.323 373 HB3 TYR 48 3HB TYR 48 -3.910 9.374 -7.445 374 HD1 TYR 48 HD2 TYR 48 -6.035 8.380 -5.711 375 HD2 TYR 48 HD1 TYR 48 -6.225 9.685 -9.756 376 HE1 TYR 48 HE2 TYR 48 -8.002 6.949 -6.074 377 HE2 TYR 48 HE1 TYR 48 -8.194 8.258 -10.130 378 HH TYR 48 HH TYR 48 -9.675 6.441 -7.482 379 H ARG 49 H ARG 49 -2.323 10.816 -6.086 380 HA ARG 49 HA ARG 49 -2.067 8.814 -4.034 381 HB2 ARG 49 2HB ARG 49 -0.283 10.229 -5.891 382 HB3 ARG 49 3HB ARG 49 0.438 9.883 -4.324 383 HG2 ARG 49 2HG ARG 49 -0.929 7.556 -5.242 384 HG3 ARG 49 3HG ARG 49 0.125 8.154 -6.525 385 HD2 ARG 49 2HD ARG 49 1.333 8.161 -3.854 386 HD3 ARG 49 3HD ARG 49 0.916 6.559 -4.461 387 HE ARG 49 HE ARG 49 2.226 7.804 -6.528 388 HH11 ARG 49 1HH1 ARG 49 2.956 6.983 -3.225 389 HH12 ARG 49 2HH1 ARG 49 4.655 6.796 -3.509 390 HH21 ARG 49 1HH2 ARG 49 4.461 7.562 -6.915 391 HH22 ARG 49 2HH2 ARG 49 5.510 7.127 -5.609 392 H ALA 50 H ALA 50 -2.152 12.264 -4.191 393 HA ALA 50 HA ALA 50 -0.723 13.055 -1.973 394 HB1 ALA 50 1HB ALA 50 -3.395 14.209 -2.744 395 HB2 ALA 50 2HB ALA 50 -2.060 15.024 -1.928 396 HB3 ALA 50 3HB ALA 50 -1.898 14.538 -3.616 397 H ILE 51 H ILE 51 -3.925 11.602 -2.121 398 HA ILE 51 HA ILE 51 -4.360 11.914 0.725 399 HB ILE 51 HB ILE 51 -5.974 10.409 -1.338 400 HG12 ILE 51 2HG1 ILE 51 -5.950 12.804 -1.774 401 HG13 ILE 51 3HG1 ILE 51 -7.525 12.331 -1.148 402 HG21 ILE 51 1HG2 ILE 51 -6.156 10.592 1.569 403 HG22 ILE 51 2HG2 ILE 51 -7.652 11.015 0.740 404 HG23 ILE 51 3HG2 ILE 51 -6.901 9.445 0.455 405 HD11 ILE 51 3HD1 ILE 51 -7.338 13.916 0.376 406 HD12 ILE 51 1HD1 ILE 51 -5.974 13.046 1.077 407 HD13 ILE 51 2HD1 ILE 51 -5.696 14.280 -0.153 408 H LYS 52 H LYS 52 -2.984 9.598 -1.402 409 HA LYS 52 HA LYS 52 -3.341 7.330 0.336 410 HB2 LYS 52 2HB LYS 52 -2.506 6.091 -1.371 411 HB3 LYS 52 3HB LYS 52 -2.872 7.534 -2.307 412 HG2 LYS 52 2HG LYS 52 -0.739 7.198 -2.989 413 HG3 LYS 52 3HG LYS 52 -0.413 8.186 -1.563 414 HD2 LYS 52 2HD LYS 52 -0.561 5.611 -0.563 415 HD3 LYS 52 3HD LYS 52 0.271 5.413 -2.107 416 HE2 LYS 52 2HE LYS 52 2.081 6.635 -1.443 417 HE3 LYS 52 3HE LYS 52 1.136 7.641 -0.345 418 HZ1 LYS 52 3HZ LYS 52 1.028 5.060 0.653 419 HZ2 LYS 52 1HZ LYS 52 1.867 6.378 1.302 420 HZ3 LYS 52 2HZ LYS 52 2.645 5.324 0.232 421 H LYS 53 H LYS 53 -1.115 9.921 0.062 422 HA LYS 53 HA LYS 53 1.040 8.554 1.432 423 HB2 LYS 53 2HB LYS 53 0.634 11.269 0.260 424 HB3 LYS 53 3HB LYS 53 1.875 11.070 1.491 425 HG2 LYS 53 2HG LYS 53 1.709 9.442 -1.036 426 HG3 LYS 53 3HG LYS 53 2.720 10.873 -0.826 427 HD2 LYS 53 2HD LYS 53 3.085 8.955 1.321 428 HD3 LYS 53 3HD LYS 53 3.427 8.252 -0.262 429 HE2 LYS 53 2HE LYS 53 5.478 9.135 0.286 430 HE3 LYS 53 3HE LYS 53 4.768 10.466 -0.627 431 HZ1 LYS 53 3HZ LYS 53 5.064 11.749 1.134 432 HZ2 LYS 53 1HZ LYS 53 5.662 10.450 2.039 433 HZ3 LYS 53 2HZ LYS 53 4.004 10.781 2.030 434 H LYS 54 H LYS 54 -1.405 10.998 2.157 435 HA LYS 54 HA LYS 54 -2.105 11.940 4.111 436 HB2 LYS 54 2HB LYS 54 -2.859 9.653 4.500 437 HB3 LYS 54 3HB LYS 54 -1.284 9.221 5.151 438 HG2 LYS 54 2HG LYS 54 -1.628 10.800 6.997 439 HG3 LYS 54 3HG LYS 54 -3.225 11.187 6.352 440 HD2 LYS 54 2HD LYS 54 -2.667 8.321 6.773 441 HD3 LYS 54 3HD LYS 54 -2.777 9.305 8.234 442 HE2 LYS 54 2HE LYS 54 -4.937 10.225 7.025 443 HE3 LYS 54 3HE LYS 54 -4.857 8.669 6.201 444 HZ1 LYS 54 3HZ LYS 54 -5.639 9.266 8.891 445 HZ2 LYS 54 1HZ LYS 54 -4.478 8.038 8.819 446 HZ3 LYS 54 2HZ LYS 54 -5.930 7.880 7.966 447 H GLY 55 H GLY 55 -0.479 13.543 4.209 448 HA2 GLY 55 2HA GLY 55 0.837 13.911 6.558 449 HA3 GLY 55 3HA GLY 55 2.000 13.021 5.586 450 H GLY 56 H GLY 56 -0.313 15.626 4.818 451 HA2 GLY 56 2HA GLY 56 1.784 17.548 4.422 452 HA3 GLY 56 3HA GLY 56 1.145 16.928 2.907 453 H GLY 57 H GLY 57 -0.568 17.927 2.062 454 HA2 GLY 57 2HA GLY 57 -1.815 20.057 3.603 455 HA3 GLY 57 3HA GLY 57 -2.017 19.757 1.883 456 H GLY 58 H GLY 58 -4.276 19.996 2.053 457 HA2 GLY 58 2HA GLY 58 -5.728 17.631 2.348 458 HA3 GLY 58 3HA GLY 58 -5.882 18.524 3.854 459 H GLY 59 H GLY 59 -7.616 19.774 3.979 460 HA2 GLY 59 2HA GLY 59 -8.978 21.573 3.252 461 HA3 GLY 59 3HA GLY 59 -8.495 21.236 1.596 462 H GLY 60 H GLY 60 -10.691 21.302 0.942 463 HA2 GLY 60 2HA GLY 60 -12.363 19.847 0.086 464 HA3 GLY 60 3HA GLY 60 -12.066 18.758 1.433 465 H GLY 61 H GLY 61 -14.070 18.582 2.296 466 HA2 GLY 61 2HA GLY 61 -15.083 20.896 3.718 467 HA3 GLY 61 3HA GLY 61 -16.137 20.299 2.445 468 H GLY 62 H GLY 62 -17.794 19.586 3.731 469 HA2 GLY 62 2HA GLY 62 -17.414 17.024 4.977 470 HA3 GLY 62 3HA GLY 62 -17.722 18.303 6.142 471 H GLY 63 H GLY 63 -19.324 15.923 5.365 472 HA2 GLY 63 2HA GLY 63 -21.862 16.794 5.711 473 HA3 GLY 63 3HA GLY 63 -21.629 16.984 3.980 474 H GLY 64 H GLY 64 -20.324 14.435 6.060 475 HA2 GLY 64 2HA GLY 64 -21.103 12.219 6.264 476 HA3 GLY 64 3HA GLY 64 -22.226 12.516 4.945 477 H VAL 65 H VAL 65 -21.160 12.881 2.770 478 HA VAL 65 HA VAL 65 -18.881 11.030 2.491 479 HB VAL 65 HB VAL 65 -19.776 10.681 0.132 480 HG11 VAL 65 1HG1 VAL 65 -20.136 8.776 1.271 481 HG12 VAL 65 2HG1 VAL 65 -20.809 9.617 2.669 482 HG13 VAL 65 3HG1 VAL 65 -21.819 9.302 1.258 483 HG21 VAL 65 3HG2 VAL 65 -22.198 11.971 1.383 484 HG22 VAL 65 1HG2 VAL 65 -21.285 12.549 -0.011 485 HG23 VAL 65 2HG2 VAL 65 -22.218 11.057 -0.125 486 H TRP 66 H TRP 66 -20.427 13.939 1.193 487 HA TRP 66 HA TRP 66 -19.627 15.513 -0.298 488 HB2 TRP 66 2HB TRP 66 -17.456 16.536 0.704 489 HB3 TRP 66 3HB TRP 66 -18.939 16.583 1.654 490 HD1 TRP 66 HD1 TRP 66 -19.122 14.738 3.684 491 HE1 TRP 66 HE1 TRP 66 -17.266 13.701 5.135 492 HE3 TRP 66 HE3 TRP 66 -15.092 15.789 0.719 493 HZ2 TRP 66 HZ2 TRP 66 -14.464 13.373 5.036 494 HZ3 TRP 66 HZ3 TRP 66 -12.859 15.079 1.470 495 HH2 TRP 66 HH2 TRP 66 -12.553 13.897 3.584 496 HA PRO 67 HA PRO 67 -16.784 12.708 -2.622 497 HB2 PRO 67 2HB PRO 67 -18.079 13.000 -4.990 498 HB3 PRO 67 3HB PRO 67 -18.557 11.809 -3.774 499 HG2 PRO 67 2HG PRO 67 -19.724 14.506 -4.344 500 HG3 PRO 67 3HG PRO 67 -20.555 12.976 -4.004 501 HD2 PRO 67 2HD PRO 67 -20.214 14.897 -2.126 502 HD3 PRO 67 3HD PRO 67 -20.243 13.168 -1.728 503 H LEU 68 H LEU 68 -15.662 14.946 -1.958 504 HA LEU 68 HA LEU 68 -15.436 16.744 -4.236 505 HB2 LEU 68 2HB LEU 68 -14.773 16.832 -1.380 506 HB3 LEU 68 3HB LEU 68 -13.592 17.613 -2.429 507 HG LEU 68 HG LEU 68 -16.515 18.287 -2.578 508 HD11 LEU 68 1HD1 LEU 68 -15.171 20.306 -1.169 509 HD12 LEU 68 2HD1 LEU 68 -14.745 18.788 -0.380 510 HD13 LEU 68 3HD1 LEU 68 -16.440 19.235 -0.576 511 HD21 LEU 68 3HD2 LEU 68 -15.744 20.301 -3.602 512 HD22 LEU 68 1HD2 LEU 68 -14.942 18.950 -4.405 513 HD23 LEU 68 2HD2 LEU 68 -14.064 19.919 -3.220 514 H VAL 69 H VAL 69 -13.827 14.042 -2.884 515 HA VAL 69 HA VAL 69 -11.228 14.603 -3.969 516 HB VAL 69 HB VAL 69 -10.708 12.259 -3.379 517 HG11 VAL 69 1HG1 VAL 69 -11.116 14.379 -1.700 518 HG12 VAL 69 2HG1 VAL 69 -12.060 13.102 -0.930 519 HG13 VAL 69 3HG1 VAL 69 -10.343 12.858 -1.253 520 HG21 VAL 69 3HG2 VAL 69 -12.752 11.335 -1.858 521 HG22 VAL 69 1HG2 VAL 69 -13.636 12.130 -3.161 522 HG23 VAL 69 2HG2 VAL 69 -12.467 10.862 -3.533 523 H ILE 70 H ILE 70 -14.050 12.746 -4.960 524 HA ILE 70 HA ILE 70 -12.852 11.422 -7.150 525 HB ILE 70 HB ILE 70 -15.092 10.935 -7.913 526 HG12 ILE 70 2HG1 ILE 70 -16.927 11.992 -6.250 527 HG13 ILE 70 3HG1 ILE 70 -15.753 13.304 -6.251 528 HG21 ILE 70 1HG2 ILE 70 -15.447 9.466 -6.267 529 HG22 ILE 70 2HG2 ILE 70 -14.051 10.205 -5.483 530 HG23 ILE 70 3HG2 ILE 70 -15.680 10.735 -5.065 531 HD11 ILE 70 3HD1 ILE 70 -17.730 12.701 -8.175 532 HD12 ILE 70 1HD1 ILE 70 -16.556 14.017 -8.178 533 HD13 ILE 70 2HD1 ILE 70 -16.153 12.474 -8.932 534 H ARG 71 H ARG 71 -14.337 14.575 -6.780 535 HA ARG 71 HA ARG 71 -14.496 15.151 -9.572 536 HB2 ARG 71 2HB ARG 71 -15.190 17.316 -8.941 537 HB3 ARG 71 3HB ARG 71 -15.837 16.246 -7.704 538 HG2 ARG 71 2HG ARG 71 -14.851 17.465 -6.148 539 HG3 ARG 71 3HG ARG 71 -13.277 17.074 -6.843 540 HD2 ARG 71 2HD ARG 71 -13.109 19.285 -7.179 541 HD3 ARG 71 3HD ARG 71 -14.169 18.990 -8.557 542 HE ARG 71 HE ARG 71 -15.664 19.432 -6.181 543 HH11 ARG 71 1HH1 ARG 71 -13.831 21.065 -8.650 544 HH12 ARG 71 2HH1 ARG 71 -14.686 22.562 -8.478 545 HH21 ARG 71 1HH2 ARG 71 -16.798 21.397 -5.946 546 HH22 ARG 71 2HH2 ARG 71 -16.373 22.750 -6.939 547 H THR 72 H THR 72 -11.960 15.124 -7.302 548 HA THR 72 HA THR 72 -10.283 17.167 -8.055 549 HB THR 72 HB THR 72 -9.340 14.356 -7.473 550 HG1 THR 72 HG1 THR 72 -9.784 16.409 -5.559 551 HG21 THR 72 3HG2 THR 72 -7.354 15.355 -7.808 552 HG22 THR 72 1HG2 THR 72 -7.638 16.108 -6.240 553 HG23 THR 72 2HG2 THR 72 -8.047 16.974 -7.721 554 H VAL 73 H VAL 73 -10.192 13.861 -9.402 555 HA VAL 73 HA VAL 73 -8.383 14.463 -11.471 556 HB VAL 73 HB VAL 73 -9.364 12.359 -12.553 557 HG11 VAL 73 1HG1 VAL 73 -8.239 12.268 -9.756 558 HG12 VAL 73 2HG1 VAL 73 -8.313 10.891 -10.857 559 HG13 VAL 73 3HG1 VAL 73 -7.327 12.296 -11.265 560 HG21 VAL 73 3HG2 VAL 73 -10.787 12.181 -9.898 561 HG22 VAL 73 1HG2 VAL 73 -11.569 12.540 -11.438 562 HG23 VAL 73 2HG2 VAL 73 -10.793 10.976 -11.186 563 H ILE 74 H ILE 74 -11.918 14.416 -11.373 564 HA ILE 74 HA ILE 74 -12.469 14.753 -14.070 565 HB ILE 74 HB ILE 74 -14.035 16.130 -11.898 566 HG12 ILE 74 2HG1 ILE 74 -13.810 13.214 -12.565 567 HG13 ILE 74 3HG1 ILE 74 -13.852 13.990 -10.986 568 HG21 ILE 74 1HG2 ILE 74 -14.428 16.195 -14.543 569 HG22 ILE 74 2HG2 ILE 74 -15.310 14.718 -14.159 570 HG23 ILE 74 3HG2 ILE 74 -15.748 16.235 -13.375 571 HD11 ILE 74 3HD1 ILE 74 -15.911 12.953 -11.136 572 HD12 ILE 74 1HD1 ILE 74 -16.268 14.615 -11.605 573 HD13 ILE 74 2HD1 ILE 74 -16.109 13.365 -12.839 574 H ALA 75 H ALA 75 -11.097 16.972 -11.821 575 HA ALA 75 HA ALA 75 -11.780 19.448 -12.790 576 HB1 ALA 75 1HB ALA 75 -8.968 18.739 -11.991 577 HB2 ALA 75 2HB ALA 75 -9.796 20.287 -11.814 578 HB3 ALA 75 3HB ALA 75 -10.284 18.908 -10.828 579 H GLY 76 H GLY 76 -9.880 17.006 -14.330 580 HA2 GLY 76 2HA GLY 76 -8.803 18.879 -16.298 581 HA3 GLY 76 3HA GLY 76 -8.419 17.168 -16.172 582 H TYR 77 H TYR 77 -11.253 16.397 -16.019 583 HA TYR 77 HA TYR 77 -11.740 15.805 -18.673 584 HB2 TYR 77 2HB TYR 77 -13.005 14.502 -17.263 585 HB3 TYR 77 3HB TYR 77 -13.417 15.850 -16.209 586 HD1 TYR 77 HD2 TYR 77 -13.933 15.113 -19.844 587 HD2 TYR 77 HD1 TYR 77 -15.688 16.207 -16.125 588 HE1 TYR 77 HE2 TYR 77 -16.128 15.292 -20.939 589 HE2 TYR 77 HE1 TYR 77 -17.888 16.387 -17.210 590 HH TYR 77 HH TYR 77 -18.472 16.828 -20.124 591 H ASN 78 H ASN 78 -13.245 18.388 -16.733 592 HA ASN 78 HA ASN 78 -14.881 19.506 -18.638 593 HB2 ASN 78 2HB ASN 78 -14.137 20.170 -16.082 594 HB3 ASN 78 3HB ASN 78 -13.467 21.505 -17.014 595 HD21 ASN 78 1HD2 ASN 78 -16.318 19.968 -15.864 596 HD22 ASN 78 2HD2 ASN 78 -17.444 21.158 -16.413 597 H LEU 79 H LEU 79 -11.456 19.460 -18.560 598 HA LEU 79 HA LEU 79 -11.210 21.665 -20.455 599 HB2 LEU 79 2HB LEU 79 -9.453 20.300 -18.583 600 HB3 LEU 79 3HB LEU 79 -8.708 20.532 -20.164 601 HG LEU 79 HG LEU 79 -10.009 22.873 -18.866 602 HD11 LEU 79 1HD1 LEU 79 -7.911 21.337 -17.629 603 HD12 LEU 79 2HD1 LEU 79 -8.763 22.762 -17.034 604 HD13 LEU 79 3HD1 LEU 79 -7.341 22.950 -18.059 605 HD21 LEU 79 3HD2 LEU 79 -7.413 22.654 -20.372 606 HD22 LEU 79 1HD2 LEU 79 -8.381 24.097 -20.067 607 HD23 LEU 79 2HD2 LEU 79 -8.973 22.855 -21.171 608 H TYR 80 H TYR 80 -10.881 18.173 -20.281 609 HA TYR 80 HA TYR 80 -9.588 17.576 -22.621 610 HB2 TYR 80 2HB TYR 80 -11.308 16.196 -20.793 611 HB3 TYR 80 3HB TYR 80 -11.755 15.754 -22.437 612 HD1 TYR 80 HD2 TYR 80 -8.993 15.997 -23.674 613 HD2 TYR 80 HD1 TYR 80 -10.340 14.157 -20.082 614 HE1 TYR 80 HE2 TYR 80 -7.098 14.432 -23.772 615 HE2 TYR 80 HE1 TYR 80 -8.448 12.588 -20.169 616 HH TYR 80 HH TYR 80 -6.757 11.810 -21.424 617 H ARG 81 H ARG 81 -13.053 18.243 -22.211 618 HA ARG 81 HA ARG 81 -13.598 18.015 -25.020 619 HB2 ARG 81 2HB ARG 81 -15.118 18.169 -22.621 620 HB3 ARG 81 3HB ARG 81 -15.646 19.477 -23.671 621 HG2 ARG 81 2HG ARG 81 -15.348 16.930 -25.058 622 HG3 ARG 81 3HG ARG 81 -16.540 16.895 -23.757 623 HD2 ARG 81 2HD ARG 81 -16.787 19.310 -25.308 624 HD3 ARG 81 3HD ARG 81 -16.875 17.890 -26.349 625 HE ARG 81 HE ARG 81 -18.538 17.323 -24.254 626 HH11 ARG 81 1HH1 ARG 81 -18.295 19.882 -26.602 627 HH12 ARG 81 2HH1 ARG 81 -19.997 20.204 -26.620 628 HH21 ARG 81 1HH2 ARG 81 -20.781 17.738 -24.269 629 HH22 ARG 81 2HH2 ARG 81 -21.410 18.985 -25.292 630 H ALA 82 H ALA 82 -12.598 20.528 -22.877 631 HA ALA 82 HA ALA 82 -13.521 22.828 -24.073 632 HB1 ALA 82 1HB ALA 82 -12.078 22.571 -21.987 633 HB2 ALA 82 2HB ALA 82 -10.697 22.590 -23.083 634 HB3 ALA 82 3HB ALA 82 -11.780 23.979 -23.006 635 H ILE 83 H ILE 83 -10.841 20.765 -25.070 636 HA ILE 83 HA ILE 83 -10.093 22.537 -27.232 637 HB ILE 83 HB ILE 83 -9.130 19.750 -26.578 638 HG12 ILE 83 2HG1 ILE 83 -8.551 21.335 -24.828 639 HG13 ILE 83 3HG1 ILE 83 -7.109 20.926 -25.751 640 HG21 ILE 83 1HG2 ILE 83 -8.647 21.529 -28.838 641 HG22 ILE 83 2HG2 ILE 83 -7.171 20.976 -28.049 642 HG23 ILE 83 3HG2 ILE 83 -8.334 19.802 -28.667 643 HD11 ILE 83 3HD1 ILE 83 -6.742 23.084 -26.029 644 HD12 ILE 83 1HD1 ILE 83 -8.217 23.182 -26.991 645 HD13 ILE 83 2HD1 ILE 83 -8.275 23.484 -25.254 646 H LYS 84 H LYS 84 -12.245 19.920 -26.739 647 HA LYS 84 HA LYS 84 -12.336 19.041 -29.475 648 HB2 LYS 84 2HB LYS 84 -13.001 17.319 -28.117 649 HB3 LYS 84 3HB LYS 84 -13.778 18.389 -26.958 650 HG2 LYS 84 2HG LYS 84 -15.742 18.491 -28.164 651 HG3 LYS 84 3HG LYS 84 -14.957 18.033 -29.677 652 HD2 LYS 84 2HD LYS 84 -15.152 16.148 -27.343 653 HD3 LYS 84 3HD LYS 84 -16.434 16.283 -28.549 654 HE2 LYS 84 2HE LYS 84 -14.074 16.052 -30.017 655 HE3 LYS 84 3HE LYS 84 -13.902 14.900 -28.694 656 HZ1 LYS 84 3HZ LYS 84 -14.956 13.847 -30.563 657 HZ2 LYS 84 1HZ LYS 84 -16.156 15.038 -30.622 658 HZ3 LYS 84 2HZ LYS 84 -16.079 13.981 -29.304 659 H LYS 85 H LYS 85 -13.948 21.426 -27.535 660 HA LYS 85 HA LYS 85 -16.138 21.815 -29.362 661 HB2 LYS 85 2HB LYS 85 -15.440 22.676 -26.721 662 HB3 LYS 85 3HB LYS 85 -15.815 24.089 -27.699 663 HG2 LYS 85 2HG LYS 85 -17.917 22.744 -28.392 664 HG3 LYS 85 3HG LYS 85 -17.569 21.791 -26.948 665 HD2 LYS 85 2HD LYS 85 -18.772 23.341 -25.865 666 HD3 LYS 85 3HD LYS 85 -17.335 24.354 -26.019 667 HE2 LYS 85 2HE LYS 85 -18.634 25.809 -27.099 668 HE3 LYS 85 3HE LYS 85 -18.622 24.669 -28.444 669 HZ1 LYS 85 3HZ LYS 85 -20.719 23.998 -28.013 670 HZ2 LYS 85 1HZ LYS 85 -20.847 25.531 -27.309 671 HZ3 LYS 85 2HZ LYS 85 -20.570 24.176 -26.337 672 H LYS 86 H LYS 86 -13.067 23.406 -28.658 673 HA LYS 86 HA LYS 86 -11.908 25.051 -29.726 674 HB2 LYS 86 2HB LYS 86 -11.793 23.306 -31.441 675 HB3 LYS 86 3HB LYS 86 -13.316 23.861 -32.123 676 HG2 LYS 86 2HG LYS 86 -12.365 25.619 -33.172 677 HG3 LYS 86 3HG LYS 86 -11.176 25.880 -31.893 678 HD2 LYS 86 2HD LYS 86 -10.422 23.449 -32.905 679 HD3 LYS 86 3HD LYS 86 -10.988 24.296 -34.347 680 HE2 LYS 86 2HE LYS 86 -9.539 26.256 -33.375 681 HE3 LYS 86 3HE LYS 86 -8.722 24.949 -32.519 682 HZ1 LYS 86 3HZ LYS 86 -9.155 24.814 -35.435 683 HZ2 LYS 86 1HZ LYS 86 -8.016 23.991 -34.494 684 HZ3 LYS 86 2HZ LYS 86 -7.829 25.646 -34.793 685 H GLY 87 H GLY 87 -13.247 26.654 -28.614 686 HA2 GLY 87 2HA GLY 87 -14.016 28.768 -30.186 687 HA3 GLY 87 3HA GLY 87 -15.486 27.831 -29.957 688 H GLY 88 H GLY 88 -12.795 28.513 -27.730 689 HA2 GLY 88 2HA GLY 88 -13.264 30.424 -26.126 690 HA3 GLY 88 3HA GLY 88 -14.796 29.606 -25.855 691 H GLY 89 H GLY 89 -13.432 30.050 -23.653 692 HA2 GLY 89 2HA GLY 89 -12.816 27.407 -22.715 693 HA3 GLY 89 3HA GLY 89 -11.393 28.434 -22.809 694 H GLY 90 H GLY 90 -12.900 27.222 -20.505 695 HA2 GLY 90 2HA GLY 90 -12.426 28.770 -18.441 696 HA3 GLY 90 3HA GLY 90 -13.810 29.628 -19.104 697 H GLY 91 H GLY 91 -15.669 27.947 -19.696 698 HA2 GLY 91 2HA GLY 91 -15.978 25.648 -18.100 699 HA3 GLY 91 3HA GLY 91 -16.681 27.019 -17.255 700 H GLY 92 H GLY 92 -18.096 24.719 -18.189 701 HA2 GLY 92 2HA GLY 92 -20.471 25.269 -18.913 702 HA3 GLY 92 3HA GLY 92 -19.708 25.876 -20.375 703 H GLY 93 H GLY 93 -20.852 24.416 -21.681 704 HA2 GLY 93 2HA GLY 93 -19.709 22.233 -22.665 705 HA3 GLY 93 3HA GLY 93 -20.454 21.563 -21.221 706 H GLY 94 H GLY 94 -21.160 20.561 -23.650 707 HA2 GLY 94 2HA GLY 94 -23.467 19.921 -24.143 708 HA3 GLY 94 3HA GLY 94 -23.902 21.614 -23.964 709 H GLY 95 H GLY 95 -24.087 19.564 -26.219 710 HA2 GLY 95 2HA GLY 95 -24.139 19.745 -28.514 711 HA3 GLY 95 3HA GLY 95 -23.619 21.415 -28.337 712 H GLY 96 H GLY 96 -21.807 21.805 -29.408 713 HA2 GLY 96 2HA GLY 96 -19.646 21.593 -30.162 714 HA3 GLY 96 3HA GLY 96 -19.418 20.351 -28.939 715 H VAL 97 H VAL 97 -19.455 18.229 -29.516 716 HA VAL 97 HA VAL 97 -20.251 17.545 -32.253 717 HB VAL 97 HB VAL 97 -18.060 15.948 -31.943 718 HG11 VAL 97 1HG1 VAL 97 -17.767 18.651 -33.192 719 HG12 VAL 97 2HG1 VAL 97 -17.186 17.086 -33.764 720 HG13 VAL 97 3HG1 VAL 97 -18.903 17.478 -33.856 721 HG21 VAL 97 3HG2 VAL 97 -16.240 17.116 -31.056 722 HG22 VAL 97 1HG2 VAL 97 -17.107 18.652 -31.059 723 HG23 VAL 97 2HG2 VAL 97 -17.534 17.400 -29.892 724 H TRP 98 H TRP 98 -18.511 15.739 -29.741 725 HA TRP 98 HA TRP 98 -20.761 14.327 -28.777 726 HB2 TRP 98 2HB TRP 98 -20.118 12.081 -29.764 727 HB3 TRP 98 3HB TRP 98 -20.870 13.219 -30.879 728 HD1 TRP 98 HD1 TRP 98 -17.485 11.590 -30.101 729 HE1 TRP 98 HE1 TRP 98 -15.966 11.838 -32.163 730 HE3 TRP 98 HE3 TRP 98 -20.460 14.629 -32.938 731 HZ2 TRP 98 HZ2 TRP 98 -16.022 13.150 -34.662 732 HZ3 TRP 98 HZ3 TRP 98 -19.653 15.335 -35.152 733 HH2 TRP 98 HH2 TRP 98 -17.479 14.611 -35.995 734 HA PRO 99 HA PRO 99 -17.448 13.920 -25.802 735 HB2 PRO 99 2HB PRO 99 -19.027 13.009 -23.790 736 HB3 PRO 99 3HB PRO 99 -18.941 14.714 -24.247 737 HG2 PRO 99 2HG PRO 99 -20.993 12.659 -24.974 738 HG3 PRO 99 3HG PRO 99 -21.225 14.346 -24.480 739 HD2 PRO 99 2HD PRO 99 -21.329 13.559 -27.069 740 HD3 PRO 99 3HD PRO 99 -20.738 15.160 -26.581 741 H LEU 100 H LEU 100 -17.240 11.993 -27.625 742 HA LEU 100 HA LEU 100 -17.754 9.407 -26.384 743 HB2 LEU 100 2HB LEU 100 -16.596 10.160 -29.062 744 HB3 LEU 100 3HB LEU 100 -16.833 8.503 -28.511 745 HG LEU 100 HG LEU 100 -19.003 10.537 -29.021 746 HD11 LEU 100 1HD1 LEU 100 -17.642 9.236 -30.910 747 HD12 LEU 100 2HD1 LEU 100 -19.369 9.572 -31.036 748 HD13 LEU 100 3HD1 LEU 100 -18.817 7.985 -30.503 749 HD21 LEU 100 3HD2 LEU 100 -20.170 9.298 -27.572 750 HD22 LEU 100 1HD2 LEU 100 -18.965 8.010 -27.561 751 HD23 LEU 100 2HD2 LEU 100 -20.180 8.070 -28.838 752 H VAL 101 H VAL 101 -15.143 11.616 -26.991 753 HA VAL 101 HA VAL 101 -13.098 9.664 -26.329 754 HB VAL 101 HB VAL 101 -11.513 11.531 -26.611 755 HG11 VAL 101 1HG1 VAL 101 -12.768 10.156 -28.538 756 HG12 VAL 101 2HG1 VAL 101 -13.224 11.796 -29.005 757 HG13 VAL 101 3HG1 VAL 101 -11.520 11.358 -28.867 758 HG21 VAL 101 3HG2 VAL 101 -12.758 13.401 -25.840 759 HG22 VAL 101 1HG2 VAL 101 -12.435 13.678 -27.552 760 HG23 VAL 101 2HG2 VAL 101 -14.029 13.131 -27.033 761 H ILE 102 H ILE 102 -14.594 12.532 -24.899 762 HA ILE 102 HA ILE 102 -12.957 12.719 -22.625 763 HB ILE 102 HB ILE 102 -14.769 14.020 -21.610 764 HG12 ILE 102 2HG1 ILE 102 -16.733 14.346 -23.447 765 HG13 ILE 102 3HG1 ILE 102 -16.343 12.650 -23.709 766 HG21 ILE 102 1HG2 ILE 102 -13.221 14.879 -23.476 767 HG22 ILE 102 2HG2 ILE 102 -14.656 14.809 -24.498 768 HG23 ILE 102 3HG2 ILE 102 -14.644 15.836 -23.064 769 HD11 ILE 102 3HD1 ILE 102 -16.509 12.957 -20.941 770 HD12 ILE 102 1HD1 ILE 102 -17.861 13.872 -21.607 771 HD13 ILE 102 2HD1 ILE 102 -17.668 12.165 -22.008 772 H ARG 103 H ARG 103 -15.842 10.815 -23.288 773 HA ARG 103 HA ARG 103 -16.326 9.945 -20.649 774 HB2 ARG 103 2HB ARG 103 -17.585 8.079 -21.768 775 HB3 ARG 103 3HB ARG 103 -18.061 9.696 -22.269 776 HG2 ARG 103 2HG ARG 103 -16.841 9.481 -24.324 777 HG3 ARG 103 3HG ARG 103 -16.171 7.932 -23.808 778 HD2 ARG 103 2HD ARG 103 -18.050 7.696 -25.397 779 HD3 ARG 103 3HD ARG 103 -18.357 6.922 -23.843 780 HE ARG 103 HE ARG 103 -19.372 9.589 -23.948 781 HH11 ARG 103 1HH1 ARG 103 -20.022 6.291 -24.852 782 HH12 ARG 103 2HH1 ARG 103 -21.742 6.501 -24.882 783 HH21 ARG 103 1HH2 ARG 103 -21.634 9.878 -23.984 784 HH22 ARG 103 2HH2 ARG 103 -22.657 8.542 -24.389 785 H THR 104 H THR 104 -14.007 9.004 -23.026 786 HA THR 104 HA THR 104 -13.421 6.394 -22.358 787 HB THR 104 HB THR 104 -11.277 8.431 -22.949 788 HG1 THR 104 HG1 THR 104 -12.767 7.041 -24.922 789 HG21 THR 104 3HG2 THR 104 -11.533 5.549 -23.804 790 HG22 THR 104 1HG2 THR 104 -10.636 6.075 -22.380 791 HG23 THR 104 2HG2 THR 104 -10.129 6.601 -23.985 792 H VAL 105 H VAL 105 -11.770 9.273 -21.038 793 HA VAL 105 HA VAL 105 -10.387 7.848 -19.028 794 HB VAL 105 HB VAL 105 -10.125 10.155 -17.971 795 HG11 VAL 105 1HG1 VAL 105 -8.972 8.993 -20.292 796 HG12 VAL 105 2HG1 VAL 105 -9.069 10.737 -20.539 797 HG13 VAL 105 3HG1 VAL 105 -8.232 10.090 -19.127 798 HG21 VAL 105 3HG2 VAL 105 -11.401 11.053 -20.551 799 HG22 VAL 105 1HG2 VAL 105 -12.206 11.076 -18.982 800 HG23 VAL 105 2HG2 VAL 105 -10.778 12.074 -19.255 801 H ILE 106 H ILE 106 -13.458 9.587 -19.049 802 HA ILE 106 HA ILE 106 -13.999 9.621 -16.324 803 HB ILE 106 HB ILE 106 -16.067 9.180 -18.476 804 HG12 ILE 106 2HG1 ILE 106 -14.223 11.313 -18.240 805 HG13 ILE 106 3HG1 ILE 106 -15.617 11.206 -19.308 806 HG21 ILE 106 1HG2 ILE 106 -16.204 10.477 -15.757 807 HG22 ILE 106 2HG2 ILE 106 -17.517 10.443 -16.933 808 HG23 ILE 106 3HG2 ILE 106 -16.926 8.938 -16.228 809 HD11 ILE 106 3HD1 ILE 106 -15.619 13.250 -17.968 810 HD12 ILE 106 1HD1 ILE 106 -17.017 12.231 -17.624 811 HD13 ILE 106 2HD1 ILE 106 -15.661 12.277 -16.498 812 H ALA 107 H ALA 107 -13.905 6.971 -18.504 813 HA ALA 107 HA ALA 107 -15.682 5.147 -17.485 814 HB1 ALA 107 1HB ALA 107 -13.995 3.401 -18.161 815 HB2 ALA 107 2HB ALA 107 -14.428 4.569 -19.409 816 HB3 ALA 107 3HB ALA 107 -12.898 4.727 -18.547 817 H GLY 108 H GLY 108 -12.827 6.407 -15.987 818 HA2 GLY 108 2HA GLY 108 -12.838 4.317 -13.936 819 HA3 GLY 108 3HA GLY 108 -11.617 5.565 -14.136 820 H TYR 109 H TYR 109 -13.671 7.680 -14.370 821 HA TYR 109 HA TYR 109 -13.718 8.595 -11.768 822 HB2 TYR 109 2HB TYR 109 -15.590 9.207 -14.059 823 HB3 TYR 109 3HB TYR 109 -15.592 10.096 -12.540 824 HD1 TYR 109 HD2 TYR 109 -12.295 9.249 -12.981 825 HD2 TYR 109 HD1 TYR 109 -15.249 11.815 -14.650 826 HE1 TYR 109 HE2 TYR 109 -10.522 10.720 -13.842 827 HE2 TYR 109 HE1 TYR 109 -13.485 13.294 -15.516 828 HH TYR 109 HH TYR 109 -10.865 13.718 -14.681 829 H ASN 110 H ASN 110 -16.257 6.826 -13.511 830 HA ASN 110 HA ASN 110 -18.259 6.856 -11.620 831 HB2 ASN 110 2HB ASN 110 -18.094 5.750 -14.016 832 HB3 ASN 110 3HB ASN 110 -17.727 4.303 -13.082 833 HD21 ASN 110 1HD2 ASN 110 -19.974 4.560 -14.701 834 HD22 ASN 110 2HD2 ASN 110 -21.382 4.542 -13.699 835 H LEU 111 H LEU 111 -15.242 5.166 -11.549 836 HA LEU 111 HA LEU 111 -16.044 3.351 -9.445 837 HB2 LEU 111 2HB LEU 111 -13.967 3.465 -11.333 838 HB3 LEU 111 3HB LEU 111 -13.199 3.579 -9.751 839 HG LEU 111 HG LEU 111 -13.260 1.277 -10.522 840 HD11 LEU 111 1HD1 LEU 111 -14.080 2.201 -8.049 841 HD12 LEU 111 2HD1 LEU 111 -13.570 0.559 -8.440 842 HD13 LEU 111 3HD1 LEU 111 -15.282 0.979 -8.467 843 HD21 LEU 111 3HD2 LEU 111 -15.069 1.100 -11.968 844 HD22 LEU 111 1HD2 LEU 111 -16.186 1.840 -10.822 845 HD23 LEU 111 2HD2 LEU 111 -15.605 0.197 -10.550 846 H TYR 112 H TYR 112 -14.283 6.370 -9.770 847 HA TYR 112 HA TYR 112 -12.984 6.610 -7.385 848 HB2 TYR 112 2HB TYR 112 -13.719 8.347 -9.424 849 HB3 TYR 112 3HB TYR 112 -14.456 9.051 -7.988 850 HD1 TYR 112 HD2 TYR 112 -12.627 8.679 -5.861 851 HD2 TYR 112 HD1 TYR 112 -11.758 9.428 -9.958 852 HE1 TYR 112 HE2 TYR 112 -10.459 9.647 -5.219 853 HE2 TYR 112 HE1 TYR 112 -9.587 10.397 -9.327 854 HH TYR 112 HH TYR 112 -8.197 10.876 -7.669 855 H ARG 113 H ARG 113 -16.416 7.337 -7.970 856 HA ARG 113 HA ARG 113 -16.925 7.906 -5.201 857 HB2 ARG 113 2HB ARG 113 -18.730 7.550 -7.593 858 HB3 ARG 113 3HB ARG 113 -19.341 7.885 -5.978 859 HG2 ARG 113 2HG ARG 113 -17.917 9.952 -5.977 860 HG3 ARG 113 3HG ARG 113 -17.598 9.640 -7.684 861 HD2 ARG 113 2HD ARG 113 -20.426 9.501 -7.062 862 HD3 ARG 113 3HD ARG 113 -19.731 11.062 -6.625 863 HE ARG 113 HE ARG 113 -19.011 10.161 -9.260 864 HH11 ARG 113 1HH1 ARG 113 -21.368 11.875 -7.355 865 HH12 ARG 113 2HH1 ARG 113 -21.968 12.799 -8.692 866 HH21 ARG 113 1HH2 ARG 113 -19.792 11.372 -11.028 867 HH22 ARG 113 2HH2 ARG 113 -21.072 12.512 -10.781 868 H ALA 114 H ALA 114 -16.980 5.106 -7.227 869 HA ALA 114 HA ALA 114 -18.791 3.439 -6.001 870 HB1 ALA 114 1HB ALA 114 -16.080 2.512 -6.916 871 HB2 ALA 114 2HB ALA 114 -17.596 1.611 -6.913 872 HB3 ALA 114 3HB ALA 114 -17.372 2.956 -8.031 873 H ILE 115 H ILE 115 -15.537 4.286 -4.947 874 HA ILE 115 HA ILE 115 -15.639 2.461 -2.701 875 HB ILE 115 HB ILE 115 -13.596 4.576 -3.394 876 HG12 ILE 115 2HG1 ILE 115 -13.677 2.825 -5.079 877 HG13 ILE 115 3HG1 ILE 115 -12.219 2.642 -4.110 878 HG21 ILE 115 1HG2 ILE 115 -13.909 2.754 -1.106 879 HG22 ILE 115 2HG2 ILE 115 -12.300 2.800 -1.825 880 HG23 ILE 115 3HG2 ILE 115 -13.043 4.285 -1.230 881 HD11 ILE 115 3HD1 ILE 115 -14.333 0.777 -4.582 882 HD12 ILE 115 1HD1 ILE 115 -12.783 0.533 -3.778 883 HD13 ILE 115 2HD1 ILE 115 -14.178 1.089 -2.854 884 H LYS 116 H LYS 116 -16.479 5.719 -3.371 885 HA LYS 116 HA LYS 116 -16.283 6.681 -0.673 886 HB2 LYS 116 2HB LYS 116 -16.814 8.714 -1.530 887 HB3 LYS 116 3HB LYS 116 -16.382 7.937 -3.048 888 HG2 LYS 116 2HG LYS 116 -18.376 8.805 -3.664 889 HG3 LYS 116 3HG LYS 116 -18.955 7.278 -2.993 890 HD2 LYS 116 2HD LYS 116 -19.926 8.280 -1.212 891 HD3 LYS 116 3HD LYS 116 -18.657 9.499 -1.073 892 HE2 LYS 116 2HE LYS 116 -20.149 10.931 -1.914 893 HE3 LYS 116 3HE LYS 116 -19.872 10.130 -3.461 894 HZ1 LYS 116 3HZ LYS 116 -22.269 10.370 -2.475 895 HZ2 LYS 116 1HZ LYS 116 -21.841 8.971 -1.626 896 HZ3 LYS 116 2HZ LYS 116 -21.815 8.974 -3.317 897 H LYS 117 H LYS 117 -18.567 4.870 -2.465 898 HA LYS 117 HA LYS 117 -20.858 5.597 -0.874 899 HB2 LYS 117 2HB LYS 117 -20.369 3.481 -2.965 900 HB3 LYS 117 3HB LYS 117 -21.887 3.594 -2.083 901 HG2 LYS 117 2HG LYS 117 -22.326 5.764 -2.975 902 HG3 LYS 117 3HG LYS 117 -20.717 5.848 -3.697 903 HD2 LYS 117 2HD LYS 117 -21.354 3.815 -5.053 904 HD3 LYS 117 3HD LYS 117 -23.005 4.050 -4.475 905 HE2 LYS 117 2HE LYS 117 -23.348 5.548 -6.075 906 HE3 LYS 117 3HE LYS 117 -22.054 6.548 -5.416 907 HZ1 LYS 117 3HZ LYS 117 -21.125 4.315 -6.979 908 HZ2 LYS 117 1HZ LYS 117 -20.664 5.942 -7.035 909 HZ3 LYS 117 2HZ LYS 117 -22.044 5.425 -7.865 910 H LYS 118 H LYS 118 -18.595 2.888 -1.051 911 HA LYS 118 HA LYS 118 -19.861 1.673 1.297 912 HB2 LYS 118 2HB LYS 118 -17.699 0.573 -0.508 913 HB3 LYS 118 3HB LYS 118 -18.510 -0.301 0.785 914 HG2 LYS 118 2HG LYS 118 -20.127 -0.916 -0.592 915 HG3 LYS 118 3HG LYS 118 -20.466 0.767 -1.004 916 HD2 LYS 118 2HD LYS 118 -19.869 0.041 -3.071 917 HD3 LYS 118 3HD LYS 118 -18.255 0.415 -2.464 918 HE2 LYS 118 2HE LYS 118 -17.776 -1.838 -2.031 919 HE3 LYS 118 3HE LYS 118 -19.473 -2.306 -2.116 920 HZ1 LYS 118 3HZ LYS 118 -18.180 -2.966 -4.087 921 HZ2 LYS 118 1HZ LYS 118 -17.882 -1.336 -4.428 922 HZ3 LYS 118 2HZ LYS 118 -19.464 -1.934 -4.470 Start of MODEL 8 1 H1 VAL 1 H VAL 1 3.910 -1.079 -4.723 2 HA VAL 1 HA VAL 1 3.350 -1.216 -6.959 3 HB VAL 1 HB VAL 1 3.985 -3.399 -7.938 4 HG11 VAL 1 1HG1 VAL 1 5.764 -2.185 -5.840 5 HG12 VAL 1 2HG1 VAL 1 6.320 -3.447 -6.942 6 HG13 VAL 1 3HG1 VAL 1 5.767 -1.898 -7.580 7 HG21 VAL 1 3HG2 VAL 1 3.225 -5.041 -6.486 8 HG22 VAL 1 1HG2 VAL 1 4.965 -5.049 -6.196 9 HG23 VAL 1 2HG2 VAL 1 3.886 -4.233 -5.064 10 H TRP 2 H TRP 2 1.009 -1.302 -5.413 11 HA TRP 2 HA TRP 2 -0.659 -3.045 -7.093 12 HB2 TRP 2 2HB TRP 2 -2.163 -3.381 -5.124 13 HB3 TRP 2 3HB TRP 2 -0.574 -4.119 -4.938 14 HD1 TRP 2 HD1 TRP 2 1.217 -2.605 -3.390 15 HE1 TRP 2 HE1 TRP 2 0.719 -1.257 -1.255 16 HE3 TRP 2 HE3 TRP 2 -3.842 -2.090 -3.916 17 HZ2 TRP 2 HZ2 TRP 2 -1.521 -0.126 0.036 18 HZ3 TRP 2 HZ3 TRP 2 -5.088 -0.861 -2.187 19 HH2 TRP 2 HH2 TRP 2 -3.950 0.099 -0.252 20 HA PRO 3 HA PRO 3 -1.988 1.450 -7.129 21 HB2 PRO 3 2HB PRO 3 -1.875 1.746 -9.825 22 HB3 PRO 3 3HB PRO 3 -0.489 2.037 -8.768 23 HG2 PRO 3 2HG PRO 3 -1.143 -0.377 -10.413 24 HG3 PRO 3 3HG PRO 3 0.417 0.438 -10.194 25 HD2 PRO 3 2HD PRO 3 -0.243 -1.827 -8.865 26 HD3 PRO 3 3HD PRO 3 0.803 -0.578 -8.161 27 H LEU 4 H LEU 4 -3.952 0.208 -6.434 28 HA LEU 4 HA LEU 4 -5.726 -0.606 -8.597 29 HB2 LEU 4 2HB LEU 4 -6.867 -1.806 -7.067 30 HB3 LEU 4 3HB LEU 4 -5.351 -1.670 -6.179 31 HG LEU 4 HG LEU 4 -6.547 0.487 -5.203 32 HD11 LEU 4 1HD1 LEU 4 -9.007 -0.840 -4.945 33 HD12 LEU 4 2HD1 LEU 4 -8.630 -0.822 -6.667 34 HD13 LEU 4 3HD1 LEU 4 -8.681 0.690 -5.761 35 HD21 LEU 4 3HD2 LEU 4 -5.805 -1.861 -4.197 36 HD22 LEU 4 1HD2 LEU 4 -7.552 -2.053 -4.052 37 HD23 LEU 4 2HD2 LEU 4 -6.747 -0.692 -3.271 38 H VAL 5 H VAL 5 -5.160 2.078 -6.515 39 HA VAL 5 HA VAL 5 -7.795 3.230 -6.998 40 HB VAL 5 HB VAL 5 -6.397 5.195 -5.728 41 HG11 VAL 5 1HG1 VAL 5 -8.390 3.233 -5.082 42 HG12 VAL 5 2HG1 VAL 5 -7.365 3.543 -3.679 43 HG13 VAL 5 3HG1 VAL 5 -8.202 4.877 -4.473 44 HG21 VAL 5 3HG2 VAL 5 -4.430 3.631 -5.620 45 HG22 VAL 5 1HG2 VAL 5 -4.970 4.269 -4.067 46 HG23 VAL 5 2HG2 VAL 5 -5.385 2.621 -4.535 47 H ILE 6 H ILE 6 -4.448 4.437 -7.295 48 HA ILE 6 HA ILE 6 -4.912 6.633 -8.862 49 HB ILE 6 HB ILE 6 -2.588 6.030 -9.910 50 HG12 ILE 6 2HG1 ILE 6 -3.110 3.622 -8.700 51 HG13 ILE 6 3HG1 ILE 6 -1.513 4.188 -9.176 52 HG21 ILE 6 1HG2 ILE 6 -3.052 6.635 -6.997 53 HG22 ILE 6 2HG2 ILE 6 -1.489 6.788 -7.797 54 HG23 ILE 6 3HG2 ILE 6 -2.846 7.787 -8.316 55 HD11 ILE 6 3HD1 ILE 6 -1.640 3.307 -6.864 56 HD12 ILE 6 1HD1 ILE 6 -1.063 4.970 -6.967 57 HD13 ILE 6 2HD1 ILE 6 -2.721 4.642 -6.462 58 H ARG 7 H ARG 7 -4.500 3.283 -9.933 59 HA ARG 7 HA ARG 7 -4.400 3.617 -12.661 60 HB2 ARG 7 2HB ARG 7 -5.375 1.371 -12.845 61 HB3 ARG 7 3HB ARG 7 -4.154 1.442 -11.581 62 HG2 ARG 7 2HG ARG 7 -5.772 1.381 -9.872 63 HG3 ARG 7 3HG ARG 7 -7.086 1.715 -11.001 64 HD2 ARG 7 2HD ARG 7 -5.383 -0.772 -11.049 65 HD3 ARG 7 3HD ARG 7 -6.958 -0.660 -10.265 66 HE ARG 7 HE ARG 7 -7.418 0.162 -12.823 67 HH11 ARG 7 1HH1 ARG 7 -6.033 -2.683 -11.371 68 HH12 ARG 7 2HH1 ARG 7 -6.537 -3.740 -12.649 69 HH21 ARG 7 1HH2 ARG 7 -8.087 -1.219 -14.511 70 HH22 ARG 7 2HH2 ARG 7 -7.704 -2.906 -14.435 71 H THR 8 H THR 8 -7.155 3.894 -10.526 72 HA THR 8 HA THR 8 -9.266 3.716 -12.300 73 HB THR 8 HB THR 8 -9.055 5.659 -9.992 74 HG1 THR 8 HG1 THR 8 -10.302 3.774 -9.019 75 HG21 THR 8 3HG2 THR 8 -11.435 4.473 -11.422 76 HG22 THR 8 1HG2 THR 8 -10.952 6.169 -11.397 77 HG23 THR 8 2HG2 THR 8 -11.525 5.393 -9.920 78 H VAL 9 H VAL 9 -7.619 6.723 -11.301 79 HA VAL 9 HA VAL 9 -8.911 8.328 -13.252 80 HB VAL 9 HB VAL 9 -7.284 10.059 -12.666 81 HG11 VAL 9 1HG1 VAL 9 -8.820 10.317 -11.057 82 HG12 VAL 9 2HG1 VAL 9 -8.881 8.588 -10.707 83 HG13 VAL 9 3HG1 VAL 9 -7.617 9.590 -9.993 84 HG21 VAL 9 3HG2 VAL 9 -5.341 8.493 -12.476 85 HG22 VAL 9 1HG2 VAL 9 -5.461 9.674 -11.172 86 HG23 VAL 9 2HG2 VAL 9 -5.962 8.005 -10.899 87 H ILE 10 H ILE 10 -5.922 6.501 -13.206 88 HA ILE 10 HA ILE 10 -4.693 7.639 -15.463 89 HB ILE 10 HB ILE 10 -4.441 4.761 -14.595 90 HG12 ILE 10 2HG1 ILE 10 -3.976 6.997 -13.007 91 HG13 ILE 10 3HG1 ILE 10 -3.335 5.379 -12.742 92 HG21 ILE 10 1HG2 ILE 10 -2.652 6.631 -16.132 93 HG22 ILE 10 2HG2 ILE 10 -2.113 5.086 -15.476 94 HG23 ILE 10 3HG2 ILE 10 -3.388 5.130 -16.695 95 HD11 ILE 10 3HD1 ILE 10 -1.958 7.493 -14.377 96 HD12 ILE 10 1HD1 ILE 10 -1.633 7.177 -12.673 97 HD13 ILE 10 2HD1 ILE 10 -1.308 5.931 -13.879 98 H ALA 11 H ALA 11 -7.432 5.628 -15.180 99 HA ALA 11 HA ALA 11 -7.454 4.060 -17.423 100 HB1 ALA 11 1HB ALA 11 -9.741 5.644 -16.262 101 HB2 ALA 11 2HB ALA 11 -9.914 4.337 -17.434 102 HB3 ALA 11 3HB ALA 11 -9.259 4.003 -15.831 103 H GLY 12 H GLY 12 -7.671 7.528 -17.243 104 HA2 GLY 12 2HA GLY 12 -8.371 7.704 -20.087 105 HA3 GLY 12 3HA GLY 12 -8.374 9.036 -18.941 106 H TYR 13 H TYR 13 -5.680 8.062 -17.948 107 HA TYR 13 HA TYR 13 -4.047 9.844 -19.258 108 HB2 TYR 13 2HB TYR 13 -3.419 8.846 -17.134 109 HB3 TYR 13 3HB TYR 13 -3.270 7.262 -17.886 110 HD1 TYR 13 HD2 TYR 13 -2.087 10.241 -19.639 111 HD2 TYR 13 HD1 TYR 13 -0.975 7.024 -17.086 112 HE1 TYR 13 HE2 TYR 13 0.284 10.692 -20.113 113 HE2 TYR 13 HE1 TYR 13 1.399 7.467 -17.552 114 HH TYR 13 HH TYR 13 2.739 8.549 -19.415 115 H ASN 14 H ASN 14 -4.281 6.340 -19.855 116 HA ASN 14 HA ASN 14 -2.430 6.105 -21.885 117 HB2 ASN 14 2HB ASN 14 -3.981 4.333 -20.702 118 HB3 ASN 14 3HB ASN 14 -5.012 4.607 -22.104 119 HD21 ASN 14 1HD2 ASN 14 -4.550 3.595 -23.946 120 HD22 ASN 14 2HD2 ASN 14 -3.124 2.666 -24.240 121 H LEU 15 H LEU 15 -5.431 7.747 -21.927 122 HA LEU 15 HA LEU 15 -5.579 7.760 -24.844 123 HB2 LEU 15 2HB LEU 15 -7.489 7.832 -22.825 124 HB3 LEU 15 3HB LEU 15 -7.479 9.468 -23.481 125 HG LEU 15 HG LEU 15 -9.187 8.021 -24.514 126 HD11 LEU 15 1HD1 LEU 15 -8.935 9.400 -26.229 127 HD12 LEU 15 2HD1 LEU 15 -7.722 8.313 -26.904 128 HD13 LEU 15 3HD1 LEU 15 -7.231 9.626 -25.834 129 HD21 LEU 15 3HD2 LEU 15 -8.682 6.118 -25.758 130 HD22 LEU 15 1HD2 LEU 15 -7.664 5.957 -24.328 131 HD23 LEU 15 2HD2 LEU 15 -6.965 6.514 -25.849 132 H TYR 16 H TYR 16 -4.797 9.839 -22.145 133 HA TYR 16 HA TYR 16 -4.921 12.357 -23.129 134 HB2 TYR 16 2HB TYR 16 -2.678 11.106 -21.538 135 HB3 TYR 16 3HB TYR 16 -2.822 12.838 -21.818 136 HD1 TYR 16 HD2 TYR 16 -6.076 11.708 -21.620 137 HD2 TYR 16 HD1 TYR 16 -2.686 12.380 -19.138 138 HE1 TYR 16 HE2 TYR 16 -7.553 11.902 -19.663 139 HE2 TYR 16 HE1 TYR 16 -4.154 12.574 -17.175 140 HH TYR 16 HH TYR 16 -6.794 11.517 -16.741 141 H ARG 17 H ARG 17 -2.238 10.092 -23.716 142 HA ARG 17 HA ARG 17 -1.018 11.885 -25.625 143 HB2 ARG 17 2HB ARG 17 -0.338 9.218 -24.462 144 HB3 ARG 17 3HB ARG 17 0.427 9.701 -25.971 145 HG2 ARG 17 2HG ARG 17 0.864 11.918 -24.542 146 HG3 ARG 17 3HG ARG 17 0.806 10.735 -23.234 147 HD2 ARG 17 2HD ARG 17 2.433 9.365 -24.667 148 HD3 ARG 17 3HD ARG 17 2.672 10.854 -25.581 149 HE ARG 17 HE ARG 17 3.004 11.374 -22.835 150 HH11 ARG 17 1HH1 ARG 17 4.571 9.750 -25.486 151 HH12 ARG 17 2HH1 ARG 17 6.165 9.951 -24.838 152 HH21 ARG 17 1HH2 ARG 17 5.098 11.645 -21.972 153 HH22 ARG 17 2HH2 ARG 17 6.464 11.029 -22.839 154 H ALA 18 H ALA 18 -3.213 9.215 -25.662 155 HA ALA 18 HA ALA 18 -2.903 8.098 -28.143 156 HB1 ALA 18 1HB ALA 18 -5.550 8.794 -26.878 157 HB2 ALA 18 2HB ALA 18 -5.254 7.544 -28.087 158 HB3 ALA 18 3HB ALA 18 -4.570 7.385 -26.469 159 H ILE 19 H ILE 19 -4.512 11.147 -27.346 160 HA ILE 19 HA ILE 19 -5.290 11.655 -30.068 161 HB ILE 19 HB ILE 19 -5.493 13.152 -27.498 162 HG12 ILE 19 2HG1 ILE 19 -7.843 13.245 -28.105 163 HG13 ILE 19 3HG1 ILE 19 -7.486 12.617 -29.710 164 HG21 ILE 19 1HG2 ILE 19 -5.580 14.386 -30.233 165 HG22 ILE 19 2HG2 ILE 19 -6.443 15.085 -28.864 166 HG23 ILE 19 3HG2 ILE 19 -4.688 14.922 -28.810 167 HD11 ILE 19 3HD1 ILE 19 -6.865 10.491 -28.798 168 HD12 ILE 19 1HD1 ILE 19 -7.023 11.105 -27.153 169 HD13 ILE 19 2HD1 ILE 19 -8.452 10.943 -28.174 170 H LYS 20 H LYS 20 -2.552 12.350 -28.057 171 HA LYS 20 HA LYS 20 -1.500 14.549 -29.477 172 HB2 LYS 20 2HB LYS 20 -0.560 12.665 -27.429 173 HB3 LYS 20 3HB LYS 20 0.714 13.277 -28.476 174 HG2 LYS 20 2HG LYS 20 -1.237 15.043 -27.019 175 HG3 LYS 20 3HG LYS 20 0.344 14.584 -26.382 176 HD2 LYS 20 2HD LYS 20 1.474 15.896 -27.866 177 HD3 LYS 20 3HD LYS 20 0.248 15.718 -29.123 178 HE2 LYS 20 2HE LYS 20 -1.242 17.136 -27.590 179 HE3 LYS 20 3HE LYS 20 0.246 17.539 -26.736 180 HZ1 LYS 20 3HZ LYS 20 -0.164 17.956 -29.646 181 HZ2 LYS 20 1HZ LYS 20 1.149 18.482 -28.717 182 HZ3 LYS 20 2HZ LYS 20 -0.382 19.158 -28.476 183 H LYS 21 H LYS 21 -1.354 11.097 -29.996 184 HA LYS 21 HA LYS 21 0.673 11.318 -32.055 185 HB2 LYS 21 2HB LYS 21 -0.944 9.006 -30.988 186 HB3 LYS 21 3HB LYS 21 0.158 8.844 -32.349 187 HG2 LYS 21 2HG LYS 21 1.839 8.534 -30.950 188 HG3 LYS 21 3HG LYS 21 1.563 10.134 -30.256 189 HD2 LYS 21 2HD LYS 21 0.416 9.310 -28.470 190 HD3 LYS 21 3HD LYS 21 -0.244 7.951 -29.384 191 HE2 LYS 21 2HE LYS 21 1.707 6.690 -29.140 192 HE3 LYS 21 3HE LYS 21 2.676 8.101 -28.717 193 HZ1 LYS 21 3HZ LYS 21 0.526 7.668 -26.882 194 HZ2 LYS 21 1HZ LYS 21 2.180 7.859 -26.578 195 HZ3 LYS 21 2HZ LYS 21 1.562 6.333 -26.966 196 H LYS 22 H LYS 22 -2.806 10.791 -31.825 197 HA LYS 22 HA LYS 22 -4.470 10.798 -33.379 198 HB2 LYS 22 2HB LYS 22 -3.569 13.117 -33.642 199 HB3 LYS 22 3HB LYS 22 -2.563 12.531 -34.960 200 HG2 LYS 22 2HG LYS 22 -5.211 11.715 -35.505 201 HG3 LYS 22 3HG LYS 22 -5.266 13.413 -35.027 202 HD2 LYS 22 2HD LYS 22 -3.641 13.989 -36.709 203 HD3 LYS 22 3HD LYS 22 -3.403 12.288 -37.117 204 HE2 LYS 22 2HE LYS 22 -5.258 12.208 -38.386 205 HE3 LYS 22 3HE LYS 22 -6.186 13.205 -37.267 206 HZ1 LYS 22 3HZ LYS 22 -5.452 14.050 -39.653 207 HZ2 LYS 22 1HZ LYS 22 -4.083 14.536 -38.785 208 HZ3 LYS 22 2HZ LYS 22 -5.613 15.098 -38.334 209 H GLY 23 H GLY 23 -4.017 8.503 -33.741 210 HA2 GLY 23 2HA GLY 23 -4.138 7.707 -36.347 211 HA3 GLY 23 3HA GLY 23 -2.415 7.729 -36.001 212 H GLY 24 H GLY 24 -2.887 6.974 -33.169 213 HA2 GLY 24 2HA GLY 24 -4.140 4.377 -33.250 214 HA3 GLY 24 3HA GLY 24 -2.384 4.306 -33.212 215 H GLY 25 H GLY 25 -2.465 3.256 -31.179 216 HA2 GLY 25 2HA GLY 25 -2.577 5.132 -28.967 217 HA3 GLY 25 3HA GLY 25 -3.753 3.828 -28.896 218 H GLY 26 H GLY 26 -2.265 3.755 -26.815 219 HA2 GLY 26 2HA GLY 26 -1.088 1.353 -26.573 220 HA3 GLY 26 3HA GLY 26 0.217 2.318 -27.247 221 H GLY 27 H GLY 27 0.655 1.183 -24.854 222 HA2 GLY 27 2HA GLY 27 0.628 3.517 -23.060 223 HA3 GLY 27 3HA GLY 27 0.100 1.954 -22.455 224 H GLY 28 H GLY 28 2.566 3.968 -22.249 225 HA2 GLY 28 2HA GLY 28 4.393 2.005 -21.331 226 HA3 GLY 28 3HA GLY 28 4.882 2.580 -22.918 227 H GLY 29 H GLY 29 6.659 2.996 -21.009 228 HA2 GLY 29 2HA GLY 29 6.234 5.719 -19.984 229 HA3 GLY 29 3HA GLY 29 7.456 4.591 -19.415 230 H GLY 30 H GLY 30 7.770 7.364 -20.283 231 HA2 GLY 30 2HA GLY 30 10.162 7.144 -21.703 232 HA3 GLY 30 3HA GLY 30 8.896 7.489 -22.872 233 H GLY 31 H GLY 31 10.806 9.307 -22.770 234 HA2 GLY 31 2HA GLY 31 9.763 11.464 -21.043 235 HA3 GLY 31 3HA GLY 31 11.422 11.368 -21.617 236 H GLY 32 H GLY 32 11.571 13.255 -22.728 237 HA2 GLY 32 2HA GLY 32 11.485 14.343 -24.811 238 HA3 GLY 32 3HA GLY 32 10.069 13.389 -25.226 239 H VAL 33 H VAL 33 10.396 16.221 -25.564 240 HA VAL 33 HA VAL 33 8.304 17.190 -23.725 241 HB VAL 33 HB VAL 33 10.350 18.389 -23.276 242 HG11 VAL 33 1HG1 VAL 33 11.353 17.924 -25.539 243 HG12 VAL 33 2HG1 VAL 33 10.395 19.273 -26.154 244 HG13 VAL 33 3HG1 VAL 33 11.618 19.551 -24.912 245 HG21 VAL 33 3HG2 VAL 33 9.461 20.502 -23.270 246 HG22 VAL 33 1HG2 VAL 33 8.848 20.367 -24.918 247 HG23 VAL 33 2HG2 VAL 33 8.010 19.554 -23.597 248 H TRP 34 H TRP 34 6.433 17.633 -24.670 249 HA TRP 34 HA TRP 34 6.051 19.164 -26.945 250 HB2 TRP 34 2HB TRP 34 6.853 17.634 -28.468 251 HB3 TRP 34 3HB TRP 34 6.395 16.250 -27.480 252 HD1 TRP 34 HD1 TRP 34 4.181 19.061 -29.001 253 HE1 TRP 34 HE1 TRP 34 2.296 17.936 -30.345 254 HE3 TRP 34 HE3 TRP 34 5.553 14.174 -28.388 255 HZ2 TRP 34 HZ2 TRP 34 1.496 15.323 -31.050 256 HZ3 TRP 34 HZ3 TRP 34 4.173 12.423 -29.429 257 HH2 TRP 34 HH2 TRP 34 2.187 12.987 -30.732 258 HA PRO 35 HA PRO 35 1.930 16.858 -25.915 259 HB2 PRO 35 2HB PRO 35 2.055 14.844 -24.099 260 HB3 PRO 35 3HB PRO 35 2.264 14.586 -25.835 261 HG2 PRO 35 2HG PRO 35 4.340 14.835 -23.693 262 HG3 PRO 35 3HG PRO 35 4.263 13.695 -25.049 263 HD2 PRO 35 2HD PRO 35 5.829 15.903 -25.090 264 HD3 PRO 35 3HD PRO 35 5.081 15.236 -26.555 265 H LEU 36 H LEU 36 1.804 18.951 -24.881 266 HA LEU 36 HA LEU 36 2.273 19.063 -22.014 267 HB2 LEU 36 2HB LEU 36 1.850 21.388 -22.173 268 HB3 LEU 36 3HB LEU 36 2.849 20.945 -23.555 269 HG LEU 36 HG LEU 36 0.393 20.774 -24.663 270 HD11 LEU 36 1HD1 LEU 36 -0.806 21.504 -22.716 271 HD12 LEU 36 2HD1 LEU 36 -0.862 22.783 -23.928 272 HD13 LEU 36 3HD1 LEU 36 0.233 22.919 -22.553 273 HD21 LEU 36 3HD2 LEU 36 1.670 22.074 -25.956 274 HD22 LEU 36 1HD2 LEU 36 2.556 22.728 -24.579 275 HD23 LEU 36 2HD2 LEU 36 1.001 23.423 -25.036 276 H VAL 37 H VAL 37 -0.395 18.932 -24.284 277 HA VAL 37 HA VAL 37 -2.529 19.652 -22.688 278 HB VAL 37 HB VAL 37 -3.888 18.040 -24.065 279 HG11 VAL 37 1HG1 VAL 37 -2.574 20.417 -24.802 280 HG12 VAL 37 2HG1 VAL 37 -2.510 19.347 -26.204 281 HG13 VAL 37 3HG1 VAL 37 -4.063 19.749 -25.470 282 HG21 VAL 37 3HG2 VAL 37 -1.178 17.433 -25.239 283 HG22 VAL 37 1HG2 VAL 37 -2.277 16.306 -24.444 284 HG23 VAL 37 2HG2 VAL 37 -2.709 17.007 -26.004 285 H ILE 38 H ILE 38 -0.751 16.620 -22.772 286 HA ILE 38 HA ILE 38 -2.514 15.082 -21.210 287 HB ILE 38 HB ILE 38 -0.681 13.562 -20.850 288 HG12 ILE 38 2HG1 ILE 38 1.572 14.491 -22.024 289 HG13 ILE 38 3HG1 ILE 38 0.932 15.991 -21.363 290 HG21 ILE 38 1HG2 ILE 38 -1.426 14.574 -23.419 291 HG22 ILE 38 2HG2 ILE 38 0.251 14.031 -23.463 292 HG23 ILE 38 3HG2 ILE 38 -1.021 12.923 -22.948 293 HD11 ILE 38 3HD1 ILE 38 1.643 15.457 -19.341 294 HD12 ILE 38 1HD1 ILE 38 0.792 13.913 -19.396 295 HD13 ILE 38 2HD1 ILE 38 2.429 14.042 -20.041 296 H ARG 39 H ARG 39 -0.062 17.424 -20.371 297 HA ARG 39 HA ARG 39 0.064 16.737 -17.599 298 HB2 ARG 39 2HB ARG 39 1.664 18.350 -17.433 299 HB3 ARG 39 3HB ARG 39 1.698 18.140 -19.178 300 HG2 ARG 39 2HG ARG 39 -0.141 20.022 -19.104 301 HG3 ARG 39 3HG ARG 39 0.625 20.383 -17.555 302 HD2 ARG 39 2HD ARG 39 2.818 20.158 -19.052 303 HD3 ARG 39 3HD ARG 39 1.683 20.641 -20.312 304 HE ARG 39 HE ARG 39 1.664 22.747 -19.427 305 HH11 ARG 39 1HH1 ARG 39 2.941 20.539 -17.058 306 HH12 ARG 39 2HH1 ARG 39 3.390 21.789 -15.944 307 HH21 ARG 39 1HH2 ARG 39 2.251 24.401 -17.970 308 HH22 ARG 39 2HH2 ARG 39 2.996 23.985 -16.464 309 H THR 40 H THR 40 -2.040 18.642 -19.547 310 HA THR 40 HA THR 40 -3.019 20.417 -17.577 311 HB THR 40 HB THR 40 -4.944 19.554 -19.638 312 HG1 THR 40 HG1 THR 40 -2.371 20.575 -20.294 313 HG21 THR 40 3HG2 THR 40 -5.036 22.004 -20.016 314 HG22 THR 40 1HG2 THR 40 -3.757 22.208 -18.821 315 HG23 THR 40 2HG2 THR 40 -5.322 21.558 -18.335 316 H VAL 41 H VAL 41 -4.270 17.307 -18.778 317 HA VAL 41 HA VAL 41 -6.402 17.241 -16.859 318 HB VAL 41 HB VAL 41 -5.444 14.795 -18.296 319 HG11 VAL 41 1HG1 VAL 41 -7.309 14.575 -16.761 320 HG12 VAL 41 2HG1 VAL 41 -8.174 15.870 -17.591 321 HG13 VAL 41 3HG1 VAL 41 -7.859 14.345 -18.420 322 HG21 VAL 41 3HG2 VAL 41 -6.701 17.221 -19.523 323 HG22 VAL 41 1HG2 VAL 41 -5.358 16.242 -20.112 324 HG23 VAL 41 2HG2 VAL 41 -7.005 15.616 -20.186 325 H ILE 42 H ILE 42 -3.208 15.777 -17.151 326 HA ILE 42 HA ILE 42 -3.430 14.007 -14.962 327 HB ILE 42 HB ILE 42 -1.081 15.206 -16.398 328 HG12 ILE 42 2HG1 ILE 42 -2.408 12.517 -16.233 329 HG13 ILE 42 3HG1 ILE 42 -2.017 13.472 -17.659 330 HG21 ILE 42 1HG2 ILE 42 -1.000 13.407 -13.981 331 HG22 ILE 42 2HG2 ILE 42 0.374 13.720 -15.041 332 HG23 ILE 42 3HG2 ILE 42 -0.345 15.039 -14.118 333 HD11 ILE 42 3HD1 ILE 42 -0.476 11.766 -17.751 334 HD12 ILE 42 1HD1 ILE 42 0.437 13.051 -16.961 335 HD13 ILE 42 2HD1 ILE 42 -0.246 11.737 -16.003 336 H ALA 43 H ALA 43 -3.016 17.402 -15.140 337 HA ALA 43 HA ALA 43 -1.543 18.094 -12.946 338 HB1 ALA 43 1HB ALA 43 -4.095 19.359 -13.932 339 HB2 ALA 43 2HB ALA 43 -2.998 20.099 -12.765 340 HB3 ALA 43 3HB ALA 43 -2.448 19.770 -14.408 341 H GLY 44 H GLY 44 -4.573 16.451 -12.995 342 HA2 GLY 44 2HA GLY 44 -5.049 16.980 -10.153 343 HA3 GLY 44 3HA GLY 44 -6.160 16.182 -11.256 344 H TYR 45 H TYR 45 -4.176 14.360 -12.326 345 HA TYR 45 HA TYR 45 -4.541 12.176 -10.666 346 HB2 TYR 45 2HB TYR 45 -3.954 11.609 -12.837 347 HB3 TYR 45 3HB TYR 45 -2.635 12.774 -12.896 348 HD1 TYR 45 HD2 TYR 45 -3.426 9.985 -10.535 349 HD2 TYR 45 HD1 TYR 45 -0.658 11.653 -13.303 350 HE1 TYR 45 HE2 TYR 45 -1.827 8.193 -10.006 351 HE2 TYR 45 HE1 TYR 45 0.949 9.865 -12.782 352 HH TYR 45 HH TYR 45 0.334 7.532 -10.218 353 H ASN 46 H ASN 46 -1.710 14.303 -10.930 354 HA ASN 46 HA ASN 46 0.043 13.048 -9.235 355 HB2 ASN 46 2HB ASN 46 -0.328 15.744 -10.241 356 HB3 ASN 46 3HB ASN 46 0.324 15.757 -8.605 357 HD21 ASN 46 1HD2 ASN 46 2.311 16.523 -9.281 358 HD22 ASN 46 2HD2 ASN 46 3.440 15.537 -10.140 359 H LEU 47 H LEU 47 -2.917 14.640 -8.439 360 HA LEU 47 HA LEU 47 -2.331 14.970 -5.644 361 HB2 LEU 47 2HB LEU 47 -4.252 15.932 -7.414 362 HB3 LEU 47 3HB LEU 47 -5.148 14.908 -6.294 363 HG LEU 47 HG LEU 47 -5.160 17.254 -5.600 364 HD11 LEU 47 1HD1 LEU 47 -5.318 15.545 -3.891 365 HD12 LEU 47 2HD1 LEU 47 -4.385 16.917 -3.293 366 HD13 LEU 47 3HD1 LEU 47 -3.559 15.442 -3.798 367 HD21 LEU 47 3HD2 LEU 47 -2.632 17.390 -6.540 368 HD22 LEU 47 1HD2 LEU 47 -2.325 17.241 -4.809 369 HD23 LEU 47 2HD2 LEU 47 -3.332 18.556 -5.416 370 H TYR 48 H TYR 48 -4.192 12.687 -7.609 371 HA TYR 48 HA TYR 48 -5.402 11.185 -5.647 372 HB2 TYR 48 2HB TYR 48 -4.626 10.778 -8.429 373 HB3 TYR 48 3HB TYR 48 -4.606 9.282 -7.502 374 HD1 TYR 48 HD1 TYR 48 -6.765 12.206 -8.311 375 HD2 TYR 48 HD2 TYR 48 -6.596 8.134 -7.089 376 HE1 TYR 48 HE1 TYR 48 -9.209 12.043 -8.537 377 HE2 TYR 48 HE2 TYR 48 -9.039 7.959 -7.313 378 HH TYR 48 HH TYR 48 -11.048 10.033 -7.206 379 H ARG 49 H ARG 49 -2.090 10.929 -6.866 380 HA ARG 49 HA ARG 49 -1.434 8.678 -5.222 381 HB2 ARG 49 2HB ARG 49 -0.211 10.138 -7.347 382 HB3 ARG 49 3HB ARG 49 0.916 10.082 -5.999 383 HG2 ARG 49 2HG ARG 49 -0.269 7.500 -6.391 384 HG3 ARG 49 3HG ARG 49 0.421 8.095 -7.903 385 HD2 ARG 49 2HD ARG 49 2.559 8.404 -6.890 386 HD3 ARG 49 3HD ARG 49 1.904 8.096 -5.283 387 HE ARG 49 HE ARG 49 2.043 5.842 -5.689 388 HH11 ARG 49 1HH1 ARG 49 2.435 7.585 -8.678 389 HH12 ARG 49 2HH1 ARG 49 2.902 6.184 -9.584 390 HH21 ARG 49 1HH2 ARG 49 2.656 3.991 -6.872 391 HH22 ARG 49 2HH2 ARG 49 3.027 4.141 -8.557 392 H ALA 50 H ALA 50 -1.446 12.107 -4.818 393 HA ALA 50 HA ALA 50 0.472 12.557 -2.899 394 HB1 ALA 50 1HB ALA 50 -2.109 13.877 -2.382 395 HB2 ALA 50 2HB ALA 50 -0.504 14.569 -2.623 396 HB3 ALA 50 3HB ALA 50 -1.465 14.066 -4.014 397 H ILE 51 H ILE 51 -2.721 11.120 -2.506 398 HA ILE 51 HA ILE 51 -2.453 10.957 0.371 399 HB ILE 51 HB ILE 51 -4.554 9.758 -1.437 400 HG12 ILE 51 2HG1 ILE 51 -4.536 12.200 -1.558 401 HG13 ILE 51 3HG1 ILE 51 -5.957 11.640 -0.683 402 HG21 ILE 51 1HG2 ILE 51 -4.018 9.513 1.402 403 HG22 ILE 51 2HG2 ILE 51 -5.634 10.138 1.078 404 HG23 ILE 51 3HG2 ILE 51 -5.127 8.601 0.379 405 HD11 ILE 51 3HD1 ILE 51 -4.856 12.168 1.431 406 HD12 ILE 51 1HD1 ILE 51 -3.442 12.742 0.547 407 HD13 ILE 51 2HD1 ILE 51 -4.985 13.582 0.385 408 H LYS 52 H LYS 52 -1.676 9.037 -2.361 409 HA LYS 52 HA LYS 52 -1.728 6.494 -1.043 410 HB2 LYS 52 2HB LYS 52 -0.829 7.529 -3.683 411 HB3 LYS 52 3HB LYS 52 -0.124 6.016 -3.128 412 HG2 LYS 52 2HG LYS 52 -3.077 6.550 -3.373 413 HG3 LYS 52 3HG LYS 52 -2.096 5.699 -4.568 414 HD2 LYS 52 2HD LYS 52 -1.838 4.673 -1.833 415 HD3 LYS 52 3HD LYS 52 -3.454 4.508 -2.525 416 HE2 LYS 52 2HE LYS 52 -2.693 2.662 -3.518 417 HE3 LYS 52 3HE LYS 52 -1.788 3.735 -4.584 418 HZ1 LYS 52 3HZ LYS 52 0.152 3.352 -3.477 419 HZ2 LYS 52 1HZ LYS 52 -0.597 1.854 -3.242 420 HZ3 LYS 52 2HZ LYS 52 -0.605 3.006 -2.004 421 H LYS 53 H LYS 53 0.605 9.048 -1.465 422 HA LYS 53 HA LYS 53 2.824 7.437 -0.536 423 HB2 LYS 53 2HB LYS 53 3.648 8.996 -1.997 424 HB3 LYS 53 3HB LYS 53 2.460 10.211 -1.542 425 HG2 LYS 53 2HG LYS 53 3.705 10.965 0.232 426 HG3 LYS 53 3HG LYS 53 4.561 9.433 0.422 427 HD2 LYS 53 2HD LYS 53 6.192 10.809 -0.482 428 HD3 LYS 53 3HD LYS 53 5.555 9.987 -1.909 429 HE2 LYS 53 2HE LYS 53 4.265 11.881 -2.528 430 HE3 LYS 53 3HE LYS 53 4.553 12.667 -0.976 431 HZ1 LYS 53 3HZ LYS 53 6.772 12.022 -2.819 432 HZ2 LYS 53 1HZ LYS 53 6.754 13.127 -1.539 433 HZ3 LYS 53 2HZ LYS 53 5.898 13.463 -2.958 434 H LYS 54 H LYS 54 0.716 9.976 0.711 435 HA LYS 54 HA LYS 54 1.462 9.214 3.424 436 HB2 LYS 54 2HB LYS 54 2.042 11.838 2.170 437 HB3 LYS 54 3HB LYS 54 1.389 11.878 3.802 438 HG2 LYS 54 2HG LYS 54 3.233 10.845 4.712 439 HG3 LYS 54 3HG LYS 54 3.696 10.091 3.185 440 HD2 LYS 54 2HD LYS 54 5.265 11.838 3.669 441 HD3 LYS 54 3HD LYS 54 4.260 12.357 2.314 442 HE2 LYS 54 2HE LYS 54 3.017 13.830 3.670 443 HE3 LYS 54 3HE LYS 54 3.629 13.105 5.156 444 HZ1 LYS 54 3HZ LYS 54 5.584 14.226 5.010 445 HZ2 LYS 54 1HZ LYS 54 4.592 15.348 4.221 446 HZ3 LYS 54 2HZ LYS 54 5.567 14.300 3.320 447 H GLY 55 H GLY 55 0.030 10.470 5.040 448 HA2 GLY 55 2HA GLY 55 -2.700 10.494 3.926 449 HA3 GLY 55 3HA GLY 55 -2.297 10.100 5.590 450 H GLY 56 H GLY 56 -4.141 12.128 4.411 451 HA2 GLY 56 2HA GLY 56 -3.936 14.137 6.267 452 HA3 GLY 56 3HA GLY 56 -2.974 14.698 4.907 453 H GLY 57 H GLY 57 -5.355 15.924 5.933 454 HA2 GLY 57 2HA GLY 57 -6.880 15.973 3.446 455 HA3 GLY 57 3HA GLY 57 -7.766 15.529 4.897 456 H GLY 58 H GLY 58 -8.636 17.681 3.544 457 HA2 GLY 58 2HA GLY 58 -7.613 19.978 5.097 458 HA3 GLY 58 3HA GLY 58 -8.322 20.114 3.494 459 H GLY 59 H GLY 59 -10.078 21.354 3.826 460 HA2 GLY 59 2HA GLY 59 -11.754 20.990 6.154 461 HA3 GLY 59 3HA GLY 59 -12.002 22.150 4.857 462 H GLY 60 H GLY 60 -14.278 21.452 5.176 463 HA2 GLY 60 2HA GLY 60 -14.936 19.461 3.186 464 HA3 GLY 60 3HA GLY 60 -15.395 19.017 4.823 465 H GLY 61 H GLY 61 -17.523 19.025 3.531 466 HA2 GLY 61 2HA GLY 61 -19.381 20.641 4.460 467 HA3 GLY 61 3HA GLY 61 -18.654 21.712 3.272 468 H GLY 62 H GLY 62 -21.125 19.601 3.774 469 HA2 GLY 62 2HA GLY 62 -22.165 19.711 1.217 470 HA3 GLY 62 3HA GLY 62 -21.217 18.233 1.276 471 H GLY 63 H GLY 63 -21.690 17.360 3.845 472 HA2 GLY 63 2HA GLY 63 -23.538 16.869 5.331 473 HA3 GLY 63 3HA GLY 63 -24.624 17.089 3.967 474 H GLY 64 H GLY 64 -24.591 15.474 2.262 475 HA2 GLY 64 2HA GLY 64 -24.321 12.819 3.388 476 HA3 GLY 64 3HA GLY 64 -25.013 13.227 1.825 477 H VAL 65 H VAL 65 -23.345 14.078 0.203 478 HA VAL 65 HA VAL 65 -20.922 12.411 0.409 479 HB VAL 65 HB VAL 65 -22.550 11.699 -1.348 480 HG11 VAL 65 1HG1 VAL 65 -22.835 14.369 -1.842 481 HG12 VAL 65 2HG1 VAL 65 -21.794 13.859 -3.173 482 HG13 VAL 65 3HG1 VAL 65 -23.355 13.076 -2.923 483 HG21 VAL 65 3HG2 VAL 65 -20.490 12.327 -3.168 484 HG22 VAL 65 1HG2 VAL 65 -19.737 12.150 -1.583 485 HG23 VAL 65 2HG2 VAL 65 -20.710 10.838 -2.248 486 H TRP 66 H TRP 66 -18.972 13.324 0.045 487 HA TRP 66 HA TRP 66 -18.942 16.171 -0.722 488 HB2 TRP 66 2HB TRP 66 -16.765 16.201 0.668 489 HB3 TRP 66 3HB TRP 66 -18.301 16.185 1.529 490 HD1 TRP 66 HD1 TRP 66 -19.055 13.729 2.561 491 HE1 TRP 66 HE1 TRP 66 -17.582 11.843 3.509 492 HE3 TRP 66 HE3 TRP 66 -14.578 15.077 0.492 493 HZ2 TRP 66 HZ2 TRP 66 -14.880 11.034 3.395 494 HZ3 TRP 66 HZ3 TRP 66 -12.598 13.694 0.961 495 HH2 TRP 66 HH2 TRP 66 -12.748 11.715 2.384 496 HA PRO 67 HA PRO 67 -16.452 13.679 -3.778 497 HB2 PRO 67 2HB PRO 67 -17.585 14.787 -5.982 498 HB3 PRO 67 3HB PRO 67 -18.259 13.373 -5.163 499 HG2 PRO 67 2HG PRO 67 -19.070 16.247 -4.957 500 HG3 PRO 67 3HG PRO 67 -20.091 14.803 -5.078 501 HD2 PRO 67 2HD PRO 67 -19.619 16.059 -2.727 502 HD3 PRO 67 3HD PRO 67 -19.872 14.306 -2.838 503 H LEU 68 H LEU 68 -15.125 15.497 -2.478 504 HA LEU 68 HA LEU 68 -14.561 17.801 -4.167 505 HB2 LEU 68 2HB LEU 68 -13.424 18.717 -2.369 506 HB3 LEU 68 3HB LEU 68 -14.741 17.826 -1.609 507 HG LEU 68 HG LEU 68 -12.859 15.944 -1.477 508 HD11 LEU 68 1HD1 LEU 68 -10.957 17.896 -0.683 509 HD12 LEU 68 2HD1 LEU 68 -11.421 18.222 -2.352 510 HD13 LEU 68 3HD1 LEU 68 -10.799 16.634 -1.904 511 HD21 LEU 68 3HD2 LEU 68 -12.845 18.214 0.492 512 HD22 LEU 68 1HD2 LEU 68 -12.610 16.493 0.795 513 HD23 LEU 68 2HD2 LEU 68 -14.204 17.098 0.347 514 H VAL 69 H VAL 69 -13.241 14.700 -3.369 515 HA VAL 69 HA VAL 69 -10.629 15.301 -4.481 516 HB VAL 69 HB VAL 69 -10.105 12.945 -4.015 517 HG11 VAL 69 1HG1 VAL 69 -11.366 14.541 -1.799 518 HG12 VAL 69 2HG1 VAL 69 -10.469 13.048 -1.515 519 HG13 VAL 69 3HG1 VAL 69 -9.661 14.440 -2.237 520 HG21 VAL 69 3HG2 VAL 69 -12.215 11.895 -4.449 521 HG22 VAL 69 1HG2 VAL 69 -11.781 11.583 -2.768 522 HG23 VAL 69 2HG2 VAL 69 -12.991 12.807 -3.153 523 H ILE 70 H ILE 70 -13.551 13.549 -5.373 524 HA ILE 70 HA ILE 70 -12.514 12.323 -7.704 525 HB ILE 70 HB ILE 70 -14.809 11.887 -8.331 526 HG12 ILE 70 2HG1 ILE 70 -16.507 12.848 -6.475 527 HG13 ILE 70 3HG1 ILE 70 -15.329 14.156 -6.489 528 HG21 ILE 70 1HG2 ILE 70 -15.337 10.463 -6.599 529 HG22 ILE 70 2HG2 ILE 70 -13.629 10.774 -6.291 530 HG23 ILE 70 3HG2 ILE 70 -14.861 11.623 -5.359 531 HD11 ILE 70 3HD1 ILE 70 -16.441 14.985 -8.213 532 HD12 ILE 70 1HD1 ILE 70 -15.815 13.641 -9.167 533 HD13 ILE 70 2HD1 ILE 70 -17.395 13.513 -8.392 534 H ARG 71 H ARG 71 -13.585 15.523 -7.014 535 HA ARG 71 HA ARG 71 -14.019 16.219 -9.795 536 HB2 ARG 71 2HB ARG 71 -14.375 18.519 -8.876 537 HB3 ARG 71 3HB ARG 71 -15.446 17.299 -8.199 538 HG2 ARG 71 2HG ARG 71 -14.154 17.204 -6.179 539 HG3 ARG 71 3HG ARG 71 -12.935 18.281 -6.863 540 HD2 ARG 71 2HD ARG 71 -15.069 19.839 -7.183 541 HD3 ARG 71 3HD ARG 71 -15.644 18.886 -5.815 542 HE ARG 71 HE ARG 71 -13.050 19.786 -5.257 543 HH11 ARG 71 1HH1 ARG 71 -16.275 21.031 -5.663 544 HH12 ARG 71 2HH1 ARG 71 -16.029 22.379 -4.602 545 HH21 ARG 71 1HH2 ARG 71 -12.713 21.556 -3.858 546 HH22 ARG 71 2HH2 ARG 71 -14.002 22.677 -3.576 547 H THR 72 H THR 72 -11.437 16.171 -7.545 548 HA THR 72 HA THR 72 -9.813 18.258 -8.334 549 HB THR 72 HB THR 72 -8.587 15.572 -7.823 550 HG1 THR 72 HG1 THR 72 -8.950 16.256 -5.497 551 HG21 THR 72 3HG2 THR 72 -7.145 17.531 -8.163 552 HG22 THR 72 1HG2 THR 72 -7.004 16.900 -6.523 553 HG23 THR 72 2HG2 THR 72 -7.954 18.354 -6.829 554 H VAL 73 H VAL 73 -9.637 14.920 -9.592 555 HA VAL 73 HA VAL 73 -7.856 15.536 -11.689 556 HB VAL 73 HB VAL 73 -9.795 13.235 -11.420 557 HG11 VAL 73 1HG1 VAL 73 -7.707 12.396 -13.008 558 HG12 VAL 73 2HG1 VAL 73 -9.324 12.830 -13.566 559 HG13 VAL 73 3HG1 VAL 73 -8.029 14.027 -13.594 560 HG21 VAL 73 3HG2 VAL 73 -7.796 11.975 -10.727 561 HG22 VAL 73 1HG2 VAL 73 -6.849 13.461 -10.809 562 HG23 VAL 73 2HG2 VAL 73 -8.154 13.311 -9.632 563 H ILE 74 H ILE 74 -11.384 15.316 -11.558 564 HA ILE 74 HA ILE 74 -11.991 15.512 -14.249 565 HB ILE 74 HB ILE 74 -13.510 16.842 -12.003 566 HG12 ILE 74 2HG1 ILE 74 -12.913 14.276 -11.924 567 HG13 ILE 74 3HG1 ILE 74 -14.532 14.831 -11.512 568 HG21 ILE 74 1HG2 ILE 74 -14.187 16.142 -14.834 569 HG22 ILE 74 2HG2 ILE 74 -15.446 16.259 -13.605 570 HG23 ILE 74 3HG2 ILE 74 -14.438 17.659 -13.970 571 HD11 ILE 74 3HD1 ILE 74 -15.458 13.972 -13.413 572 HD12 ILE 74 1HD1 ILE 74 -13.954 14.080 -14.328 573 HD13 ILE 74 2HD1 ILE 74 -14.165 12.807 -13.125 574 H ALA 75 H ALA 75 -10.713 17.916 -12.116 575 HA ALA 75 HA ALA 75 -11.468 20.304 -13.205 576 HB1 ALA 75 1HB ALA 75 -10.037 20.212 -11.277 577 HB2 ALA 75 2HB ALA 75 -8.729 19.509 -12.229 578 HB3 ALA 75 3HB ALA 75 -9.244 21.169 -12.528 579 H GLY 76 H GLY 76 -9.435 17.875 -14.633 580 HA2 GLY 76 2HA GLY 76 -8.585 19.690 -16.767 581 HA3 GLY 76 3HA GLY 76 -8.006 18.050 -16.509 582 H TYR 77 H TYR 77 -10.714 16.963 -16.223 583 HA TYR 77 HA TYR 77 -11.176 16.144 -18.833 584 HB2 TYR 77 2HB TYR 77 -12.919 16.171 -16.382 585 HB3 TYR 77 3HB TYR 77 -13.520 15.556 -17.918 586 HD1 TYR 77 HD2 TYR 77 -10.050 14.972 -17.668 587 HD2 TYR 77 HD1 TYR 77 -13.808 13.491 -16.330 588 HE1 TYR 77 HE2 TYR 77 -9.017 12.790 -17.198 589 HE2 TYR 77 HE1 TYR 77 -12.785 11.306 -15.855 590 HH TYR 77 HH TYR 77 -10.486 10.077 -16.933 591 H ASN 78 H ASN 78 -12.811 18.693 -16.977 592 HA ASN 78 HA ASN 78 -14.769 19.447 -18.740 593 HB2 ASN 78 2HB ASN 78 -13.855 20.444 -16.393 594 HB3 ASN 78 3HB ASN 78 -13.298 21.695 -17.501 595 HD21 ASN 78 1HD2 ASN 78 -15.037 22.343 -19.147 596 HD22 ASN 78 2HD2 ASN 78 -16.611 22.625 -18.493 597 H LEU 79 H LEU 79 -11.344 19.888 -19.032 598 HA LEU 79 HA LEU 79 -11.565 21.828 -21.172 599 HB2 LEU 79 2HB LEU 79 -9.577 21.083 -19.356 600 HB3 LEU 79 3HB LEU 79 -8.973 20.585 -20.935 601 HG LEU 79 HG LEU 79 -9.901 23.181 -21.324 602 HD11 LEU 79 1HD1 LEU 79 -8.142 23.246 -18.905 603 HD12 LEU 79 2HD1 LEU 79 -9.897 23.198 -18.742 604 HD13 LEU 79 3HD1 LEU 79 -9.128 24.530 -19.605 605 HD21 LEU 79 3HD2 LEU 79 -7.142 22.057 -20.881 606 HD22 LEU 79 1HD2 LEU 79 -7.455 23.691 -21.466 607 HD23 LEU 79 2HD2 LEU 79 -7.975 22.300 -22.417 608 H TYR 80 H TYR 80 -10.961 18.392 -20.786 609 HA TYR 80 HA TYR 80 -9.962 17.651 -23.215 610 HB2 TYR 80 2HB TYR 80 -11.194 16.343 -21.066 611 HB3 TYR 80 3HB TYR 80 -12.118 15.860 -22.484 612 HD1 TYR 80 HD2 TYR 80 -10.921 14.779 -24.408 613 HD2 TYR 80 HD1 TYR 80 -9.030 15.475 -20.661 614 HE1 TYR 80 HE2 TYR 80 -9.181 13.139 -24.988 615 HE2 TYR 80 HE1 TYR 80 -7.285 13.837 -21.230 616 HH TYR 80 HH TYR 80 -6.778 12.692 -24.321 617 H ARG 81 H ARG 81 -13.391 18.184 -22.437 618 HA ARG 81 HA ARG 81 -14.239 17.738 -25.143 619 HB2 ARG 81 2HB ARG 81 -15.859 19.125 -23.019 620 HB3 ARG 81 3HB ARG 81 -16.429 18.160 -24.375 621 HG2 ARG 81 2HG ARG 81 -14.848 16.410 -22.926 622 HG3 ARG 81 3HG ARG 81 -15.703 17.346 -21.698 623 HD2 ARG 81 2HD ARG 81 -17.096 16.091 -24.048 624 HD3 ARG 81 3HD ARG 81 -16.846 15.237 -22.526 625 HE ARG 81 HE ARG 81 -18.799 17.237 -23.060 626 HH11 ARG 81 1HH1 ARG 81 -16.733 15.955 -20.569 627 HH12 ARG 81 2HH1 ARG 81 -17.761 16.465 -19.272 628 HH21 ARG 81 1HH2 ARG 81 -20.162 17.913 -21.361 629 HH22 ARG 81 2HH2 ARG 81 -19.712 17.578 -19.723 630 H ALA 82 H ALA 82 -13.179 20.450 -23.277 631 HA ALA 82 HA ALA 82 -14.354 22.606 -24.514 632 HB1 ALA 82 1HB ALA 82 -11.435 22.550 -23.792 633 HB2 ALA 82 2HB ALA 82 -12.545 23.920 -23.755 634 HB3 ALA 82 3HB ALA 82 -12.719 22.614 -22.584 635 H ILE 83 H ILE 83 -11.622 20.669 -25.642 636 HA ILE 83 HA ILE 83 -11.240 22.308 -27.990 637 HB ILE 83 HB ILE 83 -10.029 19.635 -27.276 638 HG12 ILE 83 2HG1 ILE 83 -9.402 21.370 -25.683 639 HG13 ILE 83 3HG1 ILE 83 -8.027 20.971 -26.707 640 HG21 ILE 83 1HG2 ILE 83 -9.906 21.285 -29.671 641 HG22 ILE 83 2HG2 ILE 83 -8.317 20.914 -29.004 642 HG23 ILE 83 3HG2 ILE 83 -9.423 19.606 -29.425 643 HD11 ILE 83 3HD1 ILE 83 -9.818 23.373 -26.975 644 HD12 ILE 83 1HD1 ILE 83 -8.162 23.353 -26.372 645 HD13 ILE 83 2HD1 ILE 83 -8.490 22.966 -28.061 646 H LYS 84 H LYS 84 -13.130 19.588 -27.102 647 HA LYS 84 HA LYS 84 -13.448 18.521 -29.750 648 HB2 LYS 84 2HB LYS 84 -14.871 18.034 -27.137 649 HB3 LYS 84 3HB LYS 84 -15.359 17.250 -28.635 650 HG2 LYS 84 2HG LYS 84 -12.603 17.050 -27.441 651 HG3 LYS 84 3HG LYS 84 -13.890 15.867 -27.191 652 HD2 LYS 84 2HD LYS 84 -13.462 14.897 -29.150 653 HD3 LYS 84 3HD LYS 84 -13.563 16.442 -29.997 654 HE2 LYS 84 2HE LYS 84 -11.251 16.917 -29.483 655 HE3 LYS 84 3HE LYS 84 -11.135 15.457 -28.502 656 HZ1 LYS 84 3HZ LYS 84 -11.451 15.649 -31.441 657 HZ2 LYS 84 1HZ LYS 84 -11.701 14.208 -30.591 658 HZ3 LYS 84 2HZ LYS 84 -10.180 14.946 -30.574 659 H LYS 85 H LYS 85 -14.948 20.988 -27.855 660 HA LYS 85 HA LYS 85 -17.361 21.089 -29.442 661 HB2 LYS 85 2HB LYS 85 -16.315 22.430 -27.036 662 HB3 LYS 85 3HB LYS 85 -17.325 23.441 -28.062 663 HG2 LYS 85 2HG LYS 85 -19.202 22.332 -27.529 664 HG3 LYS 85 3HG LYS 85 -18.396 20.761 -27.516 665 HD2 LYS 85 2HD LYS 85 -17.306 21.552 -25.336 666 HD3 LYS 85 3HD LYS 85 -18.532 22.822 -25.335 667 HE2 LYS 85 2HE LYS 85 -19.993 20.546 -25.837 668 HE3 LYS 85 3HE LYS 85 -18.766 19.985 -24.701 669 HZ1 LYS 85 3HZ LYS 85 -20.023 20.846 -23.108 670 HZ2 LYS 85 1HZ LYS 85 -21.054 21.599 -24.218 671 HZ3 LYS 85 2HZ LYS 85 -19.651 22.387 -23.698 672 H LYS 86 H LYS 86 -14.367 22.942 -29.134 673 HA LYS 86 HA LYS 86 -13.574 24.743 -30.327 674 HB2 LYS 86 2HB LYS 86 -13.273 24.223 -32.685 675 HB3 LYS 86 3HB LYS 86 -13.000 22.786 -31.709 676 HG2 LYS 86 2HG LYS 86 -14.990 21.791 -32.396 677 HG3 LYS 86 3HG LYS 86 -15.667 23.320 -32.961 678 HD2 LYS 86 2HD LYS 86 -13.809 23.343 -34.686 679 HD3 LYS 86 3HD LYS 86 -13.488 21.670 -34.223 680 HE2 LYS 86 2HE LYS 86 -14.928 21.346 -35.974 681 HE3 LYS 86 3HE LYS 86 -16.070 21.404 -34.632 682 HZ1 LYS 86 3HZ LYS 86 -16.787 23.496 -35.217 683 HZ2 LYS 86 1HZ LYS 86 -16.509 22.807 -36.737 684 HZ3 LYS 86 2HZ LYS 86 -15.378 23.875 -36.074 685 H GLY 87 H GLY 87 -16.162 25.290 -29.437 686 HA2 GLY 87 2HA GLY 87 -16.952 27.250 -31.420 687 HA3 GLY 87 3HA GLY 87 -18.153 26.007 -31.103 688 H GLY 88 H GLY 88 -17.998 25.631 -28.421 689 HA2 GLY 88 2HA GLY 88 -18.782 28.285 -27.394 690 HA3 GLY 88 3HA GLY 88 -19.486 26.765 -26.864 691 H GLY 89 H GLY 89 -18.678 25.814 -25.093 692 HA2 GLY 89 2HA GLY 89 -15.932 26.189 -24.292 693 HA3 GLY 89 3HA GLY 89 -17.084 27.032 -23.266 694 H GLY 90 H GLY 90 -17.903 25.949 -21.594 695 HA2 GLY 90 2HA GLY 90 -18.105 23.028 -21.746 696 HA3 GLY 90 3HA GLY 90 -17.136 23.722 -20.454 697 H GLY 91 H GLY 91 -19.249 22.103 -19.834 698 HA2 GLY 91 2HA GLY 91 -20.815 22.269 -18.084 699 HA3 GLY 91 3HA GLY 91 -20.964 23.989 -18.410 700 H GLY 92 H GLY 92 -22.949 21.715 -18.132 701 HA2 GLY 92 2HA GLY 92 -25.159 21.774 -18.992 702 HA3 GLY 92 3HA GLY 92 -24.534 22.477 -20.477 703 H GLY 93 H GLY 93 -25.723 20.942 -21.697 704 HA2 GLY 93 2HA GLY 93 -24.428 18.290 -21.740 705 HA3 GLY 93 3HA GLY 93 -26.175 18.446 -21.852 706 H GLY 94 H GLY 94 -26.770 17.958 -23.860 707 HA2 GLY 94 2HA GLY 94 -26.187 19.570 -26.059 708 HA3 GLY 94 3HA GLY 94 -25.091 18.198 -26.123 709 H GLY 95 H GLY 95 -26.358 17.994 -28.220 710 HA2 GLY 95 2HA GLY 95 -28.680 16.245 -27.707 711 HA3 GLY 95 3HA GLY 95 -28.712 17.444 -28.991 712 H GLY 96 H GLY 96 -28.097 14.247 -28.256 713 HA2 GLY 96 2HA GLY 96 -27.554 12.521 -29.705 714 HA3 GLY 96 3HA GLY 96 -27.213 13.716 -30.947 715 H VAL 97 H VAL 97 -25.649 14.274 -27.971 716 HA VAL 97 HA VAL 97 -23.408 14.419 -27.505 717 HB VAL 97 HB VAL 97 -22.290 12.306 -27.315 718 HG11 VAL 97 1HG1 VAL 97 -24.300 12.811 -25.863 719 HG12 VAL 97 2HG1 VAL 97 -25.207 11.704 -26.896 720 HG13 VAL 97 3HG1 VAL 97 -23.825 11.117 -25.970 721 HG21 VAL 97 3HG2 VAL 97 -24.439 11.034 -28.994 722 HG22 VAL 97 1HG2 VAL 97 -22.899 11.577 -29.658 723 HG23 VAL 97 2HG2 VAL 97 -22.932 10.317 -28.426 724 H TRP 98 H TRP 98 -21.182 13.143 -28.557 725 HA TRP 98 HA TRP 98 -20.904 13.140 -31.320 726 HB2 TRP 98 2HB TRP 98 -21.285 15.370 -31.680 727 HB3 TRP 98 3HB TRP 98 -20.753 15.832 -30.065 728 HD1 TRP 98 HD1 TRP 98 -18.747 17.392 -30.297 729 HE1 TRP 98 HE1 TRP 98 -16.614 17.464 -31.736 730 HE3 TRP 98 HE3 TRP 98 -19.607 13.292 -33.227 731 HZ2 TRP 98 HZ2 TRP 98 -15.451 15.979 -33.836 732 HZ3 TRP 98 HZ3 TRP 98 -17.935 12.687 -34.928 733 HH2 TRP 98 HH2 TRP 98 -15.901 14.004 -35.225 734 HA PRO 99 HA PRO 99 -16.533 13.635 -29.323 735 HB2 PRO 99 2HB PRO 99 -16.433 14.256 -26.682 736 HB3 PRO 99 3HB PRO 99 -16.466 15.481 -27.956 737 HG2 PRO 99 2HG PRO 99 -18.704 14.461 -26.250 738 HG3 PRO 99 3HG PRO 99 -18.327 16.128 -26.723 739 HD2 PRO 99 2HD PRO 99 -20.252 14.667 -27.944 740 HD3 PRO 99 3HD PRO 99 -19.293 15.890 -28.802 741 H LEU 100 H LEU 100 -16.293 11.446 -29.496 742 HA LEU 100 HA LEU 100 -17.346 9.700 -27.419 743 HB2 LEU 100 2HB LEU 100 -16.689 7.881 -28.826 744 HB3 LEU 100 3HB LEU 100 -17.520 9.086 -29.807 745 HG LEU 100 HG LEU 100 -14.631 9.439 -29.816 746 HD11 LEU 100 1HD1 LEU 100 -14.524 7.391 -31.473 747 HD12 LEU 100 2HD1 LEU 100 -15.788 6.767 -30.414 748 HD13 LEU 100 3HD1 LEU 100 -14.213 7.197 -29.748 749 HD21 LEU 100 3HD2 LEU 100 -14.995 10.009 -31.993 750 HD22 LEU 100 1HD2 LEU 100 -16.617 10.275 -31.353 751 HD23 LEU 100 2HD2 LEU 100 -16.246 8.786 -32.223 752 H VAL 101 H VAL 101 -14.425 11.275 -28.265 753 HA VAL 101 HA VAL 101 -12.623 9.465 -26.979 754 HB VAL 101 HB VAL 101 -10.961 11.249 -27.189 755 HG11 VAL 101 1HG1 VAL 101 -12.177 9.878 -29.231 756 HG12 VAL 101 2HG1 VAL 101 -12.203 11.545 -29.811 757 HG13 VAL 101 3HG1 VAL 101 -10.674 10.791 -29.359 758 HG21 VAL 101 3HG2 VAL 101 -11.713 13.342 -26.950 759 HG22 VAL 101 1HG2 VAL 101 -12.142 13.246 -28.658 760 HG23 VAL 101 2HG2 VAL 101 -13.353 12.900 -27.424 761 H ILE 102 H ILE 102 -14.517 12.224 -25.977 762 HA ILE 102 HA ILE 102 -13.182 12.775 -23.552 763 HB ILE 102 HB ILE 102 -15.156 14.007 -22.897 764 HG12 ILE 102 2HG1 ILE 102 -17.039 13.887 -24.824 765 HG13 ILE 102 3HG1 ILE 102 -16.448 12.230 -24.889 766 HG21 ILE 102 1HG2 ILE 102 -13.793 15.171 -24.440 767 HG22 ILE 102 2HG2 ILE 102 -14.424 14.248 -25.803 768 HG23 ILE 102 3HG2 ILE 102 -15.457 15.412 -24.974 769 HD11 ILE 102 3HD1 ILE 102 -16.802 12.836 -22.173 770 HD12 ILE 102 1HD1 ILE 102 -18.227 13.443 -23.017 771 HD13 ILE 102 2HD1 ILE 102 -17.760 11.750 -23.180 772 H ARG 103 H ARG 103 -15.716 10.503 -24.418 773 HA ARG 103 HA ARG 103 -16.414 9.777 -21.760 774 HB2 ARG 103 2HB ARG 103 -17.785 8.145 -22.711 775 HB3 ARG 103 3HB ARG 103 -17.734 9.398 -23.944 776 HG2 ARG 103 2HG ARG 103 -17.195 7.786 -25.371 777 HG3 ARG 103 3HG ARG 103 -15.609 7.768 -24.598 778 HD2 ARG 103 2HD ARG 103 -16.108 5.583 -24.303 779 HD3 ARG 103 3HD ARG 103 -16.952 6.206 -22.886 780 HE ARG 103 HE ARG 103 -18.582 6.126 -25.249 781 HH11 ARG 103 1HH1 ARG 103 -17.408 4.305 -22.524 782 HH12 ARG 103 2HH1 ARG 103 -18.733 3.189 -22.533 783 HH21 ARG 103 1HH2 ARG 103 -20.332 4.662 -25.271 784 HH22 ARG 103 2HH2 ARG 103 -20.395 3.392 -24.097 785 H THR 104 H THR 104 -13.781 8.997 -23.801 786 HA THR 104 HA THR 104 -13.129 6.431 -22.821 787 HB THR 104 HB THR 104 -10.937 8.270 -23.648 788 HG1 THR 104 HG1 THR 104 -12.616 7.176 -25.634 789 HG21 THR 104 3HG2 THR 104 -10.025 6.209 -23.627 790 HG22 THR 104 1HG2 THR 104 -10.813 6.032 -25.194 791 HG23 THR 104 2HG2 THR 104 -11.591 5.407 -23.740 792 H VAL 105 H VAL 105 -11.884 9.651 -21.938 793 HA VAL 105 HA VAL 105 -10.277 8.667 -19.799 794 HB VAL 105 HB VAL 105 -10.051 11.047 -19.149 795 HG11 VAL 105 1HG1 VAL 105 -8.578 10.054 -20.839 796 HG12 VAL 105 2HG1 VAL 105 -9.706 10.546 -22.104 797 HG13 VAL 105 3HG1 VAL 105 -8.866 11.766 -21.148 798 HG21 VAL 105 3HG2 VAL 105 -11.051 12.745 -20.705 799 HG22 VAL 105 1HG2 VAL 105 -12.059 11.452 -21.357 800 HG23 VAL 105 2HG2 VAL 105 -12.209 11.918 -19.663 801 H ILE 106 H ILE 106 -13.468 10.187 -19.994 802 HA ILE 106 HA ILE 106 -13.939 10.461 -17.247 803 HB ILE 106 HB ILE 106 -16.003 9.920 -19.383 804 HG12 ILE 106 2HG1 ILE 106 -14.208 12.031 -19.281 805 HG13 ILE 106 3HG1 ILE 106 -15.734 12.010 -20.159 806 HG21 ILE 106 1HG2 ILE 106 -16.188 11.152 -16.641 807 HG22 ILE 106 2HG2 ILE 106 -17.474 11.224 -17.845 808 HG23 ILE 106 3HG2 ILE 106 -16.952 9.666 -17.204 809 HD11 ILE 106 3HD1 ILE 106 -15.442 12.935 -17.314 810 HD12 ILE 106 1HD1 ILE 106 -15.399 14.001 -18.717 811 HD13 ILE 106 2HD1 ILE 106 -16.861 13.084 -18.351 812 H ALA 107 H ALA 107 -13.765 7.668 -19.189 813 HA ALA 107 HA ALA 107 -15.557 5.897 -18.101 814 HB1 ALA 107 1HB ALA 107 -14.176 5.241 -19.937 815 HB2 ALA 107 2HB ALA 107 -12.713 5.408 -18.965 816 HB3 ALA 107 3HB ALA 107 -13.870 4.128 -18.603 817 H GLY 108 H GLY 108 -12.794 7.330 -16.592 818 HA2 GLY 108 2HA GLY 108 -12.835 5.402 -14.392 819 HA3 GLY 108 3HA GLY 108 -11.652 6.679 -14.629 820 H TYR 109 H TYR 109 -13.834 8.653 -15.126 821 HA TYR 109 HA TYR 109 -14.001 9.806 -12.630 822 HB2 TYR 109 2HB TYR 109 -14.526 11.166 -14.488 823 HB3 TYR 109 3HB TYR 109 -15.769 10.056 -15.056 824 HD1 TYR 109 HD2 TYR 109 -15.359 11.228 -11.569 825 HD2 TYR 109 HD1 TYR 109 -17.602 11.551 -15.170 826 HE1 TYR 109 HE2 TYR 109 -17.067 12.539 -10.381 827 HE2 TYR 109 HE1 TYR 109 -19.316 12.864 -13.992 828 HH TYR 109 HH TYR 109 -19.858 13.899 -12.090 829 H ASN 110 H ASN 110 -16.471 7.808 -14.238 830 HA ASN 110 HA ASN 110 -18.405 7.849 -12.257 831 HB2 ASN 110 2HB ASN 110 -17.836 6.279 -14.609 832 HB3 ASN 110 3HB ASN 110 -18.442 5.241 -13.322 833 HD21 ASN 110 1HD2 ASN 110 -20.303 4.909 -14.630 834 HD22 ASN 110 2HD2 ASN 110 -21.562 6.091 -14.676 835 H LEU 111 H LEU 111 -15.331 6.318 -12.258 836 HA LEU 111 HA LEU 111 -16.021 4.495 -10.096 837 HB2 LEU 111 2HB LEU 111 -13.807 4.809 -11.989 838 HB3 LEU 111 3HB LEU 111 -13.310 4.342 -10.364 839 HG LEU 111 HG LEU 111 -13.601 2.422 -11.890 840 HD11 LEU 111 1HD1 LEU 111 -15.759 1.804 -10.085 841 HD12 LEU 111 2HD1 LEU 111 -14.489 2.711 -9.264 842 HD13 LEU 111 3HD1 LEU 111 -14.098 1.208 -10.100 843 HD21 LEU 111 3HD2 LEU 111 -15.503 1.966 -13.023 844 HD22 LEU 111 1HD2 LEU 111 -15.730 3.710 -12.892 845 HD23 LEU 111 2HD2 LEU 111 -16.544 2.628 -11.761 846 H TYR 112 H TYR 112 -14.366 7.524 -10.623 847 HA TYR 112 HA TYR 112 -12.795 7.872 -8.448 848 HB2 TYR 112 2HB TYR 112 -14.747 9.851 -9.635 849 HB3 TYR 112 3HB TYR 112 -13.499 10.286 -8.472 850 HD1 TYR 112 HD1 TYR 112 -12.179 7.724 -10.415 851 HD2 TYR 112 HD2 TYR 112 -13.147 11.862 -10.621 852 HE1 TYR 112 HE1 TYR 112 -10.568 8.003 -12.252 853 HE2 TYR 112 HE2 TYR 112 -11.539 12.153 -12.459 854 HH TYR 112 HH TYR 112 -10.481 10.045 -14.328 855 H ARG 113 H ARG 113 -16.317 8.394 -8.489 856 HA ARG 113 HA ARG 113 -16.392 8.777 -5.628 857 HB2 ARG 113 2HB ARG 113 -18.316 8.963 -7.872 858 HB3 ARG 113 3HB ARG 113 -18.991 8.535 -6.306 859 HG2 ARG 113 2HG ARG 113 -17.270 10.674 -5.805 860 HG3 ARG 113 3HG ARG 113 -18.127 11.091 -7.291 861 HD2 ARG 113 2HD ARG 113 -19.782 9.946 -5.141 862 HD3 ARG 113 3HD ARG 113 -19.091 11.533 -4.804 863 HE ARG 113 HE ARG 113 -20.142 11.869 -7.256 864 HH11 ARG 113 1HH1 ARG 113 -21.437 10.549 -4.306 865 HH12 ARG 113 2HH1 ARG 113 -23.065 11.032 -4.652 866 HH21 ARG 113 1HH2 ARG 113 -22.281 12.510 -7.722 867 HH22 ARG 113 2HH2 ARG 113 -23.544 12.146 -6.596 868 H ALA 114 H ALA 114 -16.790 6.174 -7.868 869 HA ALA 114 HA ALA 114 -18.418 4.405 -6.523 870 HB1 ALA 114 1HB ALA 114 -17.456 4.052 -8.781 871 HB2 ALA 114 2HB ALA 114 -15.914 3.653 -8.023 872 HB3 ALA 114 3HB ALA 114 -17.327 2.638 -7.734 873 H ILE 115 H ILE 115 -15.009 5.116 -5.962 874 HA ILE 115 HA ILE 115 -14.751 3.083 -3.929 875 HB ILE 115 HB ILE 115 -12.869 5.316 -4.703 876 HG12 ILE 115 2HG1 ILE 115 -13.267 3.657 -6.491 877 HG13 ILE 115 3HG1 ILE 115 -11.619 3.580 -5.878 878 HG21 ILE 115 1HG2 ILE 115 -12.828 3.365 -2.534 879 HG22 ILE 115 2HG2 ILE 115 -11.370 3.349 -3.525 880 HG23 ILE 115 3HG2 ILE 115 -11.892 4.844 -2.749 881 HD11 ILE 115 3HD1 ILE 115 -13.871 1.704 -5.203 882 HD12 ILE 115 1HD1 ILE 115 -12.480 1.361 -6.231 883 HD13 ILE 115 2HD1 ILE 115 -12.253 1.642 -4.505 884 H LYS 116 H LYS 116 -15.722 6.369 -4.082 885 HA LYS 116 HA LYS 116 -15.082 7.090 -1.394 886 HB2 LYS 116 2HB LYS 116 -16.392 8.318 -3.691 887 HB3 LYS 116 3HB LYS 116 -17.178 8.729 -2.172 888 HG2 LYS 116 2HG LYS 116 -15.659 10.369 -2.097 889 HG3 LYS 116 3HG LYS 116 -14.575 9.100 -1.520 890 HD2 LYS 116 2HD LYS 116 -14.761 9.202 -4.426 891 HD3 LYS 116 3HD LYS 116 -14.167 10.708 -3.723 892 HE2 LYS 116 2HE LYS 116 -12.238 9.436 -4.082 893 HE3 LYS 116 3HE LYS 116 -12.580 9.230 -2.365 894 HZ1 LYS 116 3HZ LYS 116 -12.106 7.211 -4.038 895 HZ2 LYS 116 1HZ LYS 116 -13.795 7.270 -4.120 896 HZ3 LYS 116 2HZ LYS 116 -13.027 7.060 -2.628 897 H LYS 117 H LYS 117 -17.811 5.589 -2.979 898 HA LYS 117 HA LYS 117 -19.506 5.795 -0.639 899 HB2 LYS 117 2HB LYS 117 -21.127 4.515 -1.984 900 HB3 LYS 117 3HB LYS 117 -20.536 5.933 -2.838 901 HG2 LYS 117 2HG LYS 117 -18.980 4.500 -4.095 902 HG3 LYS 117 3HG LYS 117 -19.647 3.088 -3.271 903 HD2 LYS 117 2HD LYS 117 -21.734 4.724 -4.427 904 HD3 LYS 117 3HD LYS 117 -20.555 4.230 -5.644 905 HE2 LYS 117 2HE LYS 117 -21.622 2.219 -3.709 906 HE3 LYS 117 3HE LYS 117 -22.603 2.703 -5.092 907 HZ1 LYS 117 3HZ LYS 117 -21.108 0.703 -5.393 908 HZ2 LYS 117 1HZ LYS 117 -19.807 1.785 -5.400 909 HZ3 LYS 117 2HZ LYS 117 -21.010 1.900 -6.584 910 H LYS 118 H LYS 118 -17.637 3.320 -2.326 911 HA LYS 118 HA LYS 118 -18.465 1.050 -0.990 912 HB2 LYS 118 2HB LYS 118 -16.373 1.742 -2.735 913 HB3 LYS 118 3HB LYS 118 -15.599 1.005 -1.339 914 HG2 LYS 118 2HG LYS 118 -16.772 -1.015 -1.624 915 HG3 LYS 118 3HG LYS 118 -17.907 -0.284 -2.761 916 HD2 LYS 118 2HD LYS 118 -16.469 -0.446 -4.507 917 HD3 LYS 118 3HD LYS 118 -15.047 -0.162 -3.499 918 HE2 LYS 118 2HE LYS 118 -16.315 -2.658 -2.811 919 HE3 LYS 118 3HE LYS 118 -15.942 -2.602 -4.533 920 HZ1 LYS 118 3HZ LYS 118 -14.131 -2.585 -2.239 921 HZ2 LYS 118 1HZ LYS 118 -13.666 -1.706 -3.608 922 HZ3 LYS 118 2HZ LYS 118 -13.975 -3.364 -3.732 Start of MODEL 9 1 H1 VAL 1 H VAL 1 4.561 1.938 -2.188 2 HA VAL 1 HA VAL 1 3.993 3.677 -4.492 3 HB VAL 1 HB VAL 1 5.831 1.286 -4.621 4 HG11 VAL 1 1HG1 VAL 1 6.233 3.064 -6.759 5 HG12 VAL 1 2HG1 VAL 1 5.512 1.454 -6.812 6 HG13 VAL 1 3HG1 VAL 1 4.488 2.873 -6.593 7 HG21 VAL 1 3HG2 VAL 1 6.406 4.197 -4.228 8 HG22 VAL 1 1HG2 VAL 1 7.112 2.798 -3.418 9 HG23 VAL 1 2HG2 VAL 1 7.554 3.168 -5.085 10 H TRP 2 H TRP 2 1.784 2.964 -3.944 11 HA TRP 2 HA TRP 2 1.215 0.349 -5.171 12 HB2 TRP 2 2HB TRP 2 0.929 0.336 -2.668 13 HB3 TRP 2 3HB TRP 2 -0.348 1.533 -2.871 14 HD1 TRP 2 HD1 TRP 2 -0.084 -1.331 -5.372 15 HE1 TRP 2 HE1 TRP 2 -2.109 -2.890 -5.068 16 HE3 TRP 2 HE3 TRP 2 -2.039 0.701 -1.107 17 HZ2 TRP 2 HZ2 TRP 2 -4.252 -3.215 -3.260 18 HZ3 TRP 2 HZ3 TRP 2 -4.078 -0.293 -0.155 19 HH2 TRP 2 HH2 TRP 2 -5.161 -2.210 -1.211 20 HA PRO 3 HA PRO 3 -1.078 3.882 -7.227 21 HB2 PRO 3 2HB PRO 3 -0.191 3.356 -9.738 22 HB3 PRO 3 3HB PRO 3 0.676 4.409 -8.614 23 HG2 PRO 3 2HG PRO 3 1.178 1.536 -9.287 24 HG3 PRO 3 3HG PRO 3 2.343 2.857 -9.083 25 HD2 PRO 3 2HD PRO 3 1.861 1.027 -7.146 26 HD3 PRO 3 3HD PRO 3 2.298 2.709 -6.783 27 H LEU 4 H LEU 4 -2.543 1.921 -6.388 28 HA LEU 4 HA LEU 4 -3.432 0.237 -8.592 29 HB2 LEU 4 2HB LEU 4 -3.343 -0.052 -5.816 30 HB3 LEU 4 3HB LEU 4 -5.055 0.084 -6.211 31 HG LEU 4 HG LEU 4 -3.096 -2.002 -7.141 32 HD11 LEU 4 1HD1 LEU 4 -4.986 -1.839 -5.032 33 HD12 LEU 4 2HD1 LEU 4 -3.971 -3.203 -5.500 34 HD13 LEU 4 3HD1 LEU 4 -5.575 -3.015 -6.208 35 HD21 LEU 4 3HD2 LEU 4 -5.625 -1.077 -8.366 36 HD22 LEU 4 1HD2 LEU 4 -5.397 -2.820 -8.227 37 HD23 LEU 4 2HD2 LEU 4 -4.218 -1.844 -9.103 38 H VAL 5 H VAL 5 -4.661 2.827 -6.518 39 HA VAL 5 HA VAL 5 -7.173 2.925 -7.975 40 HB VAL 5 HB VAL 5 -7.779 4.735 -6.432 41 HG11 VAL 5 1HG1 VAL 5 -6.667 2.211 -5.236 42 HG12 VAL 5 2HG1 VAL 5 -7.587 3.384 -4.293 43 HG13 VAL 5 3HG1 VAL 5 -8.337 2.574 -5.669 44 HG21 VAL 5 3HG2 VAL 5 -4.985 4.355 -5.363 45 HG22 VAL 5 1HG2 VAL 5 -5.639 5.799 -6.136 46 HG23 VAL 5 2HG2 VAL 5 -6.247 5.290 -4.561 47 H ILE 6 H ILE 6 -4.196 4.766 -7.672 48 HA ILE 6 HA ILE 6 -5.019 7.072 -9.066 49 HB ILE 6 HB ILE 6 -2.713 7.644 -9.267 50 HG12 ILE 6 2HG1 ILE 6 -1.108 5.665 -8.364 51 HG13 ILE 6 3HG1 ILE 6 -2.344 4.706 -9.170 52 HG21 ILE 6 1HG2 ILE 6 -3.910 7.010 -6.869 53 HG22 ILE 6 2HG2 ILE 6 -2.333 6.231 -6.754 54 HG23 ILE 6 3HG2 ILE 6 -2.440 7.962 -7.075 55 HD11 ILE 6 3HD1 ILE 6 -1.668 5.327 -11.214 56 HD12 ILE 6 1HD1 ILE 6 -1.326 6.983 -10.715 57 HD13 ILE 6 2HD1 ILE 6 -0.158 5.703 -10.384 58 H ARG 7 H ARG 7 -3.934 3.935 -10.133 59 HA ARG 7 HA ARG 7 -3.414 4.715 -12.840 60 HB2 ARG 7 2HB ARG 7 -3.286 2.289 -13.274 61 HB3 ARG 7 3HB ARG 7 -2.301 2.771 -11.899 62 HG2 ARG 7 2HG ARG 7 -3.866 1.875 -10.355 63 HG3 ARG 7 3HG ARG 7 -5.065 1.624 -11.625 64 HD2 ARG 7 2HD ARG 7 -3.818 -0.433 -10.865 65 HD3 ARG 7 3HD ARG 7 -3.804 -0.122 -12.600 66 HE ARG 7 HE ARG 7 -1.534 0.988 -11.255 67 HH11 ARG 7 1HH1 ARG 7 -2.862 -1.912 -12.650 68 HH12 ARG 7 2HH1 ARG 7 -1.315 -2.623 -12.970 69 HH21 ARG 7 1HH2 ARG 7 0.509 0.063 -11.671 70 HH22 ARG 7 2HH2 ARG 7 0.602 -1.499 -12.412 71 H THR 8 H THR 8 -6.204 3.776 -11.032 72 HA THR 8 HA THR 8 -7.892 2.711 -12.922 73 HB THR 8 HB THR 8 -8.933 4.778 -11.011 74 HG1 THR 8 HG1 THR 8 -7.603 2.387 -10.414 75 HG21 THR 8 3HG2 THR 8 -9.955 2.432 -12.459 76 HG22 THR 8 1HG2 THR 8 -10.800 3.874 -11.898 77 HG23 THR 8 2HG2 THR 8 -10.474 2.550 -10.778 78 H VAL 9 H VAL 9 -7.654 6.179 -12.106 79 HA VAL 9 HA VAL 9 -9.277 7.040 -14.254 80 HB VAL 9 HB VAL 9 -8.209 9.298 -13.805 81 HG11 VAL 9 1HG1 VAL 9 -9.310 9.532 -11.597 82 HG12 VAL 9 2HG1 VAL 9 -10.308 8.695 -12.788 83 HG13 VAL 9 3HG1 VAL 9 -9.477 7.778 -11.530 84 HG21 VAL 9 3HG2 VAL 9 -6.939 7.838 -11.493 85 HG22 VAL 9 1HG2 VAL 9 -6.073 8.351 -12.941 86 HG23 VAL 9 2HG2 VAL 9 -6.803 9.554 -11.879 87 H ILE 10 H ILE 10 -5.808 6.574 -13.903 88 HA ILE 10 HA ILE 10 -4.939 7.892 -16.207 89 HB ILE 10 HB ILE 10 -3.742 5.392 -15.008 90 HG12 ILE 10 2HG1 ILE 10 -4.123 7.860 -13.778 91 HG13 ILE 10 3HG1 ILE 10 -2.993 6.607 -13.277 92 HG21 ILE 10 1HG2 ILE 10 -2.591 7.537 -16.784 93 HG22 ILE 10 2HG2 ILE 10 -1.634 6.304 -15.965 94 HG23 ILE 10 3HG2 ILE 10 -2.824 5.835 -17.179 95 HD11 ILE 10 3HD1 ILE 10 -1.982 8.853 -13.486 96 HD12 ILE 10 1HD1 ILE 10 -1.219 7.635 -14.507 97 HD13 ILE 10 2HD1 ILE 10 -2.331 8.808 -15.214 98 H ALA 11 H ALA 11 -6.771 5.037 -15.876 99 HA ALA 11 HA ALA 11 -6.065 3.429 -17.973 100 HB1 ALA 11 1HB ALA 11 -7.809 2.674 -16.608 101 HB2 ALA 11 2HB ALA 11 -8.767 4.132 -16.872 102 HB3 ALA 11 3HB ALA 11 -8.569 2.958 -18.174 103 H GLY 12 H GLY 12 -7.466 6.601 -18.112 104 HA2 GLY 12 2HA GLY 12 -8.102 6.334 -20.952 105 HA3 GLY 12 3HA GLY 12 -8.469 7.717 -19.931 106 H TYR 13 H TYR 13 -5.717 7.807 -18.867 107 HA TYR 13 HA TYR 13 -4.617 9.726 -20.505 108 HB2 TYR 13 2HB TYR 13 -3.809 9.517 -18.273 109 HB3 TYR 13 3HB TYR 13 -3.300 7.853 -18.539 110 HD1 TYR 13 HD2 TYR 13 -2.674 10.529 -20.981 111 HD2 TYR 13 HD1 TYR 13 -1.031 8.203 -17.820 112 HE1 TYR 13 HE2 TYR 13 -0.422 11.316 -21.579 113 HE2 TYR 13 HE1 TYR 13 1.225 8.985 -18.408 114 HH TYR 13 HH TYR 13 2.097 10.186 -21.155 115 H ASN 14 H ASN 14 -3.646 6.299 -20.323 116 HA ASN 14 HA ASN 14 -1.713 6.281 -22.284 117 HB2 ASN 14 2HB ASN 14 -3.663 4.198 -21.346 118 HB3 ASN 14 3HB ASN 14 -2.562 3.849 -22.676 119 HD21 ASN 14 1HD2 ASN 14 -2.892 4.336 -19.288 120 HD22 ASN 14 2HD2 ASN 14 -1.269 3.934 -18.852 121 H LEU 15 H LEU 15 -5.094 6.725 -22.636 122 HA LEU 15 HA LEU 15 -5.037 6.107 -25.491 123 HB2 LEU 15 2HB LEU 15 -7.016 6.024 -23.460 124 HB3 LEU 15 3HB LEU 15 -7.533 7.199 -24.669 125 HG LEU 15 HG LEU 15 -6.607 4.625 -25.752 126 HD11 LEU 15 1HD1 LEU 15 -7.721 3.416 -24.211 127 HD12 LEU 15 2HD1 LEU 15 -9.125 3.886 -25.169 128 HD13 LEU 15 3HD1 LEU 15 -8.719 4.778 -23.702 129 HD21 LEU 15 3HD2 LEU 15 -8.926 6.488 -26.205 130 HD22 LEU 15 1HD2 LEU 15 -8.749 4.947 -27.045 131 HD23 LEU 15 2HD2 LEU 15 -7.533 6.208 -27.250 132 H TYR 16 H TYR 16 -5.304 8.811 -23.280 133 HA TYR 16 HA TYR 16 -6.216 10.842 -24.858 134 HB2 TYR 16 2HB TYR 16 -4.365 10.663 -22.570 135 HB3 TYR 16 3HB TYR 16 -4.208 12.125 -23.538 136 HD1 TYR 16 HD2 TYR 16 -7.075 12.472 -24.346 137 HD2 TYR 16 HD1 TYR 16 -5.325 11.496 -20.593 138 HE1 TYR 16 HE2 TYR 16 -9.017 13.447 -23.194 139 HE2 TYR 16 HE1 TYR 16 -7.262 12.468 -19.430 140 HH TYR 16 HH TYR 16 -9.393 13.207 -19.704 141 H ARG 17 H ARG 17 -2.864 9.668 -24.687 142 HA ARG 17 HA ARG 17 -2.007 11.427 -26.803 143 HB2 ARG 17 2HB ARG 17 -0.752 9.863 -24.788 144 HB3 ARG 17 3HB ARG 17 -0.132 9.321 -26.342 145 HG2 ARG 17 2HG ARG 17 0.550 11.571 -26.897 146 HG3 ARG 17 3HG ARG 17 -0.160 12.181 -25.401 147 HD2 ARG 17 2HD ARG 17 2.067 11.993 -24.828 148 HD3 ARG 17 3HD ARG 17 1.416 10.455 -24.264 149 HE ARG 17 HE ARG 17 2.249 9.928 -26.799 150 HH11 ARG 17 1HH1 ARG 17 3.760 11.277 -23.967 151 HH12 ARG 17 2HH1 ARG 17 5.339 10.688 -24.369 152 HH21 ARG 17 1HH2 ARG 17 4.323 9.147 -27.339 153 HH22 ARG 17 2HH2 ARG 17 5.658 9.477 -26.287 154 H ALA 18 H ALA 18 -3.279 8.236 -26.542 155 HA ALA 18 HA ALA 18 -2.248 6.942 -28.751 156 HB1 ALA 18 1HB ALA 18 -4.174 5.544 -28.711 157 HB2 ALA 18 2HB ALA 18 -3.814 5.988 -27.042 158 HB3 ALA 18 3HB ALA 18 -5.132 6.784 -27.901 159 H ILE 19 H ILE 19 -4.697 9.451 -28.601 160 HA ILE 19 HA ILE 19 -5.410 9.204 -31.383 161 HB ILE 19 HB ILE 19 -6.073 11.364 -29.379 162 HG12 ILE 19 2HG1 ILE 19 -7.041 9.226 -28.757 163 HG13 ILE 19 3HG1 ILE 19 -8.309 10.281 -29.370 164 HG21 ILE 19 1HG2 ILE 19 -6.547 11.128 -32.254 165 HG22 ILE 19 2HG2 ILE 19 -8.000 11.456 -31.311 166 HG23 ILE 19 3HG2 ILE 19 -6.616 12.543 -31.204 167 HD11 ILE 19 3HD1 ILE 19 -8.588 8.026 -30.195 168 HD12 ILE 19 1HD1 ILE 19 -8.217 9.127 -31.522 169 HD13 ILE 19 2HD1 ILE 19 -6.966 8.058 -30.886 170 H LYS 20 H LYS 20 -3.020 10.854 -29.554 171 HA LYS 20 HA LYS 20 -2.552 12.990 -31.399 172 HB2 LYS 20 2HB LYS 20 -1.684 13.620 -29.396 173 HB3 LYS 20 3HB LYS 20 -1.309 11.969 -28.920 174 HG2 LYS 20 2HG LYS 20 0.696 11.977 -30.218 175 HG3 LYS 20 3HG LYS 20 0.284 13.536 -30.936 176 HD2 LYS 20 2HD LYS 20 1.103 14.665 -29.188 177 HD3 LYS 20 3HD LYS 20 0.295 13.610 -28.027 178 HE2 LYS 20 2HE LYS 20 2.794 13.607 -27.887 179 HE3 LYS 20 3HE LYS 20 2.065 12.019 -28.123 180 HZ1 LYS 20 3HZ LYS 20 4.095 12.757 -29.545 181 HZ2 LYS 20 1HZ LYS 20 2.927 13.555 -30.473 182 HZ3 LYS 20 2HZ LYS 20 2.837 11.879 -30.258 183 H LYS 21 H LYS 21 -1.193 9.781 -30.876 184 HA LYS 21 HA LYS 21 0.941 10.053 -32.734 185 HB2 LYS 21 2HB LYS 21 -0.340 7.800 -31.263 186 HB3 LYS 21 3HB LYS 21 0.659 7.408 -32.656 187 HG2 LYS 21 2HG LYS 21 2.536 8.608 -31.641 188 HG3 LYS 21 3HG LYS 21 1.532 8.976 -30.237 189 HD2 LYS 21 2HD LYS 21 1.348 6.195 -30.667 190 HD3 LYS 21 3HD LYS 21 3.056 6.619 -30.798 191 HE2 LYS 21 2HE LYS 21 3.053 6.470 -28.561 192 HE3 LYS 21 3HE LYS 21 2.296 8.061 -28.615 193 HZ1 LYS 21 3HZ LYS 21 0.269 6.197 -28.942 194 HZ2 LYS 21 1HZ LYS 21 0.557 7.180 -27.595 195 HZ3 LYS 21 2HZ LYS 21 1.227 5.628 -27.669 196 H LYS 22 H LYS 22 -2.364 8.839 -32.957 197 HA LYS 22 HA LYS 22 -3.658 8.217 -34.726 198 HB2 LYS 22 2HB LYS 22 -3.358 10.593 -35.265 199 HB3 LYS 22 3HB LYS 22 -1.892 10.211 -36.158 200 HG2 LYS 22 2HG LYS 22 -3.761 8.573 -37.326 201 HG3 LYS 22 3HG LYS 22 -4.678 10.040 -36.975 202 HD2 LYS 22 2HD LYS 22 -3.482 11.299 -38.441 203 HD3 LYS 22 3HD LYS 22 -1.990 10.397 -38.165 204 HE2 LYS 22 2HE LYS 22 -2.346 9.194 -39.997 205 HE3 LYS 22 3HE LYS 22 -3.911 8.670 -39.378 206 HZ1 LYS 22 3HZ LYS 22 -5.006 10.173 -40.621 207 HZ2 LYS 22 1HZ LYS 22 -3.620 10.107 -41.589 208 HZ3 LYS 22 2HZ LYS 22 -3.810 11.360 -40.469 209 H GLY 23 H GLY 23 -2.660 6.072 -34.621 210 HA2 GLY 23 2HA GLY 23 -2.096 4.966 -37.061 211 HA3 GLY 23 3HA GLY 23 -0.522 5.412 -36.418 212 H GLY 24 H GLY 24 -0.698 4.831 -33.783 213 HA2 GLY 24 2HA GLY 24 -1.867 2.703 -32.705 214 HA3 GLY 24 3HA GLY 24 -0.798 1.918 -33.858 215 H GLY 25 H GLY 25 -0.867 1.895 -30.878 216 HA2 GLY 25 2HA GLY 25 1.620 1.467 -30.116 217 HA3 GLY 25 3HA GLY 25 1.649 3.222 -30.200 218 H GLY 26 H GLY 26 2.169 1.816 -27.844 219 HA2 GLY 26 2HA GLY 26 0.042 2.903 -26.168 220 HA3 GLY 26 3HA GLY 26 0.353 1.180 -26.018 221 H GLY 27 H GLY 27 0.808 1.765 -23.758 222 HA2 GLY 27 2HA GLY 27 3.506 1.692 -23.151 223 HA3 GLY 27 3HA GLY 27 3.052 3.389 -23.099 224 H GLY 28 H GLY 28 3.637 3.299 -20.835 225 HA2 GLY 28 2HA GLY 28 1.327 2.664 -19.201 226 HA3 GLY 28 3HA GLY 28 2.767 1.727 -18.835 227 H GLY 29 H GLY 29 4.786 3.515 -19.047 228 HA2 GLY 29 2HA GLY 29 4.530 4.989 -16.628 229 HA3 GLY 29 3HA GLY 29 5.898 5.038 -17.730 230 H GLY 30 H GLY 30 6.290 7.142 -18.056 231 HA2 GLY 30 2HA GLY 30 4.281 8.704 -19.440 232 HA3 GLY 30 3HA GLY 30 4.716 9.318 -17.851 233 H GLY 31 H GLY 31 5.372 11.223 -19.130 234 HA2 GLY 31 2HA GLY 31 7.471 12.385 -19.357 235 HA3 GLY 31 3HA GLY 31 8.170 10.905 -19.997 236 H GLY 32 H GLY 32 8.212 13.575 -21.153 237 HA2 GLY 32 2HA GLY 32 8.134 13.219 -23.780 238 HA3 GLY 32 3HA GLY 32 6.417 13.386 -23.445 239 H VAL 33 H VAL 33 7.819 15.121 -25.131 240 HA VAL 33 HA VAL 33 7.473 17.631 -23.658 241 HB VAL 33 HB VAL 33 9.822 17.098 -25.483 242 HG11 VAL 33 1HG1 VAL 33 8.549 19.507 -24.757 243 HG12 VAL 33 2HG1 VAL 33 10.074 19.442 -23.871 244 HG13 VAL 33 3HG1 VAL 33 10.067 19.299 -25.629 245 HG21 VAL 33 3HG2 VAL 33 11.080 17.578 -23.282 246 HG22 VAL 33 1HG2 VAL 33 9.552 17.173 -22.500 247 HG23 VAL 33 2HG2 VAL 33 10.367 15.982 -23.514 248 H TRP 34 H TRP 34 5.424 17.481 -24.858 249 HA TRP 34 HA TRP 34 5.348 19.187 -27.049 250 HB2 TRP 34 2HB TRP 34 6.175 17.726 -28.610 251 HB3 TRP 34 3HB TRP 34 5.621 16.304 -27.731 252 HD1 TRP 34 HD1 TRP 34 3.966 15.039 -29.204 253 HE1 TRP 34 HE1 TRP 34 2.001 15.668 -30.744 254 HE3 TRP 34 HE3 TRP 34 4.261 20.131 -28.858 255 HZ2 TRP 34 HZ2 TRP 34 0.743 18.012 -31.687 256 HZ3 TRP 34 HZ3 TRP 34 2.640 21.494 -30.110 257 HH2 TRP 34 HH2 TRP 34 0.919 20.455 -31.495 258 HA PRO 35 HA PRO 35 1.021 17.095 -26.561 259 HB2 PRO 35 2HB PRO 35 0.853 14.949 -24.906 260 HB3 PRO 35 3HB PRO 35 1.210 14.806 -26.631 261 HG2 PRO 35 2HG PRO 35 3.086 14.758 -24.299 262 HG3 PRO 35 3HG PRO 35 3.069 13.728 -25.742 263 HD2 PRO 35 2HD PRO 35 4.761 15.823 -25.468 264 HD3 PRO 35 3HD PRO 35 4.116 15.316 -27.042 265 H LEU 36 H LEU 36 0.736 19.045 -25.400 266 HA LEU 36 HA LEU 36 1.060 18.999 -22.509 267 HB2 LEU 36 2HB LEU 36 0.753 21.037 -24.582 268 HB3 LEU 36 3HB LEU 36 -0.161 21.377 -23.114 269 HG LEU 36 HG LEU 36 2.620 20.601 -22.625 270 HD11 LEU 36 1HD1 LEU 36 2.960 23.249 -23.308 271 HD12 LEU 36 2HD1 LEU 36 2.023 22.594 -24.651 272 HD13 LEU 36 3HD1 LEU 36 3.561 21.855 -24.206 273 HD21 LEU 36 3HD2 LEU 36 2.380 22.855 -21.345 274 HD22 LEU 36 1HD2 LEU 36 1.519 21.426 -20.774 275 HD23 LEU 36 2HD2 LEU 36 0.663 22.660 -21.699 276 H VAL 37 H VAL 37 -1.388 18.516 -24.859 277 HA VAL 37 HA VAL 37 -3.657 19.252 -23.334 278 HB VAL 37 HB VAL 37 -4.930 17.811 -24.909 279 HG11 VAL 37 1HG1 VAL 37 -3.826 20.218 -25.361 280 HG12 VAL 37 2HG1 VAL 37 -3.113 19.304 -26.692 281 HG13 VAL 37 3HG1 VAL 37 -4.866 19.393 -26.522 282 HG21 VAL 37 3HG2 VAL 37 -3.321 17.084 -26.909 283 HG22 VAL 37 1HG2 VAL 37 -2.188 16.908 -25.569 284 HG23 VAL 37 2HG2 VAL 37 -3.706 16.011 -25.563 285 H ILE 38 H ILE 38 -1.960 16.172 -23.787 286 HA ILE 38 HA ILE 38 -3.722 14.570 -22.298 287 HB ILE 38 HB ILE 38 -1.971 12.930 -22.199 288 HG12 ILE 38 2HG1 ILE 38 -0.088 15.129 -23.080 289 HG13 ILE 38 3HG1 ILE 38 -0.156 14.434 -21.464 290 HG21 ILE 38 1HG2 ILE 38 -3.021 13.854 -24.478 291 HG22 ILE 38 2HG2 ILE 38 -1.313 14.128 -24.819 292 HG23 ILE 38 3HG2 ILE 38 -1.884 12.508 -24.422 293 HD11 ILE 38 3HD1 ILE 38 1.167 12.763 -22.054 294 HD12 ILE 38 1HD1 ILE 38 0.173 12.384 -23.460 295 HD13 ILE 38 2HD1 ILE 38 1.436 13.609 -23.577 296 H ARG 39 H ARG 39 -1.117 16.691 -21.340 297 HA ARG 39 HA ARG 39 -0.921 15.710 -18.658 298 HB2 ARG 39 2HB ARG 39 0.801 17.170 -18.426 299 HB3 ARG 39 3HB ARG 39 0.715 17.202 -20.182 300 HG2 ARG 39 2HG ARG 39 0.720 19.430 -19.802 301 HG3 ARG 39 3HG ARG 39 -1.017 19.151 -19.669 302 HD2 ARG 39 2HD ARG 39 -0.155 18.640 -17.126 303 HD3 ARG 39 3HD ARG 39 0.929 19.936 -17.629 304 HE ARG 39 HE ARG 39 -1.815 20.494 -18.221 305 HH11 ARG 39 1HH1 ARG 39 0.617 20.571 -15.730 306 HH12 ARG 39 2HH1 ARG 39 -0.156 21.836 -14.833 307 HH21 ARG 39 1HH2 ARG 39 -2.842 22.160 -17.048 308 HH22 ARG 39 2HH2 ARG 39 -2.123 22.738 -15.583 309 H THR 40 H THR 40 -3.040 17.830 -20.306 310 HA THR 40 HA THR 40 -3.815 19.662 -18.402 311 HB THR 40 HB THR 40 -5.775 18.227 -20.195 312 HG1 THR 40 HG1 THR 40 -5.168 19.832 -21.751 313 HG21 THR 40 3HG2 THR 40 -6.405 20.007 -18.366 314 HG22 THR 40 1HG2 THR 40 -7.147 20.062 -19.964 315 HG23 THR 40 2HG2 THR 40 -5.811 21.146 -19.574 316 H VAL 41 H VAL 41 -5.419 16.521 -18.969 317 HA VAL 41 HA VAL 41 -6.967 16.645 -16.599 318 HB VAL 41 HB VAL 41 -6.224 14.229 -18.255 319 HG11 VAL 41 1HG1 VAL 41 -7.889 14.593 -15.859 320 HG12 VAL 41 2HG1 VAL 41 -8.633 13.664 -17.161 321 HG13 VAL 41 3HG1 VAL 41 -7.090 13.149 -16.480 322 HG21 VAL 41 3HG2 VAL 41 -7.607 15.025 -19.800 323 HG22 VAL 41 1HG2 VAL 41 -8.916 15.016 -18.618 324 HG23 VAL 41 2HG2 VAL 41 -7.916 16.455 -18.814 325 H ILE 42 H ILE 42 -3.914 15.049 -17.407 326 HA ILE 42 HA ILE 42 -3.543 13.544 -15.110 327 HB ILE 42 HB ILE 42 -1.509 14.946 -16.839 328 HG12 ILE 42 2HG1 ILE 42 -2.840 12.284 -16.824 329 HG13 ILE 42 3HG1 ILE 42 -2.364 13.295 -18.184 330 HG21 ILE 42 1HG2 ILE 42 0.212 13.646 -15.786 331 HG22 ILE 42 2HG2 ILE 42 -0.650 14.551 -14.543 332 HG23 ILE 42 3HG2 ILE 42 -0.970 12.831 -14.763 333 HD11 ILE 42 3HD1 ILE 42 -0.703 11.396 -16.580 334 HD12 ILE 42 1HD1 ILE 42 -0.956 11.458 -18.324 335 HD13 ILE 42 2HD1 ILE 42 0.038 12.682 -17.533 336 H ALA 43 H ALA 43 -3.418 16.964 -15.528 337 HA ALA 43 HA ALA 43 -1.731 17.880 -13.591 338 HB1 ALA 43 1HB ALA 43 -4.465 18.899 -14.335 339 HB2 ALA 43 2HB ALA 43 -3.347 19.773 -13.288 340 HB3 ALA 43 3HB ALA 43 -2.904 19.432 -14.961 341 H GLY 44 H GLY 44 -4.554 15.982 -13.133 342 HA2 GLY 44 2HA GLY 44 -4.678 16.656 -10.276 343 HA3 GLY 44 3HA GLY 44 -5.892 15.756 -11.173 344 H TYR 45 H TYR 45 -3.979 13.989 -12.454 345 HA TYR 45 HA TYR 45 -3.996 11.850 -10.717 346 HB2 TYR 45 2HB TYR 45 -2.073 12.401 -12.985 347 HB3 TYR 45 3HB TYR 45 -2.273 10.838 -12.201 348 HD1 TYR 45 HD2 TYR 45 -5.446 11.841 -12.023 349 HD2 TYR 45 HD1 TYR 45 -2.594 10.932 -15.046 350 HE1 TYR 45 HE2 TYR 45 -7.274 11.296 -13.576 351 HE2 TYR 45 HE1 TYR 45 -4.414 10.385 -16.608 352 HH TYR 45 HH TYR 45 -7.815 10.754 -15.665 353 H ASN 46 H ASN 46 -1.395 14.190 -11.285 354 HA ASN 46 HA ASN 46 0.633 13.090 -9.795 355 HB2 ASN 46 2HB ASN 46 0.625 15.263 -11.158 356 HB3 ASN 46 3HB ASN 46 0.011 16.038 -9.700 357 HD21 ASN 46 1HD2 ASN 46 2.717 14.404 -11.159 358 HD22 ASN 46 2HD2 ASN 46 3.896 14.895 -9.995 359 H LEU 47 H LEU 47 -2.326 14.509 -8.684 360 HA LEU 47 HA LEU 47 -1.413 14.707 -5.934 361 HB2 LEU 47 2HB LEU 47 -3.549 15.799 -7.497 362 HB3 LEU 47 3HB LEU 47 -4.212 15.002 -6.072 363 HG LEU 47 HG LEU 47 -3.839 17.405 -5.723 364 HD11 LEU 47 1HD1 LEU 47 -3.377 17.036 -3.571 365 HD12 LEU 47 2HD1 LEU 47 -1.793 16.351 -3.934 366 HD13 LEU 47 3HD1 LEU 47 -3.233 15.338 -4.026 367 HD21 LEU 47 3HD2 LEU 47 -1.808 18.452 -5.935 368 HD22 LEU 47 1HD2 LEU 47 -1.710 17.280 -7.249 369 HD23 LEU 47 2HD2 LEU 47 -0.891 16.961 -5.721 370 H TYR 48 H TYR 48 -3.375 12.614 -7.942 371 HA TYR 48 HA TYR 48 -4.830 11.140 -6.195 372 HB2 TYR 48 2HB TYR 48 -4.096 10.834 -8.812 373 HB3 TYR 48 3HB TYR 48 -3.316 9.445 -8.063 374 HD1 TYR 48 HD2 TYR 48 -5.237 8.703 -5.976 375 HD2 TYR 48 HD1 TYR 48 -5.916 9.978 -9.978 376 HE1 TYR 48 HE2 TYR 48 -7.375 7.488 -5.994 377 HE2 TYR 48 HE1 TYR 48 -8.057 8.768 -10.006 378 HH TYR 48 HH TYR 48 -9.025 6.685 -7.349 379 H ARG 49 H ARG 49 -1.396 10.576 -6.946 380 HA ARG 49 HA ARG 49 -1.158 8.568 -4.893 381 HB2 ARG 49 2HB ARG 49 0.782 9.865 -6.792 382 HB3 ARG 49 3HB ARG 49 1.335 8.802 -5.505 383 HG2 ARG 49 2HG ARG 49 -0.082 7.005 -6.413 384 HG3 ARG 49 3HG ARG 49 -0.555 8.076 -7.734 385 HD2 ARG 49 2HD ARG 49 1.299 6.441 -8.246 386 HD3 ARG 49 3HD ARG 49 1.643 8.133 -8.600 387 HE ARG 49 HE ARG 49 3.285 8.101 -7.002 388 HH11 ARG 49 1HH1 ARG 49 1.258 5.296 -6.626 389 HH12 ARG 49 2HH1 ARG 49 2.287 4.548 -5.450 390 HH21 ARG 49 1HH2 ARG 49 4.648 7.128 -5.454 391 HH22 ARG 49 2HH2 ARG 49 4.215 5.592 -4.783 392 H ALA 50 H ALA 50 -0.676 11.984 -5.169 393 HA ALA 50 HA ALA 50 1.175 12.541 -3.210 394 HB1 ALA 50 1HB ALA 50 -1.350 14.123 -3.655 395 HB2 ALA 50 2HB ALA 50 0.191 14.712 -3.029 396 HB3 ALA 50 3HB ALA 50 0.062 14.195 -4.711 397 H ILE 51 H ILE 51 -2.269 11.829 -2.822 398 HA ILE 51 HA ILE 51 -2.194 12.192 0.034 399 HB ILE 51 HB ILE 51 -4.334 10.956 -1.702 400 HG12 ILE 51 2HG1 ILE 51 -3.960 13.288 -2.277 401 HG13 ILE 51 3HG1 ILE 51 -5.478 13.135 -1.398 402 HG21 ILE 51 1HG2 ILE 51 -4.045 11.252 1.185 403 HG22 ILE 51 2HG2 ILE 51 -5.549 11.924 0.556 404 HG23 ILE 51 3HG2 ILE 51 -5.144 10.234 0.254 405 HD11 ILE 51 3HD1 ILE 51 -3.522 13.621 0.540 406 HD12 ILE 51 1HD1 ILE 51 -3.176 14.723 -0.792 407 HD13 ILE 51 2HD1 ILE 51 -4.770 14.725 -0.038 408 H LYS 52 H LYS 52 -1.550 9.639 -2.159 409 HA LYS 52 HA LYS 52 -2.069 7.485 -0.330 410 HB2 LYS 52 2HB LYS 52 -2.222 6.684 -2.467 411 HB3 LYS 52 3HB LYS 52 -0.970 7.759 -3.076 412 HG2 LYS 52 2HG LYS 52 0.745 6.348 -2.417 413 HG3 LYS 52 3HG LYS 52 -0.268 5.503 -1.243 414 HD2 LYS 52 2HD LYS 52 -0.679 5.371 -4.228 415 HD3 LYS 52 3HD LYS 52 0.254 4.188 -3.308 416 HE2 LYS 52 2HE LYS 52 -1.641 3.090 -2.932 417 HE3 LYS 52 3HE LYS 52 -2.170 4.450 -1.942 418 HZ1 LYS 52 3HZ LYS 52 -3.261 5.420 -3.790 419 HZ2 LYS 52 1HZ LYS 52 -3.729 3.794 -3.753 420 HZ3 LYS 52 2HZ LYS 52 -2.578 4.318 -4.876 421 H LYS 53 H LYS 53 0.603 9.564 -1.072 422 HA LYS 53 HA LYS 53 2.583 7.889 0.191 423 HB2 LYS 53 2HB LYS 53 2.579 10.217 -1.472 424 HB3 LYS 53 3HB LYS 53 3.508 10.566 -0.020 425 HG2 LYS 53 2HG LYS 53 4.892 8.597 -0.425 426 HG3 LYS 53 3HG LYS 53 3.956 8.239 -1.878 427 HD2 LYS 53 2HD LYS 53 4.791 10.936 -2.056 428 HD3 LYS 53 3HD LYS 53 6.196 9.982 -1.572 429 HE2 LYS 53 2HE LYS 53 5.862 8.492 -3.458 430 HE3 LYS 53 3HE LYS 53 4.400 9.363 -3.916 431 HZ1 LYS 53 3HZ LYS 53 7.147 10.004 -4.442 432 HZ2 LYS 53 1HZ LYS 53 6.282 11.311 -3.806 433 HZ3 LYS 53 2HZ LYS 53 5.745 10.548 -5.216 434 H LYS 54 H LYS 54 0.727 10.776 1.020 435 HA LYS 54 HA LYS 54 1.861 10.707 3.729 436 HB2 LYS 54 2HB LYS 54 0.201 12.865 2.412 437 HB3 LYS 54 3HB LYS 54 0.969 12.965 3.991 438 HG2 LYS 54 2HG LYS 54 2.969 13.471 3.124 439 HG3 LYS 54 3HG LYS 54 2.798 12.320 1.796 440 HD2 LYS 54 2HD LYS 54 2.090 13.905 0.386 441 HD3 LYS 54 3HD LYS 54 0.969 14.574 1.574 442 HE2 LYS 54 2HE LYS 54 2.527 16.287 1.090 443 HE3 LYS 54 3HE LYS 54 2.967 15.652 2.674 444 HZ1 LYS 54 3HZ LYS 54 4.620 15.919 0.503 445 HZ2 LYS 54 1HZ LYS 54 4.305 14.258 0.584 446 HZ3 LYS 54 2HZ LYS 54 4.954 15.062 1.923 447 H GLY 55 H GLY 55 -0.060 11.855 5.227 448 HA2 GLY 55 2HA GLY 55 -2.424 10.120 4.885 449 HA3 GLY 55 3HA GLY 55 -1.615 10.263 6.438 450 H GLY 56 H GLY 56 -3.875 11.660 4.259 451 HA2 GLY 56 2HA GLY 56 -5.201 13.177 6.151 452 HA3 GLY 56 3HA GLY 56 -4.012 14.253 5.432 453 H GLY 57 H GLY 57 -6.877 14.508 5.310 454 HA2 GLY 57 2HA GLY 57 -8.001 15.551 3.459 455 HA3 GLY 57 3HA GLY 57 -7.168 14.442 2.380 456 H GLY 58 H GLY 58 -9.990 14.960 2.453 457 HA2 GLY 58 2HA GLY 58 -11.604 13.273 1.838 458 HA3 GLY 58 3HA GLY 58 -10.906 12.226 3.065 459 H GLY 59 H GLY 59 -13.560 12.433 3.101 460 HA2 GLY 59 2HA GLY 59 -14.476 12.832 5.511 461 HA3 GLY 59 3HA GLY 59 -14.263 14.514 5.048 462 H GLY 60 H GLY 60 -16.581 14.673 5.460 463 HA2 GLY 60 2HA GLY 60 -18.215 15.132 3.456 464 HA3 GLY 60 3HA GLY 60 -18.289 13.376 3.465 465 H GLY 61 H GLY 61 -20.520 15.062 3.856 466 HA2 GLY 61 2HA GLY 61 -22.337 14.365 5.327 467 HA3 GLY 61 3HA GLY 61 -21.180 14.367 6.649 468 H GLY 62 H GLY 62 -23.173 16.335 4.565 469 HA2 GLY 62 2HA GLY 62 -24.019 18.228 6.213 470 HA3 GLY 62 3HA GLY 62 -22.373 18.781 5.943 471 H GLY 63 H GLY 63 -25.559 18.577 4.669 472 HA2 GLY 63 2HA GLY 63 -26.388 20.113 3.070 473 HA3 GLY 63 3HA GLY 63 -24.751 20.333 2.469 474 H GLY 64 H GLY 64 -24.378 17.347 2.450 475 HA2 GLY 64 2HA GLY 64 -25.861 15.699 1.103 476 HA3 GLY 64 3HA GLY 64 -25.688 16.923 -0.146 477 H VAL 65 H VAL 65 -24.750 15.162 -1.401 478 HA VAL 65 HA VAL 65 -22.448 13.757 -0.740 479 HB VAL 65 HB VAL 65 -22.040 13.604 -3.207 480 HG11 VAL 65 1HG1 VAL 65 -23.376 11.848 -2.953 481 HG12 VAL 65 2HG1 VAL 65 -24.287 12.672 -1.685 482 HG13 VAL 65 3HG1 VAL 65 -24.745 12.877 -3.377 483 HG21 VAL 65 3HG2 VAL 65 -24.627 14.886 -3.798 484 HG22 VAL 65 1HG2 VAL 65 -23.306 15.979 -3.382 485 HG23 VAL 65 2HG2 VAL 65 -23.132 14.859 -4.733 486 H TRP 66 H TRP 66 -20.248 14.035 -1.536 487 HA TRP 66 HA TRP 66 -19.464 16.834 -1.956 488 HB2 TRP 66 2HB TRP 66 -19.155 16.299 0.434 489 HB3 TRP 66 3HB TRP 66 -18.125 14.941 -0.011 490 HD1 TRP 66 HD1 TRP 66 -17.553 17.996 -2.106 491 HE1 TRP 66 HE1 TRP 66 -15.351 19.129 -1.408 492 HE3 TRP 66 HE3 TRP 66 -16.631 15.395 2.198 493 HZ2 TRP 66 HZ2 TRP 66 -13.471 18.945 0.690 494 HZ3 TRP 66 HZ3 TRP 66 -14.609 15.935 3.491 495 HH2 TRP 66 HH2 TRP 66 -13.062 17.673 2.751 496 HA PRO 67 HA PRO 67 -17.465 13.818 -4.924 497 HB2 PRO 67 2HB PRO 67 -18.251 15.108 -7.179 498 HB3 PRO 67 3HB PRO 67 -19.236 13.873 -6.386 499 HG2 PRO 67 2HG PRO 67 -19.445 16.855 -6.225 500 HG3 PRO 67 3HG PRO 67 -20.736 15.650 -6.386 501 HD2 PRO 67 2HD PRO 67 -20.115 16.811 -4.020 502 HD3 PRO 67 3HD PRO 67 -20.719 15.146 -4.137 503 H LEU 68 H LEU 68 -15.851 15.345 -3.570 504 HA LEU 68 HA LEU 68 -14.751 17.458 -5.246 505 HB2 LEU 68 2HB LEU 68 -14.684 18.189 -3.085 506 HB3 LEU 68 3HB LEU 68 -14.416 16.574 -2.433 507 HG LEU 68 HG LEU 68 -12.073 16.680 -3.086 508 HD11 LEU 68 1HD1 LEU 68 -11.759 19.429 -3.673 509 HD12 LEU 68 2HD1 LEU 68 -12.988 18.787 -4.762 510 HD13 LEU 68 3HD1 LEU 68 -11.392 18.039 -4.695 511 HD21 LEU 68 3HD2 LEU 68 -12.325 17.421 -0.912 512 HD22 LEU 68 1HD2 LEU 68 -13.223 18.860 -1.394 513 HD23 LEU 68 2HD2 LEU 68 -11.483 18.776 -1.666 514 H VAL 69 H VAL 69 -13.580 14.482 -3.671 515 HA VAL 69 HA VAL 69 -11.038 14.382 -4.728 516 HB VAL 69 HB VAL 69 -11.239 11.876 -4.555 517 HG11 VAL 69 1HG1 VAL 69 -10.394 12.831 -2.637 518 HG12 VAL 69 2HG1 VAL 69 -11.861 13.760 -2.324 519 HG13 VAL 69 3HG1 VAL 69 -11.832 12.023 -2.016 520 HG21 VAL 69 3HG2 VAL 69 -13.333 11.094 -3.365 521 HG22 VAL 69 1HG2 VAL 69 -14.065 12.625 -3.845 522 HG23 VAL 69 2HG2 VAL 69 -13.514 11.487 -5.075 523 H ILE 70 H ILE 70 -14.040 13.146 -6.164 524 HA ILE 70 HA ILE 70 -12.861 12.048 -8.476 525 HB ILE 70 HB ILE 70 -15.039 11.849 -9.373 526 HG12 ILE 70 2HG1 ILE 70 -15.887 13.984 -7.404 527 HG13 ILE 70 3HG1 ILE 70 -15.749 14.175 -9.148 528 HG21 ILE 70 1HG2 ILE 70 -15.813 10.433 -7.824 529 HG22 ILE 70 2HG2 ILE 70 -14.423 10.942 -6.866 530 HG23 ILE 70 3HG2 ILE 70 -15.992 11.707 -6.618 531 HD11 ILE 70 3HD1 ILE 70 -18.005 13.882 -8.878 532 HD12 ILE 70 1HD1 ILE 70 -17.476 12.235 -9.221 533 HD13 ILE 70 2HD1 ILE 70 -17.808 12.728 -7.560 534 H ARG 71 H ARG 71 -13.771 15.289 -7.618 535 HA ARG 71 HA ARG 71 -13.682 16.292 -10.319 536 HB2 ARG 71 2HB ARG 71 -15.145 17.484 -8.918 537 HB3 ARG 71 3HB ARG 71 -13.970 17.564 -7.612 538 HG2 ARG 71 2HG ARG 71 -14.257 19.732 -8.659 539 HG3 ARG 71 3HG ARG 71 -12.620 19.125 -8.915 540 HD2 ARG 71 2HD ARG 71 -12.879 19.320 -11.110 541 HD3 ARG 71 3HD ARG 71 -14.254 18.218 -11.056 542 HE ARG 71 HE ARG 71 -15.610 20.014 -11.387 543 HH11 ARG 71 1HH1 ARG 71 -12.612 21.139 -10.021 544 HH12 ARG 71 2HH1 ARG 71 -13.043 22.814 -10.122 545 HH21 ARG 71 1HH2 ARG 71 -16.189 22.216 -11.525 546 HH22 ARG 71 2HH2 ARG 71 -15.079 23.426 -10.977 547 H THR 72 H THR 72 -11.420 15.628 -7.855 548 HA THR 72 HA THR 72 -9.462 17.554 -8.216 549 HB THR 72 HB THR 72 -8.767 14.654 -7.812 550 HG1 THR 72 HG1 THR 72 -9.659 16.432 -5.775 551 HG21 THR 72 3HG2 THR 72 -7.551 17.296 -7.154 552 HG22 THR 72 1HG2 THR 72 -6.793 15.834 -7.784 553 HG23 THR 72 2HG2 THR 72 -7.245 15.930 -6.082 554 H VAL 73 H VAL 73 -9.620 14.367 -9.818 555 HA VAL 73 HA VAL 73 -7.548 15.038 -11.676 556 HB VAL 73 HB VAL 73 -8.115 12.904 -12.774 557 HG11 VAL 73 1HG1 VAL 73 -6.692 13.118 -10.660 558 HG12 VAL 73 2HG1 VAL 73 -8.085 12.452 -9.806 559 HG13 VAL 73 3HG1 VAL 73 -7.296 11.515 -11.076 560 HG21 VAL 73 3HG2 VAL 73 -10.464 12.775 -12.580 561 HG22 VAL 73 1HG2 VAL 73 -9.831 11.460 -11.589 562 HG23 VAL 73 2HG2 VAL 73 -10.406 12.942 -10.825 563 H ILE 74 H ILE 74 -11.077 14.738 -11.869 564 HA ILE 74 HA ILE 74 -11.305 15.254 -14.629 565 HB ILE 74 HB ILE 74 -13.353 15.889 -12.504 566 HG12 ILE 74 2HG1 ILE 74 -12.358 13.499 -12.576 567 HG13 ILE 74 3HG1 ILE 74 -14.109 13.676 -12.587 568 HG21 ILE 74 1HG2 ILE 74 -13.500 15.494 -15.478 569 HG22 ILE 74 2HG2 ILE 74 -14.916 15.353 -14.437 570 HG23 ILE 74 3HG2 ILE 74 -14.035 16.878 -14.525 571 HD11 ILE 74 3HD1 ILE 74 -14.308 12.810 -14.642 572 HD12 ILE 74 1HD1 ILE 74 -12.849 13.603 -15.235 573 HD13 ILE 74 2HD1 ILE 74 -12.725 12.118 -14.291 574 H ALA 75 H ALA 75 -10.495 17.292 -12.038 575 HA ALA 75 HA ALA 75 -11.579 19.739 -12.602 576 HB1 ALA 75 1HB ALA 75 -9.383 20.694 -11.772 577 HB2 ALA 75 2HB ALA 75 -10.195 19.550 -10.702 578 HB3 ALA 75 3HB ALA 75 -8.812 19.028 -11.665 579 H GLY 76 H GLY 76 -9.271 17.961 -14.482 580 HA2 GLY 76 2HA GLY 76 -8.678 20.298 -16.148 581 HA3 GLY 76 3HA GLY 76 -7.867 18.741 -16.226 582 H TYR 77 H TYR 77 -10.419 17.268 -16.238 583 HA TYR 77 HA TYR 77 -10.756 16.952 -18.977 584 HB2 TYR 77 2HB TYR 77 -11.702 15.692 -16.704 585 HB3 TYR 77 3HB TYR 77 -13.166 16.320 -17.452 586 HD1 TYR 77 HD2 TYR 77 -12.161 16.101 -20.342 587 HD2 TYR 77 HD1 TYR 77 -12.123 13.376 -17.075 588 HE1 TYR 77 HE2 TYR 77 -12.166 14.215 -21.922 589 HE2 TYR 77 HE1 TYR 77 -12.127 11.483 -18.645 590 HH TYR 77 HH TYR 77 -11.925 11.995 -22.138 591 H ASN 78 H ASN 78 -12.567 18.945 -16.691 592 HA ASN 78 HA ASN 78 -14.719 19.737 -18.171 593 HB2 ASN 78 2HB ASN 78 -14.510 20.531 -15.934 594 HB3 ASN 78 3HB ASN 78 -12.988 21.343 -16.290 595 HD21 ASN 78 1HD2 ASN 78 -13.111 23.442 -16.562 596 HD22 ASN 78 2HD2 ASN 78 -14.508 24.327 -17.061 597 H LEU 79 H LEU 79 -11.397 20.458 -18.756 598 HA LEU 79 HA LEU 79 -12.012 22.611 -20.617 599 HB2 LEU 79 2HB LEU 79 -9.723 21.772 -19.106 600 HB3 LEU 79 3HB LEU 79 -9.299 21.892 -20.813 601 HG LEU 79 HG LEU 79 -10.739 24.174 -19.555 602 HD11 LEU 79 1HD1 LEU 79 -8.721 25.118 -18.674 603 HD12 LEU 79 2HD1 LEU 79 -7.775 23.740 -19.237 604 HD13 LEU 79 3HD1 LEU 79 -8.958 23.528 -17.947 605 HD21 LEU 79 3HD2 LEU 79 -9.459 23.615 -22.004 606 HD22 LEU 79 1HD2 LEU 79 -8.482 24.828 -21.177 607 HD23 LEU 79 2HD2 LEU 79 -10.193 25.131 -21.479 608 H TYR 80 H TYR 80 -10.814 19.293 -20.632 609 HA TYR 80 HA TYR 80 -10.061 19.030 -23.276 610 HB2 TYR 80 2HB TYR 80 -10.737 17.262 -21.102 611 HB3 TYR 80 3HB TYR 80 -11.375 16.629 -22.615 612 HD1 TYR 80 HD2 TYR 80 -9.799 16.239 -24.533 613 HD2 TYR 80 HD1 TYR 80 -8.424 17.165 -20.615 614 HE1 TYR 80 HE2 TYR 80 -7.570 15.379 -25.118 615 HE2 TYR 80 HE1 TYR 80 -6.191 16.309 -21.189 616 HH TYR 80 HH TYR 80 -5.463 15.121 -24.453 617 H ARG 81 H ARG 81 -13.297 18.678 -21.865 618 HA ARG 81 HA ARG 81 -14.537 18.094 -24.381 619 HB2 ARG 81 2HB ARG 81 -15.954 19.064 -21.907 620 HB3 ARG 81 3HB ARG 81 -16.585 18.044 -23.193 621 HG2 ARG 81 2HG ARG 81 -16.110 16.288 -21.935 622 HG3 ARG 81 3HG ARG 81 -14.399 16.653 -22.164 623 HD2 ARG 81 2HD ARG 81 -14.438 16.722 -19.899 624 HD3 ARG 81 3HD ARG 81 -14.937 18.385 -20.207 625 HE ARG 81 HE ARG 81 -17.259 16.909 -20.128 626 HH11 ARG 81 1HH1 ARG 81 -14.613 17.579 -17.967 627 HH12 ARG 81 2HH1 ARG 81 -15.575 17.430 -16.534 628 HH21 ARG 81 1HH2 ARG 81 -18.536 16.711 -18.248 629 HH22 ARG 81 2HH2 ARG 81 -17.806 16.935 -16.695 630 H ALA 82 H ALA 82 -13.630 20.950 -22.713 631 HA ALA 82 HA ALA 82 -15.465 22.838 -23.490 632 HB1 ALA 82 1HB ALA 82 -12.578 23.533 -23.715 633 HB2 ALA 82 2HB ALA 82 -13.900 24.426 -22.962 634 HB3 ALA 82 3HB ALA 82 -13.212 23.019 -22.151 635 H ILE 83 H ILE 83 -12.854 21.429 -25.405 636 HA ILE 83 HA ILE 83 -13.388 23.119 -27.681 637 HB ILE 83 HB ILE 83 -11.480 20.899 -27.103 638 HG12 ILE 83 2HG1 ILE 83 -9.842 22.538 -27.818 639 HG13 ILE 83 3HG1 ILE 83 -11.113 23.611 -28.392 640 HG21 ILE 83 1HG2 ILE 83 -12.350 21.780 -29.839 641 HG22 ILE 83 2HG2 ILE 83 -10.765 21.070 -29.540 642 HG23 ILE 83 3HG2 ILE 83 -12.225 20.142 -29.198 643 HD11 ILE 83 3HD1 ILE 83 -10.196 24.364 -26.273 644 HD12 ILE 83 1HD1 ILE 83 -11.894 23.916 -26.107 645 HD13 ILE 83 2HD1 ILE 83 -10.633 22.826 -25.528 646 H LYS 84 H LYS 84 -14.427 20.037 -26.507 647 HA LYS 84 HA LYS 84 -15.278 18.908 -28.960 648 HB2 LYS 84 2HB LYS 84 -15.757 18.371 -26.076 649 HB3 LYS 84 3HB LYS 84 -16.913 17.701 -27.219 650 HG2 LYS 84 2HG LYS 84 -13.937 17.247 -27.297 651 HG3 LYS 84 3HG LYS 84 -15.128 16.121 -26.642 652 HD2 LYS 84 2HD LYS 84 -15.512 15.299 -28.671 653 HD3 LYS 84 3HD LYS 84 -15.923 16.906 -29.274 654 HE2 LYS 84 2HE LYS 84 -13.488 17.340 -29.573 655 HE3 LYS 84 3HE LYS 84 -13.180 15.661 -29.129 656 HZ1 LYS 84 3HZ LYS 84 -14.676 15.040 -31.017 657 HZ2 LYS 84 1HZ LYS 84 -13.217 15.766 -31.474 658 HZ3 LYS 84 2HZ LYS 84 -14.651 16.662 -31.499 659 H LYS 85 H LYS 85 -16.679 21.226 -26.783 660 HA LYS 85 HA LYS 85 -19.314 21.042 -27.977 661 HB2 LYS 85 2HB LYS 85 -18.258 22.027 -25.542 662 HB3 LYS 85 3HB LYS 85 -18.972 23.400 -26.378 663 HG2 LYS 85 2HG LYS 85 -21.056 22.045 -26.645 664 HG3 LYS 85 3HG LYS 85 -20.323 20.829 -25.596 665 HD2 LYS 85 2HD LYS 85 -20.368 23.642 -24.640 666 HD3 LYS 85 3HD LYS 85 -21.891 22.751 -24.648 667 HE2 LYS 85 2HE LYS 85 -21.291 21.533 -22.877 668 HE3 LYS 85 3HE LYS 85 -19.708 21.177 -23.566 669 HZ1 LYS 85 3HZ LYS 85 -18.744 22.816 -22.405 670 HZ2 LYS 85 1HZ LYS 85 -20.098 22.691 -21.398 671 HZ3 LYS 85 2HZ LYS 85 -20.043 23.883 -22.597 672 H LYS 86 H LYS 86 -16.550 23.237 -28.004 673 HA LYS 86 HA LYS 86 -16.005 25.006 -29.328 674 HB2 LYS 86 2HB LYS 86 -16.224 23.152 -31.024 675 HB3 LYS 86 3HB LYS 86 -17.852 23.733 -31.351 676 HG2 LYS 86 2HG LYS 86 -16.898 24.983 -32.927 677 HG3 LYS 86 3HG LYS 86 -16.361 26.013 -31.598 678 HD2 LYS 86 2HD LYS 86 -14.725 23.643 -32.403 679 HD3 LYS 86 3HD LYS 86 -14.635 25.134 -33.344 680 HE2 LYS 86 2HE LYS 86 -14.291 26.249 -31.012 681 HE3 LYS 86 3HE LYS 86 -13.833 24.623 -30.510 682 HZ1 LYS 86 3HZ LYS 86 -12.012 26.191 -31.335 683 HZ2 LYS 86 1HZ LYS 86 -12.611 25.876 -32.886 684 HZ3 LYS 86 2HZ LYS 86 -12.020 24.609 -31.934 685 H GLY 87 H GLY 87 -17.146 26.468 -27.926 686 HA2 GLY 87 2HA GLY 87 -18.788 28.282 -29.221 687 HA3 GLY 87 3HA GLY 87 -19.864 27.179 -28.376 688 H GLY 88 H GLY 88 -17.951 26.759 -26.179 689 HA2 GLY 88 2HA GLY 88 -16.900 28.683 -24.752 690 HA3 GLY 88 3HA GLY 88 -18.570 29.230 -24.727 691 H GLY 89 H GLY 89 -16.691 28.248 -22.588 692 HA2 GLY 89 2HA GLY 89 -18.613 26.867 -21.039 693 HA3 GLY 89 3HA GLY 89 -17.424 25.726 -21.652 694 H GLY 90 H GLY 90 -17.645 25.962 -18.980 695 HA2 GLY 90 2HA GLY 90 -15.160 26.260 -17.986 696 HA3 GLY 90 3HA GLY 90 -15.754 27.914 -17.977 697 H GLY 91 H GLY 91 -15.113 25.722 -15.879 698 HA2 GLY 91 2HA GLY 91 -15.865 25.213 -13.771 699 HA3 GLY 91 3HA GLY 91 -16.912 26.617 -13.916 700 H GLY 92 H GLY 92 -17.158 24.018 -16.211 701 HA2 GLY 92 2HA GLY 92 -18.710 22.098 -15.390 702 HA3 GLY 92 3HA GLY 92 -19.833 23.429 -15.151 703 H GLY 93 H GLY 93 -19.179 20.994 -17.166 704 HA2 GLY 93 2HA GLY 93 -20.702 22.158 -19.308 705 HA3 GLY 93 3HA GLY 93 -19.022 21.880 -19.743 706 H GLY 94 H GLY 94 -19.575 20.342 -21.311 707 HA2 GLY 94 2HA GLY 94 -19.261 17.825 -21.213 708 HA3 GLY 94 3HA GLY 94 -20.733 17.841 -20.252 709 H GLY 95 H GLY 95 -19.789 16.881 -23.085 710 HA2 GLY 95 2HA GLY 95 -21.389 16.202 -24.736 711 HA3 GLY 95 3HA GLY 95 -22.319 17.649 -24.376 712 H GLY 96 H GLY 96 -22.027 17.298 -26.933 713 HA2 GLY 96 2HA GLY 96 -21.217 19.380 -28.228 714 HA3 GLY 96 3HA GLY 96 -19.628 18.770 -27.792 715 H VAL 97 H VAL 97 -18.936 18.387 -29.873 716 HA VAL 97 HA VAL 97 -20.506 16.874 -31.739 717 HB VAL 97 HB VAL 97 -18.372 16.849 -33.087 718 HG11 VAL 97 1HG1 VAL 97 -19.566 19.442 -32.135 719 HG12 VAL 97 2HG1 VAL 97 -18.418 19.345 -33.472 720 HG13 VAL 97 3HG1 VAL 97 -19.974 18.520 -33.582 721 HG21 VAL 97 3HG2 VAL 97 -17.061 18.956 -31.667 722 HG22 VAL 97 1HG2 VAL 97 -17.256 17.565 -30.600 723 HG23 VAL 97 2HG2 VAL 97 -16.430 17.381 -32.148 724 H TRP 98 H TRP 98 -20.881 14.787 -31.337 725 HA TRP 98 HA TRP 98 -20.555 12.660 -30.491 726 HB2 TRP 98 2HB TRP 98 -18.563 11.586 -31.765 727 HB3 TRP 98 3HB TRP 98 -19.925 12.211 -32.691 728 HD1 TRP 98 HD1 TRP 98 -19.524 14.621 -33.942 729 HE1 TRP 98 HE1 TRP 98 -17.362 15.647 -34.888 730 HE3 TRP 98 HE3 TRP 98 -16.105 11.749 -31.452 731 HZ2 TRP 98 HZ2 TRP 98 -14.576 15.287 -34.616 732 HZ3 TRP 98 HZ3 TRP 98 -13.711 12.153 -31.852 733 HH2 TRP 98 HH2 TRP 98 -12.964 13.885 -33.401 734 HA PRO 99 HA PRO 99 -17.262 13.911 -27.420 735 HB2 PRO 99 2HB PRO 99 -18.847 13.666 -25.229 736 HB3 PRO 99 3HB PRO 99 -18.728 15.160 -26.167 737 HG2 PRO 99 2HG PRO 99 -20.827 13.028 -26.259 738 HG3 PRO 99 3HG PRO 99 -21.021 14.790 -26.282 739 HD2 PRO 99 2HD PRO 99 -21.158 13.279 -28.525 740 HD3 PRO 99 3HD PRO 99 -20.530 14.940 -28.529 741 H LEU 100 H LEU 100 -16.968 11.576 -28.539 742 HA LEU 100 HA LEU 100 -17.628 9.434 -26.680 743 HB2 LEU 100 2HB LEU 100 -17.027 9.638 -29.482 744 HB3 LEU 100 3HB LEU 100 -15.960 8.461 -28.718 745 HG LEU 100 HG LEU 100 -18.743 8.101 -27.952 746 HD11 LEU 100 1HD1 LEU 100 -18.036 8.334 -30.826 747 HD12 LEU 100 2HD1 LEU 100 -19.550 8.697 -29.997 748 HD13 LEU 100 3HD1 LEU 100 -19.110 7.023 -30.336 749 HD21 LEU 100 3HD2 LEU 100 -17.436 5.986 -29.452 750 HD22 LEU 100 1HD2 LEU 100 -18.049 5.989 -27.798 751 HD23 LEU 100 2HD2 LEU 100 -16.431 6.603 -28.140 752 H VAL 101 H VAL 101 -14.987 11.483 -27.514 753 HA VAL 101 HA VAL 101 -12.950 9.780 -26.381 754 HB VAL 101 HB VAL 101 -11.445 11.705 -26.720 755 HG11 VAL 101 1HG1 VAL 101 -12.644 11.795 -29.327 756 HG12 VAL 101 2HG1 VAL 101 -11.174 10.973 -28.800 757 HG13 VAL 101 3HG1 VAL 101 -12.734 10.160 -28.673 758 HG21 VAL 101 3HG2 VAL 101 -12.757 13.519 -28.242 759 HG22 VAL 101 1HG2 VAL 101 -14.013 13.091 -27.080 760 HG23 VAL 101 2HG2 VAL 101 -12.459 13.706 -26.514 761 H ILE 102 H ILE 102 -14.832 12.586 -25.394 762 HA ILE 102 HA ILE 102 -13.410 13.167 -23.026 763 HB ILE 102 HB ILE 102 -15.369 14.439 -22.335 764 HG12 ILE 102 2HG1 ILE 102 -17.230 14.370 -24.295 765 HG13 ILE 102 3HG1 ILE 102 -16.692 12.695 -24.330 766 HG21 ILE 102 1HG2 ILE 102 -13.982 15.596 -23.844 767 HG22 ILE 102 2HG2 ILE 102 -14.570 14.666 -25.221 768 HG23 ILE 102 3HG2 ILE 102 -15.624 15.841 -24.437 769 HD11 ILE 102 3HD1 ILE 102 -17.030 13.036 -21.682 770 HD12 ILE 102 1HD1 ILE 102 -18.253 14.141 -22.309 771 HD13 ILE 102 2HD1 ILE 102 -18.281 12.439 -22.772 772 H ARG 103 H ARG 103 -15.642 10.681 -23.828 773 HA ARG 103 HA ARG 103 -16.213 10.082 -21.026 774 HB2 ARG 103 2HB ARG 103 -17.682 8.291 -22.009 775 HB3 ARG 103 3HB ARG 103 -18.129 9.937 -22.438 776 HG2 ARG 103 2HG ARG 103 -17.106 9.683 -24.616 777 HG3 ARG 103 3HG ARG 103 -16.551 8.063 -24.189 778 HD2 ARG 103 2HD ARG 103 -19.443 8.911 -24.267 779 HD3 ARG 103 3HD ARG 103 -18.609 8.098 -25.591 780 HE ARG 103 HE ARG 103 -18.593 6.126 -24.349 781 HH11 ARG 103 1HH1 ARG 103 -19.958 8.764 -22.533 782 HH12 ARG 103 2HH1 ARG 103 -20.650 7.741 -21.318 783 HH21 ARG 103 1HH2 ARG 103 -19.499 4.769 -22.755 784 HH22 ARG 103 2HH2 ARG 103 -20.387 5.469 -21.444 785 H THR 104 H THR 104 -14.109 9.151 -23.552 786 HA THR 104 HA THR 104 -13.619 6.470 -23.024 787 HB THR 104 HB THR 104 -11.498 8.480 -23.791 788 HG1 THR 104 HG1 THR 104 -13.535 7.224 -25.318 789 HG21 THR 104 3HG2 THR 104 -10.418 6.624 -24.873 790 HG22 THR 104 1HG2 THR 104 -11.775 5.560 -24.505 791 HG23 THR 104 2HG2 THR 104 -10.755 6.172 -23.202 792 H VAL 105 H VAL 105 -11.695 9.223 -21.809 793 HA VAL 105 HA VAL 105 -10.239 7.681 -19.944 794 HB VAL 105 HB VAL 105 -10.759 10.653 -19.818 795 HG11 VAL 105 1HG1 VAL 105 -8.160 9.642 -18.980 796 HG12 VAL 105 2HG1 VAL 105 -9.259 10.757 -18.166 797 HG13 VAL 105 3HG1 VAL 105 -9.491 9.015 -18.008 798 HG21 VAL 105 3HG2 VAL 105 -9.371 9.112 -21.793 799 HG22 VAL 105 1HG2 VAL 105 -9.612 10.857 -21.709 800 HG23 VAL 105 2HG2 VAL 105 -8.221 10.120 -20.915 801 H ILE 106 H ILE 106 -13.238 9.500 -19.721 802 HA ILE 106 HA ILE 106 -13.543 9.595 -16.957 803 HB ILE 106 HB ILE 106 -15.535 9.485 -19.200 804 HG12 ILE 106 2HG1 ILE 106 -14.513 11.568 -17.286 805 HG13 ILE 106 3HG1 ILE 106 -14.518 11.600 -19.046 806 HG21 ILE 106 1HG2 ILE 106 -16.164 9.629 -16.255 807 HG22 ILE 106 2HG2 ILE 106 -17.316 9.921 -17.556 808 HG23 ILE 106 3HG2 ILE 106 -16.596 8.323 -17.359 809 HD11 ILE 106 3HD1 ILE 106 -16.160 13.128 -18.357 810 HD12 ILE 106 1HD1 ILE 106 -17.037 11.698 -18.900 811 HD13 ILE 106 2HD1 ILE 106 -16.826 12.002 -17.175 812 H ALA 107 H ALA 107 -13.669 6.912 -19.086 813 HA ALA 107 HA ALA 107 -15.403 5.132 -17.959 814 HB1 ALA 107 1HB ALA 107 -12.699 4.744 -19.186 815 HB2 ALA 107 2HB ALA 107 -13.620 3.372 -18.569 816 HB3 ALA 107 3HB ALA 107 -14.290 4.377 -19.854 817 H GLY 108 H GLY 108 -12.513 6.411 -16.557 818 HA2 GLY 108 2HA GLY 108 -12.500 4.373 -14.451 819 HA3 GLY 108 3HA GLY 108 -11.260 5.588 -14.721 820 H TYR 109 H TYR 109 -13.198 7.770 -14.948 821 HA TYR 109 HA TYR 109 -13.195 8.709 -12.350 822 HB2 TYR 109 2HB TYR 109 -13.571 10.386 -13.885 823 HB3 TYR 109 3HB TYR 109 -14.718 9.428 -14.814 824 HD1 TYR 109 HD2 TYR 109 -17.064 9.303 -14.147 825 HD2 TYR 109 HD1 TYR 109 -14.288 11.686 -11.975 826 HE1 TYR 109 HE2 TYR 109 -18.931 10.464 -13.047 827 HE2 TYR 109 HE1 TYR 109 -16.149 12.854 -10.867 828 HH TYR 109 HH TYR 109 -19.515 12.181 -11.732 829 H ASN 110 H ASN 110 -15.797 7.035 -14.086 830 HA ASN 110 HA ASN 110 -17.826 7.208 -12.234 831 HB2 ASN 110 2HB ASN 110 -17.463 5.868 -14.598 832 HB3 ASN 110 3HB ASN 110 -17.578 4.541 -13.445 833 HD21 ASN 110 1HD2 ASN 110 -19.176 7.623 -14.180 834 HD22 ASN 110 2HD2 ASN 110 -20.785 7.041 -13.938 835 H LEU 111 H LEU 111 -14.881 5.418 -12.039 836 HA LEU 111 HA LEU 111 -15.804 3.695 -9.902 837 HB2 LEU 111 2HB LEU 111 -13.750 3.586 -11.770 838 HB3 LEU 111 3HB LEU 111 -12.929 3.848 -10.233 839 HG LEU 111 HG LEU 111 -14.974 1.703 -10.317 840 HD11 LEU 111 1HD1 LEU 111 -14.087 0.647 -12.058 841 HD12 LEU 111 2HD1 LEU 111 -12.626 0.436 -11.093 842 HD13 LEU 111 3HD1 LEU 111 -12.771 1.816 -12.182 843 HD21 LEU 111 3HD2 LEU 111 -12.932 0.634 -9.062 844 HD22 LEU 111 1HD2 LEU 111 -13.968 1.815 -8.260 845 HD23 LEU 111 2HD2 LEU 111 -12.411 2.313 -8.923 846 H TYR 112 H TYR 112 -13.941 6.639 -10.287 847 HA TYR 112 HA TYR 112 -12.617 6.939 -7.947 848 HB2 TYR 112 2HB TYR 112 -13.373 8.639 -9.970 849 HB3 TYR 112 3HB TYR 112 -14.198 9.329 -8.576 850 HD1 TYR 112 HD2 TYR 112 -12.418 9.044 -6.377 851 HD2 TYR 112 HD1 TYR 112 -11.465 9.839 -10.447 852 HE1 TYR 112 HE2 TYR 112 -10.326 10.126 -5.670 853 HE2 TYR 112 HE1 TYR 112 -9.369 10.922 -9.751 854 HH TYR 112 HH TYR 112 -8.178 10.718 -6.529 855 H ARG 113 H ARG 113 -16.071 7.663 -8.413 856 HA ARG 113 HA ARG 113 -16.468 8.147 -5.600 857 HB2 ARG 113 2HB ARG 113 -17.961 8.538 -8.048 858 HB3 ARG 113 3HB ARG 113 -18.970 7.807 -6.808 859 HG2 ARG 113 2HG ARG 113 -17.853 9.729 -5.340 860 HG3 ARG 113 3HG ARG 113 -17.755 10.497 -6.926 861 HD2 ARG 113 2HD ARG 113 -19.930 10.960 -6.904 862 HD3 ARG 113 3HD ARG 113 -20.334 9.280 -6.554 863 HE ARG 113 HE ARG 113 -20.174 11.459 -4.676 864 HH11 ARG 113 1HH1 ARG 113 -20.096 8.004 -5.098 865 HH12 ARG 113 2HH1 ARG 113 -20.569 7.663 -3.467 866 HH21 ARG 113 1HH2 ARG 113 -20.796 11.023 -2.525 867 HH22 ARG 113 2HH2 ARG 113 -20.968 9.381 -2.004 868 H ALA 114 H ALA 114 -16.722 5.466 -7.774 869 HA ALA 114 HA ALA 114 -18.553 3.812 -6.556 870 HB1 ALA 114 1HB ALA 114 -17.430 1.968 -7.581 871 HB2 ALA 114 2HB ALA 114 -17.317 3.348 -8.674 872 HB3 ALA 114 3HB ALA 114 -15.925 2.880 -7.698 873 H ILE 115 H ILE 115 -15.215 4.449 -5.619 874 HA ILE 115 HA ILE 115 -15.289 2.502 -3.481 875 HB ILE 115 HB ILE 115 -13.203 4.589 -4.127 876 HG12 ILE 115 2HG1 ILE 115 -13.438 2.959 -5.924 877 HG13 ILE 115 3HG1 ILE 115 -11.933 2.680 -5.055 878 HG21 ILE 115 1HG2 ILE 115 -13.524 2.731 -1.909 879 HG22 ILE 115 2HG2 ILE 115 -11.981 2.551 -2.742 880 HG23 ILE 115 3HG2 ILE 115 -12.448 4.117 -2.079 881 HD11 ILE 115 3HD1 ILE 115 -14.124 0.899 -5.519 882 HD12 ILE 115 1HD1 ILE 115 -12.531 0.565 -4.840 883 HD13 ILE 115 2HD1 ILE 115 -13.847 1.087 -3.788 884 H LYS 116 H LYS 116 -16.061 5.812 -3.912 885 HA LYS 116 HA LYS 116 -15.684 6.631 -1.193 886 HB2 LYS 116 2HB LYS 116 -15.639 8.481 -2.538 887 HB3 LYS 116 3HB LYS 116 -16.820 7.825 -3.664 888 HG2 LYS 116 2HG LYS 116 -18.617 8.537 -2.402 889 HG3 LYS 116 3HG LYS 116 -17.668 8.630 -0.916 890 HD2 LYS 116 2HD LYS 116 -16.840 10.405 -3.134 891 HD3 LYS 116 3HD LYS 116 -18.372 10.786 -2.345 892 HE2 LYS 116 2HE LYS 116 -17.226 11.783 -0.724 893 HE3 LYS 116 3HE LYS 116 -16.566 10.210 -0.280 894 HZ1 LYS 116 3HZ LYS 116 -14.630 11.243 -0.711 895 HZ2 LYS 116 1HZ LYS 116 -15.326 12.397 -1.734 896 HZ3 LYS 116 2HZ LYS 116 -14.984 10.847 -2.317 897 H LYS 117 H LYS 117 -18.265 5.198 -3.041 898 HA LYS 117 HA LYS 117 -20.261 5.692 -1.003 899 HB2 LYS 117 2HB LYS 117 -21.744 4.366 -2.469 900 HB3 LYS 117 3HB LYS 117 -20.962 5.687 -3.327 901 HG2 LYS 117 2HG LYS 117 -19.328 4.108 -4.249 902 HG3 LYS 117 3HG LYS 117 -20.150 2.788 -3.413 903 HD2 LYS 117 2HD LYS 117 -22.254 3.680 -4.677 904 HD3 LYS 117 3HD LYS 117 -21.060 4.417 -5.748 905 HE2 LYS 117 2HE LYS 117 -20.014 2.142 -5.972 906 HE3 LYS 117 3HE LYS 117 -21.407 1.493 -5.109 907 HZ1 LYS 117 3HZ LYS 117 -22.013 3.193 -7.381 908 HZ2 LYS 117 1HZ LYS 117 -22.737 1.746 -6.887 909 HZ3 LYS 117 2HZ LYS 117 -21.286 1.713 -7.756 910 H LYS 118 H LYS 118 -18.318 2.990 -2.176 911 HA LYS 118 HA LYS 118 -17.886 0.925 -1.326 912 HB2 LYS 118 2HB LYS 118 -16.964 2.102 0.546 913 HB3 LYS 118 3HB LYS 118 -18.561 2.408 1.215 914 HG2 LYS 118 2HG LYS 118 -17.440 0.667 2.462 915 HG3 LYS 118 3HG LYS 118 -18.846 0.010 1.620 916 HD2 LYS 118 2HD LYS 118 -17.588 -1.382 0.398 917 HD3 LYS 118 3HD LYS 118 -16.404 -0.125 0.035 918 HE2 LYS 118 2HE LYS 118 -15.557 -0.456 2.409 919 HE3 LYS 118 3HE LYS 118 -16.547 -1.915 2.448 920 HZ1 LYS 118 3HZ LYS 118 -14.285 -2.432 1.820 921 HZ2 LYS 118 1HZ LYS 118 -14.356 -1.347 0.524 922 HZ3 LYS 118 2HZ LYS 118 -15.323 -2.734 0.518 Start of MODEL 10 1 H1 VAL 1 H VAL 1 -1.578 1.537 1.691 2 HA VAL 1 HA VAL 1 -0.747 2.777 -0.090 3 HB VAL 1 HB VAL 1 1.600 2.146 -0.552 4 HG11 VAL 1 1HG1 VAL 1 0.503 3.022 1.803 5 HG12 VAL 1 2HG1 VAL 1 1.531 1.688 2.329 6 HG13 VAL 1 3HG1 VAL 1 2.221 3.025 1.409 7 HG21 VAL 1 3HG2 VAL 1 2.564 0.183 0.552 8 HG22 VAL 1 1HG2 VAL 1 0.959 -0.287 1.114 9 HG23 VAL 1 2HG2 VAL 1 1.322 -0.278 -0.612 10 H TRP 2 H TRP 2 -1.115 -0.629 -0.692 11 HA TRP 2 HA TRP 2 -0.325 -1.145 -3.180 12 HB2 TRP 2 2HB TRP 2 -2.498 -2.393 -3.544 13 HB3 TRP 2 3HB TRP 2 -1.646 -2.774 -2.050 14 HD1 TRP 2 HD1 TRP 2 -4.853 -1.187 -3.349 15 HE1 TRP 2 HE1 TRP 2 -6.459 -0.813 -1.373 16 HE3 TRP 2 HE3 TRP 2 -1.681 -2.311 0.499 17 HZ2 TRP 2 HZ2 TRP 2 -6.391 -0.974 1.444 18 HZ3 TRP 2 HZ3 TRP 2 -2.529 -2.176 2.805 19 HH2 TRP 2 HH2 TRP 2 -4.836 -1.520 3.265 20 HA PRO 3 HA PRO 3 -1.939 2.315 -5.527 21 HB2 PRO 3 2HB PRO 3 -0.615 1.693 -7.814 22 HB3 PRO 3 3HB PRO 3 0.160 2.497 -6.443 23 HG2 PRO 3 2HG PRO 3 0.213 -0.393 -7.222 24 HG3 PRO 3 3HG PRO 3 1.540 0.637 -6.656 25 HD2 PRO 3 2HD PRO 3 0.258 -1.109 -5.032 26 HD3 PRO 3 3HD PRO 3 0.930 0.426 -4.444 27 H LEU 4 H LEU 4 -3.857 0.518 -5.162 28 HA LEU 4 HA LEU 4 -4.558 -0.703 -7.715 29 HB2 LEU 4 2HB LEU 4 -5.886 -0.780 -5.012 30 HB3 LEU 4 3HB LEU 4 -6.504 -1.601 -6.444 31 HG LEU 4 HG LEU 4 -3.929 -2.188 -4.987 32 HD11 LEU 4 1HD1 LEU 4 -5.187 -3.565 -3.789 33 HD12 LEU 4 2HD1 LEU 4 -5.554 -4.457 -5.265 34 HD13 LEU 4 3HD1 LEU 4 -6.617 -3.153 -4.735 35 HD21 LEU 4 3HD2 LEU 4 -3.908 -4.149 -6.635 36 HD22 LEU 4 1HD2 LEU 4 -3.398 -2.568 -7.230 37 HD23 LEU 4 2HD2 LEU 4 -5.011 -3.173 -7.607 38 H VAL 5 H VAL 5 -5.312 2.061 -5.788 39 HA VAL 5 HA VAL 5 -7.759 2.641 -7.254 40 HB VAL 5 HB VAL 5 -7.907 4.641 -5.824 41 HG11 VAL 5 1HG1 VAL 5 -8.393 2.070 -5.126 42 HG12 VAL 5 2HG1 VAL 5 -7.325 2.575 -3.815 43 HG13 VAL 5 3HG1 VAL 5 -8.815 3.465 -4.134 44 HG21 VAL 5 3HG2 VAL 5 -5.640 5.235 -5.481 45 HG22 VAL 5 1HG2 VAL 5 -6.276 4.782 -3.900 46 HG23 VAL 5 2HG2 VAL 5 -5.255 3.656 -4.795 47 H ILE 6 H ILE 6 -4.481 3.922 -6.895 48 HA ILE 6 HA ILE 6 -4.688 6.234 -8.396 49 HB ILE 6 HB ILE 6 -2.267 5.910 -8.943 50 HG12 ILE 6 2HG1 ILE 6 -1.467 3.850 -7.323 51 HG13 ILE 6 3HG1 ILE 6 -2.941 3.197 -8.028 52 HG21 ILE 6 1HG2 ILE 6 -3.028 6.996 -6.871 53 HG22 ILE 6 2HG2 ILE 6 -3.004 5.431 -6.059 54 HG23 ILE 6 3HG2 ILE 6 -1.502 6.138 -6.654 55 HD11 ILE 6 3HD1 ILE 6 -1.793 4.130 -10.245 56 HD12 ILE 6 1HD1 ILE 6 -0.347 3.816 -9.286 57 HD13 ILE 6 2HD1 ILE 6 -1.491 2.513 -9.610 58 H ARG 7 H ARG 7 -4.128 2.917 -9.500 59 HA ARG 7 HA ARG 7 -3.626 3.420 -12.187 60 HB2 ARG 7 2HB ARG 7 -4.560 1.108 -12.564 61 HB3 ARG 7 3HB ARG 7 -3.289 1.217 -11.353 62 HG2 ARG 7 2HG ARG 7 -4.967 1.164 -9.580 63 HG3 ARG 7 3HG ARG 7 -6.244 1.061 -10.794 64 HD2 ARG 7 2HD ARG 7 -4.021 -0.942 -10.759 65 HD3 ARG 7 3HD ARG 7 -5.383 -1.105 -9.651 66 HE ARG 7 HE ARG 7 -6.198 -0.725 -12.369 67 HH11 ARG 7 1HH1 ARG 7 -5.131 -3.074 -10.032 68 HH12 ARG 7 2HH1 ARG 7 -5.888 -4.409 -10.835 69 HH21 ARG 7 1HH2 ARG 7 -7.199 -2.475 -13.436 70 HH22 ARG 7 2HH2 ARG 7 -7.063 -4.068 -12.771 71 H THR 8 H THR 8 -6.711 3.046 -10.495 72 HA THR 8 HA THR 8 -8.471 2.970 -12.607 73 HB THR 8 HB THR 8 -9.114 4.695 -10.241 74 HG1 THR 8 HG1 THR 8 -9.635 2.532 -9.243 75 HG21 THR 8 3HG2 THR 8 -10.554 3.293 -12.308 76 HG22 THR 8 1HG2 THR 8 -11.148 4.461 -11.127 77 HG23 THR 8 2HG2 THR 8 -11.071 2.748 -10.712 78 H VAL 9 H VAL 9 -6.804 5.759 -11.250 79 HA VAL 9 HA VAL 9 -8.236 7.691 -12.800 80 HB VAL 9 HB VAL 9 -5.509 8.187 -11.650 81 HG11 VAL 9 1HG1 VAL 9 -7.817 10.048 -11.431 82 HG12 VAL 9 2HG1 VAL 9 -6.100 10.393 -11.651 83 HG13 VAL 9 3HG1 VAL 9 -7.070 9.830 -13.013 84 HG21 VAL 9 3HG2 VAL 9 -6.724 8.789 -9.511 85 HG22 VAL 9 1HG2 VAL 9 -8.093 7.875 -10.142 86 HG23 VAL 9 2HG2 VAL 9 -6.554 7.067 -9.849 87 H ILE 10 H ILE 10 -5.083 6.100 -13.079 88 HA ILE 10 HA ILE 10 -4.196 7.516 -15.350 89 HB ILE 10 HB ILE 10 -3.416 4.675 -14.751 90 HG12 ILE 10 2HG1 ILE 10 -2.689 7.196 -13.279 91 HG13 ILE 10 3HG1 ILE 10 -3.210 5.649 -12.619 92 HG21 ILE 10 1HG2 ILE 10 -2.044 7.031 -16.021 93 HG22 ILE 10 2HG2 ILE 10 -1.191 5.567 -15.536 94 HG23 ILE 10 3HG2 ILE 10 -2.458 5.485 -16.759 95 HD11 ILE 10 3HD1 ILE 10 -0.967 5.664 -12.128 96 HD12 ILE 10 1HD1 ILE 10 -0.999 4.766 -13.645 97 HD13 ILE 10 2HD1 ILE 10 -0.532 6.467 -13.637 98 H ALA 11 H ALA 11 -6.603 5.152 -14.986 99 HA ALA 11 HA ALA 11 -6.544 3.634 -17.264 100 HB1 ALA 11 1HB ALA 11 -9.059 3.681 -17.152 101 HB2 ALA 11 2HB ALA 11 -8.239 3.231 -15.656 102 HB3 ALA 11 3HB ALA 11 -8.900 4.855 -15.845 103 H GLY 12 H GLY 12 -7.082 7.041 -17.003 104 HA2 GLY 12 2HA GLY 12 -8.115 7.217 -19.736 105 HA3 GLY 12 3HA GLY 12 -8.003 8.538 -18.582 106 H TYR 13 H TYR 13 -5.191 7.774 -17.932 107 HA TYR 13 HA TYR 13 -3.815 9.577 -19.456 108 HB2 TYR 13 2HB TYR 13 -3.129 8.048 -17.378 109 HB3 TYR 13 3HB TYR 13 -2.321 7.132 -18.645 110 HD1 TYR 13 HD2 TYR 13 -1.752 9.671 -20.368 111 HD2 TYR 13 HD1 TYR 13 -1.079 8.696 -16.281 112 HE1 TYR 13 HE2 TYR 13 0.135 11.248 -20.308 113 HE2 TYR 13 HE1 TYR 13 0.808 10.271 -16.210 114 HH TYR 13 HH TYR 13 2.260 11.467 -17.536 115 H ASN 14 H ASN 14 -4.009 6.070 -20.035 116 HA ASN 14 HA ASN 14 -2.411 5.825 -22.242 117 HB2 ASN 14 2HB ASN 14 -4.096 4.152 -20.934 118 HB3 ASN 14 3HB ASN 14 -4.985 4.381 -22.437 119 HD21 ASN 14 1HD2 ASN 14 -4.106 3.648 -24.365 120 HD22 ASN 14 2HD2 ASN 14 -2.788 2.532 -24.410 121 H LEU 15 H LEU 15 -5.468 7.423 -22.009 122 HA LEU 15 HA LEU 15 -5.758 7.587 -24.909 123 HB2 LEU 15 2HB LEU 15 -7.645 7.224 -23.130 124 HB3 LEU 15 3HB LEU 15 -7.562 8.978 -22.981 125 HG LEU 15 HG LEU 15 -9.359 8.222 -24.488 126 HD11 LEU 15 1HD1 LEU 15 -7.594 9.515 -26.419 127 HD12 LEU 15 2HD1 LEU 15 -7.609 10.295 -24.838 128 HD13 LEU 15 3HD1 LEU 15 -9.117 10.067 -25.723 129 HD21 LEU 15 3HD2 LEU 15 -7.551 7.536 -26.679 130 HD22 LEU 15 1HD2 LEU 15 -9.062 6.781 -26.173 131 HD23 LEU 15 2HD2 LEU 15 -7.553 6.364 -25.361 132 H TYR 16 H TYR 16 -4.928 9.558 -22.141 133 HA TYR 16 HA TYR 16 -5.177 12.115 -22.991 134 HB2 TYR 16 2HB TYR 16 -3.026 10.752 -21.416 135 HB3 TYR 16 3HB TYR 16 -2.837 12.449 -21.844 136 HD1 TYR 16 HD2 TYR 16 -5.986 10.689 -20.964 137 HD2 TYR 16 HD1 TYR 16 -3.031 13.501 -19.753 138 HE1 TYR 16 HE2 TYR 16 -7.386 11.326 -19.044 139 HE2 TYR 16 HE1 TYR 16 -4.423 14.144 -17.829 140 HH TYR 16 HH TYR 16 -6.252 13.664 -16.638 141 H ARG 17 H ARG 17 -2.428 9.995 -23.787 142 HA ARG 17 HA ARG 17 -1.354 11.916 -25.652 143 HB2 ARG 17 2HB ARG 17 -0.552 9.209 -24.673 144 HB3 ARG 17 3HB ARG 17 0.135 9.800 -26.181 145 HG2 ARG 17 2HG ARG 17 0.866 11.848 -24.938 146 HG3 ARG 17 3HG ARG 17 0.363 11.039 -23.452 147 HD2 ARG 17 2HD ARG 17 2.254 9.874 -23.382 148 HD3 ARG 17 3HD ARG 17 2.005 9.287 -25.025 149 HE ARG 17 HE ARG 17 2.933 11.786 -25.421 150 HH11 ARG 17 1HH1 ARG 17 4.065 9.118 -23.493 151 HH12 ARG 17 2HH1 ARG 17 5.735 9.558 -23.630 152 HH21 ARG 17 1HH2 ARG 17 5.128 12.376 -25.609 153 HH22 ARG 17 2HH2 ARG 17 6.339 11.412 -24.833 154 H ALA 18 H ALA 18 -3.476 9.191 -25.749 155 HA ALA 18 HA ALA 18 -3.227 8.261 -28.330 156 HB1 ALA 18 1HB ALA 18 -5.501 7.508 -28.173 157 HB2 ALA 18 2HB ALA 18 -4.738 7.333 -26.592 158 HB3 ALA 18 3HB ALA 18 -5.844 8.673 -26.894 159 H ILE 19 H ILE 19 -4.935 11.137 -27.190 160 HA ILE 19 HA ILE 19 -5.986 11.795 -29.777 161 HB ILE 19 HB ILE 19 -5.754 13.486 -27.284 162 HG12 ILE 19 2HG1 ILE 19 -7.180 11.527 -26.969 163 HG13 ILE 19 3HG1 ILE 19 -8.156 12.990 -27.024 164 HG21 ILE 19 1HG2 ILE 19 -6.641 14.089 -30.001 165 HG22 ILE 19 2HG2 ILE 19 -7.823 14.499 -28.759 166 HG23 ILE 19 3HG2 ILE 19 -6.196 15.175 -28.684 167 HD11 ILE 19 3HD1 ILE 19 -7.993 12.035 -29.661 168 HD12 ILE 19 1HD1 ILE 19 -8.332 10.644 -28.631 169 HD13 ILE 19 2HD1 ILE 19 -9.395 12.051 -28.591 170 H LYS 20 H LYS 20 -3.021 12.329 -28.123 171 HA LYS 20 HA LYS 20 -2.230 14.654 -29.614 172 HB2 LYS 20 2HB LYS 20 -0.768 12.765 -27.778 173 HB3 LYS 20 3HB LYS 20 0.060 14.060 -28.632 174 HG2 LYS 20 2HG LYS 20 -2.197 14.388 -26.665 175 HG3 LYS 20 3HG LYS 20 -0.490 14.732 -26.371 176 HD2 LYS 20 2HD LYS 20 -2.323 16.135 -28.314 177 HD3 LYS 20 3HD LYS 20 -1.633 16.799 -26.832 178 HE2 LYS 20 2HE LYS 20 -0.123 17.653 -28.288 179 HE3 LYS 20 3HE LYS 20 0.625 16.072 -28.066 180 HZ1 LYS 20 3HZ LYS 20 -1.371 16.458 -30.194 181 HZ2 LYS 20 1HZ LYS 20 -0.099 15.344 -30.108 182 HZ3 LYS 20 2HZ LYS 20 0.222 16.971 -30.439 183 H LYS 21 H LYS 21 -2.063 11.227 -30.046 184 HA LYS 21 HA LYS 21 -0.002 11.343 -32.070 185 HB2 LYS 21 2HB LYS 21 0.135 9.308 -31.024 186 HB3 LYS 21 3HB LYS 21 -1.600 9.208 -30.753 187 HG2 LYS 21 2HG LYS 21 -2.011 8.300 -32.815 188 HG3 LYS 21 3HG LYS 21 -0.568 9.013 -33.539 189 HD2 LYS 21 2HD LYS 21 -0.179 6.672 -33.358 190 HD3 LYS 21 3HD LYS 21 0.795 7.457 -32.113 191 HE2 LYS 21 2HE LYS 21 -1.883 6.744 -31.205 192 HE3 LYS 21 3HE LYS 21 -0.935 5.352 -31.727 193 HZ1 LYS 21 3HZ LYS 21 -0.092 7.368 -29.715 194 HZ2 LYS 21 1HZ LYS 21 0.831 6.044 -30.224 195 HZ3 LYS 21 2HZ LYS 21 -0.614 5.794 -29.381 196 H LYS 22 H LYS 22 -3.508 10.977 -31.929 197 HA LYS 22 HA LYS 22 -5.128 11.045 -33.528 198 HB2 LYS 22 2HB LYS 22 -4.129 13.338 -33.728 199 HB3 LYS 22 3HB LYS 22 -3.135 12.735 -35.047 200 HG2 LYS 22 2HG LYS 22 -5.103 12.258 -36.363 201 HG3 LYS 22 3HG LYS 22 -6.146 12.742 -35.024 202 HD2 LYS 22 2HD LYS 22 -5.236 15.015 -35.145 203 HD3 LYS 22 3HD LYS 22 -4.202 14.527 -36.490 204 HE2 LYS 22 2HE LYS 22 -6.365 13.833 -37.662 205 HE3 LYS 22 3HE LYS 22 -7.197 14.757 -36.412 206 HZ1 LYS 22 3HZ LYS 22 -6.759 16.031 -38.466 207 HZ2 LYS 22 1HZ LYS 22 -5.098 15.873 -38.190 208 HZ3 LYS 22 2HZ LYS 22 -6.060 16.729 -37.094 209 H GLY 23 H GLY 23 -4.768 8.751 -33.931 210 HA2 GLY 23 2HA GLY 23 -4.634 8.137 -36.658 211 HA3 GLY 23 3HA GLY 23 -3.060 7.790 -35.958 212 H GLY 24 H GLY 24 -2.878 6.155 -34.360 213 HA2 GLY 24 2HA GLY 24 -5.227 4.374 -34.184 214 HA3 GLY 24 3HA GLY 24 -3.628 3.746 -34.551 215 H GLY 25 H GLY 25 -2.967 2.617 -32.841 216 HA2 GLY 25 2HA GLY 25 -2.913 3.986 -30.245 217 HA3 GLY 25 3HA GLY 25 -3.667 2.401 -30.337 218 H GLY 26 H GLY 26 -2.074 1.728 -28.766 219 HA2 GLY 26 2HA GLY 26 -0.121 0.095 -29.582 220 HA3 GLY 26 3HA GLY 26 0.701 1.647 -29.631 221 H GLY 27 H GLY 27 2.123 1.432 -27.980 222 HA2 GLY 27 2HA GLY 27 1.439 0.222 -25.483 223 HA3 GLY 27 3HA GLY 27 2.912 1.112 -25.839 224 H GLY 28 H GLY 28 2.792 2.086 -23.759 225 HA2 GLY 28 2HA GLY 28 1.115 4.472 -23.767 226 HA3 GLY 28 3HA GLY 28 0.882 3.361 -22.425 227 H GLY 29 H GLY 29 1.694 6.018 -22.084 228 HA2 GLY 29 2HA GLY 29 3.895 5.700 -20.369 229 HA3 GLY 29 3HA GLY 29 4.474 6.376 -21.885 230 H GLY 30 H GLY 30 4.851 7.854 -19.678 231 HA2 GLY 30 2HA GLY 30 3.073 10.122 -20.178 232 HA3 GLY 30 3HA GLY 30 3.173 9.530 -18.527 233 H GLY 31 H GLY 31 4.298 11.844 -20.529 234 HA2 GLY 31 2HA GLY 31 5.862 13.375 -19.262 235 HA3 GLY 31 3HA GLY 31 6.922 11.976 -19.181 236 H GLY 32 H GLY 32 6.273 14.776 -20.838 237 HA2 GLY 32 2HA GLY 32 8.249 14.202 -22.827 238 HA3 GLY 32 3HA GLY 32 6.631 14.261 -23.512 239 H VAL 33 H VAL 33 8.131 16.034 -24.608 240 HA VAL 33 HA VAL 33 7.553 18.568 -23.214 241 HB VAL 33 HB VAL 33 9.493 19.510 -24.562 242 HG11 VAL 33 1HG1 VAL 33 10.874 19.235 -22.778 243 HG12 VAL 33 2HG1 VAL 33 9.391 18.603 -22.060 244 HG13 VAL 33 3HG1 VAL 33 10.606 17.494 -22.697 245 HG21 VAL 33 3HG2 VAL 33 10.731 18.212 -25.889 246 HG22 VAL 33 1HG2 VAL 33 10.868 16.958 -24.657 247 HG23 VAL 33 2HG2 VAL 33 9.464 16.996 -25.724 248 H TRP 34 H TRP 34 5.476 18.337 -24.384 249 HA TRP 34 HA TRP 34 5.319 20.047 -26.568 250 HB2 TRP 34 2HB TRP 34 6.164 18.616 -28.146 251 HB3 TRP 34 3HB TRP 34 5.667 17.176 -27.262 252 HD1 TRP 34 HD1 TRP 34 4.045 15.865 -28.735 253 HE1 TRP 34 HE1 TRP 34 2.033 16.436 -30.234 254 HE3 TRP 34 HE3 TRP 34 4.151 20.960 -28.328 255 HZ2 TRP 34 HZ2 TRP 34 0.671 18.742 -31.127 256 HZ3 TRP 34 HZ3 TRP 34 2.458 22.275 -29.536 257 HH2 TRP 34 HH2 TRP 34 0.755 21.187 -30.907 258 HA PRO 35 HA PRO 35 1.062 17.829 -26.024 259 HB2 PRO 35 2HB PRO 35 0.980 15.676 -24.373 260 HB3 PRO 35 3HB PRO 35 1.316 15.547 -26.104 261 HG2 PRO 35 2HG PRO 35 3.226 15.548 -23.799 262 HG3 PRO 35 3HG PRO 35 3.218 14.521 -25.245 263 HD2 PRO 35 2HD PRO 35 4.853 16.664 -24.989 264 HD3 PRO 35 3HD PRO 35 4.200 16.143 -26.556 265 H LEU 36 H LEU 36 0.411 19.596 -24.860 266 HA LEU 36 HA LEU 36 0.994 19.761 -22.016 267 HB2 LEU 36 2HB LEU 36 -0.632 21.622 -23.740 268 HB3 LEU 36 3HB LEU 36 -0.041 21.941 -22.110 269 HG LEU 36 HG LEU 36 2.199 21.331 -23.748 270 HD11 LEU 36 1HD1 LEU 36 0.746 23.676 -24.888 271 HD12 LEU 36 2HD1 LEU 36 0.434 22.059 -25.519 272 HD13 LEU 36 3HD1 LEU 36 2.065 22.727 -25.574 273 HD21 LEU 36 3HD2 LEU 36 1.901 22.812 -21.671 274 HD22 LEU 36 1HD2 LEU 36 1.401 24.065 -22.808 275 HD23 LEU 36 2HD2 LEU 36 3.012 23.357 -22.928 276 H VAL 37 H VAL 37 -1.731 19.201 -24.167 277 HA VAL 37 HA VAL 37 -3.860 19.410 -22.426 278 HB VAL 37 HB VAL 37 -5.018 17.732 -23.828 279 HG11 VAL 37 1HG1 VAL 37 -3.699 19.256 -25.928 280 HG12 VAL 37 2HG1 VAL 37 -5.374 19.302 -25.376 281 HG13 VAL 37 3HG1 VAL 37 -4.141 20.243 -24.536 282 HG21 VAL 37 3HG2 VAL 37 -3.765 16.846 -25.814 283 HG22 VAL 37 1HG2 VAL 37 -2.279 17.388 -25.033 284 HG23 VAL 37 2HG2 VAL 37 -3.281 16.157 -24.264 285 H ILE 38 H ILE 38 -1.575 16.757 -22.810 286 HA ILE 38 HA ILE 38 -2.928 14.884 -21.186 287 HB ILE 38 HB ILE 38 -0.857 13.650 -21.105 288 HG12 ILE 38 2HG1 ILE 38 1.063 14.984 -22.493 289 HG13 ILE 38 3HG1 ILE 38 0.301 16.316 -21.630 290 HG21 ILE 38 1HG2 ILE 38 -1.988 14.690 -23.548 291 HG22 ILE 38 2HG2 ILE 38 -0.290 14.265 -23.759 292 HG23 ILE 38 3HG2 ILE 38 -1.434 13.059 -23.170 293 HD11 ILE 38 3HD1 ILE 38 0.747 14.109 -19.854 294 HD12 ILE 38 1HD1 ILE 38 2.241 14.555 -20.678 295 HD13 ILE 38 2HD1 ILE 38 1.344 15.766 -19.761 296 H ARG 39 H ARG 39 -0.760 17.529 -20.472 297 HA ARG 39 HA ARG 39 -0.477 16.729 -17.691 298 HB2 ARG 39 2HB ARG 39 1.255 18.202 -17.565 299 HB3 ARG 39 3HB ARG 39 1.244 17.979 -19.310 300 HG2 ARG 39 2HG ARG 39 1.281 20.237 -19.263 301 HG3 ARG 39 3HG ARG 39 -0.466 20.011 -19.158 302 HD2 ARG 39 2HD ARG 39 -0.439 21.170 -17.263 303 HD3 ARG 39 3HD ARG 39 0.474 19.852 -16.529 304 HE ARG 39 HE ARG 39 2.347 21.371 -17.823 305 HH11 ARG 39 1HH1 ARG 39 -0.063 21.951 -15.379 306 HH12 ARG 39 2HH1 ARG 39 0.835 23.216 -14.608 307 HH21 ARG 39 1HH2 ARG 39 3.539 23.035 -16.818 308 HH22 ARG 39 2HH2 ARG 39 2.884 23.832 -15.428 309 H THR 40 H THR 40 -2.491 18.719 -19.623 310 HA THR 40 HA THR 40 -3.268 20.667 -17.754 311 HB THR 40 HB THR 40 -5.149 19.539 -19.815 312 HG1 THR 40 HG1 THR 40 -3.161 21.500 -20.348 313 HG21 THR 40 3HG2 THR 40 -4.947 21.969 -18.192 314 HG22 THR 40 1HG2 THR 40 -6.351 21.241 -18.970 315 HG23 THR 40 2HG2 THR 40 -5.265 22.273 -19.899 316 H VAL 41 H VAL 41 -4.994 17.686 -18.697 317 HA VAL 41 HA VAL 41 -6.835 17.875 -16.522 318 HB VAL 41 HB VAL 41 -6.277 15.354 -18.064 319 HG11 VAL 41 1HG1 VAL 41 -7.911 15.624 -16.040 320 HG12 VAL 41 2HG1 VAL 41 -8.967 16.356 -17.249 321 HG13 VAL 41 3HG1 VAL 41 -8.399 14.700 -17.460 322 HG21 VAL 41 3HG2 VAL 41 -8.338 16.545 -19.410 323 HG22 VAL 41 1HG2 VAL 41 -7.275 17.912 -19.072 324 HG23 VAL 41 2HG2 VAL 41 -6.658 16.510 -19.947 325 H ILE 42 H ILE 42 -3.809 16.190 -17.079 326 HA ILE 42 HA ILE 42 -3.925 14.393 -14.923 327 HB ILE 42 HB ILE 42 -1.769 15.485 -16.638 328 HG12 ILE 42 2HG1 ILE 42 -3.257 13.159 -16.521 329 HG13 ILE 42 3HG1 ILE 42 -1.784 13.391 -17.458 330 HG21 ILE 42 1HG2 ILE 42 -1.249 14.234 -13.949 331 HG22 ILE 42 2HG2 ILE 42 -0.045 14.336 -15.233 332 HG23 ILE 42 3HG2 ILE 42 -0.709 15.810 -14.528 333 HD11 ILE 42 3HD1 ILE 42 -1.822 11.340 -16.050 334 HD12 ILE 42 1HD1 ILE 42 -0.456 12.412 -15.746 335 HD13 ILE 42 2HD1 ILE 42 -1.820 12.382 -14.628 336 H ALA 43 H ALA 43 -3.359 17.789 -15.044 337 HA ALA 43 HA ALA 43 -1.789 18.368 -12.898 338 HB1 ALA 43 1HB ALA 43 -3.284 20.383 -12.559 339 HB2 ALA 43 2HB ALA 43 -2.628 20.161 -14.181 340 HB3 ALA 43 3HB ALA 43 -4.302 19.724 -13.840 341 H GLY 44 H GLY 44 -4.944 16.925 -12.848 342 HA2 GLY 44 2HA GLY 44 -5.152 17.290 -9.943 343 HA3 GLY 44 3HA GLY 44 -6.436 16.728 -11.004 344 H TYR 45 H TYR 45 -4.728 14.799 -12.376 345 HA TYR 45 HA TYR 45 -5.248 12.533 -10.853 346 HB2 TYR 45 2HB TYR 45 -3.398 13.049 -13.167 347 HB3 TYR 45 3HB TYR 45 -3.481 11.462 -12.411 348 HD1 TYR 45 HD1 TYR 45 -6.549 13.355 -12.418 349 HD2 TYR 45 HD2 TYR 45 -4.182 10.635 -14.677 350 HE1 TYR 45 HE1 TYR 45 -8.509 12.803 -13.797 351 HE2 TYR 45 HE2 TYR 45 -6.135 10.077 -16.063 352 HH TYR 45 HH TYR 45 -8.305 10.392 -16.399 353 H ASN 46 H ASN 46 -2.176 14.273 -11.285 354 HA ASN 46 HA ASN 46 -0.507 12.666 -9.796 355 HB2 ASN 46 2HB ASN 46 0.253 14.621 -11.094 356 HB3 ASN 46 3HB ASN 46 -0.477 15.691 -9.901 357 HD21 ASN 46 1HD2 ASN 46 1.481 16.658 -9.416 358 HD22 ASN 46 2HD2 ASN 46 2.710 15.852 -8.508 359 H LEU 47 H LEU 47 -3.075 14.695 -8.708 360 HA LEU 47 HA LEU 47 -2.204 14.940 -5.996 361 HB2 LEU 47 2HB LEU 47 -4.093 16.173 -7.521 362 HB3 LEU 47 3HB LEU 47 -5.085 15.111 -6.524 363 HG LEU 47 HG LEU 47 -3.289 16.394 -4.776 364 HD11 LEU 47 1HD1 LEU 47 -2.758 18.143 -6.212 365 HD12 LEU 47 2HD1 LEU 47 -4.098 18.785 -5.264 366 HD13 LEU 47 3HD1 LEU 47 -4.380 18.199 -6.903 367 HD21 LEU 47 3HD2 LEU 47 -6.072 17.374 -5.078 368 HD22 LEU 47 1HD2 LEU 47 -5.193 16.879 -3.631 369 HD23 LEU 47 2HD2 LEU 47 -5.843 15.660 -4.728 370 H TYR 48 H TYR 48 -4.439 12.807 -7.722 371 HA TYR 48 HA TYR 48 -5.583 11.444 -5.624 372 HB2 TYR 48 2HB TYR 48 -5.228 11.016 -8.445 373 HB3 TYR 48 3HB TYR 48 -5.014 9.495 -7.588 374 HD1 TYR 48 HD2 TYR 48 -6.879 9.256 -5.584 375 HD2 TYR 48 HD1 TYR 48 -7.353 11.382 -9.239 376 HE1 TYR 48 HE2 TYR 48 -9.320 9.009 -5.404 377 HE2 TYR 48 HE1 TYR 48 -9.795 11.142 -9.068 378 HH TYR 48 HH TYR 48 -11.286 9.415 -6.343 379 H ARG 49 H ARG 49 -2.431 10.886 -7.132 380 HA ARG 49 HA ARG 49 -1.825 8.624 -5.471 381 HB2 ARG 49 2HB ARG 49 0.115 10.274 -7.092 382 HB3 ARG 49 3HB ARG 49 0.316 8.614 -6.547 383 HG2 ARG 49 2HG ARG 49 -0.497 7.929 -8.485 384 HG3 ARG 49 3HG ARG 49 -2.047 8.655 -8.056 385 HD2 ARG 49 2HD ARG 49 -1.693 9.827 -9.955 386 HD3 ARG 49 3HD ARG 49 -0.739 10.847 -8.879 387 HE ARG 49 HE ARG 49 1.051 9.011 -9.741 388 HH11 ARG 49 1HH1 ARG 49 -1.182 11.128 -11.371 389 HH12 ARG 49 2HH1 ARG 49 -0.195 11.293 -12.785 390 HH21 ARG 49 1HH2 ARG 49 2.359 9.221 -11.597 391 HH22 ARG 49 2HH2 ARG 49 1.819 10.207 -12.913 392 H ALA 50 H ALA 50 -1.486 12.046 -5.230 393 HA ALA 50 HA ALA 50 0.679 12.380 -3.560 394 HB1 ALA 50 1HB ALA 50 -1.716 13.961 -2.867 395 HB2 ALA 50 2HB ALA 50 -0.076 14.487 -3.245 396 HB3 ALA 50 3HB ALA 50 -1.180 14.042 -4.545 397 H ILE 51 H ILE 51 -2.576 11.297 -2.751 398 HA ILE 51 HA ILE 51 -2.005 11.222 0.084 399 HB ILE 51 HB ILE 51 -4.398 10.189 -1.443 400 HG12 ILE 51 2HG1 ILE 51 -4.186 12.606 -1.629 401 HG13 ILE 51 3HG1 ILE 51 -5.518 12.210 -0.549 402 HG21 ILE 51 1HG2 ILE 51 -3.590 9.974 1.349 403 HG22 ILE 51 2HG2 ILE 51 -5.195 10.672 1.137 404 HG23 ILE 51 3HG2 ILE 51 -4.825 9.089 0.454 405 HD11 ILE 51 3HD1 ILE 51 -3.182 13.791 -0.059 406 HD12 ILE 51 1HD1 ILE 51 -4.619 13.573 0.939 407 HD13 ILE 51 2HD1 ILE 51 -3.265 12.452 1.085 408 H LYS 52 H LYS 52 -1.716 9.124 -2.611 409 HA LYS 52 HA LYS 52 -1.813 6.669 -1.109 410 HB2 LYS 52 2HB LYS 52 -1.341 7.443 -3.937 411 HB3 LYS 52 3HB LYS 52 -0.643 5.919 -3.405 412 HG2 LYS 52 2HG LYS 52 -3.394 6.193 -2.551 413 HG3 LYS 52 3HG LYS 52 -3.226 6.338 -4.302 414 HD2 LYS 52 2HD LYS 52 -2.781 4.161 -4.534 415 HD3 LYS 52 3HD LYS 52 -1.615 4.179 -3.208 416 HE2 LYS 52 2HE LYS 52 -4.499 4.345 -2.520 417 HE3 LYS 52 3HE LYS 52 -3.882 2.796 -3.091 418 HZ1 LYS 52 3HZ LYS 52 -3.751 3.718 -0.537 419 HZ2 LYS 52 1HZ LYS 52 -2.189 4.004 -1.122 420 HZ3 LYS 52 2HZ LYS 52 -2.839 2.443 -1.173 421 H LYS 53 H LYS 53 0.556 9.037 -1.873 422 HA LYS 53 HA LYS 53 2.816 7.282 -1.430 423 HB2 LYS 53 2HB LYS 53 2.559 10.245 -1.930 424 HB3 LYS 53 3HB LYS 53 4.100 9.482 -1.561 425 HG2 LYS 53 2HG LYS 53 4.270 8.522 -3.598 426 HG3 LYS 53 3HG LYS 53 2.529 8.270 -3.746 427 HD2 LYS 53 2HD LYS 53 2.290 10.146 -4.926 428 HD3 LYS 53 3HD LYS 53 3.171 11.085 -3.719 429 HE2 LYS 53 2HE LYS 53 5.152 10.900 -4.823 430 HE3 LYS 53 3HE LYS 53 4.760 9.313 -5.484 431 HZ1 LYS 53 3HZ LYS 53 3.005 11.225 -6.566 432 HZ2 LYS 53 1HZ LYS 53 4.146 10.267 -7.368 433 HZ3 LYS 53 2HZ LYS 53 4.591 11.781 -6.758 434 H LYS 54 H LYS 54 1.096 9.840 0.293 435 HA LYS 54 HA LYS 54 2.336 8.915 2.780 436 HB2 LYS 54 2HB LYS 54 2.061 11.847 2.110 437 HB3 LYS 54 3HB LYS 54 2.820 11.147 3.534 438 HG2 LYS 54 2HG LYS 54 4.738 11.384 2.436 439 HG3 LYS 54 3HG LYS 54 4.222 9.998 1.472 440 HD2 LYS 54 2HD LYS 54 3.630 11.291 -0.321 441 HD3 LYS 54 3HD LYS 54 3.255 12.697 0.679 442 HE2 LYS 54 2HE LYS 54 5.651 13.048 1.065 443 HE3 LYS 54 3HE LYS 54 6.015 11.654 0.049 444 HZ1 LYS 54 3HZ LYS 54 6.273 13.548 -1.298 445 HZ2 LYS 54 1HZ LYS 54 4.819 14.235 -0.773 446 HZ3 LYS 54 2HZ LYS 54 4.797 12.866 -1.765 447 H GLY 55 H GLY 55 -0.019 7.998 2.392 448 HA2 GLY 55 2HA GLY 55 -2.079 9.876 3.248 449 HA3 GLY 55 3HA GLY 55 -2.328 8.206 2.759 450 H GLY 56 H GLY 56 -3.729 8.815 4.857 451 HA2 GLY 56 2HA GLY 56 -3.422 7.098 6.816 452 HA3 GLY 56 3HA GLY 56 -2.176 8.248 7.276 453 H GLY 57 H GLY 57 -5.606 8.272 6.284 454 HA2 GLY 57 2HA GLY 57 -6.800 9.143 8.543 455 HA3 GLY 57 3HA GLY 57 -6.106 10.622 7.896 456 H GLY 58 H GLY 58 -7.507 7.903 6.108 457 HA2 GLY 58 2HA GLY 58 -9.950 8.176 5.503 458 HA3 GLY 58 3HA GLY 58 -9.488 9.800 5.017 459 H GLY 59 H GLY 59 -6.938 8.987 3.879 460 HA2 GLY 59 2HA GLY 59 -6.067 8.257 1.883 461 HA3 GLY 59 3HA GLY 59 -7.288 6.993 1.907 462 H GLY 60 H GLY 60 -7.973 10.445 1.921 463 HA2 GLY 60 2HA GLY 60 -8.474 11.750 -0.032 464 HA3 GLY 60 3HA GLY 60 -8.831 10.258 -0.889 465 H GLY 61 H GLY 61 -10.539 8.996 0.867 466 HA2 GLY 61 2HA GLY 61 -12.848 10.832 0.804 467 HA3 GLY 61 3HA GLY 61 -12.951 9.089 0.610 468 H GLY 62 H GLY 62 -13.831 11.378 2.637 469 HA2 GLY 62 2HA GLY 62 -13.042 9.952 5.088 470 HA3 GLY 62 3HA GLY 62 -13.658 11.597 5.020 471 H GLY 63 H GLY 63 -15.783 11.942 5.331 472 HA2 GLY 63 2HA GLY 63 -17.723 9.847 4.859 473 HA3 GLY 63 3HA GLY 63 -17.461 10.220 6.557 474 H GLY 64 H GLY 64 -19.581 10.730 4.234 475 HA2 GLY 64 2HA GLY 64 -21.322 12.394 5.092 476 HA3 GLY 64 3HA GLY 64 -20.031 13.570 4.889 477 H VAL 65 H VAL 65 -20.696 14.820 3.251 478 HA VAL 65 HA VAL 65 -20.996 13.571 0.635 479 HB VAL 65 HB VAL 65 -23.003 15.035 0.152 480 HG11 VAL 65 1HG1 VAL 65 -22.887 12.489 0.873 481 HG12 VAL 65 2HG1 VAL 65 -23.804 13.095 2.253 482 HG13 VAL 65 3HG1 VAL 65 -24.424 13.313 0.616 483 HG21 VAL 65 3HG2 VAL 65 -22.516 16.279 2.434 484 HG22 VAL 65 1HG2 VAL 65 -24.154 16.126 1.797 485 HG23 VAL 65 2HG2 VAL 65 -23.595 15.036 3.066 486 H TRP 66 H TRP 66 -18.808 14.706 0.815 487 HA TRP 66 HA TRP 66 -19.116 17.405 -0.297 488 HB2 TRP 66 2HB TRP 66 -17.049 18.095 0.950 489 HB3 TRP 66 3HB TRP 66 -18.452 17.802 1.975 490 HD1 TRP 66 HD1 TRP 66 -18.455 15.285 3.221 491 HE1 TRP 66 HE1 TRP 66 -16.459 14.015 4.235 492 HE3 TRP 66 HE3 TRP 66 -14.647 17.696 0.808 493 HZ2 TRP 66 HZ2 TRP 66 -13.643 14.033 4.039 494 HZ3 TRP 66 HZ3 TRP 66 -12.331 17.010 1.277 495 HH2 TRP 66 HH2 TRP 66 -11.842 15.216 2.860 496 HA PRO 67 HA PRO 67 -16.454 14.619 -2.913 497 HB2 PRO 67 2HB PRO 67 -17.738 15.173 -5.240 498 HB3 PRO 67 3HB PRO 67 -18.255 13.890 -4.139 499 HG2 PRO 67 2HG PRO 67 -19.332 16.666 -4.453 500 HG3 PRO 67 3HG PRO 67 -20.213 15.140 -4.254 501 HD2 PRO 67 2HD PRO 67 -19.809 16.866 -2.207 502 HD3 PRO 67 3HD PRO 67 -19.896 15.108 -1.971 503 H LEU 68 H LEU 68 -15.265 16.753 -2.044 504 HA LEU 68 HA LEU 68 -14.971 18.738 -4.155 505 HB2 LEU 68 2HB LEU 68 -14.211 18.528 -1.303 506 HB3 LEU 68 3HB LEU 68 -13.157 19.491 -2.336 507 HG LEU 68 HG LEU 68 -15.655 20.449 -2.962 508 HD11 LEU 68 1HD1 LEU 68 -16.548 19.088 -1.057 509 HD12 LEU 68 2HD1 LEU 68 -16.860 20.819 -0.948 510 HD13 LEU 68 3HD1 LEU 68 -15.583 20.091 0.026 511 HD21 LEU 68 3HD2 LEU 68 -14.947 22.323 -1.340 512 HD22 LEU 68 1HD2 LEU 68 -13.899 21.952 -2.709 513 HD23 LEU 68 2HD2 LEU 68 -13.490 21.357 -1.100 514 H VAL 69 H VAL 69 -13.416 15.909 -2.972 515 HA VAL 69 HA VAL 69 -10.849 16.517 -4.169 516 HB VAL 69 HB VAL 69 -10.207 14.249 -3.469 517 HG11 VAL 69 1HG1 VAL 69 -11.535 16.018 -1.433 518 HG12 VAL 69 2HG1 VAL 69 -10.600 14.591 -0.984 519 HG13 VAL 69 3HG1 VAL 69 -9.824 15.918 -1.849 520 HG21 VAL 69 3HG2 VAL 69 -13.077 14.056 -2.565 521 HG22 VAL 69 1HG2 VAL 69 -12.274 13.069 -3.787 522 HG23 VAL 69 2HG2 VAL 69 -11.805 12.929 -2.093 523 H ILE 70 H ILE 70 -13.683 14.556 -4.877 524 HA ILE 70 HA ILE 70 -12.588 13.133 -7.063 525 HB ILE 70 HB ILE 70 -14.830 12.503 -7.624 526 HG12 ILE 70 2HG1 ILE 70 -16.619 13.698 -5.983 527 HG13 ILE 70 3HG1 ILE 70 -15.494 15.030 -6.230 528 HG21 ILE 70 1HG2 ILE 70 -14.831 11.156 -5.863 529 HG22 ILE 70 2HG2 ILE 70 -13.747 12.262 -5.020 530 HG23 ILE 70 3HG2 ILE 70 -15.493 12.447 -4.860 531 HD11 ILE 70 3HD1 ILE 70 -17.531 14.034 -7.964 532 HD12 ILE 70 1HD1 ILE 70 -16.520 15.469 -8.134 533 HD13 ILE 70 2HD1 ILE 70 -15.961 13.917 -8.760 534 H ARG 71 H ARG 71 -13.976 16.309 -6.741 535 HA ARG 71 HA ARG 71 -14.350 16.704 -9.568 536 HB2 ARG 71 2HB ARG 71 -14.751 19.093 -8.877 537 HB3 ARG 71 3HB ARG 71 -15.819 17.911 -8.133 538 HG2 ARG 71 2HG ARG 71 -14.646 18.030 -6.068 539 HG3 ARG 71 3HG ARG 71 -13.353 18.988 -6.792 540 HD2 ARG 71 2HD ARG 71 -16.225 19.869 -6.530 541 HD3 ARG 71 3HD ARG 71 -14.921 20.339 -5.441 542 HE ARG 71 HE ARG 71 -14.200 20.973 -8.083 543 HH11 ARG 71 1HH1 ARG 71 -16.408 21.968 -5.583 544 HH12 ARG 71 2HH1 ARG 71 -16.491 23.610 -6.128 545 HH21 ARG 71 1HH2 ARG 71 -14.300 23.132 -8.811 546 HH22 ARG 71 2HH2 ARG 71 -15.291 24.271 -7.965 547 H THR 72 H THR 72 -11.787 17.089 -7.297 548 HA THR 72 HA THR 72 -10.243 19.103 -8.354 549 HB THR 72 HB THR 72 -8.899 16.563 -7.510 550 HG1 THR 72 HG1 THR 72 -10.037 18.370 -5.640 551 HG21 THR 72 3HG2 THR 72 -7.158 17.907 -7.101 552 HG22 THR 72 1HG2 THR 72 -8.158 19.067 -6.228 553 HG23 THR 72 2HG2 THR 72 -8.043 19.149 -7.986 554 H VAL 73 H VAL 73 -10.107 15.655 -9.260 555 HA VAL 73 HA VAL 73 -8.246 16.009 -11.356 556 HB VAL 73 HB VAL 73 -9.017 13.760 -12.130 557 HG11 VAL 73 1HG1 VAL 73 -7.494 14.431 -9.971 558 HG12 VAL 73 2HG1 VAL 73 -8.669 13.325 -9.255 559 HG13 VAL 73 3HG1 VAL 73 -7.674 12.798 -10.613 560 HG21 VAL 73 3HG2 VAL 73 -11.186 14.391 -10.256 561 HG22 VAL 73 1HG2 VAL 73 -11.165 13.309 -11.649 562 HG23 VAL 73 2HG2 VAL 73 -10.524 12.764 -10.099 563 H ILE 74 H ILE 74 -11.777 15.940 -11.274 564 HA ILE 74 HA ILE 74 -12.288 15.900 -14.012 565 HB ILE 74 HB ILE 74 -13.897 17.372 -11.924 566 HG12 ILE 74 2HG1 ILE 74 -13.447 14.520 -12.407 567 HG13 ILE 74 3HG1 ILE 74 -14.132 15.329 -11.001 568 HG21 ILE 74 1HG2 ILE 74 -14.662 16.242 -14.612 569 HG22 ILE 74 2HG2 ILE 74 -15.783 16.940 -13.445 570 HG23 ILE 74 3HG2 ILE 74 -14.541 17.949 -14.187 571 HD11 ILE 74 3HD1 ILE 74 -15.757 13.840 -11.941 572 HD12 ILE 74 1HD1 ILE 74 -16.280 15.504 -12.202 573 HD13 ILE 74 2HD1 ILE 74 -15.575 14.582 -13.531 574 H ALA 75 H ALA 75 -10.907 18.361 -12.089 575 HA ALA 75 HA ALA 75 -11.665 20.728 -13.229 576 HB1 ALA 75 1HB ALA 75 -8.959 19.828 -12.280 577 HB2 ALA 75 2HB ALA 75 -9.286 21.483 -12.796 578 HB3 ALA 75 3HB ALA 75 -10.154 20.800 -11.421 579 H GLY 76 H GLY 76 -9.855 18.164 -14.692 580 HA2 GLY 76 2HA GLY 76 -9.026 19.860 -16.929 581 HA3 GLY 76 3HA GLY 76 -8.543 18.192 -16.657 582 H TYR 77 H TYR 77 -11.295 17.301 -16.176 583 HA TYR 77 HA TYR 77 -11.979 16.388 -18.680 584 HB2 TYR 77 2HB TYR 77 -12.950 15.348 -16.766 585 HB3 TYR 77 3HB TYR 77 -13.696 16.853 -16.241 586 HD1 TYR 77 HD2 TYR 77 -13.719 15.658 -19.730 587 HD2 TYR 77 HD1 TYR 77 -15.938 16.034 -16.118 588 HE1 TYR 77 HE2 TYR 77 -15.775 15.054 -20.937 589 HE2 TYR 77 HE1 TYR 77 -18.000 15.430 -17.315 590 HH TYR 77 HH TYR 77 -18.292 13.917 -19.827 591 H ASN 78 H ASN 78 -13.374 19.182 -16.969 592 HA ASN 78 HA ASN 78 -15.237 20.010 -18.797 593 HB2 ASN 78 2HB ASN 78 -14.247 21.045 -16.486 594 HB3 ASN 78 3HB ASN 78 -13.617 22.200 -17.658 595 HD21 ASN 78 1HD2 ASN 78 -14.942 23.823 -16.824 596 HD22 ASN 78 2HD2 ASN 78 -16.638 23.871 -17.152 597 H LEU 79 H LEU 79 -11.812 20.032 -19.123 598 HA LEU 79 HA LEU 79 -11.892 21.863 -21.397 599 HB2 LEU 79 2HB LEU 79 -9.932 21.102 -19.458 600 HB3 LEU 79 3HB LEU 79 -9.311 20.768 -21.073 601 HG LEU 79 HG LEU 79 -8.593 22.955 -20.343 602 HD11 LEU 79 1HD1 LEU 79 -10.527 23.981 -22.211 603 HD12 LEU 79 2HD1 LEU 79 -9.932 22.403 -22.726 604 HD13 LEU 79 3HD1 LEU 79 -8.796 23.716 -22.417 605 HD21 LEU 79 3HD2 LEU 79 -10.497 23.313 -18.763 606 HD22 LEU 79 1HD2 LEU 79 -11.500 23.722 -20.155 607 HD23 LEU 79 2HD2 LEU 79 -10.097 24.714 -19.758 608 H TYR 80 H TYR 80 -11.348 18.482 -20.625 609 HA TYR 80 HA TYR 80 -10.255 17.487 -22.922 610 HB2 TYR 80 2HB TYR 80 -11.610 16.421 -20.699 611 HB3 TYR 80 3HB TYR 80 -12.425 15.766 -22.115 612 HD1 TYR 80 HD2 TYR 80 -10.755 14.881 -23.996 613 HD2 TYR 80 HD1 TYR 80 -9.799 15.261 -19.868 614 HE1 TYR 80 HE2 TYR 80 -8.961 13.220 -24.265 615 HE2 TYR 80 HE1 TYR 80 -8.002 13.602 -20.125 616 HH TYR 80 HH TYR 80 -7.252 12.183 -23.291 617 H ARG 81 H ARG 81 -13.711 18.085 -22.333 618 HA ARG 81 HA ARG 81 -14.416 17.406 -25.043 619 HB2 ARG 81 2HB ARG 81 -15.842 18.101 -22.561 620 HB3 ARG 81 3HB ARG 81 -16.622 18.654 -24.037 621 HG2 ARG 81 2HG ARG 81 -16.214 16.200 -24.829 622 HG3 ARG 81 3HG ARG 81 -16.093 15.878 -23.098 623 HD2 ARG 81 2HD ARG 81 -18.408 17.309 -24.388 624 HD3 ARG 81 3HD ARG 81 -18.381 15.576 -24.065 625 HE ARG 81 HE ARG 81 -17.795 17.016 -21.707 626 HH11 ARG 81 1HH1 ARG 81 -20.431 16.229 -23.841 627 HH12 ARG 81 2HH1 ARG 81 -21.640 16.359 -22.607 628 HH21 ARG 81 1HH2 ARG 81 -19.378 17.189 -20.073 629 HH22 ARG 81 2HH2 ARG 81 -21.040 16.905 -20.464 630 H ALA 82 H ALA 82 -13.449 20.227 -23.342 631 HA ALA 82 HA ALA 82 -14.683 22.293 -24.675 632 HB1 ALA 82 1HB ALA 82 -11.767 22.280 -23.918 633 HB2 ALA 82 2HB ALA 82 -12.840 23.675 -24.050 634 HB3 ALA 82 3HB ALA 82 -13.084 22.493 -22.763 635 H ILE 83 H ILE 83 -12.156 20.164 -25.811 636 HA ILE 83 HA ILE 83 -11.658 21.753 -28.186 637 HB ILE 83 HB ILE 83 -10.491 19.259 -27.041 638 HG12 ILE 83 2HG1 ILE 83 -8.411 20.454 -27.344 639 HG13 ILE 83 3HG1 ILE 83 -9.214 21.690 -28.307 640 HG21 ILE 83 1HG2 ILE 83 -10.449 20.025 -29.943 641 HG22 ILE 83 2HG2 ILE 83 -9.171 19.056 -29.213 642 HG23 ILE 83 3HG2 ILE 83 -10.832 18.463 -29.221 643 HD11 ILE 83 3HD1 ILE 83 -9.708 21.150 -25.388 644 HD12 ILE 83 1HD1 ILE 83 -8.729 22.461 -26.047 645 HD13 ILE 83 2HD1 ILE 83 -10.465 22.414 -26.357 646 H LYS 84 H LYS 84 -13.581 19.037 -27.220 647 HA LYS 84 HA LYS 84 -14.037 17.946 -29.805 648 HB2 LYS 84 2HB LYS 84 -15.369 16.429 -28.750 649 HB3 LYS 84 3HB LYS 84 -14.509 17.031 -27.338 650 HG2 LYS 84 2HG LYS 84 -16.629 17.176 -26.554 651 HG3 LYS 84 3HG LYS 84 -16.514 18.763 -27.319 652 HD2 LYS 84 2HD LYS 84 -18.047 18.248 -28.873 653 HD3 LYS 84 3HD LYS 84 -17.370 16.640 -29.138 654 HE2 LYS 84 2HE LYS 84 -19.393 16.073 -28.239 655 HE3 LYS 84 3HE LYS 84 -18.428 16.180 -26.768 656 HZ1 LYS 84 3HZ LYS 84 -19.244 18.443 -26.456 657 HZ2 LYS 84 1HZ LYS 84 -20.521 17.335 -26.509 658 HZ3 LYS 84 2HZ LYS 84 -20.192 18.310 -27.850 659 H LYS 85 H LYS 85 -15.364 20.618 -28.056 660 HA LYS 85 HA LYS 85 -17.701 20.835 -29.761 661 HB2 LYS 85 2HB LYS 85 -18.438 22.526 -28.336 662 HB3 LYS 85 3HB LYS 85 -17.550 21.460 -27.256 663 HG2 LYS 85 2HG LYS 85 -15.552 23.036 -27.752 664 HG3 LYS 85 3HG LYS 85 -16.805 24.165 -28.276 665 HD2 LYS 85 2HD LYS 85 -16.929 22.788 -25.609 666 HD3 LYS 85 3HD LYS 85 -16.033 24.291 -25.837 667 HE2 LYS 85 2HE LYS 85 -17.966 25.324 -25.409 668 HE3 LYS 85 3HE LYS 85 -18.450 24.829 -27.030 669 HZ1 LYS 85 3HZ LYS 85 -19.191 23.670 -24.436 670 HZ2 LYS 85 1HZ LYS 85 -19.153 22.666 -25.798 671 HZ3 LYS 85 2HZ LYS 85 -20.165 24.021 -25.774 672 H LYS 86 H LYS 86 -14.580 22.399 -29.327 673 HA LYS 86 HA LYS 86 -13.454 23.961 -30.546 674 HB2 LYS 86 2HB LYS 86 -13.595 22.113 -32.192 675 HB3 LYS 86 3HB LYS 86 -15.085 22.808 -32.817 676 HG2 LYS 86 2HG LYS 86 -13.729 23.789 -34.301 677 HG3 LYS 86 3HG LYS 86 -13.419 24.935 -32.994 678 HD2 LYS 86 2HD LYS 86 -11.787 22.438 -33.407 679 HD3 LYS 86 3HD LYS 86 -11.378 23.986 -34.150 680 HE2 LYS 86 2HE LYS 86 -11.486 24.940 -31.777 681 HE3 LYS 86 3HE LYS 86 -11.451 23.262 -31.236 682 HZ1 LYS 86 3HZ LYS 86 -9.350 24.843 -32.524 683 HZ2 LYS 86 1HZ LYS 86 -9.399 23.181 -32.840 684 HZ3 LYS 86 2HZ LYS 86 -9.240 23.735 -31.250 685 H GLY 87 H GLY 87 -14.436 25.767 -29.534 686 HA2 GLY 87 2HA GLY 87 -15.490 27.691 -31.236 687 HA3 GLY 87 3HA GLY 87 -16.862 26.925 -30.448 688 H GLY 88 H GLY 88 -15.346 26.430 -27.972 689 HA2 GLY 88 2HA GLY 88 -14.468 28.960 -26.960 690 HA3 GLY 88 3HA GLY 88 -16.110 28.589 -26.455 691 H GLY 89 H GLY 89 -15.714 28.310 -24.295 692 HA2 GLY 89 2HA GLY 89 -14.044 25.970 -23.620 693 HA3 GLY 89 3HA GLY 89 -13.982 27.443 -22.664 694 H GLY 90 H GLY 90 -15.050 24.443 -22.489 695 HA2 GLY 90 2HA GLY 90 -16.483 24.357 -20.312 696 HA3 GLY 90 3HA GLY 90 -17.689 25.073 -21.371 697 H GLY 91 H GLY 91 -19.120 23.357 -21.249 698 HA2 GLY 91 2HA GLY 91 -18.377 21.062 -22.897 699 HA3 GLY 91 3HA GLY 91 -18.902 20.724 -21.254 700 H GLY 92 H GLY 92 -20.336 19.555 -23.153 701 HA2 GLY 92 2HA GLY 92 -22.770 19.417 -23.093 702 HA3 GLY 92 3HA GLY 92 -22.807 21.169 -23.225 703 H GLY 93 H GLY 93 -23.945 18.917 -24.896 704 HA2 GLY 93 2HA GLY 93 -24.578 19.178 -27.174 705 HA3 GLY 93 3HA GLY 93 -23.072 20.035 -27.465 706 H GLY 94 H GLY 94 -22.837 18.633 -29.325 707 HA2 GLY 94 2HA GLY 94 -20.950 16.831 -29.409 708 HA3 GLY 94 3HA GLY 94 -22.213 15.835 -28.701 709 H GLY 95 H GLY 95 -21.110 15.030 -31.039 710 HA2 GLY 95 2HA GLY 95 -23.304 14.645 -32.709 711 HA3 GLY 95 3HA GLY 95 -22.399 16.000 -33.366 712 H GLY 96 H GLY 96 -22.832 12.782 -33.654 713 HA2 GLY 96 2HA GLY 96 -21.650 11.093 -34.662 714 HA3 GLY 96 3HA GLY 96 -20.717 12.373 -35.424 715 H VAL 97 H VAL 97 -19.192 10.381 -35.099 716 HA VAL 97 HA VAL 97 -18.114 9.729 -32.625 717 HB VAL 97 HB VAL 97 -17.544 8.447 -34.590 718 HG11 VAL 97 1HG1 VAL 97 -15.561 10.110 -35.805 719 HG12 VAL 97 2HG1 VAL 97 -17.003 9.391 -36.525 720 HG13 VAL 97 3HG1 VAL 97 -17.097 10.974 -35.753 721 HG21 VAL 97 3HG2 VAL 97 -15.486 7.877 -33.863 722 HG22 VAL 97 1HG2 VAL 97 -14.867 9.522 -34.003 723 HG23 VAL 97 2HG2 VAL 97 -15.824 9.057 -32.596 724 H TRP 98 H TRP 98 -17.067 10.890 -31.162 725 HA TRP 98 HA TRP 98 -14.884 12.537 -31.627 726 HB2 TRP 98 2HB TRP 98 -17.219 13.837 -32.409 727 HB3 TRP 98 3HB TRP 98 -16.875 14.495 -30.812 728 HD1 TRP 98 HD1 TRP 98 -16.180 15.234 -34.268 729 HE1 TRP 98 HE1 TRP 98 -14.078 16.695 -34.538 730 HE3 TRP 98 HE3 TRP 98 -14.163 14.620 -29.611 731 HZ2 TRP 98 HZ2 TRP 98 -11.858 17.482 -32.982 732 HZ3 TRP 98 HZ3 TRP 98 -12.047 15.760 -29.082 733 HH2 TRP 98 HH2 TRP 98 -10.920 17.160 -30.734 734 HA PRO 99 HA PRO 99 -16.502 13.299 -27.135 735 HB2 PRO 99 2HB PRO 99 -18.928 12.258 -26.499 736 HB3 PRO 99 3HB PRO 99 -18.724 13.886 -27.156 737 HG2 PRO 99 2HG PRO 99 -19.513 11.363 -28.559 738 HG3 PRO 99 3HG PRO 99 -20.185 12.995 -28.729 739 HD2 PRO 99 2HD PRO 99 -18.419 11.955 -30.499 740 HD3 PRO 99 3HD PRO 99 -18.482 13.688 -30.118 741 H LEU 100 H LEU 100 -16.523 10.447 -28.909 742 HA LEU 100 HA LEU 100 -16.832 8.520 -26.856 743 HB2 LEU 100 2HB LEU 100 -15.203 8.195 -29.364 744 HB3 LEU 100 3HB LEU 100 -15.994 6.935 -28.418 745 HG LEU 100 HG LEU 100 -17.373 9.031 -30.096 746 HD11 LEU 100 1HD1 LEU 100 -18.069 7.033 -31.421 747 HD12 LEU 100 2HD1 LEU 100 -16.914 6.081 -30.490 748 HD13 LEU 100 3HD1 LEU 100 -16.347 7.405 -31.508 749 HD21 LEU 100 3HD2 LEU 100 -19.127 8.646 -28.779 750 HD22 LEU 100 1HD2 LEU 100 -18.312 7.318 -27.953 751 HD23 LEU 100 2HD2 LEU 100 -19.169 7.022 -29.466 752 H VAL 101 H VAL 101 -14.286 10.649 -27.670 753 HA VAL 101 HA VAL 101 -12.215 9.048 -26.413 754 HB VAL 101 HB VAL 101 -10.724 10.936 -26.906 755 HG11 VAL 101 1HG1 VAL 101 -12.301 9.509 -28.917 756 HG12 VAL 101 2HG1 VAL 101 -11.497 10.958 -29.522 757 HG13 VAL 101 3HG1 VAL 101 -10.554 9.679 -28.756 758 HG21 VAL 101 3HG2 VAL 101 -12.040 12.630 -28.566 759 HG22 VAL 101 1HG2 VAL 101 -13.287 12.294 -27.366 760 HG23 VAL 101 2HG2 VAL 101 -11.730 12.948 -26.860 761 H ILE 102 H ILE 102 -14.192 11.867 -25.709 762 HA ILE 102 HA ILE 102 -12.816 12.657 -23.356 763 HB ILE 102 HB ILE 102 -14.556 14.172 -22.965 764 HG12 ILE 102 2HG1 ILE 102 -16.707 13.601 -24.609 765 HG13 ILE 102 3HG1 ILE 102 -16.222 12.014 -24.022 766 HG21 ILE 102 1HG2 ILE 102 -14.386 15.366 -24.853 767 HG22 ILE 102 2HG2 ILE 102 -13.415 14.015 -25.437 768 HG23 ILE 102 3HG2 ILE 102 -15.132 14.103 -25.832 769 HD11 ILE 102 3HD1 ILE 102 -16.220 13.208 -21.699 770 HD12 ILE 102 1HD1 ILE 102 -17.284 14.350 -22.520 771 HD13 ILE 102 2HD1 ILE 102 -17.727 12.646 -22.423 772 H ARG 103 H ARG 103 -15.053 10.145 -24.040 773 HA ARG 103 HA ARG 103 -15.892 9.828 -21.280 774 HB2 ARG 103 2HB ARG 103 -17.079 7.800 -22.196 775 HB3 ARG 103 3HB ARG 103 -17.569 9.337 -22.894 776 HG2 ARG 103 2HG ARG 103 -16.317 8.913 -24.883 777 HG3 ARG 103 3HG ARG 103 -15.584 7.474 -24.172 778 HD2 ARG 103 2HD ARG 103 -18.254 6.957 -23.898 779 HD3 ARG 103 3HD ARG 103 -18.203 7.833 -25.427 780 HE ARG 103 HE ARG 103 -16.200 5.941 -25.561 781 HH11 ARG 103 1HH1 ARG 103 -19.659 5.963 -25.168 782 HH12 ARG 103 2HH1 ARG 103 -19.887 4.427 -25.936 783 HH21 ARG 103 1HH2 ARG 103 -16.487 3.918 -26.574 784 HH22 ARG 103 2HH2 ARG 103 -18.082 3.264 -26.735 785 H THR 104 H THR 104 -13.538 8.527 -23.476 786 HA THR 104 HA THR 104 -12.952 6.068 -22.378 787 HB THR 104 HB THR 104 -10.588 7.697 -23.088 788 HG1 THR 104 HG1 THR 104 -12.355 7.005 -25.178 789 HG21 THR 104 3HG2 THR 104 -10.165 5.745 -24.550 790 HG22 THR 104 1HG2 THR 104 -11.711 5.062 -24.048 791 HG23 THR 104 2HG2 THR 104 -10.421 5.288 -22.866 792 H VAL 105 H VAL 105 -11.638 9.231 -21.413 793 HA VAL 105 HA VAL 105 -10.072 8.190 -19.278 794 HB VAL 105 HB VAL 105 -9.816 10.524 -18.563 795 HG11 VAL 105 1HG1 VAL 105 -9.600 10.230 -21.557 796 HG12 VAL 105 2HG1 VAL 105 -8.691 11.349 -20.539 797 HG13 VAL 105 3HG1 VAL 105 -8.433 9.610 -20.390 798 HG21 VAL 105 3HG2 VAL 105 -10.884 12.305 -19.972 799 HG22 VAL 105 1HG2 VAL 105 -11.912 11.048 -20.661 800 HG23 VAL 105 2HG2 VAL 105 -11.998 11.410 -18.937 801 H ILE 106 H ILE 106 -13.304 9.583 -19.502 802 HA ILE 106 HA ILE 106 -13.838 9.860 -16.770 803 HB ILE 106 HB ILE 106 -15.862 9.125 -18.884 804 HG12 ILE 106 2HG1 ILE 106 -14.167 11.262 -19.044 805 HG13 ILE 106 3HG1 ILE 106 -15.778 11.211 -19.750 806 HG21 ILE 106 1HG2 ILE 106 -16.065 10.500 -16.214 807 HG22 ILE 106 2HG2 ILE 106 -17.359 10.500 -17.411 808 HG23 ILE 106 3HG2 ILE 106 -16.810 8.980 -16.708 809 HD11 ILE 106 3HD1 ILE 106 -15.266 12.212 -16.969 810 HD12 ILE 106 1HD1 ILE 106 -15.198 13.254 -18.390 811 HD13 ILE 106 2HD1 ILE 106 -16.702 12.435 -17.968 812 H ALA 107 H ALA 107 -13.501 7.051 -18.685 813 HA ALA 107 HA ALA 107 -15.185 5.196 -17.569 814 HB1 ALA 107 1HB ALA 107 -13.837 4.507 -19.370 815 HB2 ALA 107 2HB ALA 107 -12.348 4.923 -18.520 816 HB3 ALA 107 3HB ALA 107 -13.307 3.540 -17.993 817 H GLY 108 H GLY 108 -12.463 6.768 -16.102 818 HA2 GLY 108 2HA GLY 108 -12.484 4.898 -13.844 819 HA3 GLY 108 3HA GLY 108 -11.277 6.139 -14.143 820 H TYR 109 H TYR 109 -13.514 8.089 -14.707 821 HA TYR 109 HA TYR 109 -13.587 9.404 -12.292 822 HB2 TYR 109 2HB TYR 109 -15.375 9.472 -14.697 823 HB3 TYR 109 3HB TYR 109 -15.794 10.415 -13.271 824 HD1 TYR 109 HD1 TYR 109 -12.401 9.749 -14.630 825 HD2 TYR 109 HD2 TYR 109 -15.482 12.617 -14.017 826 HE1 TYR 109 HE1 TYR 109 -10.878 11.533 -15.370 827 HE2 TYR 109 HE2 TYR 109 -13.969 14.410 -14.757 828 HH TYR 109 HH TYR 109 -10.674 14.047 -15.005 829 H ASN 110 H ASN 110 -16.062 7.223 -13.624 830 HA ASN 110 HA ASN 110 -17.949 7.370 -11.625 831 HB2 ASN 110 2HB ASN 110 -17.582 5.811 -13.869 832 HB3 ASN 110 3HB ASN 110 -17.519 4.629 -12.565 833 HD21 ASN 110 1HD2 ASN 110 -19.488 6.679 -14.442 834 HD22 ASN 110 2HD2 ASN 110 -20.998 6.303 -13.690 835 H LEU 111 H LEU 111 -14.806 5.955 -11.513 836 HA LEU 111 HA LEU 111 -15.383 4.441 -9.093 837 HB2 LEU 111 2HB LEU 111 -13.345 4.418 -11.144 838 HB3 LEU 111 3HB LEU 111 -12.634 4.415 -9.532 839 HG LEU 111 HG LEU 111 -14.771 2.480 -9.728 840 HD11 LEU 111 1HD1 LEU 111 -12.964 1.077 -11.211 841 HD12 LEU 111 2HD1 LEU 111 -12.917 2.662 -11.983 842 HD13 LEU 111 3HD1 LEU 111 -14.448 1.799 -11.835 843 HD21 LEU 111 3HD2 LEU 111 -12.627 1.032 -9.199 844 HD22 LEU 111 1HD2 LEU 111 -13.344 2.095 -7.988 845 HD23 LEU 111 2HD2 LEU 111 -11.921 2.619 -8.890 846 H TYR 112 H TYR 112 -13.742 7.364 -10.114 847 HA TYR 112 HA TYR 112 -12.149 8.031 -8.028 848 HB2 TYR 112 2HB TYR 112 -14.080 9.813 -9.520 849 HB3 TYR 112 3HB TYR 112 -12.839 10.421 -8.430 850 HD1 TYR 112 HD1 TYR 112 -11.516 7.577 -9.925 851 HD2 TYR 112 HD2 TYR 112 -12.464 11.631 -10.802 852 HE1 TYR 112 HE1 TYR 112 -9.887 7.553 -11.767 853 HE2 TYR 112 HE2 TYR 112 -10.839 11.618 -12.648 854 HH TYR 112 HH TYR 112 -9.807 9.749 -14.179 855 H ARG 113 H ARG 113 -15.664 8.590 -8.140 856 HA ARG 113 HA ARG 113 -15.730 9.444 -5.388 857 HB2 ARG 113 2HB ARG 113 -17.735 9.113 -7.574 858 HB3 ARG 113 3HB ARG 113 -18.310 9.163 -5.913 859 HG2 ARG 113 2HG ARG 113 -17.169 11.332 -5.619 860 HG3 ARG 113 3HG ARG 113 -16.705 11.285 -7.321 861 HD2 ARG 113 2HD ARG 113 -19.564 11.097 -6.407 862 HD3 ARG 113 3HD ARG 113 -18.773 12.637 -6.740 863 HE ARG 113 HE ARG 113 -18.371 11.060 -8.971 864 HH11 ARG 113 1HH1 ARG 113 -21.081 12.376 -7.228 865 HH12 ARG 113 2HH1 ARG 113 -22.096 12.486 -8.628 866 HH21 ARG 113 1HH2 ARG 113 -19.696 11.199 -10.822 867 HH22 ARG 113 2HH2 ARG 113 -21.307 11.815 -10.672 868 H ALA 114 H ALA 114 -16.130 6.485 -7.135 869 HA ALA 114 HA ALA 114 -17.730 4.967 -5.491 870 HB1 ALA 114 1HB ALA 114 -15.219 3.961 -6.818 871 HB2 ALA 114 2HB ALA 114 -16.655 3.029 -6.391 872 HB3 ALA 114 3HB ALA 114 -16.741 4.247 -7.664 873 H ILE 115 H ILE 115 -14.296 5.720 -5.109 874 HA ILE 115 HA ILE 115 -14.041 4.113 -2.730 875 HB ILE 115 HB ILE 115 -12.147 6.149 -3.911 876 HG12 ILE 115 2HG1 ILE 115 -12.523 4.257 -5.407 877 HG13 ILE 115 3HG1 ILE 115 -10.908 4.168 -4.712 878 HG21 ILE 115 1HG2 ILE 115 -12.051 4.474 -1.482 879 HG22 ILE 115 2HG2 ILE 115 -10.581 4.529 -2.454 880 HG23 ILE 115 3HG2 ILE 115 -11.279 6.022 -1.827 881 HD11 ILE 115 3HD1 ILE 115 -11.411 2.053 -4.256 882 HD12 ILE 115 1HD1 ILE 115 -12.403 2.699 -2.949 883 HD13 ILE 115 2HD1 ILE 115 -13.137 2.317 -4.507 884 H LYS 116 H LYS 116 -14.997 7.319 -3.479 885 HA LYS 116 HA LYS 116 -14.329 8.503 -0.960 886 HB2 LYS 116 2HB LYS 116 -15.196 9.430 -3.447 887 HB3 LYS 116 3HB LYS 116 -16.521 9.800 -2.351 888 HG2 LYS 116 2HG LYS 116 -13.912 10.488 -1.257 889 HG3 LYS 116 3HG LYS 116 -14.289 11.338 -2.758 890 HD2 LYS 116 2HD LYS 116 -15.280 12.770 -1.294 891 HD3 LYS 116 3HD LYS 116 -16.627 11.653 -1.521 892 HE2 LYS 116 2HE LYS 116 -15.241 10.448 0.492 893 HE3 LYS 116 3HE LYS 116 -14.959 12.153 0.840 894 HZ1 LYS 116 3HZ LYS 116 -17.530 10.705 0.709 895 HZ2 LYS 116 1HZ LYS 116 -17.466 12.389 0.561 896 HZ3 LYS 116 2HZ LYS 116 -16.908 11.642 1.972 897 H LYS 117 H LYS 117 -16.994 6.670 -2.207 898 HA LYS 117 HA LYS 117 -18.810 7.417 -0.089 899 HB2 LYS 117 2HB LYS 117 -19.051 6.213 -2.624 900 HB3 LYS 117 3HB LYS 117 -19.571 5.000 -1.461 901 HG2 LYS 117 2HG LYS 117 -20.923 7.072 -0.493 902 HG3 LYS 117 3HG LYS 117 -20.793 7.601 -2.172 903 HD2 LYS 117 2HD LYS 117 -21.536 5.059 -2.574 904 HD3 LYS 117 3HD LYS 117 -22.290 5.331 -1.001 905 HE2 LYS 117 2HE LYS 117 -23.890 6.598 -1.895 906 HE3 LYS 117 3HE LYS 117 -22.720 7.562 -2.794 907 HZ1 LYS 117 3HZ LYS 117 -23.988 6.571 -4.437 908 HZ2 LYS 117 1HZ LYS 117 -24.102 5.092 -3.623 909 HZ3 LYS 117 2HZ LYS 117 -22.645 5.547 -4.353 910 H LYS 118 H LYS 118 -16.760 4.661 -0.906 911 HA LYS 118 HA LYS 118 -17.510 3.332 1.591 912 HB2 LYS 118 2HB LYS 118 -15.937 2.417 -0.817 913 HB3 LYS 118 3HB LYS 118 -16.071 1.463 0.654 914 HG2 LYS 118 2HG LYS 118 -18.600 1.661 0.333 915 HG3 LYS 118 3HG LYS 118 -18.216 2.199 -1.304 916 HD2 LYS 118 2HD LYS 118 -16.760 -0.201 -0.527 917 HD3 LYS 118 3HD LYS 118 -18.511 -0.416 -0.481 918 HE2 LYS 118 2HE LYS 118 -18.671 -0.387 -2.709 919 HE3 LYS 118 3HE LYS 118 -17.618 1.021 -2.847 920 HZ1 LYS 118 3HZ LYS 118 -15.935 -1.007 -2.147 921 HZ2 LYS 118 1HZ LYS 118 -16.137 -0.375 -3.704 922 HZ3 LYS 118 2HZ LYS 118 -17.007 -1.745 -3.228 Start of MODEL 11 1 H1 VAL 1 H VAL 1 -6.110 -0.223 -0.303 2 HA VAL 1 HA VAL 1 -4.535 2.036 -0.867 3 HB VAL 1 HB VAL 1 -3.669 -0.360 0.752 4 HG11 VAL 1 1HG1 VAL 1 -2.382 2.053 0.099 5 HG12 VAL 1 2HG1 VAL 1 -2.879 2.191 1.787 6 HG13 VAL 1 3HG1 VAL 1 -1.873 0.837 1.270 7 HG21 VAL 1 3HG2 VAL 1 -4.589 1.457 2.560 8 HG22 VAL 1 1HG2 VAL 1 -5.750 1.644 1.245 9 HG23 VAL 1 2HG2 VAL 1 -5.500 0.061 1.983 10 H TRP 2 H TRP 2 -4.241 1.513 -3.218 11 HA TRP 2 HA TRP 2 -1.569 0.555 -3.627 12 HB2 TRP 2 2HB TRP 2 -2.358 -1.098 -5.437 13 HB3 TRP 2 3HB TRP 2 -2.476 -1.607 -3.755 14 HD1 TRP 2 HD1 TRP 2 -4.884 0.253 -6.188 15 HE1 TRP 2 HE1 TRP 2 -7.219 -0.799 -5.932 16 HE3 TRP 2 HE3 TRP 2 -3.805 -3.259 -2.633 17 HZ2 TRP 2 HZ2 TRP 2 -8.442 -2.847 -4.421 18 HZ3 TRP 2 HZ3 TRP 2 -5.614 -4.724 -1.836 19 HH2 TRP 2 HH2 TRP 2 -7.884 -4.520 -2.712 20 HA PRO 3 HA PRO 3 -1.715 3.405 -6.961 21 HB2 PRO 3 2HB PRO 3 0.044 2.304 -8.711 22 HB3 PRO 3 3HB PRO 3 0.546 3.074 -7.201 23 HG2 PRO 3 2HG PRO 3 0.188 0.166 -7.817 24 HG3 PRO 3 3HG PRO 3 1.487 0.967 -6.914 25 HD2 PRO 3 2HD PRO 3 -0.559 -0.317 -5.691 26 HD3 PRO 3 3HD PRO 3 0.233 1.108 -4.986 27 H LEU 4 H LEU 4 -2.904 0.278 -7.280 28 HA LEU 4 HA LEU 4 -3.431 0.157 -10.056 29 HB2 LEU 4 2HB LEU 4 -3.850 -1.469 -7.806 30 HB3 LEU 4 3HB LEU 4 -5.442 -1.192 -8.509 31 HG LEU 4 HG LEU 4 -3.326 -1.989 -10.404 32 HD11 LEU 4 1HD1 LEU 4 -3.011 -3.336 -8.221 33 HD12 LEU 4 2HD1 LEU 4 -3.115 -4.201 -9.753 34 HD13 LEU 4 3HD1 LEU 4 -4.517 -4.128 -8.685 35 HD21 LEU 4 3HD2 LEU 4 -5.859 -3.457 -10.209 36 HD22 LEU 4 1HD2 LEU 4 -5.077 -2.716 -11.605 37 HD23 LEU 4 2HD2 LEU 4 -6.027 -1.725 -10.498 38 H VAL 5 H VAL 5 -4.849 1.949 -7.510 39 HA VAL 5 HA VAL 5 -7.382 2.343 -8.874 40 HB VAL 5 HB VAL 5 -7.939 3.828 -6.994 41 HG11 VAL 5 1HG1 VAL 5 -7.028 1.034 -6.589 42 HG12 VAL 5 2HG1 VAL 5 -7.458 1.971 -5.157 43 HG13 VAL 5 3HG1 VAL 5 -8.641 1.732 -6.444 44 HG21 VAL 5 3HG2 VAL 5 -6.181 4.890 -6.081 45 HG22 VAL 5 1HG2 VAL 5 -6.051 3.449 -5.073 46 HG23 VAL 5 2HG2 VAL 5 -5.052 3.608 -6.518 47 H ILE 6 H ILE 6 -4.387 4.079 -8.276 48 HA ILE 6 HA ILE 6 -5.269 6.596 -9.251 49 HB ILE 6 HB ILE 6 -3.052 7.322 -9.098 50 HG12 ILE 6 2HG1 ILE 6 -1.363 5.159 -8.738 51 HG13 ILE 6 3HG1 ILE 6 -2.453 4.609 -10.006 52 HG21 ILE 6 1HG2 ILE 6 -2.752 6.987 -6.906 53 HG22 ILE 6 2HG2 ILE 6 -4.190 5.974 -7.012 54 HG23 ILE 6 3HG2 ILE 6 -2.588 5.242 -7.099 55 HD11 ILE 6 3HD1 ILE 6 -0.350 6.645 -10.071 56 HD12 ILE 6 1HD1 ILE 6 -0.991 5.624 -11.359 57 HD13 ILE 6 2HD1 ILE 6 -1.847 7.093 -10.889 58 H ARG 7 H ARG 7 -4.300 3.682 -10.783 59 HA ARG 7 HA ARG 7 -3.616 4.958 -13.298 60 HB2 ARG 7 2HB ARG 7 -3.401 2.580 -14.099 61 HB3 ARG 7 3HB ARG 7 -2.336 3.019 -12.770 62 HG2 ARG 7 2HG ARG 7 -3.707 1.859 -11.196 63 HG3 ARG 7 3HG ARG 7 -4.952 1.577 -12.415 64 HD2 ARG 7 2HD ARG 7 -3.559 -0.415 -11.990 65 HD3 ARG 7 3HD ARG 7 -3.466 0.141 -13.661 66 HE ARG 7 HE ARG 7 -1.368 1.338 -12.311 67 HH11 ARG 7 1HH1 ARG 7 -2.417 -1.890 -13.086 68 HH12 ARG 7 2HH1 ARG 7 -0.812 -2.542 -13.128 69 HH21 ARG 7 1HH2 ARG 7 0.750 0.492 -12.364 70 HH22 ARG 7 2HH2 ARG 7 0.988 -1.187 -12.716 71 H THR 8 H THR 8 -6.373 3.593 -11.751 72 HA THR 8 HA THR 8 -7.930 2.700 -13.843 73 HB THR 8 HB THR 8 -9.288 4.366 -11.783 74 HG1 THR 8 HG1 THR 8 -7.619 2.154 -11.251 75 HG21 THR 8 3HG2 THR 8 -10.521 2.047 -11.662 76 HG22 THR 8 1HG2 THR 8 -9.737 1.789 -13.220 77 HG23 THR 8 2HG2 THR 8 -10.827 3.158 -12.997 78 H VAL 9 H VAL 9 -7.545 6.028 -12.671 79 HA VAL 9 HA VAL 9 -9.363 7.157 -14.555 80 HB VAL 9 HB VAL 9 -7.143 8.689 -13.228 81 HG11 VAL 9 1HG1 VAL 9 -8.486 9.902 -14.839 82 HG12 VAL 9 2HG1 VAL 9 -9.966 9.396 -14.021 83 HG13 VAL 9 3HG1 VAL 9 -8.834 10.479 -13.209 84 HG21 VAL 9 3HG2 VAL 9 -9.272 8.952 -11.531 85 HG22 VAL 9 1HG2 VAL 9 -9.344 7.243 -11.960 86 HG23 VAL 9 2HG2 VAL 9 -7.873 7.914 -11.256 87 H ILE 10 H ILE 10 -5.867 6.697 -14.461 88 HA ILE 10 HA ILE 10 -5.193 8.239 -16.703 89 HB ILE 10 HB ILE 10 -3.812 5.724 -15.760 90 HG12 ILE 10 2HG1 ILE 10 -3.597 8.596 -14.862 91 HG13 ILE 10 3HG1 ILE 10 -3.940 7.177 -13.880 92 HG21 ILE 10 1HG2 ILE 10 -2.851 8.054 -17.412 93 HG22 ILE 10 2HG2 ILE 10 -1.813 6.782 -16.770 94 HG23 ILE 10 3HG2 ILE 10 -3.064 6.388 -17.949 95 HD11 ILE 10 3HD1 ILE 10 -1.580 6.412 -14.620 96 HD12 ILE 10 1HD1 ILE 10 -1.344 8.117 -15.002 97 HD13 ILE 10 2HD1 ILE 10 -1.748 7.629 -13.356 98 H ALA 11 H ALA 11 -6.896 5.303 -16.477 99 HA ALA 11 HA ALA 11 -6.245 3.859 -18.706 100 HB1 ALA 11 1HB ALA 11 -8.713 3.276 -18.814 101 HB2 ALA 11 2HB ALA 11 -7.899 2.986 -17.276 102 HB3 ALA 11 3HB ALA 11 -8.932 4.402 -17.474 103 H GLY 12 H GLY 12 -7.694 6.998 -18.576 104 HA2 GLY 12 2HA GLY 12 -8.499 6.888 -21.386 105 HA3 GLY 12 3HA GLY 12 -8.831 8.197 -20.262 106 H TYR 13 H TYR 13 -6.024 8.279 -19.351 107 HA TYR 13 HA TYR 13 -5.053 10.321 -20.918 108 HB2 TYR 13 2HB TYR 13 -4.167 9.846 -18.699 109 HB3 TYR 13 3HB TYR 13 -3.474 8.333 -19.271 110 HD1 TYR 13 HD2 TYR 13 -1.696 8.493 -21.132 111 HD2 TYR 13 HD1 TYR 13 -2.908 11.809 -18.758 112 HE1 TYR 13 HE2 TYR 13 0.389 9.662 -21.711 113 HE2 TYR 13 HE1 TYR 13 -0.828 12.988 -19.331 114 HH TYR 13 HH TYR 13 1.823 11.541 -20.571 115 H ASN 14 H ASN 14 -4.140 6.883 -21.079 116 HA ASN 14 HA ASN 14 -2.252 6.943 -23.056 117 HB2 ASN 14 2HB ASN 14 -3.044 4.913 -21.807 118 HB3 ASN 14 3HB ASN 14 -4.438 4.861 -22.881 119 HD21 ASN 14 1HD2 ASN 14 -0.926 5.276 -23.211 120 HD22 ASN 14 2HD2 ASN 14 -0.740 4.119 -24.481 121 H LEU 15 H LEU 15 -5.620 7.617 -23.345 122 HA LEU 15 HA LEU 15 -5.570 7.397 -26.255 123 HB2 LEU 15 2HB LEU 15 -7.511 6.773 -24.559 124 HB3 LEU 15 3HB LEU 15 -7.920 8.472 -24.789 125 HG LEU 15 HG LEU 15 -9.248 7.120 -26.270 126 HD11 LEU 15 1HD1 LEU 15 -9.005 8.428 -28.106 127 HD12 LEU 15 2HD1 LEU 15 -7.261 8.187 -28.187 128 HD13 LEU 15 3HD1 LEU 15 -7.941 9.315 -27.015 129 HD21 LEU 15 3HD2 LEU 15 -8.278 5.127 -26.730 130 HD22 LEU 15 1HD2 LEU 15 -6.652 5.807 -26.795 131 HD23 LEU 15 2HD2 LEU 15 -7.740 5.989 -28.172 132 H TYR 16 H TYR 16 -5.778 9.814 -23.709 133 HA TYR 16 HA TYR 16 -6.475 12.069 -25.113 134 HB2 TYR 16 2HB TYR 16 -5.250 11.492 -22.601 135 HB3 TYR 16 3HB TYR 16 -4.357 12.808 -23.357 136 HD1 TYR 16 HD2 TYR 16 -5.903 14.705 -24.397 137 HD2 TYR 16 HD1 TYR 16 -7.083 12.029 -21.306 138 HE1 TYR 16 HE2 TYR 16 -7.641 16.295 -23.691 139 HE2 TYR 16 HE1 TYR 16 -8.825 13.611 -20.593 140 HH TYR 16 HH TYR 16 -9.446 15.863 -20.755 141 H ARG 17 H ARG 17 -3.247 10.630 -24.803 142 HA ARG 17 HA ARG 17 -2.013 12.616 -26.470 143 HB2 ARG 17 2HB ARG 17 -1.158 10.297 -24.901 144 HB3 ARG 17 3HB ARG 17 -0.269 10.485 -26.406 145 HG2 ARG 17 2HG ARG 17 -0.163 13.008 -25.534 146 HG3 ARG 17 3HG ARG 17 -0.283 12.172 -23.985 147 HD2 ARG 17 2HD ARG 17 2.017 12.328 -24.392 148 HD3 ARG 17 3HD ARG 17 1.598 10.676 -24.845 149 HE ARG 17 HE ARG 17 1.388 12.050 -27.175 150 HH11 ARG 17 1HH1 ARG 17 3.894 11.725 -24.779 151 HH12 ARG 17 2HH1 ARG 17 5.186 11.939 -25.913 152 HH21 ARG 17 1HH2 ARG 17 3.081 12.333 -28.677 153 HH22 ARG 17 2HH2 ARG 17 4.723 12.286 -28.129 154 H ALA 18 H ALA 18 -3.614 9.599 -26.962 155 HA ALA 18 HA ALA 18 -2.518 8.636 -29.294 156 HB1 ALA 18 1HB ALA 18 -4.470 7.734 -27.864 157 HB2 ALA 18 2HB ALA 18 -5.490 8.689 -28.941 158 HB3 ALA 18 3HB ALA 18 -4.466 7.413 -29.598 159 H ILE 19 H ILE 19 -4.792 11.301 -28.881 160 HA ILE 19 HA ILE 19 -5.043 11.718 -31.733 161 HB ILE 19 HB ILE 19 -6.034 13.395 -29.424 162 HG12 ILE 19 2HG1 ILE 19 -7.075 11.186 -29.488 163 HG13 ILE 19 3HG1 ILE 19 -8.232 12.419 -29.978 164 HG21 ILE 19 1HG2 ILE 19 -6.029 13.806 -32.321 165 HG22 ILE 19 2HG2 ILE 19 -7.612 13.988 -31.567 166 HG23 ILE 19 3HG2 ILE 19 -6.253 14.963 -31.010 167 HD11 ILE 19 3HD1 ILE 19 -8.629 11.272 -31.819 168 HD12 ILE 19 1HD1 ILE 19 -6.954 11.510 -32.318 169 HD13 ILE 19 2HD1 ILE 19 -7.401 10.089 -31.373 170 H LYS 20 H LYS 20 -2.994 12.769 -29.193 171 HA LYS 20 HA LYS 20 -2.202 15.259 -30.361 172 HB2 LYS 20 2HB LYS 20 -1.006 13.536 -28.192 173 HB3 LYS 20 3HB LYS 20 -0.287 15.057 -28.705 174 HG2 LYS 20 2HG LYS 20 -3.126 14.856 -27.747 175 HG3 LYS 20 3HG LYS 20 -1.765 15.130 -26.656 176 HD2 LYS 20 2HD LYS 20 -2.030 17.306 -27.079 177 HD3 LYS 20 3HD LYS 20 -1.372 16.974 -28.683 178 HE2 LYS 20 2HE LYS 20 -3.622 16.600 -29.541 179 HE3 LYS 20 3HE LYS 20 -4.294 16.874 -27.934 180 HZ1 LYS 20 3HZ LYS 20 -4.501 18.850 -29.272 181 HZ2 LYS 20 1HZ LYS 20 -2.839 18.867 -29.587 182 HZ3 LYS 20 2HZ LYS 20 -3.405 19.139 -28.017 183 H LYS 21 H LYS 21 -1.239 11.945 -30.702 184 HA LYS 21 HA LYS 21 1.266 12.570 -32.002 185 HB2 LYS 21 2HB LYS 21 -0.218 10.050 -31.350 186 HB3 LYS 21 3HB LYS 21 1.091 10.010 -32.525 187 HG2 LYS 21 2HG LYS 21 2.642 10.858 -30.869 188 HG3 LYS 21 3HG LYS 21 1.336 10.994 -29.689 189 HD2 LYS 21 2HD LYS 21 1.234 8.360 -30.643 190 HD3 LYS 21 3HD LYS 21 2.944 8.710 -30.379 191 HE2 LYS 21 2HE LYS 21 2.684 8.964 -28.127 192 HE3 LYS 21 3HE LYS 21 1.025 9.543 -28.274 193 HZ1 LYS 21 3HZ LYS 21 0.417 7.214 -28.893 194 HZ2 LYS 21 1HZ LYS 21 0.939 7.409 -27.296 195 HZ3 LYS 21 2HZ LYS 21 1.980 6.743 -28.450 196 H LYS 22 H LYS 22 -1.955 11.456 -32.938 197 HA LYS 22 HA LYS 22 -3.013 11.335 -34.949 198 HB2 LYS 22 2HB LYS 22 -2.401 13.777 -34.887 199 HB3 LYS 22 3HB LYS 22 -0.988 13.385 -35.858 200 HG2 LYS 22 2HG LYS 22 -2.173 13.333 -37.737 201 HG3 LYS 22 3HG LYS 22 -3.436 12.338 -37.009 202 HD2 LYS 22 2HD LYS 22 -4.745 14.115 -36.557 203 HD3 LYS 22 3HD LYS 22 -3.377 15.128 -36.088 204 HE2 LYS 22 2HE LYS 22 -3.364 16.122 -38.077 205 HE3 LYS 22 3HE LYS 22 -3.279 14.568 -38.904 206 HZ1 LYS 22 3HZ LYS 22 -5.292 16.129 -39.291 207 HZ2 LYS 22 1HZ LYS 22 -5.853 15.495 -37.826 208 HZ3 LYS 22 2HZ LYS 22 -5.548 14.464 -39.132 209 H GLY 23 H GLY 23 -1.372 9.257 -34.638 210 HA2 GLY 23 2HA GLY 23 -0.916 8.309 -37.208 211 HA3 GLY 23 3HA GLY 23 0.617 8.953 -36.639 212 H GLY 24 H GLY 24 -1.955 7.188 -34.925 213 HA2 GLY 24 2HA GLY 24 -1.886 4.972 -34.151 214 HA3 GLY 24 3HA GLY 24 -0.200 4.878 -34.638 215 H GLY 25 H GLY 25 -0.690 3.794 -32.292 216 HA2 GLY 25 2HA GLY 25 0.986 5.064 -30.498 217 HA3 GLY 25 3HA GLY 25 -0.638 5.591 -30.082 218 H GLY 26 H GLY 26 1.356 3.876 -28.652 219 HA2 GLY 26 2HA GLY 26 -0.527 1.941 -27.683 220 HA3 GLY 26 3HA GLY 26 0.774 1.200 -28.602 221 H GLY 27 H GLY 27 -0.160 2.612 -25.616 222 HA2 GLY 27 2HA GLY 27 0.921 2.847 -23.604 223 HA3 GLY 27 3HA GLY 27 1.901 1.490 -24.138 224 H GLY 28 H GLY 28 3.886 2.115 -23.450 225 HA2 GLY 28 2HA GLY 28 5.904 3.163 -24.334 226 HA3 GLY 28 3HA GLY 28 4.941 4.599 -24.649 227 H GLY 29 H GLY 29 3.548 4.560 -22.117 228 HA2 GLY 29 2HA GLY 29 4.183 4.639 -19.759 229 HA3 GLY 29 3HA GLY 29 5.785 5.141 -20.278 230 H GLY 30 H GLY 30 6.179 7.205 -19.873 231 HA2 GLY 30 2HA GLY 30 3.983 9.139 -20.264 232 HA3 GLY 30 3HA GLY 30 5.006 9.205 -18.836 233 H GLY 31 H GLY 31 4.935 11.468 -20.143 234 HA2 GLY 31 2HA GLY 31 7.392 12.351 -20.631 235 HA3 GLY 31 3HA GLY 31 7.042 11.551 -22.157 236 H GLY 32 H GLY 32 7.575 14.358 -21.720 237 HA2 GLY 32 2HA GLY 32 5.165 15.404 -23.003 238 HA3 GLY 32 3HA GLY 32 5.694 16.200 -21.528 239 H VAL 33 H VAL 33 5.773 16.433 -24.775 240 HA VAL 33 HA VAL 33 7.946 18.337 -24.707 241 HB VAL 33 HB VAL 33 8.999 16.077 -25.212 242 HG11 VAL 33 1HG1 VAL 33 8.190 16.307 -28.028 243 HG12 VAL 33 2HG1 VAL 33 8.446 14.874 -27.032 244 HG13 VAL 33 3HG1 VAL 33 6.925 15.762 -26.928 245 HG21 VAL 33 3HG2 VAL 33 9.470 17.870 -27.536 246 HG22 VAL 33 1HG2 VAL 33 9.742 18.516 -25.917 247 HG23 VAL 33 2HG2 VAL 33 10.626 17.088 -26.457 248 H TRP 34 H TRP 34 5.000 18.118 -25.278 249 HA TRP 34 HA TRP 34 4.792 20.074 -27.238 250 HB2 TRP 34 2HB TRP 34 5.300 18.762 -29.047 251 HB3 TRP 34 3HB TRP 34 4.747 17.283 -28.266 252 HD1 TRP 34 HD1 TRP 34 2.828 16.314 -29.639 253 HE1 TRP 34 HE1 TRP 34 0.744 17.249 -30.827 254 HE3 TRP 34 HE3 TRP 34 3.568 21.297 -28.773 255 HZ2 TRP 34 HZ2 TRP 34 -0.429 19.766 -31.331 256 HZ3 TRP 34 HZ3 TRP 34 1.918 22.903 -29.642 257 HH2 TRP 34 HH2 TRP 34 -0.038 22.151 -30.895 258 HA PRO 35 HA PRO 35 0.404 18.226 -26.421 259 HB2 PRO 35 2HB PRO 35 0.269 15.914 -25.005 260 HB3 PRO 35 3HB PRO 35 0.399 15.955 -26.767 261 HG2 PRO 35 2HG PRO 35 2.537 15.506 -24.721 262 HG3 PRO 35 3HG PRO 35 2.260 14.659 -26.254 263 HD2 PRO 35 2HD PRO 35 4.136 16.591 -25.975 264 HD3 PRO 35 3HD PRO 35 3.264 16.320 -27.498 265 H LEU 36 H LEU 36 0.091 19.907 -25.011 266 HA LEU 36 HA LEU 36 0.986 19.676 -22.253 267 HB2 LEU 36 2HB LEU 36 -0.506 21.873 -23.680 268 HB3 LEU 36 3HB LEU 36 0.070 21.953 -22.016 269 HG LEU 36 HG LEU 36 1.958 21.532 -24.313 270 HD11 LEU 36 1HD1 LEU 36 1.934 23.680 -24.920 271 HD12 LEU 36 2HD1 LEU 36 1.792 24.245 -23.255 272 HD13 LEU 36 3HD1 LEU 36 0.352 23.742 -24.141 273 HD21 LEU 36 3HD2 LEU 36 2.730 23.065 -21.935 274 HD22 LEU 36 1HD2 LEU 36 3.587 21.782 -22.791 275 HD23 LEU 36 2HD2 LEU 36 2.329 21.375 -21.624 276 H VAL 37 H VAL 37 -1.986 19.616 -24.122 277 HA VAL 37 HA VAL 37 -3.900 19.863 -22.154 278 HB VAL 37 HB VAL 37 -5.321 18.343 -23.560 279 HG11 VAL 37 1HG1 VAL 37 -4.203 20.138 -25.570 280 HG12 VAL 37 2HG1 VAL 37 -5.813 20.104 -24.848 281 HG13 VAL 37 3HG1 VAL 37 -4.488 20.916 -24.014 282 HG21 VAL 37 3HG2 VAL 37 -3.674 16.828 -24.412 283 HG22 VAL 37 1HG2 VAL 37 -4.367 17.703 -25.778 284 HG23 VAL 37 2HG2 VAL 37 -2.775 18.147 -25.162 285 H ILE 38 H ILE 38 -2.008 17.014 -23.034 286 HA ILE 38 HA ILE 38 -3.324 15.080 -21.547 287 HB ILE 38 HB ILE 38 -1.243 13.826 -21.517 288 HG12 ILE 38 2HG1 ILE 38 0.689 15.219 -22.791 289 HG13 ILE 38 3HG1 ILE 38 -0.085 16.527 -21.904 290 HG21 ILE 38 1HG2 ILE 38 -2.048 13.462 -23.590 291 HG22 ILE 38 2HG2 ILE 38 -2.214 15.182 -23.942 292 HG23 ILE 38 3HG2 ILE 38 -0.639 14.402 -24.083 293 HD11 ILE 38 3HD1 ILE 38 1.602 14.341 -20.951 294 HD12 ILE 38 1HD1 ILE 38 1.314 15.942 -20.268 295 HD13 ILE 38 2HD1 ILE 38 0.165 14.636 -19.971 296 H ARG 39 H ARG 39 -1.151 17.605 -20.504 297 HA ARG 39 HA ARG 39 -0.718 16.527 -17.883 298 HB2 ARG 39 2HB ARG 39 0.699 18.284 -17.559 299 HB3 ARG 39 3HB ARG 39 0.642 18.317 -19.316 300 HG2 ARG 39 2HG ARG 39 -1.367 19.950 -18.911 301 HG3 ARG 39 3HG ARG 39 -0.590 20.169 -17.342 302 HD2 ARG 39 2HD ARG 39 1.560 20.565 -18.676 303 HD3 ARG 39 3HD ARG 39 0.505 20.745 -20.077 304 HE ARG 39 HE ARG 39 -0.123 22.801 -19.294 305 HH11 ARG 39 1HH1 ARG 39 1.425 21.029 -16.728 306 HH12 ARG 39 2HH1 ARG 39 1.465 22.380 -15.644 307 HH21 ARG 39 1HH2 ARG 39 -0.076 24.586 -17.875 308 HH22 ARG 39 2HH2 ARG 39 0.610 24.402 -16.297 309 H THR 40 H THR 40 -3.102 18.541 -19.387 310 HA THR 40 HA THR 40 -4.144 19.975 -17.277 311 HB THR 40 HB THR 40 -5.974 18.630 -19.245 312 HG1 THR 40 HG1 THR 40 -5.372 20.495 -20.627 313 HG21 THR 40 3HG2 THR 40 -6.720 21.200 -19.163 314 HG22 THR 40 1HG2 THR 40 -5.980 21.073 -17.568 315 HG23 THR 40 2HG2 THR 40 -7.307 20.000 -18.012 316 H VAL 41 H VAL 41 -5.251 16.753 -18.346 317 HA VAL 41 HA VAL 41 -6.952 16.343 -16.121 318 HB VAL 41 HB VAL 41 -5.706 14.159 -17.784 319 HG11 VAL 41 1HG1 VAL 41 -8.416 14.317 -16.476 320 HG12 VAL 41 2HG1 VAL 41 -7.681 12.913 -17.251 321 HG13 VAL 41 3HG1 VAL 41 -7.009 13.545 -15.747 322 HG21 VAL 41 3HG2 VAL 41 -6.614 15.151 -19.571 323 HG22 VAL 41 1HG2 VAL 41 -8.169 14.671 -18.892 324 HG23 VAL 41 2HG2 VAL 41 -7.533 16.286 -18.581 325 H ILE 42 H ILE 42 -3.623 15.373 -16.817 326 HA ILE 42 HA ILE 42 -3.204 13.687 -14.634 327 HB ILE 42 HB ILE 42 -1.249 15.484 -16.069 328 HG12 ILE 42 2HG1 ILE 42 -2.579 13.158 -16.882 329 HG13 ILE 42 3HG1 ILE 42 -1.189 13.908 -17.658 330 HG21 ILE 42 1HG2 ILE 42 -0.375 14.971 -13.875 331 HG22 ILE 42 2HG2 ILE 42 -0.725 13.259 -14.104 332 HG23 ILE 42 3HG2 ILE 42 0.504 14.048 -15.093 333 HD11 ILE 42 3HD1 ILE 42 0.318 12.514 -16.419 334 HD12 ILE 42 1HD1 ILE 42 -1.014 11.845 -15.478 335 HD13 ILE 42 2HD1 ILE 42 -0.894 11.503 -17.204 336 H ALA 43 H ALA 43 -3.312 17.160 -14.836 337 HA ALA 43 HA ALA 43 -1.920 18.013 -12.648 338 HB1 ALA 43 1HB ALA 43 -3.398 19.905 -12.539 339 HB2 ALA 43 2HB ALA 43 -3.160 19.466 -14.231 340 HB3 ALA 43 3HB ALA 43 -4.656 19.025 -13.408 341 H GLY 44 H GLY 44 -4.828 16.122 -12.692 342 HA2 GLY 44 2HA GLY 44 -5.238 16.527 -9.815 343 HA3 GLY 44 3HA GLY 44 -6.355 15.730 -10.914 344 H TYR 45 H TYR 45 -4.217 14.096 -12.113 345 HA TYR 45 HA TYR 45 -4.477 11.797 -10.578 346 HB2 TYR 45 2HB TYR 45 -2.331 12.504 -12.588 347 HB3 TYR 45 3HB TYR 45 -2.620 10.885 -11.962 348 HD1 TYR 45 HD2 TYR 45 -5.776 12.126 -12.076 349 HD2 TYR 45 HD1 TYR 45 -2.661 11.011 -14.751 350 HE1 TYR 45 HE2 TYR 45 -7.441 11.739 -13.844 351 HE2 TYR 45 HE1 TYR 45 -4.317 10.623 -16.528 352 HH TYR 45 HH TYR 45 -6.706 10.121 -16.739 353 H ASN 46 H ASN 46 -1.784 14.105 -10.717 354 HA ASN 46 HA ASN 46 0.054 12.856 -9.106 355 HB2 ASN 46 2HB ASN 46 0.192 15.135 -10.312 356 HB3 ASN 46 3HB ASN 46 -0.490 15.803 -8.833 357 HD21 ASN 46 1HD2 ASN 46 1.929 16.655 -9.655 358 HD22 ASN 46 2HD2 ASN 46 3.170 16.049 -8.617 359 H LEU 47 H LEU 47 -2.988 14.230 -8.211 360 HA LEU 47 HA LEU 47 -2.362 14.280 -5.378 361 HB2 LEU 47 2HB LEU 47 -4.013 15.785 -6.842 362 HB3 LEU 47 3HB LEU 47 -5.153 14.539 -6.337 363 HG LEU 47 HG LEU 47 -3.856 15.293 -3.992 364 HD11 LEU 47 1HD1 LEU 47 -4.072 17.557 -5.889 365 HD12 LEU 47 2HD1 LEU 47 -2.937 17.285 -4.568 366 HD13 LEU 47 3HD1 LEU 47 -4.573 17.843 -4.222 367 HD21 LEU 47 3HD2 LEU 47 -6.020 15.027 -3.527 368 HD22 LEU 47 1HD2 LEU 47 -6.503 15.392 -5.184 369 HD23 LEU 47 2HD2 LEU 47 -6.229 16.703 -4.035 370 H TYR 48 H TYR 48 -4.205 12.328 -7.656 371 HA TYR 48 HA TYR 48 -5.680 10.723 -5.999 372 HB2 TYR 48 2HB TYR 48 -4.809 10.632 -8.693 373 HB3 TYR 48 3HB TYR 48 -4.475 9.052 -7.994 374 HD1 TYR 48 HD2 TYR 48 -6.508 8.128 -6.493 375 HD2 TYR 48 HD1 TYR 48 -6.868 10.926 -9.679 376 HE1 TYR 48 HE2 TYR 48 -8.872 7.506 -6.765 377 HE2 TYR 48 HE1 TYR 48 -9.233 10.312 -9.959 378 HH TYR 48 HH TYR 48 -10.825 8.809 -9.397 379 H ARG 49 H ARG 49 -2.261 10.336 -6.863 380 HA ARG 49 HA ARG 49 -1.941 8.000 -5.220 381 HB2 ARG 49 2HB ARG 49 -0.308 9.546 -7.095 382 HB3 ARG 49 3HB ARG 49 0.601 8.936 -5.718 383 HG2 ARG 49 2HG ARG 49 -0.755 6.717 -6.385 384 HG3 ARG 49 3HG ARG 49 -0.634 7.491 -7.967 385 HD2 ARG 49 2HD ARG 49 1.327 6.333 -7.976 386 HD3 ARG 49 3HD ARG 49 1.879 7.819 -7.204 387 HE ARG 49 HE ARG 49 1.000 6.037 -5.223 388 HH11 ARG 49 1HH1 ARG 49 3.573 6.407 -7.539 389 HH12 ARG 49 2HH1 ARG 49 4.724 5.518 -6.598 390 HH21 ARG 49 1HH2 ARG 49 2.507 4.865 -3.974 391 HH22 ARG 49 2HH2 ARG 49 4.116 4.641 -4.571 392 H ALA 50 H ALA 50 -1.683 11.416 -4.789 393 HA ALA 50 HA ALA 50 0.114 11.691 -2.724 394 HB1 ALA 50 1HB ALA 50 -0.905 13.735 -2.222 395 HB2 ALA 50 2HB ALA 50 -1.258 13.482 -3.932 396 HB3 ALA 50 3HB ALA 50 -2.499 13.166 -2.720 397 H ILE 51 H ILE 51 -3.230 10.576 -2.580 398 HA ILE 51 HA ILE 51 -3.186 10.367 0.305 399 HB ILE 51 HB ILE 51 -5.256 9.422 -1.681 400 HG12 ILE 51 2HG1 ILE 51 -4.964 11.864 -1.662 401 HG13 ILE 51 3HG1 ILE 51 -6.520 11.401 -0.982 402 HG21 ILE 51 1HG2 ILE 51 -4.991 9.123 1.222 403 HG22 ILE 51 2HG2 ILE 51 -6.550 9.748 0.688 404 HG23 ILE 51 3HG2 ILE 51 -5.959 8.206 0.069 405 HD11 ILE 51 3HD1 ILE 51 -4.066 12.258 0.531 406 HD12 ILE 51 1HD1 ILE 51 -5.571 13.157 0.338 407 HD13 ILE 51 2HD1 ILE 51 -5.549 11.665 1.279 408 H LYS 52 H LYS 52 -2.408 8.393 -2.388 409 HA LYS 52 HA LYS 52 -2.805 5.861 -1.109 410 HB2 LYS 52 2HB LYS 52 -1.271 6.675 -3.580 411 HB3 LYS 52 3HB LYS 52 -1.417 5.008 -3.037 412 HG2 LYS 52 2HG LYS 52 -3.696 6.815 -3.821 413 HG3 LYS 52 3HG LYS 52 -3.017 5.511 -4.797 414 HD2 LYS 52 2HD LYS 52 -4.435 4.101 -3.825 415 HD3 LYS 52 3HD LYS 52 -3.625 4.396 -2.284 416 HE2 LYS 52 2HE LYS 52 -5.107 6.334 -1.914 417 HE3 LYS 52 3HE LYS 52 -5.942 5.959 -3.420 418 HZ1 LYS 52 3HZ LYS 52 -5.774 4.166 -1.058 419 HZ2 LYS 52 1HZ LYS 52 -6.597 3.833 -2.498 420 HZ3 LYS 52 2HZ LYS 52 -7.122 5.089 -1.495 421 H LYS 53 H LYS 53 -0.265 8.212 -1.222 422 HA LYS 53 HA LYS 53 1.757 6.386 -0.236 423 HB2 LYS 53 2HB LYS 53 2.802 7.954 -1.541 424 HB3 LYS 53 3HB LYS 53 1.676 9.231 -1.099 425 HG2 LYS 53 2HG LYS 53 2.833 9.782 0.805 426 HG3 LYS 53 3HG LYS 53 3.563 8.182 0.955 427 HD2 LYS 53 2HD LYS 53 4.268 9.745 -1.457 428 HD3 LYS 53 3HD LYS 53 4.907 10.331 0.081 429 HE2 LYS 53 2HE LYS 53 5.607 7.860 0.441 430 HE3 LYS 53 3HE LYS 53 5.393 7.721 -1.304 431 HZ1 LYS 53 3HZ LYS 53 7.618 8.657 0.027 432 HZ2 LYS 53 1HZ LYS 53 6.908 10.029 -0.661 433 HZ3 LYS 53 2HZ LYS 53 7.330 8.715 -1.639 434 H LYS 54 H LYS 54 -0.225 9.037 0.996 435 HA LYS 54 HA LYS 54 0.938 8.889 3.633 436 HB2 LYS 54 2HB LYS 54 -1.368 10.443 2.467 437 HB3 LYS 54 3HB LYS 54 -0.968 10.496 4.179 438 HG2 LYS 54 2HG LYS 54 1.433 11.073 3.209 439 HG3 LYS 54 3HG LYS 54 0.459 11.653 1.856 440 HD2 LYS 54 2HD LYS 54 -0.885 12.974 3.510 441 HD3 LYS 54 3HD LYS 54 0.294 12.515 4.741 442 HE2 LYS 54 2HE LYS 54 1.957 13.809 3.822 443 HE3 LYS 54 3HE LYS 54 1.263 13.740 2.203 444 HZ1 LYS 54 3HZ LYS 54 -0.636 15.053 3.583 445 HZ2 LYS 54 1HZ LYS 54 0.575 15.800 2.668 446 HZ3 LYS 54 2HZ LYS 54 0.769 15.615 4.338 447 H GLY 55 H GLY 55 -2.463 8.606 2.585 448 HA2 GLY 55 2HA GLY 55 -3.897 6.781 3.031 449 HA3 GLY 55 3HA GLY 55 -2.732 6.181 4.201 450 H GLY 56 H GLY 56 -5.340 8.448 3.639 451 HA2 GLY 56 2HA GLY 56 -6.216 8.293 6.334 452 HA3 GLY 56 3HA GLY 56 -5.377 9.812 6.058 453 H GLY 57 H GLY 57 -8.092 7.818 4.991 454 HA2 GLY 57 2HA GLY 57 -9.808 10.076 4.770 455 HA3 GLY 57 3HA GLY 57 -9.283 9.541 3.180 456 H GLY 58 H GLY 58 -10.094 7.677 6.099 457 HA2 GLY 58 2HA GLY 58 -12.097 6.244 4.468 458 HA3 GLY 58 3HA GLY 58 -11.183 5.514 5.779 459 H GLY 59 H GLY 59 -11.458 6.969 7.908 460 HA2 GLY 59 2HA GLY 59 -14.335 7.560 8.190 461 HA3 GLY 59 3HA GLY 59 -13.511 6.525 9.346 462 H GLY 60 H GLY 60 -13.697 9.804 8.064 463 HA2 GLY 60 2HA GLY 60 -11.907 10.915 10.004 464 HA3 GLY 60 3HA GLY 60 -12.969 11.814 8.931 465 H GLY 61 H GLY 61 -14.910 12.560 9.674 466 HA2 GLY 61 2HA GLY 61 -16.594 11.805 11.583 467 HA3 GLY 61 3HA GLY 61 -15.275 12.427 12.564 468 H GLY 62 H GLY 62 -18.017 13.395 12.373 469 HA2 GLY 62 2HA GLY 62 -18.187 15.883 12.823 470 HA3 GLY 62 3HA GLY 62 -17.537 16.062 11.200 471 H GLY 63 H GLY 63 -19.109 13.711 10.256 472 HA2 GLY 63 2HA GLY 63 -21.457 13.199 9.984 473 HA3 GLY 63 3HA GLY 63 -21.815 14.879 10.354 474 H GLY 64 H GLY 64 -19.574 15.787 8.605 475 HA2 GLY 64 2HA GLY 64 -20.945 15.344 6.025 476 HA3 GLY 64 3HA GLY 64 -20.192 16.864 6.486 477 H VAL 65 H VAL 65 -19.823 14.387 4.472 478 HA VAL 65 HA VAL 65 -17.220 13.450 4.759 479 HB VAL 65 HB VAL 65 -17.271 13.183 2.235 480 HG11 VAL 65 1HG1 VAL 65 -19.426 12.072 4.012 481 HG12 VAL 65 2HG1 VAL 65 -19.191 11.522 2.352 482 HG13 VAL 65 3HG1 VAL 65 -17.900 11.325 3.538 483 HG21 VAL 65 3HG2 VAL 65 -20.146 14.016 2.459 484 HG22 VAL 65 1HG2 VAL 65 -18.883 15.158 2.000 485 HG23 VAL 65 2HG2 VAL 65 -19.187 13.733 1.007 486 H TRP 66 H TRP 66 -15.500 13.976 2.964 487 HA TRP 66 HA TRP 66 -15.195 16.898 2.779 488 HB2 TRP 66 2HB TRP 66 -12.749 16.569 3.183 489 HB3 TRP 66 3HB TRP 66 -13.757 16.177 4.573 490 HD1 TRP 66 HD1 TRP 66 -11.114 14.743 2.375 491 HE1 TRP 66 HE1 TRP 66 -10.692 12.279 2.990 492 HE3 TRP 66 HE3 TRP 66 -15.155 13.960 5.407 493 HZ2 TRP 66 HZ2 TRP 66 -11.912 10.270 4.554 494 HZ3 TRP 66 HZ3 TRP 66 -15.455 11.739 6.423 495 HH2 TRP 66 HH2 TRP 66 -13.866 9.934 6.003 496 HA PRO 67 HA PRO 67 -14.738 14.945 -1.398 497 HB2 PRO 67 2HB PRO 67 -16.222 16.818 -2.686 498 HB3 PRO 67 3HB PRO 67 -16.931 15.396 -1.912 499 HG2 PRO 67 2HG PRO 67 -16.729 18.203 -0.894 500 HG3 PRO 67 3HG PRO 67 -18.099 17.080 -0.814 501 HD2 PRO 67 2HD PRO 67 -16.451 17.521 1.289 502 HD3 PRO 67 3HD PRO 67 -17.230 15.952 0.999 503 H LEU 68 H LEU 68 -12.606 16.165 -0.355 504 HA LEU 68 HA LEU 68 -12.047 18.594 -1.869 505 HB2 LEU 68 2HB LEU 68 -10.179 18.896 -0.497 506 HB3 LEU 68 3HB LEU 68 -11.432 18.267 0.571 507 HG LEU 68 HG LEU 68 -10.186 15.971 -0.098 508 HD11 LEU 68 1HD1 LEU 68 -8.457 16.853 -1.424 509 HD12 LEU 68 2HD1 LEU 68 -7.719 16.507 0.139 510 HD13 LEU 68 3HD1 LEU 68 -8.142 18.165 -0.288 511 HD21 LEU 68 3HD2 LEU 68 -9.491 15.921 2.085 512 HD22 LEU 68 1HD2 LEU 68 -10.682 17.220 2.160 513 HD23 LEU 68 2HD2 LEU 68 -8.963 17.605 2.072 514 H VAL 69 H VAL 69 -11.436 15.208 -1.966 515 HA VAL 69 HA VAL 69 -9.160 15.440 -3.752 516 HB VAL 69 HB VAL 69 -9.224 12.979 -3.827 517 HG11 VAL 69 1HG1 VAL 69 -9.380 13.099 -0.992 518 HG12 VAL 69 2HG1 VAL 69 -7.943 13.087 -2.017 519 HG13 VAL 69 3HG1 VAL 69 -8.698 14.618 -1.573 520 HG21 VAL 69 3HG2 VAL 69 -11.811 13.429 -2.434 521 HG22 VAL 69 1HG2 VAL 69 -11.375 12.234 -3.655 522 HG23 VAL 69 2HG2 VAL 69 -10.859 12.014 -1.983 523 H ILE 70 H ILE 70 -12.554 14.437 -3.912 524 HA ILE 70 HA ILE 70 -12.754 13.463 -6.452 525 HB ILE 70 HB ILE 70 -15.053 14.595 -6.513 526 HG12 ILE 70 2HG1 ILE 70 -15.381 15.099 -3.797 527 HG13 ILE 70 3HG1 ILE 70 -13.850 15.874 -4.190 528 HG21 ILE 70 1HG2 ILE 70 -14.979 12.343 -5.885 529 HG22 ILE 70 2HG2 ILE 70 -14.151 12.701 -4.370 530 HG23 ILE 70 3HG2 ILE 70 -15.849 13.133 -4.570 531 HD11 ILE 70 3HD1 ILE 70 -15.435 16.675 -6.255 532 HD12 ILE 70 1HD1 ILE 70 -16.574 16.619 -4.911 533 HD13 ILE 70 2HD1 ILE 70 -15.116 17.604 -4.791 534 H ARG 71 H ARG 71 -13.003 16.902 -5.548 535 HA ARG 71 HA ARG 71 -13.368 18.000 -8.046 536 HB2 ARG 71 2HB ARG 71 -12.173 20.024 -7.110 537 HB3 ARG 71 3HB ARG 71 -13.520 19.423 -6.153 538 HG2 ARG 71 2HG ARG 71 -11.921 18.265 -4.679 539 HG3 ARG 71 3HG ARG 71 -10.595 18.960 -5.613 540 HD2 ARG 71 2HD ARG 71 -12.423 21.027 -4.848 541 HD3 ARG 71 3HD ARG 71 -11.960 20.093 -3.426 542 HE ARG 71 HE ARG 71 -9.641 20.659 -4.864 543 HH11 ARG 71 1HH1 ARG 71 -12.109 22.355 -3.088 544 HH12 ARG 71 2HH1 ARG 71 -11.060 23.650 -2.613 545 HH21 ARG 71 1HH2 ARG 71 -8.251 22.358 -4.245 546 HH22 ARG 71 2HH2 ARG 71 -8.866 23.652 -3.272 547 H THR 72 H THR 72 -10.308 17.154 -6.465 548 HA THR 72 HA THR 72 -8.495 18.153 -8.271 549 HB THR 72 HB THR 72 -7.988 15.405 -7.226 550 HG1 THR 72 HG1 THR 72 -8.146 17.728 -5.577 551 HG21 THR 72 3HG2 THR 72 -5.926 16.059 -7.766 552 HG22 THR 72 1HG2 THR 72 -6.009 17.232 -6.453 553 HG23 THR 72 2HG2 THR 72 -6.477 17.703 -8.087 554 H VAL 73 H VAL 73 -10.300 15.114 -8.461 555 HA VAL 73 HA VAL 73 -9.035 14.209 -10.848 556 HB VAL 73 HB VAL 73 -11.773 13.368 -9.921 557 HG11 VAL 73 1HG1 VAL 73 -10.949 12.578 -12.122 558 HG12 VAL 73 2HG1 VAL 73 -9.581 11.824 -11.301 559 HG13 VAL 73 3HG1 VAL 73 -11.223 11.273 -10.969 560 HG21 VAL 73 3HG2 VAL 73 -10.495 11.571 -8.648 561 HG22 VAL 73 1HG2 VAL 73 -9.083 12.613 -8.814 562 HG23 VAL 73 2HG2 VAL 73 -10.505 13.188 -7.945 563 H ILE 74 H ILE 74 -12.144 15.790 -10.174 564 HA ILE 74 HA ILE 74 -13.103 15.830 -12.808 565 HB ILE 74 HB ILE 74 -13.767 18.130 -11.053 566 HG12 ILE 74 2HG1 ILE 74 -14.228 15.249 -10.329 567 HG13 ILE 74 3HG1 ILE 74 -13.653 16.564 -9.309 568 HG21 ILE 74 1HG2 ILE 74 -14.868 16.845 -13.284 569 HG22 ILE 74 2HG2 ILE 74 -15.957 16.499 -11.941 570 HG23 ILE 74 3HG2 ILE 74 -15.567 18.169 -12.353 571 HD11 ILE 74 3HD1 ILE 74 -16.072 17.514 -9.869 572 HD12 ILE 74 1HD1 ILE 74 -16.407 15.792 -10.044 573 HD13 ILE 74 2HD1 ILE 74 -15.764 16.415 -8.524 574 H ALA 75 H ALA 75 -10.703 17.744 -11.225 575 HA ALA 75 HA ALA 75 -10.698 20.117 -12.598 576 HB1 ALA 75 1HB ALA 75 -9.146 19.680 -10.802 577 HB2 ALA 75 2HB ALA 75 -8.312 18.467 -11.774 578 HB3 ALA 75 3HB ALA 75 -8.255 20.165 -12.245 579 H GLY 76 H GLY 76 -9.985 16.956 -13.813 580 HA2 GLY 76 2HA GLY 76 -8.764 18.021 -16.247 581 HA3 GLY 76 3HA GLY 76 -8.894 16.325 -15.808 582 H TYR 77 H TYR 77 -11.785 16.721 -15.127 583 HA TYR 77 HA TYR 77 -12.951 15.768 -17.422 584 HB2 TYR 77 2HB TYR 77 -14.756 15.648 -16.105 585 HB3 TYR 77 3HB TYR 77 -13.828 16.482 -14.864 586 HD1 TYR 77 HD2 TYR 77 -16.167 17.014 -17.690 587 HD2 TYR 77 HD1 TYR 77 -14.393 18.674 -14.198 588 HE1 TYR 77 HE2 TYR 77 -17.736 18.905 -17.799 589 HE2 TYR 77 HE1 TYR 77 -15.958 20.569 -14.296 590 HH TYR 77 HH TYR 77 -18.247 20.924 -16.970 591 H ASN 78 H ASN 78 -12.820 19.145 -16.326 592 HA ASN 78 HA ASN 78 -14.323 20.375 -18.261 593 HB2 ASN 78 2HB ASN 78 -12.718 21.251 -16.242 594 HB3 ASN 78 3HB ASN 78 -11.796 21.770 -17.650 595 HD21 ASN 78 1HD2 ASN 78 -12.844 23.592 -15.906 596 HD22 ASN 78 2HD2 ASN 78 -14.122 24.465 -16.674 597 H LEU 79 H LEU 79 -11.317 18.758 -18.643 598 HA LEU 79 HA LEU 79 -10.834 19.975 -21.258 599 HB2 LEU 79 2HB LEU 79 -9.130 19.173 -19.274 600 HB3 LEU 79 3HB LEU 79 -9.059 17.814 -20.395 601 HG LEU 79 HG LEU 79 -7.262 19.442 -20.777 602 HD11 LEU 79 1HD1 LEU 79 -8.699 19.934 -23.226 603 HD12 LEU 79 2HD1 LEU 79 -8.948 18.281 -22.665 604 HD13 LEU 79 3HD1 LEU 79 -7.312 18.887 -22.925 605 HD21 LEU 79 3HD2 LEU 79 -8.907 21.379 -20.109 606 HD22 LEU 79 1HD2 LEU 79 -9.230 21.407 -21.843 607 HD23 LEU 79 2HD2 LEU 79 -7.589 21.661 -21.248 608 H TYR 80 H TYR 80 -11.761 16.942 -19.765 609 HA TYR 80 HA TYR 80 -11.450 15.114 -21.763 610 HB2 TYR 80 2HB TYR 80 -12.748 13.803 -20.475 611 HB3 TYR 80 3HB TYR 80 -12.813 15.174 -19.373 612 HD1 TYR 80 HD2 TYR 80 -14.561 13.857 -22.403 613 HD2 TYR 80 HD1 TYR 80 -14.888 15.946 -18.711 614 HE1 TYR 80 HE2 TYR 80 -17.003 13.954 -22.680 615 HE2 TYR 80 HE1 TYR 80 -17.330 16.049 -18.978 616 HH TYR 80 HH TYR 80 -19.010 15.888 -20.634 617 H ARG 81 H ARG 81 -14.062 17.488 -21.460 618 HA ARG 81 HA ARG 81 -15.252 16.635 -23.964 619 HB2 ARG 81 2HB ARG 81 -16.125 18.076 -21.654 620 HB3 ARG 81 3HB ARG 81 -16.380 19.084 -23.072 621 HG2 ARG 81 2HG ARG 81 -17.228 16.316 -23.440 622 HG3 ARG 81 3HG ARG 81 -18.091 17.165 -22.155 623 HD2 ARG 81 2HD ARG 81 -17.728 18.707 -24.626 624 HD3 ARG 81 3HD ARG 81 -18.736 17.271 -24.795 625 HE ARG 81 HE ARG 81 -19.633 18.590 -22.540 626 HH11 ARG 81 1HH1 ARG 81 -19.335 19.257 -25.944 627 HH12 ARG 81 2HH1 ARG 81 -20.694 20.331 -25.985 628 HH21 ARG 81 1HH2 ARG 81 -21.424 20.002 -22.581 629 HH22 ARG 81 2HH2 ARG 81 -21.881 20.755 -24.072 630 H ALA 82 H ALA 82 -13.038 19.021 -22.821 631 HA ALA 82 HA ALA 82 -13.289 21.068 -24.655 632 HB1 ALA 82 1HB ALA 82 -11.019 21.636 -24.183 633 HB2 ALA 82 2HB ALA 82 -11.733 21.002 -22.700 634 HB3 ALA 82 3HB ALA 82 -10.656 19.990 -23.664 635 H ILE 83 H ILE 83 -11.832 17.899 -25.066 636 HA ILE 83 HA ILE 83 -10.748 18.523 -27.666 637 HB ILE 83 HB ILE 83 -11.035 15.877 -26.238 638 HG12 ILE 83 2HG1 ILE 83 -9.498 17.383 -25.105 639 HG13 ILE 83 3HG1 ILE 83 -8.589 16.107 -25.907 640 HG21 ILE 83 1HG2 ILE 83 -10.187 16.567 -28.957 641 HG22 ILE 83 2HG2 ILE 83 -9.064 15.532 -28.078 642 HG23 ILE 83 3HG2 ILE 83 -10.740 15.029 -28.294 643 HD11 ILE 83 3HD1 ILE 83 -8.381 18.939 -26.202 644 HD12 ILE 83 1HD1 ILE 83 -7.357 17.667 -26.867 645 HD13 ILE 83 2HD1 ILE 83 -8.784 18.205 -27.754 646 H LYS 84 H LYS 84 -13.734 17.405 -26.401 647 HA LYS 84 HA LYS 84 -14.635 16.034 -28.747 648 HB2 LYS 84 2HB LYS 84 -15.807 15.298 -26.916 649 HB3 LYS 84 3HB LYS 84 -15.839 16.886 -26.162 650 HG2 LYS 84 2HG LYS 84 -18.065 16.213 -26.822 651 HG3 LYS 84 3HG LYS 84 -17.541 17.610 -27.765 652 HD2 LYS 84 2HD LYS 84 -18.045 16.464 -29.606 653 HD3 LYS 84 3HD LYS 84 -16.714 15.369 -29.223 654 HE2 LYS 84 2HE LYS 84 -18.690 14.058 -29.539 655 HE3 LYS 84 3HE LYS 84 -18.297 14.050 -27.820 656 HZ1 LYS 84 3HZ LYS 84 -20.441 15.568 -29.187 657 HZ2 LYS 84 1HZ LYS 84 -19.944 15.921 -27.609 658 HZ3 LYS 84 2HZ LYS 84 -20.601 14.405 -27.969 659 H LYS 85 H LYS 85 -14.912 19.302 -27.481 660 HA LYS 85 HA LYS 85 -16.821 20.206 -29.387 661 HB2 LYS 85 2HB LYS 85 -14.859 21.703 -27.644 662 HB3 LYS 85 3HB LYS 85 -16.073 22.488 -28.646 663 HG2 LYS 85 2HG LYS 85 -17.607 22.220 -27.076 664 HG3 LYS 85 3HG LYS 85 -17.319 20.479 -27.034 665 HD2 LYS 85 2HD LYS 85 -16.719 20.958 -24.898 666 HD3 LYS 85 3HD LYS 85 -15.168 21.293 -25.672 667 HE2 LYS 85 2HE LYS 85 -15.712 23.659 -25.779 668 HE3 LYS 85 3HE LYS 85 -17.300 23.345 -25.081 669 HZ1 LYS 85 3HZ LYS 85 -15.397 24.149 -23.565 670 HZ2 LYS 85 1HZ LYS 85 -14.864 22.545 -23.630 671 HZ3 LYS 85 2HZ LYS 85 -16.401 22.901 -23.020 672 H LYS 86 H LYS 86 -13.296 20.231 -29.238 673 HA LYS 86 HA LYS 86 -12.717 21.884 -31.381 674 HB2 LYS 86 2HB LYS 86 -11.303 20.073 -29.738 675 HB3 LYS 86 3HB LYS 86 -10.933 19.629 -31.399 676 HG2 LYS 86 2HG LYS 86 -10.809 22.507 -30.792 677 HG3 LYS 86 3HG LYS 86 -9.593 21.497 -30.005 678 HD2 LYS 86 2HD LYS 86 -8.592 20.928 -31.978 679 HD3 LYS 86 3HD LYS 86 -10.089 21.065 -32.903 680 HE2 LYS 86 2HE LYS 86 -9.821 23.618 -32.265 681 HE3 LYS 86 3HE LYS 86 -8.124 23.161 -32.131 682 HZ1 LYS 86 3HZ LYS 86 -7.998 23.377 -34.319 683 HZ2 LYS 86 1HZ LYS 86 -9.667 23.618 -34.461 684 HZ3 LYS 86 2HZ LYS 86 -9.033 22.050 -34.490 685 H GLY 87 H GLY 87 -13.010 21.766 -33.514 686 HA2 GLY 87 2HA GLY 87 -13.219 20.822 -35.624 687 HA3 GLY 87 3HA GLY 87 -13.057 19.231 -34.896 688 H GLY 88 H GLY 88 -15.405 21.355 -33.540 689 HA2 GLY 88 2HA GLY 88 -17.626 21.020 -35.121 690 HA3 GLY 88 3HA GLY 88 -17.523 19.539 -34.180 691 H GLY 89 H GLY 89 -17.355 23.071 -33.703 692 HA2 GLY 89 2HA GLY 89 -19.072 24.142 -32.347 693 HA3 GLY 89 3HA GLY 89 -19.088 22.701 -31.342 694 H GLY 90 H GLY 90 -18.882 24.731 -29.829 695 HA2 GLY 90 2HA GLY 90 -16.083 24.768 -28.994 696 HA3 GLY 90 3HA GLY 90 -16.825 26.321 -29.349 697 H GLY 91 H GLY 91 -16.308 26.814 -27.100 698 HA2 GLY 91 2HA GLY 91 -17.247 25.477 -24.871 699 HA3 GLY 91 3HA GLY 91 -17.026 27.218 -24.956 700 H GLY 92 H GLY 92 -19.262 24.697 -24.666 701 HA2 GLY 92 2HA GLY 92 -21.419 26.307 -24.014 702 HA3 GLY 92 3HA GLY 92 -21.568 25.975 -25.733 703 H GLY 93 H GLY 93 -23.557 24.883 -25.231 704 HA2 GLY 93 2HA GLY 93 -23.165 22.259 -23.937 705 HA3 GLY 93 3HA GLY 93 -24.700 23.111 -24.016 706 H GLY 94 H GLY 94 -24.233 20.411 -24.830 707 HA2 GLY 94 2HA GLY 94 -25.476 19.368 -26.610 708 HA3 GLY 94 3HA GLY 94 -24.978 20.681 -27.667 709 H GLY 95 H GLY 95 -24.020 19.494 -29.262 710 HA2 GLY 95 2HA GLY 95 -22.001 18.717 -30.187 711 HA3 GLY 95 3HA GLY 95 -21.437 18.321 -28.570 712 H GLY 96 H GLY 96 -21.518 16.738 -31.099 713 HA2 GLY 96 2HA GLY 96 -21.888 14.214 -30.131 714 HA3 GLY 96 3HA GLY 96 -23.487 14.683 -30.689 715 H VAL 97 H VAL 97 -20.113 14.381 -31.733 716 HA VAL 97 HA VAL 97 -21.111 13.722 -34.427 717 HB VAL 97 HB VAL 97 -18.964 14.663 -35.318 718 HG11 VAL 97 1HG1 VAL 97 -21.280 16.091 -34.324 719 HG12 VAL 97 2HG1 VAL 97 -19.858 17.131 -34.429 720 HG13 VAL 97 3HG1 VAL 97 -20.422 16.260 -35.855 721 HG21 VAL 97 3HG2 VAL 97 -17.604 14.665 -33.350 722 HG22 VAL 97 1HG2 VAL 97 -17.818 16.339 -33.862 723 HG23 VAL 97 2HG2 VAL 97 -18.743 15.708 -32.499 724 H TRP 98 H TRP 98 -18.625 13.217 -31.982 725 HA TRP 98 HA TRP 98 -18.349 10.466 -32.711 726 HB2 TRP 98 2HB TRP 98 -16.914 11.735 -34.407 727 HB3 TRP 98 3HB TRP 98 -15.859 12.132 -33.053 728 HD1 TRP 98 HD1 TRP 98 -17.504 8.684 -33.573 729 HE1 TRP 98 HE1 TRP 98 -15.637 6.938 -33.872 730 HE3 TRP 98 HE3 TRP 98 -13.468 11.820 -33.666 731 HZ2 TRP 98 HZ2 TRP 98 -12.825 6.896 -34.114 732 HZ3 TRP 98 HZ3 TRP 98 -11.224 10.847 -33.934 733 HH2 TRP 98 HH2 TRP 98 -10.911 8.436 -34.153 734 HA PRO 99 HA PRO 99 -17.331 11.776 -28.329 735 HB2 PRO 99 2HB PRO 99 -19.274 10.293 -27.147 736 HB3 PRO 99 3HB PRO 99 -19.538 11.947 -27.713 737 HG2 PRO 99 2HG PRO 99 -20.244 9.357 -29.037 738 HG3 PRO 99 3HG PRO 99 -21.204 10.841 -28.900 739 HD2 PRO 99 2HD PRO 99 -19.845 10.187 -31.149 740 HD3 PRO 99 3HD PRO 99 -20.093 11.869 -30.638 741 H LEU 100 H LEU 100 -15.709 10.114 -29.635 742 HA LEU 100 HA LEU 100 -15.873 7.461 -28.431 743 HB2 LEU 100 2HB LEU 100 -14.891 8.461 -30.859 744 HB3 LEU 100 3HB LEU 100 -13.477 7.929 -29.951 745 HG LEU 100 HG LEU 100 -15.834 6.277 -30.834 746 HD11 LEU 100 1HD1 LEU 100 -13.090 6.691 -31.744 747 HD12 LEU 100 2HD1 LEU 100 -14.484 6.028 -32.597 748 HD13 LEU 100 3HD1 LEU 100 -13.526 4.995 -31.537 749 HD21 LEU 100 3HD2 LEU 100 -15.458 5.427 -28.702 750 HD22 LEU 100 1HD2 LEU 100 -13.719 5.712 -28.788 751 HD23 LEU 100 2HD2 LEU 100 -14.446 4.408 -29.727 752 H VAL 101 H VAL 101 -13.990 10.407 -28.266 753 HA VAL 101 HA VAL 101 -11.997 9.250 -26.515 754 HB VAL 101 HB VAL 101 -11.083 11.532 -26.380 755 HG11 VAL 101 1HG1 VAL 101 -10.767 11.806 -28.949 756 HG12 VAL 101 2HG1 VAL 101 -10.140 10.369 -28.139 757 HG13 VAL 101 3HG1 VAL 101 -11.658 10.286 -29.035 758 HG21 VAL 101 3HG2 VAL 101 -13.664 12.184 -27.692 759 HG22 VAL 101 1HG2 VAL 101 -12.746 13.084 -26.484 760 HG23 VAL 101 2HG2 VAL 101 -12.243 13.111 -28.175 761 H ILE 102 H ILE 102 -14.740 11.469 -26.252 762 HA ILE 102 HA ILE 102 -14.517 12.394 -23.699 763 HB ILE 102 HB ILE 102 -17.047 12.259 -23.577 764 HG12 ILE 102 2HG1 ILE 102 -17.715 11.808 -26.218 765 HG13 ILE 102 3HG1 ILE 102 -16.525 10.551 -25.896 766 HG21 ILE 102 1HG2 ILE 102 -15.866 14.218 -24.421 767 HG22 ILE 102 2HG2 ILE 102 -15.812 13.502 -26.031 768 HG23 ILE 102 3HG2 ILE 102 -17.361 13.949 -25.317 769 HD11 ILE 102 3HD1 ILE 102 -19.266 10.859 -24.909 770 HD12 ILE 102 1HD1 ILE 102 -18.306 9.404 -25.177 771 HD13 ILE 102 2HD1 ILE 102 -18.087 10.346 -23.701 772 H ARG 103 H ARG 103 -15.887 9.258 -24.666 773 HA ARG 103 HA ARG 103 -16.522 8.381 -22.066 774 HB2 ARG 103 2HB ARG 103 -16.560 6.107 -23.091 775 HB3 ARG 103 3HB ARG 103 -17.515 7.297 -23.966 776 HG2 ARG 103 2HG ARG 103 -15.617 7.568 -25.547 777 HG3 ARG 103 3HG ARG 103 -14.799 6.244 -24.716 778 HD2 ARG 103 2HD ARG 103 -17.484 5.479 -25.369 779 HD3 ARG 103 3HD ARG 103 -16.668 6.080 -26.811 780 HE ARG 103 HE ARG 103 -14.857 4.383 -25.726 781 HH11 ARG 103 1HH1 ARG 103 -18.215 4.082 -26.597 782 HH12 ARG 103 2HH1 ARG 103 -18.103 2.392 -26.962 783 HH21 ARG 103 1HH2 ARG 103 -14.697 2.159 -26.205 784 HH22 ARG 103 2HH2 ARG 103 -16.102 1.299 -26.738 785 H THR 104 H THR 104 -13.651 7.884 -24.087 786 HA THR 104 HA THR 104 -12.232 6.112 -22.533 787 HB THR 104 HB THR 104 -10.682 8.370 -23.690 788 HG1 THR 104 HG1 THR 104 -11.129 7.600 -25.808 789 HG21 THR 104 3HG2 THR 104 -9.884 5.953 -24.791 790 HG22 THR 104 1HG2 THR 104 -10.368 5.534 -23.148 791 HG23 THR 104 2HG2 THR 104 -9.141 6.772 -23.417 792 H VAL 105 H VAL 105 -12.353 9.647 -22.229 793 HA VAL 105 HA VAL 105 -10.557 9.750 -20.016 794 HB VAL 105 HB VAL 105 -12.595 11.864 -20.674 795 HG11 VAL 105 1HG1 VAL 105 -9.811 11.979 -19.517 796 HG12 VAL 105 2HG1 VAL 105 -10.844 13.372 -19.845 797 HG13 VAL 105 3HG1 VAL 105 -11.321 12.186 -18.629 798 HG21 VAL 105 3HG2 VAL 105 -11.644 11.432 -22.785 799 HG22 VAL 105 1HG2 VAL 105 -10.751 12.813 -22.148 800 HG23 VAL 105 2HG2 VAL 105 -10.033 11.203 -22.103 801 H ILE 106 H ILE 106 -14.092 9.977 -20.314 802 HA ILE 106 HA ILE 106 -14.691 10.369 -17.621 803 HB ILE 106 HB ILE 106 -16.328 8.875 -19.672 804 HG12 ILE 106 2HG1 ILE 106 -15.579 11.607 -19.516 805 HG13 ILE 106 3HG1 ILE 106 -16.716 10.856 -20.631 806 HG21 ILE 106 1HG2 ILE 106 -17.135 10.136 -17.055 807 HG22 ILE 106 2HG2 ILE 106 -18.243 9.456 -18.246 808 HG23 ILE 106 3HG2 ILE 106 -17.091 8.410 -17.417 809 HD11 ILE 106 3HD1 ILE 106 -18.529 11.239 -19.070 810 HD12 ILE 106 1HD1 ILE 106 -17.401 11.935 -17.907 811 HD13 ILE 106 2HD1 ILE 106 -17.698 12.749 -19.444 812 H ALA 107 H ALA 107 -13.568 7.562 -19.254 813 HA ALA 107 HA ALA 107 -14.565 5.447 -17.836 814 HB1 ALA 107 1HB ALA 107 -13.015 5.208 -19.708 815 HB2 ALA 107 2HB ALA 107 -11.698 5.809 -18.701 816 HB3 ALA 107 3HB ALA 107 -12.477 4.276 -18.310 817 H GLY 108 H GLY 108 -12.413 7.927 -16.713 818 HA2 GLY 108 2HA GLY 108 -11.816 6.428 -14.264 819 HA3 GLY 108 3HA GLY 108 -11.054 7.930 -14.767 820 H TYR 109 H TYR 109 -13.752 9.076 -15.407 821 HA TYR 109 HA TYR 109 -14.183 10.564 -13.139 822 HB2 TYR 109 2HB TYR 109 -15.185 10.736 -15.565 823 HB3 TYR 109 3HB TYR 109 -16.530 9.850 -14.854 824 HD1 TYR 109 HD2 TYR 109 -14.415 12.466 -13.269 825 HD2 TYR 109 HD1 TYR 109 -18.246 11.443 -14.812 826 HE1 TYR 109 HE2 TYR 109 -15.328 14.571 -12.383 827 HE2 TYR 109 HE1 TYR 109 -19.169 13.546 -13.932 828 HH TYR 109 HH TYR 109 -18.776 15.317 -12.607 829 H ASN 110 H ASN 110 -15.939 7.631 -14.127 830 HA ASN 110 HA ASN 110 -17.747 7.441 -12.063 831 HB2 ASN 110 2HB ASN 110 -16.321 5.371 -13.703 832 HB3 ASN 110 3HB ASN 110 -17.397 4.875 -12.400 833 HD21 ASN 110 1HD2 ASN 110 -17.158 6.233 -15.554 834 HD22 ASN 110 2HD2 ASN 110 -18.849 6.266 -15.904 835 H LEU 111 H LEU 111 -14.331 7.070 -11.945 836 HA LEU 111 HA LEU 111 -14.390 5.703 -9.372 837 HB2 LEU 111 2HB LEU 111 -12.683 5.482 -11.422 838 HB3 LEU 111 3HB LEU 111 -11.852 6.730 -10.496 839 HG LEU 111 HG LEU 111 -12.339 4.890 -8.561 840 HD11 LEU 111 1HD1 LEU 111 -12.398 3.504 -11.165 841 HD12 LEU 111 2HD1 LEU 111 -13.095 3.042 -9.612 842 HD13 LEU 111 3HD1 LEU 111 -11.377 2.787 -9.918 843 HD21 LEU 111 3HD2 LEU 111 -9.912 4.082 -9.439 844 HD22 LEU 111 1HD2 LEU 111 -10.192 5.562 -8.522 845 HD23 LEU 111 2HD2 LEU 111 -10.068 5.624 -10.280 846 H TYR 112 H TYR 112 -13.773 8.863 -10.736 847 HA TYR 112 HA TYR 112 -12.410 10.197 -8.808 848 HB2 TYR 112 2HB TYR 112 -13.070 12.053 -9.900 849 HB3 TYR 112 3HB TYR 112 -13.897 10.946 -10.990 850 HD1 TYR 112 HD2 TYR 112 -14.472 12.726 -7.754 851 HD2 TYR 112 HD1 TYR 112 -16.145 11.289 -11.392 852 HE1 TYR 112 HE2 TYR 112 -16.622 13.767 -7.169 853 HE2 TYR 112 HE1 TYR 112 -18.300 12.327 -10.818 854 HH TYR 112 HH TYR 112 -18.701 14.648 -8.646 855 H ARG 113 H ARG 113 -15.864 9.406 -8.738 856 HA ARG 113 HA ARG 113 -16.160 10.556 -6.089 857 HB2 ARG 113 2HB ARG 113 -17.906 9.916 -8.256 858 HB3 ARG 113 3HB ARG 113 -18.452 9.044 -6.830 859 HG2 ARG 113 2HG ARG 113 -17.772 11.832 -6.304 860 HG3 ARG 113 3HG ARG 113 -19.091 11.621 -7.458 861 HD2 ARG 113 2HD ARG 113 -19.976 9.911 -5.698 862 HD3 ARG 113 3HD ARG 113 -18.922 10.791 -4.593 863 HE ARG 113 HE ARG 113 -20.471 12.659 -5.966 864 HH11 ARG 113 1HH1 ARG 113 -20.890 10.076 -3.670 865 HH12 ARG 113 2HH1 ARG 113 -22.291 10.782 -2.934 866 HH21 ARG 113 1HH2 ARG 113 -22.315 13.598 -5.006 867 HH22 ARG 113 2HH2 ARG 113 -23.102 12.784 -3.696 868 H ALA 114 H ALA 114 -15.636 7.466 -7.555 869 HA ALA 114 HA ALA 114 -16.627 5.685 -5.711 870 HB1 ALA 114 1HB ALA 114 -14.980 4.117 -6.479 871 HB2 ALA 114 2HB ALA 114 -15.512 5.093 -7.850 872 HB3 ALA 114 3HB ALA 114 -13.957 5.421 -7.084 873 H ILE 115 H ILE 115 -13.724 7.658 -5.501 874 HA ILE 115 HA ILE 115 -12.766 6.396 -3.106 875 HB ILE 115 HB ILE 115 -11.970 8.993 -4.424 876 HG12 ILE 115 2HG1 ILE 115 -11.450 7.027 -5.769 877 HG13 ILE 115 3HG1 ILE 115 -9.968 7.710 -5.107 878 HG21 ILE 115 1HG2 ILE 115 -11.217 7.791 -1.858 879 HG22 ILE 115 2HG2 ILE 115 -9.859 8.272 -2.873 880 HG23 ILE 115 3HG2 ILE 115 -11.081 9.458 -2.416 881 HD11 ILE 115 3HD1 ILE 115 -11.011 5.069 -4.853 882 HD12 ILE 115 1HD1 ILE 115 -9.460 5.713 -4.316 883 HD13 ILE 115 2HD1 ILE 115 -10.866 5.800 -3.255 884 H LYS 116 H LYS 116 -14.962 8.945 -3.863 885 HA LYS 116 HA LYS 116 -14.824 10.336 -1.383 886 HB2 LYS 116 2HB LYS 116 -16.005 10.818 -3.809 887 HB3 LYS 116 3HB LYS 116 -17.394 10.420 -2.806 888 HG2 LYS 116 2HG LYS 116 -16.350 12.122 -1.144 889 HG3 LYS 116 3HG LYS 116 -15.478 12.695 -2.568 890 HD2 LYS 116 2HD LYS 116 -17.272 13.870 -3.154 891 HD3 LYS 116 3HD LYS 116 -18.173 12.363 -3.336 892 HE2 LYS 116 2HE LYS 116 -18.736 12.445 -0.937 893 HE3 LYS 116 3HE LYS 116 -17.887 13.984 -0.807 894 HZ1 LYS 116 3HZ LYS 116 -19.913 14.823 -1.209 895 HZ2 LYS 116 1HZ LYS 116 -20.497 13.401 -1.916 896 HZ3 LYS 116 2HZ LYS 116 -19.564 14.477 -2.828 897 H LYS 117 H LYS 117 -16.862 7.734 -2.636 898 HA LYS 117 HA LYS 117 -18.569 7.615 -0.358 899 HB2 LYS 117 2HB LYS 117 -19.619 6.622 -2.124 900 HB3 LYS 117 3HB LYS 117 -18.122 5.994 -2.801 901 HG2 LYS 117 2HG LYS 117 -18.169 4.096 -1.497 902 HG3 LYS 117 3HG LYS 117 -19.192 4.840 -0.266 903 HD2 LYS 117 2HD LYS 117 -21.107 4.732 -1.713 904 HD3 LYS 117 3HD LYS 117 -20.112 4.182 -3.063 905 HE2 LYS 117 2HE LYS 117 -19.699 2.092 -2.017 906 HE3 LYS 117 3HE LYS 117 -20.368 2.650 -0.485 907 HZ1 LYS 117 3HZ LYS 117 -22.530 2.909 -1.728 908 HZ2 LYS 117 1HZ LYS 117 -22.014 1.320 -1.461 909 HZ3 LYS 117 2HZ LYS 117 -21.822 2.026 -2.986 910 H LYS 118 H LYS 118 -15.634 5.920 -1.337 911 HA LYS 118 HA LYS 118 -15.577 3.917 0.587 912 HB2 LYS 118 2HB LYS 118 -13.656 5.212 -1.189 913 HB3 LYS 118 3HB LYS 118 -12.923 4.651 0.308 914 HG2 LYS 118 2HG LYS 118 -12.995 2.532 -0.349 915 HG3 LYS 118 3HG LYS 118 -14.688 2.661 -0.831 916 HD2 LYS 118 2HD LYS 118 -14.165 3.247 -2.997 917 HD3 LYS 118 3HD LYS 118 -12.585 3.897 -2.551 918 HE2 LYS 118 2HE LYS 118 -11.759 1.634 -2.160 919 HE3 LYS 118 3HE LYS 118 -13.341 0.976 -2.572 920 HZ1 LYS 118 3HZ LYS 118 -11.458 1.093 -4.345 921 HZ2 LYS 118 1HZ LYS 118 -11.972 2.695 -4.516 922 HZ3 LYS 118 2HZ LYS 118 -13.058 1.426 -4.781 Start of MODEL 12 1 H1 VAL 1 H VAL 1 2.385 2.262 -1.356 2 HA VAL 1 HA VAL 1 1.106 0.365 -0.610 3 HB VAL 1 HB VAL 1 -0.847 2.617 -1.101 4 HG11 VAL 1 1HG1 VAL 1 -1.190 0.082 0.048 5 HG12 VAL 1 2HG1 VAL 1 -1.140 1.224 1.392 6 HG13 VAL 1 3HG1 VAL 1 -2.310 1.444 0.090 7 HG21 VAL 1 3HG2 VAL 1 1.312 2.256 0.944 8 HG22 VAL 1 1HG2 VAL 1 0.908 3.681 -0.013 9 HG23 VAL 1 2HG2 VAL 1 -0.137 3.189 1.319 10 H TRP 2 H TRP 2 -0.925 2.041 -3.018 11 HA TRP 2 HA TRP 2 -1.267 -0.412 -4.517 12 HB2 TRP 2 2HB TRP 2 -3.833 -0.095 -4.361 13 HB3 TRP 2 3HB TRP 2 -3.001 -0.888 -3.026 14 HD1 TRP 2 HD1 TRP 2 -3.121 2.933 -3.508 15 HE1 TRP 2 HE1 TRP 2 -4.344 3.962 -1.490 16 HE3 TRP 2 HE3 TRP 2 -4.599 -1.369 -1.175 17 HZ2 TRP 2 HZ2 TRP 2 -5.749 3.068 0.789 18 HZ3 TRP 2 HZ3 TRP 2 -5.878 -1.195 0.920 19 HH2 TRP 2 HH2 TRP 2 -6.440 0.978 1.880 20 HA PRO 3 HA PRO 3 -1.399 3.600 -6.911 21 HB2 PRO 3 2HB PRO 3 0.624 2.956 -8.603 22 HB3 PRO 3 3HB PRO 3 0.891 3.741 -7.042 23 HG2 PRO 3 2HG PRO 3 1.158 0.852 -7.780 24 HG3 PRO 3 3HG PRO 3 2.226 1.855 -6.781 25 HD2 PRO 3 2HD PRO 3 0.429 0.131 -5.716 26 HD3 PRO 3 3HD PRO 3 0.883 1.651 -4.919 27 H LEU 4 H LEU 4 -1.953 0.331 -7.388 28 HA LEU 4 HA LEU 4 -2.306 0.227 -10.197 29 HB2 LEU 4 2HB LEU 4 -2.607 -1.523 -7.968 30 HB3 LEU 4 3HB LEU 4 -4.077 -1.591 -8.938 31 HG LEU 4 HG LEU 4 -1.298 -2.065 -10.011 32 HD11 LEU 4 1HD1 LEU 4 -3.173 -4.304 -9.902 33 HD12 LEU 4 2HD1 LEU 4 -2.648 -3.728 -8.320 34 HD13 LEU 4 3HD1 LEU 4 -1.454 -4.239 -9.513 35 HD21 LEU 4 3HD2 LEU 4 -4.043 -2.106 -11.189 36 HD22 LEU 4 1HD2 LEU 4 -2.794 -3.175 -11.828 37 HD23 LEU 4 2HD2 LEU 4 -2.550 -1.428 -11.841 38 H VAL 5 H VAL 5 -4.168 1.580 -7.665 39 HA VAL 5 HA VAL 5 -6.654 1.547 -9.176 40 HB VAL 5 HB VAL 5 -7.614 2.740 -7.252 41 HG11 VAL 5 1HG1 VAL 5 -5.984 0.332 -6.447 42 HG12 VAL 5 2HG1 VAL 5 -7.431 0.932 -5.634 43 HG13 VAL 5 3HG1 VAL 5 -7.542 0.288 -7.272 44 HG21 VAL 5 3HG2 VAL 5 -6.176 4.055 -6.137 45 HG22 VAL 5 1HG2 VAL 5 -5.799 2.592 -5.226 46 HG23 VAL 5 2HG2 VAL 5 -4.780 3.074 -6.583 47 H ILE 6 H ILE 6 -4.111 3.787 -8.250 48 HA ILE 6 HA ILE 6 -5.421 6.152 -9.113 49 HB ILE 6 HB ILE 6 -3.409 7.280 -8.756 50 HG12 ILE 6 2HG1 ILE 6 -1.306 5.544 -8.475 51 HG13 ILE 6 3HG1 ILE 6 -2.218 4.794 -9.781 52 HG21 ILE 6 1HG2 ILE 6 -4.349 5.591 -6.849 53 HG22 ILE 6 2HG2 ILE 6 -2.650 5.126 -6.917 54 HG23 ILE 6 3HG2 ILE 6 -3.093 6.800 -6.585 55 HD11 ILE 6 3HD1 ILE 6 -2.092 7.541 -10.362 56 HD12 ILE 6 1HD1 ILE 6 -0.475 7.046 -9.862 57 HD13 ILE 6 2HD1 ILE 6 -1.282 6.211 -11.190 58 H ARG 7 H ARG 7 -3.790 3.619 -10.770 59 HA ARG 7 HA ARG 7 -3.180 5.166 -13.126 60 HB2 ARG 7 2HB ARG 7 -2.478 3.034 -14.093 61 HB3 ARG 7 3HB ARG 7 -1.781 3.254 -12.494 62 HG2 ARG 7 2HG ARG 7 -2.711 1.386 -11.746 63 HG3 ARG 7 3HG ARG 7 -4.302 1.863 -12.343 64 HD2 ARG 7 2HD ARG 7 -3.660 -0.194 -13.406 65 HD3 ARG 7 3HD ARG 7 -3.626 1.100 -14.603 66 HE ARG 7 HE ARG 7 -1.084 0.604 -13.356 67 HH11 ARG 7 1HH1 ARG 7 -3.239 -0.306 -15.933 68 HH12 ARG 7 2HH1 ARG 7 -1.979 -0.936 -16.941 69 HH21 ARG 7 1HH2 ARG 7 0.585 -0.222 -14.673 70 HH22 ARG 7 2HH2 ARG 7 0.196 -0.888 -16.223 71 H THR 8 H THR 8 -5.849 3.357 -11.913 72 HA THR 8 HA THR 8 -7.151 2.495 -14.183 73 HB THR 8 HB THR 8 -8.751 3.811 -12.020 74 HG1 THR 8 HG1 THR 8 -7.183 1.447 -11.772 75 HG21 THR 8 3HG2 THR 8 -10.018 2.730 -13.731 76 HG22 THR 8 1HG2 THR 8 -10.073 1.689 -12.310 77 HG23 THR 8 2HG2 THR 8 -9.005 1.289 -13.655 78 H VAL 9 H VAL 9 -7.212 5.728 -12.725 79 HA VAL 9 HA VAL 9 -9.034 6.814 -14.633 80 HB VAL 9 HB VAL 9 -7.093 8.472 -13.050 81 HG11 VAL 9 1HG1 VAL 9 -8.653 9.493 -14.729 82 HG12 VAL 9 2HG1 VAL 9 -9.991 8.954 -13.713 83 HG13 VAL 9 3HG1 VAL 9 -8.818 10.112 -13.086 84 HG21 VAL 9 3HG2 VAL 9 -9.215 8.361 -11.397 85 HG22 VAL 9 1HG2 VAL 9 -9.238 6.718 -12.038 86 HG23 VAL 9 2HG2 VAL 9 -7.795 7.329 -11.230 87 H ILE 10 H ILE 10 -5.535 6.623 -14.377 88 HA ILE 10 HA ILE 10 -4.913 8.452 -16.438 89 HB ILE 10 HB ILE 10 -3.213 6.068 -15.752 90 HG12 ILE 10 2HG1 ILE 10 -3.600 8.615 -14.173 91 HG13 ILE 10 3HG1 ILE 10 -3.851 6.963 -13.618 92 HG21 ILE 10 1HG2 ILE 10 -2.890 8.353 -17.385 93 HG22 ILE 10 2HG2 ILE 10 -1.807 8.531 -16.006 94 HG23 ILE 10 3HG2 ILE 10 -1.711 7.093 -17.023 95 HD11 ILE 10 3HD1 ILE 10 -1.298 8.435 -14.078 96 HD12 ILE 10 1HD1 ILE 10 -1.832 7.527 -12.664 97 HD13 ILE 10 2HD1 ILE 10 -1.334 6.673 -14.125 98 H ALA 11 H ALA 11 -6.141 5.254 -16.489 99 HA ALA 11 HA ALA 11 -5.168 4.172 -18.825 100 HB1 ALA 11 1HB ALA 11 -6.741 3.082 -17.218 101 HB2 ALA 11 2HB ALA 11 -8.049 4.003 -17.962 102 HB3 ALA 11 3HB ALA 11 -7.140 2.832 -18.917 103 H GLY 12 H GLY 12 -7.147 6.953 -18.439 104 HA2 GLY 12 2HA GLY 12 -8.061 6.906 -21.213 105 HA3 GLY 12 3HA GLY 12 -8.509 8.086 -19.989 106 H TYR 13 H TYR 13 -5.754 8.597 -19.181 107 HA TYR 13 HA TYR 13 -5.170 10.789 -20.763 108 HB2 TYR 13 2HB TYR 13 -3.833 11.084 -18.992 109 HB3 TYR 13 3HB TYR 13 -3.913 9.374 -18.580 110 HD1 TYR 13 HD2 TYR 13 -2.076 11.889 -20.570 111 HD2 TYR 13 HD1 TYR 13 -2.111 7.906 -19.075 112 HE1 TYR 13 HE2 TYR 13 0.278 11.626 -21.232 113 HE2 TYR 13 HE1 TYR 13 0.243 7.632 -19.732 114 HH TYR 13 HH TYR 13 1.866 8.566 -21.200 115 H ASN 14 H ASN 14 -3.807 7.516 -20.931 116 HA ASN 14 HA ASN 14 -1.873 7.846 -22.845 117 HB2 ASN 14 2HB ASN 14 -2.873 5.700 -21.584 118 HB3 ASN 14 3HB ASN 14 -3.617 5.460 -23.162 119 HD21 ASN 14 1HD2 ASN 14 -0.452 6.547 -21.971 120 HD22 ASN 14 2HD2 ASN 14 0.476 5.482 -22.966 121 H LEU 15 H LEU 15 -5.268 8.174 -23.216 122 HA LEU 15 HA LEU 15 -5.157 7.929 -26.119 123 HB2 LEU 15 2HB LEU 15 -7.135 7.497 -24.186 124 HB3 LEU 15 3HB LEU 15 -7.662 8.913 -25.094 125 HG LEU 15 HG LEU 15 -8.652 6.928 -26.034 126 HD11 LEU 15 1HD1 LEU 15 -6.634 7.367 -28.111 127 HD12 LEU 15 2HD1 LEU 15 -7.339 8.842 -27.451 128 HD13 LEU 15 3HD1 LEU 15 -8.381 7.605 -28.152 129 HD21 LEU 15 3HD2 LEU 15 -6.535 5.545 -27.214 130 HD22 LEU 15 1HD2 LEU 15 -7.561 4.999 -25.887 131 HD23 LEU 15 2HD2 LEU 15 -6.038 5.820 -25.543 132 H TYR 16 H TYR 16 -5.569 10.365 -23.617 133 HA TYR 16 HA TYR 16 -6.413 12.540 -25.066 134 HB2 TYR 16 2HB TYR 16 -5.207 12.095 -22.529 135 HB3 TYR 16 3HB TYR 16 -4.359 13.435 -23.293 136 HD1 TYR 16 HD2 TYR 16 -5.772 15.377 -24.182 137 HD2 TYR 16 HD1 TYR 16 -7.287 12.431 -21.512 138 HE1 TYR 16 HE2 TYR 16 -7.597 16.899 -23.548 139 HE2 TYR 16 HE1 TYR 16 -9.118 13.944 -20.872 140 HH TYR 16 HH TYR 16 -9.632 17.004 -22.516 141 H ARG 17 H ARG 17 -3.087 11.362 -24.685 142 HA ARG 17 HA ARG 17 -1.984 13.400 -26.376 143 HB2 ARG 17 2HB ARG 17 -0.986 11.216 -24.725 144 HB3 ARG 17 3HB ARG 17 -0.114 11.354 -26.247 145 HG2 ARG 17 2HG ARG 17 -0.067 13.909 -25.578 146 HG3 ARG 17 3HG ARG 17 -0.250 13.234 -23.958 147 HD2 ARG 17 2HD ARG 17 1.915 12.573 -25.951 148 HD3 ARG 17 3HD ARG 17 2.098 13.527 -24.480 149 HE ARG 17 HE ARG 17 1.097 11.063 -23.712 150 HH11 ARG 17 1HH1 ARG 17 3.954 12.313 -25.258 151 HH12 ARG 17 2HH1 ARG 17 4.986 11.055 -24.662 152 HH21 ARG 17 1HH2 ARG 17 2.445 9.401 -22.921 153 HH22 ARG 17 2HH2 ARG 17 4.126 9.399 -23.333 154 H ALA 18 H ALA 18 -3.364 10.274 -26.840 155 HA ALA 18 HA ALA 18 -2.171 9.357 -29.145 156 HB1 ALA 18 1HB ALA 18 -5.143 9.204 -28.810 157 HB2 ALA 18 2HB ALA 18 -4.031 7.999 -29.460 158 HB3 ALA 18 3HB ALA 18 -4.061 8.327 -27.728 159 H ILE 19 H ILE 19 -4.628 11.862 -28.795 160 HA ILE 19 HA ILE 19 -4.891 12.214 -31.652 161 HB ILE 19 HB ILE 19 -5.991 13.872 -29.379 162 HG12 ILE 19 2HG1 ILE 19 -6.877 11.588 -29.407 163 HG13 ILE 19 3HG1 ILE 19 -8.116 12.743 -29.887 164 HG21 ILE 19 1HG2 ILE 19 -6.025 14.205 -32.291 165 HG22 ILE 19 2HG2 ILE 19 -7.605 14.328 -31.519 166 HG23 ILE 19 3HG2 ILE 19 -6.290 15.386 -31.009 167 HD11 ILE 19 3HD1 ILE 19 -7.669 12.171 -32.247 168 HD12 ILE 19 1HD1 ILE 19 -6.533 10.940 -31.699 169 HD13 ILE 19 2HD1 ILE 19 -8.243 10.806 -31.290 170 H LYS 20 H LYS 20 -2.918 13.437 -29.130 171 HA LYS 20 HA LYS 20 -2.284 15.954 -30.331 172 HB2 LYS 20 2HB LYS 20 -0.991 14.330 -28.144 173 HB3 LYS 20 3HB LYS 20 -0.339 15.870 -28.687 174 HG2 LYS 20 2HG LYS 20 -3.128 15.490 -27.620 175 HG3 LYS 20 3HG LYS 20 -1.750 16.029 -26.657 176 HD2 LYS 20 2HD LYS 20 -1.864 18.113 -27.468 177 HD3 LYS 20 3HD LYS 20 -2.095 17.548 -29.125 178 HE2 LYS 20 2HE LYS 20 -4.293 17.461 -27.077 179 HE3 LYS 20 3HE LYS 20 -3.992 18.886 -28.070 180 HZ1 LYS 20 3HZ LYS 20 -4.289 16.277 -29.383 181 HZ2 LYS 20 1HZ LYS 20 -4.659 17.822 -29.965 182 HZ3 LYS 20 2HZ LYS 20 -5.676 17.078 -28.838 183 H LYS 21 H LYS 21 -1.067 12.703 -30.586 184 HA LYS 21 HA LYS 21 1.344 13.506 -31.976 185 HB2 LYS 21 2HB LYS 21 1.810 11.586 -30.818 186 HB3 LYS 21 3HB LYS 21 0.181 10.950 -31.002 187 HG2 LYS 21 2HG LYS 21 0.624 10.027 -33.058 188 HG3 LYS 21 3HG LYS 21 1.944 11.150 -33.397 189 HD2 LYS 21 2HD LYS 21 2.169 9.173 -31.159 190 HD3 LYS 21 3HD LYS 21 2.492 8.680 -32.822 191 HE2 LYS 21 2HE LYS 21 4.277 10.211 -33.031 192 HE3 LYS 21 3HE LYS 21 3.810 11.072 -31.565 193 HZ1 LYS 21 3HZ LYS 21 5.292 9.805 -30.530 194 HZ2 LYS 21 1HZ LYS 21 5.477 8.775 -31.860 195 HZ3 LYS 21 2HZ LYS 21 4.236 8.500 -30.744 196 H LYS 22 H LYS 22 -1.777 12.046 -32.751 197 HA LYS 22 HA LYS 22 -2.845 11.659 -34.724 198 HB2 LYS 22 2HB LYS 22 -2.447 14.194 -34.745 199 HB3 LYS 22 3HB LYS 22 -1.152 13.862 -35.888 200 HG2 LYS 22 2HG LYS 22 -2.587 13.289 -37.564 201 HG3 LYS 22 3HG LYS 22 -3.840 12.732 -36.453 202 HD2 LYS 22 2HD LYS 22 -3.494 15.483 -35.961 203 HD3 LYS 22 3HD LYS 22 -3.543 15.289 -37.715 204 HE2 LYS 22 2HE LYS 22 -5.610 13.858 -37.342 205 HE3 LYS 22 3HE LYS 22 -5.606 14.465 -35.687 206 HZ1 LYS 22 3HZ LYS 22 -6.090 15.930 -38.194 207 HZ2 LYS 22 1HZ LYS 22 -5.512 16.757 -36.836 208 HZ3 LYS 22 2HZ LYS 22 -6.990 15.937 -36.761 209 H GLY 23 H GLY 23 -1.885 9.603 -35.048 210 HA2 GLY 23 2HA GLY 23 -0.275 9.493 -37.467 211 HA3 GLY 23 3HA GLY 23 0.476 8.819 -36.027 212 H GLY 24 H GLY 24 -1.862 7.714 -34.853 213 HA2 GLY 24 2HA GLY 24 -3.590 6.188 -36.188 214 HA3 GLY 24 3HA GLY 24 -2.088 5.338 -36.522 215 H GLY 25 H GLY 25 -3.958 6.652 -33.787 216 HA2 GLY 25 2HA GLY 25 -4.384 5.782 -31.706 217 HA3 GLY 25 3HA GLY 25 -4.071 4.202 -32.409 218 H GLY 26 H GLY 26 -2.557 3.118 -31.353 219 HA2 GLY 26 2HA GLY 26 -0.209 2.893 -30.822 220 HA3 GLY 26 3HA GLY 26 -0.192 4.600 -30.405 221 H GLY 27 H GLY 27 0.741 2.430 -28.774 222 HA2 GLY 27 2HA GLY 27 -1.254 2.437 -26.601 223 HA3 GLY 27 3HA GLY 27 0.010 1.232 -26.799 224 H GLY 28 H GLY 28 1.577 1.399 -25.351 225 HA2 GLY 28 2HA GLY 28 1.945 3.870 -23.881 226 HA3 GLY 28 3HA GLY 28 2.749 2.339 -23.570 227 H GLY 29 H GLY 29 3.806 5.110 -23.777 228 HA2 GLY 29 2HA GLY 29 6.293 4.761 -24.716 229 HA3 GLY 29 3HA GLY 29 5.406 5.074 -26.201 230 H GLY 30 H GLY 30 7.318 6.506 -24.012 231 HA2 GLY 30 2HA GLY 30 6.073 9.139 -24.495 232 HA3 GLY 30 3HA GLY 30 6.737 8.724 -22.921 233 H GLY 31 H GLY 31 7.645 10.964 -24.140 234 HA2 GLY 31 2HA GLY 31 10.433 10.243 -24.634 235 HA3 GLY 31 3HA GLY 31 9.613 11.155 -25.893 236 H GLY 32 H GLY 32 9.997 13.260 -25.827 237 HA2 GLY 32 2HA GLY 32 11.112 14.473 -23.455 238 HA3 GLY 32 3HA GLY 32 10.842 15.259 -25.004 239 H VAL 33 H VAL 33 10.005 17.099 -23.945 240 HA VAL 33 HA VAL 33 7.293 16.709 -22.852 241 HB VAL 33 HB VAL 33 7.632 18.786 -21.544 242 HG11 VAL 33 1HG1 VAL 33 7.905 16.905 -20.234 243 HG12 VAL 33 2HG1 VAL 33 9.344 16.375 -21.108 244 HG13 VAL 33 3HG1 VAL 33 9.440 17.739 -19.993 245 HG21 VAL 33 3HG2 VAL 33 9.922 19.640 -21.241 246 HG22 VAL 33 1HG2 VAL 33 10.484 18.536 -22.497 247 HG23 VAL 33 2HG2 VAL 33 9.354 19.829 -22.900 248 H TRP 34 H TRP 34 5.708 18.229 -23.412 249 HA TRP 34 HA TRP 34 6.060 20.550 -24.892 250 HB2 TRP 34 2HB TRP 34 6.846 19.557 -26.811 251 HB3 TRP 34 3HB TRP 34 5.982 18.051 -26.514 252 HD1 TRP 34 HD1 TRP 34 4.600 21.652 -27.000 253 HE1 TRP 34 HE1 TRP 34 2.833 21.569 -28.870 254 HE3 TRP 34 HE3 TRP 34 4.986 16.713 -28.264 255 HZ2 TRP 34 HZ2 TRP 34 1.747 19.663 -30.646 256 HZ3 TRP 34 HZ3 TRP 34 3.547 15.839 -30.058 257 HH2 TRP 34 HH2 TRP 34 1.961 17.285 -31.223 258 HA PRO 35 HA PRO 35 1.470 19.104 -25.330 259 HB2 PRO 35 2HB PRO 35 0.872 16.593 -24.490 260 HB3 PRO 35 3HB PRO 35 1.364 16.959 -26.148 261 HG2 PRO 35 2HG PRO 35 2.995 15.876 -23.883 262 HG3 PRO 35 3HG PRO 35 2.977 15.381 -25.585 263 HD2 PRO 35 2HD PRO 35 4.895 16.991 -24.557 264 HD3 PRO 35 3HD PRO 35 4.338 17.123 -26.237 265 H LEU 36 H LEU 36 1.428 20.611 -23.578 266 HA LEU 36 HA LEU 36 1.478 19.608 -20.863 267 HB2 LEU 36 2HB LEU 36 1.414 21.825 -20.169 268 HB3 LEU 36 3HB LEU 36 2.347 21.875 -21.664 269 HG LEU 36 HG LEU 36 -0.153 22.387 -22.594 270 HD11 LEU 36 1HD1 LEU 36 -1.362 22.591 -20.644 271 HD12 LEU 36 2HD1 LEU 36 -0.879 24.260 -20.942 272 HD13 LEU 36 3HD1 LEU 36 -0.012 23.290 -19.751 273 HD21 LEU 36 3HD2 LEU 36 1.684 24.512 -21.511 274 HD22 LEU 36 1HD2 LEU 36 0.589 24.622 -22.889 275 HD23 LEU 36 2HD2 LEU 36 2.020 23.595 -22.980 276 H VAL 37 H VAL 37 -0.849 20.240 -23.316 277 HA VAL 37 HA VAL 37 -3.138 20.780 -21.815 278 HB VAL 37 HB VAL 37 -4.404 19.770 -23.723 279 HG11 VAL 37 1HG1 VAL 37 -4.221 21.773 -24.663 280 HG12 VAL 37 2HG1 VAL 37 -2.812 22.080 -23.646 281 HG13 VAL 37 3HG1 VAL 37 -2.605 21.394 -25.258 282 HG21 VAL 37 3HG2 VAL 37 -1.621 19.068 -24.621 283 HG22 VAL 37 1HG2 VAL 37 -3.014 18.003 -24.438 284 HG23 VAL 37 2HG2 VAL 37 -2.977 19.191 -25.741 285 H ILE 38 H ILE 38 -1.718 17.674 -22.770 286 HA ILE 38 HA ILE 38 -3.728 16.007 -21.762 287 HB ILE 38 HB ILE 38 -2.033 14.232 -21.715 288 HG12 ILE 38 2HG1 ILE 38 0.137 15.841 -22.820 289 HG13 ILE 38 3HG1 ILE 38 -0.262 16.293 -21.166 290 HG21 ILE 38 1HG2 ILE 38 -2.477 14.102 -23.884 291 HG22 ILE 38 2HG2 ILE 38 -2.752 15.842 -23.963 292 HG23 ILE 38 3HG2 ILE 38 -1.129 15.194 -24.202 293 HD11 ILE 38 3HD1 ILE 38 -0.030 13.897 -20.536 294 HD12 ILE 38 1HD1 ILE 38 0.558 13.582 -22.169 295 HD13 ILE 38 2HD1 ILE 38 1.459 14.656 -21.098 296 H ARG 39 H ARG 39 -1.343 17.877 -20.145 297 HA ARG 39 HA ARG 39 -1.376 16.329 -17.709 298 HB2 ARG 39 2HB ARG 39 -0.386 19.147 -17.812 299 HB3 ARG 39 3HB ARG 39 0.250 17.771 -16.921 300 HG2 ARG 39 2HG ARG 39 0.462 18.177 -19.897 301 HG3 ARG 39 3HG ARG 39 1.745 18.467 -18.721 302 HD2 ARG 39 2HD ARG 39 0.394 15.798 -19.025 303 HD3 ARG 39 3HD ARG 39 1.811 16.255 -19.968 304 HE ARG 39 HE ARG 39 2.623 16.721 -17.449 305 HH11 ARG 39 1HH1 ARG 39 1.084 13.981 -18.946 306 HH12 ARG 39 2HH1 ARG 39 1.821 12.824 -17.888 307 HH21 ARG 39 1HH2 ARG 39 3.600 15.208 -16.050 308 HH22 ARG 39 2HH2 ARG 39 3.251 13.523 -16.240 309 H THR 40 H THR 40 -3.250 18.825 -19.115 310 HA THR 40 HA THR 40 -4.177 20.283 -16.969 311 HB THR 40 HB THR 40 -5.977 19.334 -19.198 312 HG1 THR 40 HG1 THR 40 -5.142 21.202 -20.324 313 HG21 THR 40 3HG2 THR 40 -6.002 22.104 -18.141 314 HG22 THR 40 1HG2 THR 40 -6.635 20.841 -17.087 315 HG23 THR 40 2HG2 THR 40 -7.336 21.087 -18.686 316 H VAL 41 H VAL 41 -5.518 17.230 -18.223 317 HA VAL 41 HA VAL 41 -7.445 17.003 -16.123 318 HB VAL 41 HB VAL 41 -7.846 14.737 -16.997 319 HG11 VAL 41 1HG1 VAL 41 -9.205 15.891 -18.330 320 HG12 VAL 41 2HG1 VAL 41 -8.031 17.197 -18.510 321 HG13 VAL 41 3HG1 VAL 41 -7.951 15.785 -19.564 322 HG21 VAL 41 3HG2 VAL 41 -5.711 13.960 -17.611 323 HG22 VAL 41 1HG2 VAL 41 -6.594 14.130 -19.128 324 HG23 VAL 41 2HG2 VAL 41 -5.413 15.351 -18.653 325 H ILE 42 H ILE 42 -4.306 15.505 -16.800 326 HA ILE 42 HA ILE 42 -4.281 13.710 -14.643 327 HB ILE 42 HB ILE 42 -1.942 15.055 -16.002 328 HG12 ILE 42 2HG1 ILE 42 -3.713 12.810 -16.710 329 HG13 ILE 42 3HG1 ILE 42 -2.718 13.831 -17.743 330 HG21 ILE 42 1HG2 ILE 42 -2.009 12.577 -14.285 331 HG22 ILE 42 2HG2 ILE 42 -0.599 13.223 -15.123 332 HG23 ILE 42 3HG2 ILE 42 -1.343 14.140 -13.813 333 HD11 ILE 42 3HD1 ILE 42 -1.909 11.611 -17.919 334 HD12 ILE 42 1HD1 ILE 42 -0.735 12.524 -16.972 335 HD13 ILE 42 2HD1 ILE 42 -1.855 11.425 -16.167 336 H ALA 43 H ALA 43 -4.005 17.106 -14.712 337 HA ALA 43 HA ALA 43 -2.314 17.771 -12.665 338 HB1 ALA 43 1HB ALA 43 -3.906 19.679 -12.213 339 HB2 ALA 43 2HB ALA 43 -3.356 19.511 -13.880 340 HB3 ALA 43 3HB ALA 43 -4.969 18.963 -13.425 341 H GLY 44 H GLY 44 -5.314 16.063 -12.458 342 HA2 GLY 44 2HA GLY 44 -5.448 16.432 -9.554 343 HA3 GLY 44 3HA GLY 44 -6.686 15.693 -10.560 344 H TYR 45 H TYR 45 -4.666 14.021 -11.949 345 HA TYR 45 HA TYR 45 -4.924 11.675 -10.529 346 HB2 TYR 45 2HB TYR 45 -2.770 12.470 -12.495 347 HB3 TYR 45 3HB TYR 45 -3.027 10.824 -11.927 348 HD1 TYR 45 HD1 TYR 45 -6.197 12.109 -12.016 349 HD2 TYR 45 HD2 TYR 45 -3.089 10.947 -14.680 350 HE1 TYR 45 HE1 TYR 45 -7.860 11.756 -13.793 351 HE2 TYR 45 HE2 TYR 45 -4.744 10.593 -16.465 352 HH TYR 45 HH TYR 45 -7.868 11.744 -16.332 353 H ASN 46 H ASN 46 -2.187 13.934 -10.518 354 HA ASN 46 HA ASN 46 -0.413 12.553 -8.928 355 HB2 ASN 46 2HB ASN 46 0.366 14.568 -9.857 356 HB3 ASN 46 3HB ASN 46 -0.981 15.495 -9.203 357 HD21 ASN 46 1HD2 ASN 46 -0.308 16.849 -7.720 358 HD22 ASN 46 2HD2 ASN 46 0.887 16.533 -6.513 359 H LEU 47 H LEU 47 -3.420 13.998 -8.046 360 HA LEU 47 HA LEU 47 -2.859 14.041 -5.213 361 HB2 LEU 47 2HB LEU 47 -4.633 15.360 -6.826 362 HB3 LEU 47 3HB LEU 47 -5.662 14.161 -6.044 363 HG LEU 47 HG LEU 47 -5.782 16.194 -4.794 364 HD11 LEU 47 1HD1 LEU 47 -5.211 13.790 -3.699 365 HD12 LEU 47 2HD1 LEU 47 -5.617 15.233 -2.770 366 HD13 LEU 47 3HD1 LEU 47 -3.928 14.782 -3.004 367 HD21 LEU 47 3HD2 LEU 47 -4.039 17.543 -4.238 368 HD22 LEU 47 1HD2 LEU 47 -3.352 16.807 -5.686 369 HD23 LEU 47 2HD2 LEU 47 -2.901 16.202 -4.092 370 H TYR 48 H TYR 48 -4.558 11.984 -7.503 371 HA TYR 48 HA TYR 48 -6.023 10.345 -5.880 372 HB2 TYR 48 2HB TYR 48 -5.032 10.238 -8.528 373 HB3 TYR 48 3HB TYR 48 -4.646 8.692 -7.781 374 HD1 TYR 48 HD2 TYR 48 -6.528 7.369 -6.712 375 HD2 TYR 48 HD1 TYR 48 -7.222 10.721 -9.238 376 HE1 TYR 48 HE2 TYR 48 -8.841 6.613 -7.069 377 HE2 TYR 48 HE1 TYR 48 -9.537 9.976 -9.602 378 HH TYR 48 HH TYR 48 -10.891 8.036 -9.457 379 H ARG 49 H ARG 49 -2.557 10.069 -6.596 380 HA ARG 49 HA ARG 49 -2.215 7.798 -4.871 381 HB2 ARG 49 2HB ARG 49 -0.407 9.526 -6.509 382 HB3 ARG 49 3HB ARG 49 0.294 8.510 -5.256 383 HG2 ARG 49 2HG ARG 49 -0.784 6.546 -6.304 384 HG3 ARG 49 3HG ARG 49 -1.354 7.596 -7.603 385 HD2 ARG 49 2HD ARG 49 0.653 6.482 -8.321 386 HD3 ARG 49 3HD ARG 49 0.999 8.195 -8.089 387 HE ARG 49 HE ARG 49 1.978 5.979 -6.471 388 HH11 ARG 49 1HH1 ARG 49 1.726 9.416 -6.962 389 HH12 ARG 49 2HH1 ARG 49 3.045 9.795 -5.904 390 HH21 ARG 49 1HH2 ARG 49 3.715 6.465 -5.076 391 HH22 ARG 49 2HH2 ARG 49 4.176 8.116 -4.832 392 H ALA 50 H ALA 50 -2.097 11.234 -4.532 393 HA ALA 50 HA ALA 50 -0.405 11.624 -2.395 394 HB1 ALA 50 1HB ALA 50 -1.748 13.343 -3.720 395 HB2 ALA 50 2HB ALA 50 -3.055 13.022 -2.580 396 HB3 ALA 50 3HB ALA 50 -1.513 13.650 -1.999 397 H ILE 51 H ILE 51 -3.739 10.457 -2.368 398 HA ILE 51 HA ILE 51 -3.869 10.358 0.507 399 HB ILE 51 HB ILE 51 -5.719 9.144 -1.549 400 HG12 ILE 51 2HG1 ILE 51 -5.605 11.583 -1.726 401 HG13 ILE 51 3HG1 ILE 51 -7.160 11.083 -1.069 402 HG21 ILE 51 1HG2 ILE 51 -5.621 9.000 1.353 403 HG22 ILE 51 2HG2 ILE 51 -7.160 9.613 0.750 404 HG23 ILE 51 3HG2 ILE 51 -6.559 8.048 0.203 405 HD11 ILE 51 3HD1 ILE 51 -5.543 11.481 1.155 406 HD12 ILE 51 1HD1 ILE 51 -5.156 12.809 0.061 407 HD13 ILE 51 2HD1 ILE 51 -6.825 12.537 0.563 408 H LYS 52 H LYS 52 -2.779 8.288 -2.004 409 HA LYS 52 HA LYS 52 -3.128 5.797 -0.675 410 HB2 LYS 52 2HB LYS 52 -2.366 4.936 -2.600 411 HB3 LYS 52 3HB LYS 52 -2.367 6.586 -3.207 412 HG2 LYS 52 2HG LYS 52 -0.023 6.825 -2.496 413 HG3 LYS 52 3HG LYS 52 -0.035 5.140 -1.968 414 HD2 LYS 52 2HD LYS 52 -1.003 5.047 -4.566 415 HD3 LYS 52 3HD LYS 52 0.287 6.250 -4.629 416 HE2 LYS 52 2HE LYS 52 0.493 3.414 -3.625 417 HE3 LYS 52 3HE LYS 52 1.202 4.070 -5.100 418 HZ1 LYS 52 3HZ LYS 52 2.339 5.690 -3.433 419 HZ2 LYS 52 1HZ LYS 52 2.972 4.139 -3.674 420 HZ3 LYS 52 2HZ LYS 52 2.026 4.463 -2.310 421 H LYS 53 H LYS 53 -0.621 8.240 -0.686 422 HA LYS 53 HA LYS 53 1.238 6.585 0.792 423 HB2 LYS 53 2HB LYS 53 1.284 9.251 -0.483 424 HB3 LYS 53 3HB LYS 53 2.294 9.076 0.946 425 HG2 LYS 53 2HG LYS 53 3.314 7.060 -0.129 426 HG3 LYS 53 3HG LYS 53 2.425 7.474 -1.596 427 HD2 LYS 53 2HD LYS 53 3.867 9.101 -2.130 428 HD3 LYS 53 3HD LYS 53 3.890 9.733 -0.482 429 HE2 LYS 53 2HE LYS 53 5.371 7.246 -1.302 430 HE3 LYS 53 3HE LYS 53 6.088 8.854 -1.382 431 HZ1 LYS 53 3HZ LYS 53 5.690 9.098 0.997 432 HZ2 LYS 53 1HZ LYS 53 6.669 7.756 0.677 433 HZ3 LYS 53 2HZ LYS 53 5.037 7.539 1.065 434 H LYS 54 H LYS 54 -0.877 9.349 1.409 435 HA LYS 54 HA LYS 54 -0.098 9.906 4.030 436 HB2 LYS 54 2HB LYS 54 -1.873 11.006 2.326 437 HB3 LYS 54 3HB LYS 54 -2.982 10.150 3.389 438 HG2 LYS 54 2HG LYS 54 -2.474 11.454 5.202 439 HG3 LYS 54 3HG LYS 54 -0.862 11.852 4.601 440 HD2 LYS 54 2HD LYS 54 -1.720 13.807 3.954 441 HD3 LYS 54 3HD LYS 54 -2.570 12.911 2.693 442 HE2 LYS 54 2HE LYS 54 -3.701 13.237 5.457 443 HE3 LYS 54 3HE LYS 54 -3.957 14.443 4.197 444 HZ1 LYS 54 3HZ LYS 54 -4.580 12.079 2.992 445 HZ2 LYS 54 1HZ LYS 54 -5.686 13.208 3.596 446 HZ3 LYS 54 2HZ LYS 54 -5.208 11.898 4.552 447 H GLY 55 H GLY 55 -0.888 9.262 6.046 448 HA2 GLY 55 2HA GLY 55 -2.109 6.583 6.034 449 HA3 GLY 55 3HA GLY 55 -1.131 7.250 7.333 450 H GLY 56 H GLY 56 -4.240 7.624 5.664 451 HA2 GLY 56 2HA GLY 56 -5.691 7.774 8.093 452 HA3 GLY 56 3HA GLY 56 -5.462 9.388 7.435 453 H GLY 57 H GLY 57 -6.186 9.734 5.177 454 HA2 GLY 57 2HA GLY 57 -7.553 8.466 3.399 455 HA3 GLY 57 3HA GLY 57 -8.679 8.233 4.727 456 H GLY 58 H GLY 58 -9.081 10.471 5.931 457 HA2 GLY 58 2HA GLY 58 -9.137 12.928 5.298 458 HA3 GLY 58 3HA GLY 58 -9.844 12.358 3.794 459 H GLY 59 H GLY 59 -10.831 14.110 6.067 460 HA2 GLY 59 2HA GLY 59 -12.988 12.638 7.268 461 HA3 GLY 59 3HA GLY 59 -12.729 14.373 7.362 462 H GLY 60 H GLY 60 -14.039 11.776 5.372 463 HA2 GLY 60 2HA GLY 60 -16.016 13.663 4.331 464 HA3 GLY 60 3HA GLY 60 -15.019 12.817 3.157 465 H GLY 61 H GLY 61 -17.951 12.745 3.700 466 HA2 GLY 61 2HA GLY 61 -18.826 10.419 2.927 467 HA3 GLY 61 3HA GLY 61 -18.286 9.948 4.532 468 H GLY 62 H GLY 62 -20.406 12.261 2.860 469 HA2 GLY 62 2HA GLY 62 -22.543 11.693 4.706 470 HA3 GLY 62 3HA GLY 62 -21.854 13.295 4.920 471 H GLY 63 H GLY 63 -22.565 14.911 3.659 472 HA2 GLY 63 2HA GLY 63 -24.042 14.197 1.209 473 HA3 GLY 63 3HA GLY 63 -24.750 15.291 2.388 474 H GLY 64 H GLY 64 -22.432 16.757 3.055 475 HA2 GLY 64 2HA GLY 64 -21.265 17.802 0.634 476 HA3 GLY 64 3HA GLY 64 -22.473 18.865 1.342 477 H VAL 65 H VAL 65 -19.314 17.437 1.733 478 HA VAL 65 HA VAL 65 -18.780 19.353 3.910 479 HB VAL 65 HB VAL 65 -17.097 17.798 4.788 480 HG11 VAL 65 1HG1 VAL 65 -18.579 16.415 5.931 481 HG12 VAL 65 2HG1 VAL 65 -19.594 17.768 5.426 482 HG13 VAL 65 3HG1 VAL 65 -19.647 16.244 4.538 483 HG21 VAL 65 3HG2 VAL 65 -17.808 15.353 3.625 484 HG22 VAL 65 1HG2 VAL 65 -17.570 16.471 2.282 485 HG23 VAL 65 2HG2 VAL 65 -16.279 16.215 3.456 486 H TRP 66 H TRP 66 -18.498 20.019 1.203 487 HA TRP 66 HA TRP 66 -17.026 21.062 -0.184 488 HB2 TRP 66 2HB TRP 66 -15.620 22.311 1.023 489 HB3 TRP 66 3HB TRP 66 -15.850 21.241 2.403 490 HD1 TRP 66 HD1 TRP 66 -13.924 19.523 2.959 491 HE1 TRP 66 HE1 TRP 66 -11.510 19.257 2.107 492 HE3 TRP 66 HE3 TRP 66 -14.162 22.586 -1.128 493 HZ2 TRP 66 HZ2 TRP 66 -9.917 20.218 -0.015 494 HZ3 TRP 66 HZ3 TRP 66 -12.148 22.859 -2.516 495 HH2 TRP 66 HH2 TRP 66 -10.071 21.699 -1.969 496 HA PRO 67 HA PRO 67 -15.332 17.491 -2.202 497 HB2 PRO 67 2HB PRO 67 -14.547 18.760 -4.469 498 HB3 PRO 67 3HB PRO 67 -16.234 18.354 -4.131 499 HG2 PRO 67 2HG PRO 67 -14.808 20.963 -3.785 500 HG3 PRO 67 3HG PRO 67 -16.425 20.650 -4.443 501 HD2 PRO 67 2HD PRO 67 -16.026 21.520 -1.909 502 HD3 PRO 67 3HD PRO 67 -17.375 20.453 -2.352 503 H LEU 68 H LEU 68 -13.447 16.680 -1.534 504 HA LEU 68 HA LEU 68 -11.093 18.402 -1.374 505 HB2 LEU 68 2HB LEU 68 -12.085 16.258 0.160 506 HB3 LEU 68 3HB LEU 68 -10.590 15.695 -0.584 507 HG LEU 68 HG LEU 68 -10.502 18.340 0.744 508 HD11 LEU 68 1HD1 LEU 68 -10.400 17.493 2.944 509 HD12 LEU 68 2HD1 LEU 68 -10.442 15.821 2.385 510 HD13 LEU 68 3HD1 LEU 68 -11.877 16.837 2.239 511 HD21 LEU 68 3HD2 LEU 68 -8.561 16.161 1.237 512 HD22 LEU 68 1HD2 LEU 68 -8.292 17.879 0.946 513 HD23 LEU 68 2HD2 LEU 68 -8.648 16.802 -0.404 514 H VAL 69 H VAL 69 -11.531 14.995 -2.328 515 HA VAL 69 HA VAL 69 -9.457 15.345 -4.358 516 HB VAL 69 HB VAL 69 -9.486 12.895 -4.548 517 HG11 VAL 69 1HG1 VAL 69 -9.083 12.625 -1.858 518 HG12 VAL 69 2HG1 VAL 69 -7.894 13.236 -3.009 519 HG13 VAL 69 3HG1 VAL 69 -8.893 14.363 -2.090 520 HG21 VAL 69 3HG2 VAL 69 -11.757 12.356 -4.107 521 HG22 VAL 69 1HG2 VAL 69 -10.803 11.621 -2.819 522 HG23 VAL 69 2HG2 VAL 69 -11.697 13.110 -2.514 523 H ILE 70 H ILE 70 -12.833 14.344 -4.041 524 HA ILE 70 HA ILE 70 -13.469 13.429 -6.509 525 HB ILE 70 HB ILE 70 -15.687 14.663 -6.249 526 HG12 ILE 70 2HG1 ILE 70 -14.264 15.554 -3.741 527 HG13 ILE 70 3HG1 ILE 70 -15.040 16.561 -4.958 528 HG21 ILE 70 1HG2 ILE 70 -15.251 12.351 -5.493 529 HG22 ILE 70 2HG2 ILE 70 -14.765 12.985 -3.922 530 HG23 ILE 70 3HG2 ILE 70 -16.424 13.194 -4.482 531 HD11 ILE 70 3HD1 ILE 70 -16.658 16.629 -3.391 532 HD12 ILE 70 1HD1 ILE 70 -17.154 15.135 -4.187 533 HD13 ILE 70 2HD1 ILE 70 -16.209 15.070 -2.698 534 H ARG 71 H ARG 71 -13.251 16.864 -5.610 535 HA ARG 71 HA ARG 71 -13.846 17.847 -8.200 536 HB2 ARG 71 2HB ARG 71 -12.918 19.996 -7.329 537 HB3 ARG 71 3HB ARG 71 -14.156 19.284 -6.302 538 HG2 ARG 71 2HG ARG 71 -12.697 19.719 -4.661 539 HG3 ARG 71 3HG ARG 71 -11.930 18.224 -5.200 540 HD2 ARG 71 2HD ARG 71 -10.086 19.485 -5.398 541 HD3 ARG 71 3HD ARG 71 -10.829 20.045 -6.896 542 HE ARG 71 HE ARG 71 -11.744 21.624 -4.757 543 HH11 ARG 71 1HH1 ARG 71 -8.866 21.020 -6.621 544 HH12 ARG 71 2HH1 ARG 71 -8.226 22.614 -6.393 545 HH21 ARG 71 1HH2 ARG 71 -10.911 23.726 -4.449 546 HH22 ARG 71 2HH2 ARG 71 -9.390 24.152 -5.156 547 H THR 72 H THR 72 -10.795 17.301 -6.474 548 HA THR 72 HA THR 72 -8.992 18.356 -8.257 549 HB THR 72 HB THR 72 -8.308 15.701 -7.090 550 HG1 THR 72 HG1 THR 72 -8.496 17.993 -5.430 551 HG21 THR 72 3HG2 THR 72 -6.703 17.285 -8.264 552 HG22 THR 72 1HG2 THR 72 -6.213 16.716 -6.669 553 HG23 THR 72 2HG2 THR 72 -6.875 18.339 -6.861 554 H VAL 73 H VAL 73 -10.555 15.181 -8.375 555 HA VAL 73 HA VAL 73 -9.138 14.299 -10.691 556 HB VAL 73 HB VAL 73 -11.810 13.227 -9.822 557 HG11 VAL 73 1HG1 VAL 73 -9.385 11.920 -11.054 558 HG12 VAL 73 2HG1 VAL 73 -10.910 11.121 -10.666 559 HG13 VAL 73 3HG1 VAL 73 -10.860 12.373 -11.908 560 HG21 VAL 73 3HG2 VAL 73 -10.843 13.061 -7.770 561 HG22 VAL 73 1HG2 VAL 73 -10.157 11.610 -8.501 562 HG23 VAL 73 2HG2 VAL 73 -9.202 13.091 -8.417 563 H ILE 74 H ILE 74 -12.400 15.595 -10.144 564 HA ILE 74 HA ILE 74 -13.320 15.433 -12.778 565 HB ILE 74 HB ILE 74 -14.055 17.562 -10.768 566 HG12 ILE 74 2HG1 ILE 74 -14.247 14.869 -10.349 567 HG13 ILE 74 3HG1 ILE 74 -15.303 16.072 -9.616 568 HG21 ILE 74 1HG2 ILE 74 -15.400 16.497 -13.237 569 HG22 ILE 74 2HG2 ILE 74 -16.260 17.416 -12.002 570 HG23 ILE 74 3HG2 ILE 74 -14.923 18.157 -12.881 571 HD11 ILE 74 3HD1 ILE 74 -16.479 14.132 -10.630 572 HD12 ILE 74 1HD1 ILE 74 -16.983 15.700 -11.261 573 HD13 ILE 74 2HD1 ILE 74 -15.904 14.673 -12.207 574 H ALA 75 H ALA 75 -11.005 17.524 -11.356 575 HA ALA 75 HA ALA 75 -11.151 19.864 -12.760 576 HB1 ALA 75 1HB ALA 75 -8.660 19.941 -12.610 577 HB2 ALA 75 2HB ALA 75 -9.470 19.565 -11.089 578 HB3 ALA 75 3HB ALA 75 -8.698 18.280 -12.018 579 H GLY 76 H GLY 76 -10.314 16.712 -13.971 580 HA2 GLY 76 2HA GLY 76 -9.412 17.834 -16.524 581 HA3 GLY 76 3HA GLY 76 -9.287 16.152 -16.033 582 H TYR 77 H TYR 77 -12.133 16.199 -15.106 583 HA TYR 77 HA TYR 77 -13.357 15.032 -17.271 584 HB2 TYR 77 2HB TYR 77 -14.121 15.132 -14.816 585 HB3 TYR 77 3HB TYR 77 -14.922 16.635 -15.258 586 HD1 TYR 77 HD2 TYR 77 -16.369 16.395 -17.527 587 HD2 TYR 77 HD1 TYR 77 -15.413 13.228 -14.851 588 HE1 TYR 77 HE2 TYR 77 -18.309 15.124 -18.347 589 HE2 TYR 77 HE1 TYR 77 -17.350 11.948 -15.664 590 HH TYR 77 HH TYR 77 -19.087 11.912 -17.040 591 H ASN 78 H ASN 78 -13.783 18.400 -16.182 592 HA ASN 78 HA ASN 78 -15.502 19.284 -18.148 593 HB2 ASN 78 2HB ASN 78 -14.993 20.718 -16.302 594 HB3 ASN 78 3HB ASN 78 -13.280 20.743 -16.713 595 HD21 ASN 78 1HD2 ASN 78 -13.032 22.887 -17.015 596 HD22 ASN 78 2HD2 ASN 78 -13.831 23.793 -18.251 597 H LEU 79 H LEU 79 -12.197 18.393 -18.435 598 HA LEU 79 HA LEU 79 -11.881 19.756 -20.996 599 HB2 LEU 79 2HB LEU 79 -10.128 19.073 -18.946 600 HB3 LEU 79 3HB LEU 79 -9.729 17.967 -20.258 601 HG LEU 79 HG LEU 79 -8.338 20.007 -20.240 602 HD11 LEU 79 1HD1 LEU 79 -8.180 19.424 -22.380 603 HD12 LEU 79 2HD1 LEU 79 -9.398 20.655 -22.713 604 HD13 LEU 79 3HD1 LEU 79 -9.885 18.979 -22.462 605 HD21 LEU 79 3HD2 LEU 79 -10.375 21.413 -19.441 606 HD22 LEU 79 1HD2 LEU 79 -10.711 21.570 -21.166 607 HD23 LEU 79 2HD2 LEU 79 -9.176 22.141 -20.511 608 H TYR 80 H TYR 80 -12.365 16.567 -19.660 609 HA TYR 80 HA TYR 80 -11.611 14.853 -21.616 610 HB2 TYR 80 2HB TYR 80 -14.140 14.850 -19.972 611 HB3 TYR 80 3HB TYR 80 -13.697 13.513 -21.027 612 HD1 TYR 80 HD1 TYR 80 -10.729 14.886 -19.821 613 HD2 TYR 80 HD2 TYR 80 -14.001 12.464 -18.585 614 HE1 TYR 80 HE1 TYR 80 -9.339 13.934 -18.029 615 HE2 TYR 80 HE2 TYR 80 -12.621 11.507 -16.788 616 HH TYR 80 HH TYR 80 -9.834 12.829 -15.707 617 H ARG 81 H ARG 81 -14.707 16.615 -21.569 618 HA ARG 81 HA ARG 81 -15.364 15.746 -24.238 619 HB2 ARG 81 2HB ARG 81 -16.681 17.393 -22.134 620 HB3 ARG 81 3HB ARG 81 -17.196 17.627 -23.799 621 HG2 ARG 81 2HG ARG 81 -18.197 15.604 -23.921 622 HG3 ARG 81 3HG ARG 81 -17.028 14.837 -22.845 623 HD2 ARG 81 2HD ARG 81 -18.924 14.852 -21.536 624 HD3 ARG 81 3HD ARG 81 -18.128 16.341 -21.028 625 HE ARG 81 HE ARG 81 -19.840 16.984 -23.124 626 HH11 ARG 81 1HH1 ARG 81 -20.042 15.772 -19.866 627 HH12 ARG 81 2HH1 ARG 81 -21.605 16.457 -19.570 628 HH21 ARG 81 1HH2 ARG 81 -21.899 17.890 -22.745 629 HH22 ARG 81 2HH2 ARG 81 -22.661 17.661 -21.208 630 H ALA 82 H ALA 82 -13.798 18.452 -22.765 631 HA ALA 82 HA ALA 82 -14.172 20.494 -24.570 632 HB1 ALA 82 1HB ALA 82 -12.079 21.404 -23.829 633 HB2 ALA 82 2HB ALA 82 -12.879 20.643 -22.454 634 HB3 ALA 82 3HB ALA 82 -11.542 19.823 -23.260 635 H ILE 83 H ILE 83 -12.074 17.679 -24.852 636 HA ILE 83 HA ILE 83 -10.931 18.603 -27.347 637 HB ILE 83 HB ILE 83 -10.644 15.958 -25.917 638 HG12 ILE 83 2HG1 ILE 83 -9.660 17.781 -24.654 639 HG13 ILE 83 3HG1 ILE 83 -8.376 16.819 -25.378 640 HG21 ILE 83 1HG2 ILE 83 -9.680 16.935 -28.530 641 HG22 ILE 83 2HG2 ILE 83 -8.506 16.079 -27.532 642 HG23 ILE 83 3HG2 ILE 83 -10.017 15.292 -27.984 643 HD11 ILE 83 3HD1 ILE 83 -7.816 19.125 -25.593 644 HD12 ILE 83 1HD1 ILE 83 -8.226 18.507 -27.193 645 HD13 ILE 83 2HD1 ILE 83 -9.387 19.493 -26.304 646 H LYS 84 H LYS 84 -13.615 16.728 -26.311 647 HA LYS 84 HA LYS 84 -13.929 15.231 -28.743 648 HB2 LYS 84 2HB LYS 84 -15.605 14.146 -27.669 649 HB3 LYS 84 3HB LYS 84 -14.863 14.865 -26.245 650 HG2 LYS 84 2HG LYS 84 -17.013 15.465 -25.867 651 HG3 LYS 84 3HG LYS 84 -16.516 16.847 -26.845 652 HD2 LYS 84 2HD LYS 84 -17.870 16.277 -28.543 653 HD3 LYS 84 3HD LYS 84 -17.470 14.563 -28.409 654 HE2 LYS 84 2HE LYS 84 -19.745 14.671 -27.878 655 HE3 LYS 84 3HE LYS 84 -18.937 14.574 -26.314 656 HZ1 LYS 84 3HZ LYS 84 -20.770 16.288 -26.572 657 HZ2 LYS 84 1HZ LYS 84 -19.681 17.170 -27.519 658 HZ3 LYS 84 2HZ LYS 84 -19.312 16.828 -25.905 659 H LYS 85 H LYS 85 -14.743 18.382 -27.671 660 HA LYS 85 HA LYS 85 -16.892 18.752 -29.579 661 HB2 LYS 85 2HB LYS 85 -15.495 20.675 -27.712 662 HB3 LYS 85 3HB LYS 85 -16.839 21.115 -28.757 663 HG2 LYS 85 2HG LYS 85 -18.353 19.788 -27.561 664 HG3 LYS 85 3HG LYS 85 -17.062 18.896 -26.752 665 HD2 LYS 85 2HD LYS 85 -16.499 20.769 -25.404 666 HD3 LYS 85 3HD LYS 85 -17.509 21.850 -26.366 667 HE2 LYS 85 2HE LYS 85 -19.356 21.305 -25.227 668 HE3 LYS 85 3HE LYS 85 -18.977 19.584 -25.268 669 HZ1 LYS 85 3HZ LYS 85 -17.817 21.563 -23.381 670 HZ2 LYS 85 1HZ LYS 85 -17.460 19.910 -23.418 671 HZ3 LYS 85 2HZ LYS 85 -19.016 20.430 -23.007 672 H LYS 86 H LYS 86 -13.521 19.734 -29.185 673 HA LYS 86 HA LYS 86 -12.034 20.724 -30.601 674 HB2 LYS 86 2HB LYS 86 -12.412 18.556 -31.748 675 HB3 LYS 86 3HB LYS 86 -13.684 19.307 -32.702 676 HG2 LYS 86 2HG LYS 86 -12.182 19.938 -34.195 677 HG3 LYS 86 3HG LYS 86 -11.370 20.911 -32.966 678 HD2 LYS 86 2HD LYS 86 -10.868 17.976 -33.015 679 HD3 LYS 86 3HD LYS 86 -10.108 18.980 -34.252 680 HE2 LYS 86 2HE LYS 86 -9.089 20.362 -32.532 681 HE3 LYS 86 3HE LYS 86 -9.899 19.428 -31.275 682 HZ1 LYS 86 3HZ LYS 86 -7.454 18.902 -31.924 683 HZ2 LYS 86 1HZ LYS 86 -8.163 18.039 -33.195 684 HZ3 LYS 86 2HZ LYS 86 -8.528 17.638 -31.593 685 H GLY 87 H GLY 87 -12.764 22.863 -30.161 686 HA2 GLY 87 2HA GLY 87 -13.077 24.581 -32.198 687 HA3 GLY 87 3HA GLY 87 -14.732 24.053 -31.933 688 H GLY 88 H GLY 88 -12.139 24.685 -29.587 689 HA2 GLY 88 2HA GLY 88 -12.353 27.073 -28.615 690 HA3 GLY 88 3HA GLY 88 -13.976 26.528 -28.217 691 H GLY 89 H GLY 89 -14.233 25.806 -26.216 692 HA2 GLY 89 2HA GLY 89 -13.077 23.867 -24.830 693 HA3 GLY 89 3HA GLY 89 -11.866 25.128 -24.648 694 H GLY 90 H GLY 90 -12.645 24.435 -22.335 695 HA2 GLY 90 2HA GLY 90 -13.359 25.617 -20.429 696 HA3 GLY 90 3HA GLY 90 -14.404 26.591 -21.452 697 H GLY 91 H GLY 91 -15.871 26.106 -19.565 698 HA2 GLY 91 2HA GLY 91 -17.174 23.480 -19.922 699 HA3 GLY 91 3HA GLY 91 -17.205 24.408 -18.430 700 H GLY 92 H GLY 92 -19.179 23.394 -20.701 701 HA2 GLY 92 2HA GLY 92 -21.440 24.582 -20.292 702 HA3 GLY 92 3HA GLY 92 -20.616 25.937 -21.049 703 H GLY 93 H GLY 93 -23.011 24.470 -21.912 704 HA2 GLY 93 2HA GLY 93 -23.806 24.175 -24.099 705 HA3 GLY 93 3HA GLY 93 -22.148 24.010 -24.657 706 H GLY 94 H GLY 94 -23.299 22.228 -25.883 707 HA2 GLY 94 2HA GLY 94 -22.755 19.733 -24.502 708 HA3 GLY 94 3HA GLY 94 -24.428 19.969 -24.985 709 H GLY 95 H GLY 95 -24.951 19.071 -26.857 710 HA2 GLY 95 2HA GLY 95 -24.813 18.538 -29.109 711 HA3 GLY 95 3HA GLY 95 -23.243 19.327 -29.165 712 H GLY 96 H GLY 96 -22.821 17.407 -30.580 713 HA2 GLY 96 2HA GLY 96 -20.981 15.728 -29.999 714 HA3 GLY 96 3HA GLY 96 -22.219 15.001 -28.986 715 H VAL 97 H VAL 97 -20.658 14.453 -31.696 716 HA VAL 97 HA VAL 97 -23.023 13.438 -33.135 717 HB VAL 97 HB VAL 97 -21.763 15.121 -34.417 718 HG11 VAL 97 1HG1 VAL 97 -19.538 14.124 -33.289 719 HG12 VAL 97 2HG1 VAL 97 -19.473 13.310 -34.853 720 HG13 VAL 97 3HG1 VAL 97 -19.532 15.072 -34.776 721 HG21 VAL 97 3HG2 VAL 97 -21.410 12.371 -35.600 722 HG22 VAL 97 1HG2 VAL 97 -22.953 13.221 -35.515 723 HG23 VAL 97 2HG2 VAL 97 -21.629 13.891 -36.467 724 H TRP 98 H TRP 98 -20.008 12.661 -31.649 725 HA TRP 98 HA TRP 98 -20.568 9.855 -31.805 726 HB2 TRP 98 2HB TRP 98 -18.395 9.266 -32.909 727 HB3 TRP 98 3HB TRP 98 -19.561 10.040 -33.979 728 HD1 TRP 98 HD1 TRP 98 -18.011 12.601 -31.820 729 HE1 TRP 98 HE1 TRP 98 -16.180 13.878 -33.102 730 HE3 TRP 98 HE3 TRP 98 -17.544 9.509 -35.865 731 HZ2 TRP 98 HZ2 TRP 98 -14.731 13.611 -35.509 732 HZ3 TRP 98 HZ3 TRP 98 -15.913 10.092 -37.613 733 HH2 TRP 98 HH2 TRP 98 -14.537 12.101 -37.437 734 HA PRO 99 HA PRO 99 -18.096 11.447 -28.168 735 HB2 PRO 99 2HB PRO 99 -19.865 10.636 -26.275 736 HB3 PRO 99 3HB PRO 99 -19.961 12.213 -27.067 737 HG2 PRO 99 2HG PRO 99 -21.492 9.706 -27.645 738 HG3 PRO 99 3HG PRO 99 -22.074 11.379 -27.564 739 HD2 PRO 99 2HD PRO 99 -21.563 10.126 -29.909 740 HD3 PRO 99 3HD PRO 99 -21.332 11.872 -29.690 741 H LEU 100 H LEU 100 -17.252 9.293 -29.484 742 HA LEU 100 HA LEU 100 -17.571 6.937 -27.795 743 HB2 LEU 100 2HB LEU 100 -16.649 5.691 -29.519 744 HB3 LEU 100 3HB LEU 100 -17.577 6.933 -30.358 745 HG LEU 100 HG LEU 100 -15.090 8.070 -30.211 746 HD11 LEU 100 1HD1 LEU 100 -14.149 5.981 -29.319 747 HD12 LEU 100 2HD1 LEU 100 -13.485 6.396 -30.899 748 HD13 LEU 100 3HD1 LEU 100 -14.706 5.131 -30.761 749 HD21 LEU 100 3HD2 LEU 100 -14.922 7.208 -32.626 750 HD22 LEU 100 1HD2 LEU 100 -16.305 8.214 -32.195 751 HD23 LEU 100 2HD2 LEU 100 -16.493 6.465 -32.320 752 H VAL 101 H VAL 101 -15.386 9.528 -28.325 753 HA VAL 101 HA VAL 101 -13.102 8.159 -27.175 754 HB VAL 101 HB VAL 101 -11.942 10.317 -27.409 755 HG11 VAL 101 1HG1 VAL 101 -11.472 9.588 -29.451 756 HG12 VAL 101 2HG1 VAL 101 -12.996 8.700 -29.504 757 HG13 VAL 101 3HG1 VAL 101 -12.928 10.373 -30.060 758 HG21 VAL 101 3HG2 VAL 101 -14.697 11.261 -27.868 759 HG22 VAL 101 1HG2 VAL 101 -13.309 12.097 -27.171 760 HG23 VAL 101 2HG2 VAL 101 -13.463 11.951 -28.922 761 H ILE 102 H ILE 102 -15.485 10.579 -26.238 762 HA ILE 102 HA ILE 102 -14.408 11.523 -23.884 763 HB ILE 102 HB ILE 102 -16.812 11.728 -23.087 764 HG12 ILE 102 2HG1 ILE 102 -18.198 11.405 -25.460 765 HG13 ILE 102 3HG1 ILE 102 -17.155 9.988 -25.411 766 HG21 ILE 102 1HG2 ILE 102 -15.890 13.620 -24.098 767 HG22 ILE 102 2HG2 ILE 102 -15.828 12.855 -25.685 768 HG23 ILE 102 3HG2 ILE 102 -17.379 13.339 -25.000 769 HD11 ILE 102 3HD1 ILE 102 -18.549 9.019 -24.003 770 HD12 ILE 102 1HD1 ILE 102 -18.296 10.321 -22.841 771 HD13 ILE 102 2HD1 ILE 102 -19.584 10.446 -24.040 772 H ARG 103 H ARG 103 -16.413 8.619 -24.333 773 HA ARG 103 HA ARG 103 -16.554 7.803 -21.681 774 HB2 ARG 103 2HB ARG 103 -16.857 5.495 -22.629 775 HB3 ARG 103 3HB ARG 103 -17.922 6.718 -23.309 776 HG2 ARG 103 2HG ARG 103 -16.464 6.893 -25.268 777 HG3 ARG 103 3HG ARG 103 -15.412 5.651 -24.586 778 HD2 ARG 103 2HD ARG 103 -16.756 4.457 -26.057 779 HD3 ARG 103 3HD ARG 103 -17.542 4.206 -24.499 780 HE ARG 103 HE ARG 103 -18.592 6.450 -25.942 781 HH11 ARG 103 1HH1 ARG 103 -18.752 2.995 -25.546 782 HH12 ARG 103 2HH1 ARG 103 -20.375 2.871 -26.140 783 HH21 ARG 103 1HH2 ARG 103 -20.729 6.300 -26.725 784 HH22 ARG 103 2HH2 ARG 103 -21.498 4.751 -26.811 785 H THR 104 H THR 104 -14.060 7.174 -24.107 786 HA THR 104 HA THR 104 -12.509 5.305 -22.826 787 HB THR 104 HB THR 104 -10.987 7.510 -24.084 788 HG1 THR 104 HG1 THR 104 -11.815 6.743 -26.186 789 HG21 THR 104 3HG2 THR 104 -10.447 5.274 -25.490 790 HG22 THR 104 1HG2 THR 104 -10.990 4.559 -23.973 791 HG23 THR 104 2HG2 THR 104 -9.639 5.692 -23.979 792 H VAL 105 H VAL 105 -12.361 8.837 -22.433 793 HA VAL 105 HA VAL 105 -10.353 8.675 -20.381 794 HB VAL 105 HB VAL 105 -12.012 11.126 -20.765 795 HG11 VAL 105 1HG1 VAL 105 -9.039 10.732 -20.450 796 HG12 VAL 105 2HG1 VAL 105 -9.928 12.253 -20.346 797 HG13 VAL 105 3HG1 VAL 105 -10.160 11.009 -19.117 798 HG21 VAL 105 3HG2 VAL 105 -10.271 9.858 -22.820 799 HG22 VAL 105 1HG2 VAL 105 -11.755 10.790 -23.015 800 HG23 VAL 105 2HG2 VAL 105 -10.238 11.614 -22.653 801 H ILE 106 H ILE 106 -13.839 8.924 -20.520 802 HA ILE 106 HA ILE 106 -14.291 9.694 -17.842 803 HB ILE 106 HB ILE 106 -16.083 8.114 -19.691 804 HG12 ILE 106 2HG1 ILE 106 -15.228 10.819 -19.765 805 HG13 ILE 106 3HG1 ILE 106 -16.444 10.038 -20.770 806 HG21 ILE 106 1HG2 ILE 106 -16.705 9.574 -17.127 807 HG22 ILE 106 2HG2 ILE 106 -17.905 8.891 -18.223 808 HG23 ILE 106 3HG2 ILE 106 -16.769 7.831 -17.389 809 HD11 ILE 106 3HD1 ILE 106 -18.167 10.607 -19.172 810 HD12 ILE 106 1HD1 ILE 106 -16.964 11.321 -18.099 811 HD13 ILE 106 2HD1 ILE 106 -17.289 12.052 -19.671 812 H ALA 107 H ALA 107 -13.306 6.730 -19.241 813 HA ALA 107 HA ALA 107 -14.339 4.778 -17.616 814 HB1 ALA 107 1HB ALA 107 -12.142 3.588 -17.958 815 HB2 ALA 107 2HB ALA 107 -12.953 4.138 -19.425 816 HB3 ALA 107 3HB ALA 107 -11.579 5.041 -18.785 817 H GLY 108 H GLY 108 -12.160 7.313 -16.756 818 HA2 GLY 108 2HA GLY 108 -11.383 5.995 -14.264 819 HA3 GLY 108 3HA GLY 108 -10.757 7.521 -14.870 820 H TYR 109 H TYR 109 -13.474 8.545 -15.415 821 HA TYR 109 HA TYR 109 -13.913 10.021 -13.136 822 HB2 TYR 109 2HB TYR 109 -15.249 10.994 -14.648 823 HB3 TYR 109 3HB TYR 109 -15.320 9.528 -15.619 824 HD1 TYR 109 HD2 TYR 109 -16.919 11.387 -12.869 825 HD2 TYR 109 HD1 TYR 109 -17.197 8.048 -15.491 826 HE1 TYR 109 HE2 TYR 109 -19.269 11.075 -12.213 827 HE2 TYR 109 HE1 TYR 109 -19.548 7.727 -14.844 828 HH TYR 109 HH TYR 109 -21.390 9.008 -13.905 829 H ASN 110 H ASN 110 -15.565 7.025 -14.107 830 HA ASN 110 HA ASN 110 -17.357 6.787 -12.024 831 HB2 ASN 110 2HB ASN 110 -15.995 4.876 -13.841 832 HB3 ASN 110 3HB ASN 110 -16.741 4.194 -12.399 833 HD21 ASN 110 1HD2 ASN 110 -17.309 4.425 -15.460 834 HD22 ASN 110 2HD2 ASN 110 -19.008 4.735 -15.497 835 H LEU 111 H LEU 111 -13.938 6.555 -11.937 836 HA LEU 111 HA LEU 111 -13.916 5.147 -9.384 837 HB2 LEU 111 2HB LEU 111 -12.084 5.488 -11.542 838 HB3 LEU 111 3HB LEU 111 -11.337 6.095 -10.066 839 HG LEU 111 HG LEU 111 -10.799 3.725 -10.580 840 HD11 LEU 111 1HD1 LEU 111 -10.424 3.660 -8.398 841 HD12 LEU 111 2HD1 LEU 111 -12.092 3.146 -8.148 842 HD13 LEU 111 3HD1 LEU 111 -11.684 4.861 -8.112 843 HD21 LEU 111 3HD2 LEU 111 -13.521 2.925 -9.692 844 HD22 LEU 111 1HD2 LEU 111 -12.360 2.064 -10.703 845 HD23 LEU 111 2HD2 LEU 111 -13.296 3.398 -11.376 846 H TYR 112 H TYR 112 -13.420 8.344 -10.718 847 HA TYR 112 HA TYR 112 -12.097 9.701 -8.776 848 HB2 TYR 112 2HB TYR 112 -12.817 11.547 -9.849 849 HB3 TYR 112 3HB TYR 112 -13.603 10.424 -10.953 850 HD1 TYR 112 HD2 TYR 112 -14.250 12.135 -7.692 851 HD2 TYR 112 HD1 TYR 112 -15.857 10.710 -11.365 852 HE1 TYR 112 HE2 TYR 112 -16.436 13.097 -7.102 853 HE2 TYR 112 HE1 TYR 112 -18.046 11.669 -10.786 854 HH TYR 112 HH TYR 112 -19.227 12.788 -9.281 855 H ARG 113 H ARG 113 -15.518 8.785 -8.713 856 HA ARG 113 HA ARG 113 -15.857 9.905 -6.056 857 HB2 ARG 113 2HB ARG 113 -17.579 9.218 -8.229 858 HB3 ARG 113 3HB ARG 113 -18.093 8.319 -6.807 859 HG2 ARG 113 2HG ARG 113 -17.513 11.122 -6.255 860 HG3 ARG 113 3HG ARG 113 -18.813 10.882 -7.424 861 HD2 ARG 113 2HD ARG 113 -19.998 9.460 -5.874 862 HD3 ARG 113 3HD ARG 113 -18.662 9.545 -4.726 863 HE ARG 113 HE ARG 113 -19.402 11.613 -4.056 864 HH11 ARG 113 1HH1 ARG 113 -21.028 10.686 -6.992 865 HH12 ARG 113 2HH1 ARG 113 -22.167 11.990 -6.927 866 HH21 ARG 113 1HH2 ARG 113 -20.897 13.334 -3.959 867 HH22 ARG 113 2HH2 ARG 113 -22.091 13.496 -5.202 868 H ALA 114 H ALA 114 -15.228 6.846 -7.548 869 HA ALA 114 HA ALA 114 -16.152 5.026 -5.699 870 HB1 ALA 114 1HB ALA 114 -13.489 4.823 -7.092 871 HB2 ALA 114 2HB ALA 114 -14.506 3.501 -6.520 872 HB3 ALA 114 3HB ALA 114 -15.038 4.501 -7.871 873 H ILE 115 H ILE 115 -13.289 7.064 -5.534 874 HA ILE 115 HA ILE 115 -12.326 5.826 -3.112 875 HB ILE 115 HB ILE 115 -11.442 8.370 -4.479 876 HG12 ILE 115 2HG1 ILE 115 -11.057 6.437 -5.890 877 HG13 ILE 115 3HG1 ILE 115 -9.520 6.974 -5.221 878 HG21 ILE 115 1HG2 ILE 115 -10.707 7.129 -1.943 879 HG22 ILE 115 2HG2 ILE 115 -9.329 7.450 -2.995 880 HG23 ILE 115 3HG2 ILE 115 -10.412 8.764 -2.534 881 HD11 ILE 115 3HD1 ILE 115 -11.162 4.663 -4.214 882 HD12 ILE 115 1HD1 ILE 115 -9.711 4.550 -5.210 883 HD13 ILE 115 2HD1 ILE 115 -9.608 5.191 -3.570 884 H LYS 116 H LYS 116 -14.506 8.337 -3.943 885 HA LYS 116 HA LYS 116 -14.285 9.830 -1.508 886 HB2 LYS 116 2HB LYS 116 -15.160 11.158 -3.167 887 HB3 LYS 116 3HB LYS 116 -16.087 9.844 -3.879 888 HG2 LYS 116 2HG LYS 116 -17.556 11.506 -2.907 889 HG3 LYS 116 3HG LYS 116 -17.690 9.975 -2.038 890 HD2 LYS 116 2HD LYS 116 -17.148 10.979 -0.130 891 HD3 LYS 116 3HD LYS 116 -15.636 11.557 -0.835 892 HE2 LYS 116 2HE LYS 116 -17.430 13.260 -1.956 893 HE3 LYS 116 3HE LYS 116 -18.180 12.960 -0.389 894 HZ1 LYS 116 3HZ LYS 116 -16.684 14.862 -0.325 895 HZ2 LYS 116 1HZ LYS 116 -15.389 13.887 -0.809 896 HZ3 LYS 116 2HZ LYS 116 -16.131 13.626 0.689 897 H LYS 117 H LYS 117 -16.313 7.210 -2.684 898 HA LYS 117 HA LYS 117 -18.151 7.251 -0.512 899 HB2 LYS 117 2HB LYS 117 -17.450 5.157 -2.566 900 HB3 LYS 117 3HB LYS 117 -18.674 4.896 -1.330 901 HG2 LYS 117 2HG LYS 117 -19.973 6.753 -2.177 902 HG3 LYS 117 3HG LYS 117 -18.722 7.111 -3.370 903 HD2 LYS 117 2HD LYS 117 -19.464 5.528 -4.765 904 HD3 LYS 117 3HD LYS 117 -19.603 4.339 -3.467 905 HE2 LYS 117 2HE LYS 117 -21.754 5.231 -2.829 906 HE3 LYS 117 3HE LYS 117 -21.602 6.533 -4.007 907 HZ1 LYS 117 3HZ LYS 117 -21.291 4.381 -5.559 908 HZ2 LYS 117 1HZ LYS 117 -22.778 5.140 -5.289 909 HZ3 LYS 117 2HZ LYS 117 -22.356 3.766 -4.399 910 H LYS 118 H LYS 118 -15.165 5.490 -1.174 911 HA LYS 118 HA LYS 118 -15.318 4.259 1.489 912 HB2 LYS 118 2HB LYS 118 -13.408 3.602 -0.758 913 HB3 LYS 118 3HB LYS 118 -13.654 2.685 0.722 914 HG2 LYS 118 2HG LYS 118 -15.954 2.190 0.012 915 HG3 LYS 118 3HG LYS 118 -15.659 3.063 -1.493 916 HD2 LYS 118 2HD LYS 118 -13.547 1.216 -1.182 917 HD3 LYS 118 3HD LYS 118 -15.044 0.349 -0.832 918 HE2 LYS 118 2HE LYS 118 -15.888 0.684 -2.950 919 HE3 LYS 118 3HE LYS 118 -14.911 2.126 -3.226 920 HZ1 LYS 118 3HZ LYS 118 -13.026 0.848 -3.666 921 HZ2 LYS 118 1HZ LYS 118 -14.268 0.026 -4.468 922 HZ3 LYS 118 2HZ LYS 118 -13.687 -0.555 -2.990 Start of MODEL 13 1 H1 VAL 1 H VAL 1 -2.251 -4.315 -4.463 2 HA VAL 1 HA VAL 1 -2.059 -4.918 -2.263 3 HB VAL 1 HB VAL 1 0.160 -3.935 -2.197 4 HG11 VAL 1 1HG1 VAL 1 -1.097 -1.311 -1.430 5 HG12 VAL 1 2HG1 VAL 1 0.596 -1.645 -1.801 6 HG13 VAL 1 3HG1 VAL 1 -0.615 -1.696 -3.083 7 HG21 VAL 1 3HG2 VAL 1 -1.441 -3.045 0.200 8 HG22 VAL 1 1HG2 VAL 1 -0.896 -4.696 -0.096 9 HG23 VAL 1 2HG2 VAL 1 0.284 -3.410 0.159 10 H TRP 2 H TRP 2 -3.315 -1.889 -3.278 11 HA TRP 2 HA TRP 2 -5.650 -2.066 -1.782 12 HB2 TRP 2 2HB TRP 2 -4.741 -1.576 0.265 13 HB3 TRP 2 3HB TRP 2 -3.411 -0.651 -0.426 14 HD1 TRP 2 HD1 TRP 2 -3.570 1.753 0.415 15 HE1 TRP 2 HE1 TRP 2 -5.455 3.470 0.769 16 HE3 TRP 2 HE3 TRP 2 -7.572 -1.156 -0.873 17 HZ2 TRP 2 HZ2 TRP 2 -8.266 3.577 0.535 18 HZ3 TRP 2 HZ3 TRP 2 -9.824 -0.171 -0.781 19 HH2 TRP 2 HH2 TRP 2 -10.162 2.146 -0.091 20 HA PRO 3 HA PRO 3 -5.321 2.388 -3.624 21 HB2 PRO 3 2HB PRO 3 -2.926 3.135 -4.662 22 HB3 PRO 3 3HB PRO 3 -3.364 3.399 -2.970 23 HG2 PRO 3 2HG PRO 3 -1.688 1.231 -4.176 24 HG3 PRO 3 3HG PRO 3 -1.411 2.166 -2.695 25 HD2 PRO 3 2HD PRO 3 -2.422 -0.346 -2.665 26 HD3 PRO 3 3HD PRO 3 -2.870 0.878 -1.460 27 H LEU 4 H LEU 4 -6.472 0.777 -5.060 28 HA LEU 4 HA LEU 4 -5.109 0.160 -7.554 29 HB2 LEU 4 2HB LEU 4 -6.418 -1.628 -6.983 30 HB3 LEU 4 3HB LEU 4 -7.676 -0.618 -6.275 31 HG LEU 4 HG LEU 4 -8.378 0.015 -8.577 32 HD11 LEU 4 1HD1 LEU 4 -7.464 -0.898 -10.477 33 HD12 LEU 4 2HD1 LEU 4 -6.780 -2.277 -9.619 34 HD13 LEU 4 3HD1 LEU 4 -6.030 -0.688 -9.473 35 HD21 LEU 4 3HD2 LEU 4 -8.626 -2.859 -8.785 36 HD22 LEU 4 1HD2 LEU 4 -9.859 -1.640 -8.461 37 HD23 LEU 4 2HD2 LEU 4 -8.901 -2.300 -7.135 38 H VAL 5 H VAL 5 -7.236 2.528 -6.260 39 HA VAL 5 HA VAL 5 -8.485 3.370 -8.661 40 HB VAL 5 HB VAL 5 -8.977 5.469 -7.434 41 HG11 VAL 5 1HG1 VAL 5 -9.944 2.918 -6.967 42 HG12 VAL 5 2HG1 VAL 5 -9.669 3.573 -5.352 43 HG13 VAL 5 3HG1 VAL 5 -10.709 4.433 -6.488 44 HG21 VAL 5 3HG2 VAL 5 -8.325 5.134 -4.861 45 HG22 VAL 5 1HG2 VAL 5 -6.939 4.341 -5.611 46 HG23 VAL 5 2HG2 VAL 5 -7.310 6.022 -5.998 47 H ILE 6 H ILE 6 -5.531 4.357 -6.991 48 HA ILE 6 HA ILE 6 -4.838 6.623 -8.373 49 HB ILE 6 HB ILE 6 -2.497 6.086 -7.933 50 HG12 ILE 6 2HG1 ILE 6 -2.379 3.753 -6.556 51 HG13 ILE 6 3HG1 ILE 6 -3.598 3.346 -7.759 52 HG21 ILE 6 1HG2 ILE 6 -2.944 6.775 -5.872 53 HG22 ILE 6 2HG2 ILE 6 -4.591 6.161 -6.002 54 HG23 ILE 6 3HG2 ILE 6 -3.305 5.112 -5.408 55 HD11 ILE 6 3HD1 ILE 6 -0.712 3.880 -8.080 56 HD12 ILE 6 1HD1 ILE 6 -1.757 2.729 -8.911 57 HD13 ILE 6 2HD1 ILE 6 -1.781 4.432 -9.370 58 H ARG 7 H ARG 7 -4.526 3.271 -9.411 59 HA ARG 7 HA ARG 7 -3.268 4.080 -11.912 60 HB2 ARG 7 2HB ARG 7 -3.255 1.600 -12.359 61 HB3 ARG 7 3HB ARG 7 -2.337 2.111 -10.949 62 HG2 ARG 7 2HG ARG 7 -4.087 1.375 -9.476 63 HG3 ARG 7 3HG ARG 7 -5.131 0.999 -10.848 64 HD2 ARG 7 2HD ARG 7 -3.970 -0.970 -9.797 65 HD3 ARG 7 3HD ARG 7 -3.734 -0.788 -11.534 66 HE ARG 7 HE ARG 7 -1.502 -0.523 -11.149 67 HH11 ARG 7 1HH1 ARG 7 -3.227 0.109 -8.192 68 HH12 ARG 7 2HH1 ARG 7 -1.791 0.272 -7.236 69 HH21 ARG 7 1HH2 ARG 7 0.395 -0.311 -9.902 70 HH22 ARG 7 2HH2 ARG 7 0.269 0.035 -8.210 71 H THR 8 H THR 8 -6.311 2.786 -10.711 72 HA THR 8 HA THR 8 -7.563 2.054 -13.055 73 HB THR 8 HB THR 8 -8.799 3.415 -10.654 74 HG1 THR 8 HG1 THR 8 -8.776 0.652 -11.328 75 HG21 THR 8 3HG2 THR 8 -10.760 1.865 -11.678 76 HG22 THR 8 1HG2 THR 8 -9.953 2.372 -13.161 77 HG23 THR 8 2HG2 THR 8 -10.579 3.581 -12.041 78 H VAL 9 H VAL 9 -7.550 5.280 -11.544 79 HA VAL 9 HA VAL 9 -9.059 6.564 -13.540 80 HB VAL 9 HB VAL 9 -8.017 8.676 -12.658 81 HG11 VAL 9 1HG1 VAL 9 -8.822 7.838 -10.150 82 HG12 VAL 9 2HG1 VAL 9 -9.861 8.490 -11.418 83 HG13 VAL 9 3HG1 VAL 9 -9.664 6.745 -11.248 84 HG21 VAL 9 3HG2 VAL 9 -5.944 8.328 -11.825 85 HG22 VAL 9 1HG2 VAL 9 -6.833 8.024 -10.332 86 HG23 VAL 9 2HG2 VAL 9 -6.302 6.673 -11.333 87 H ILE 10 H ILE 10 -5.541 6.343 -13.065 88 HA ILE 10 HA ILE 10 -4.786 7.881 -15.280 89 HB ILE 10 HB ILE 10 -3.258 5.548 -14.124 90 HG12 ILE 10 2HG1 ILE 10 -4.122 7.605 -12.636 91 HG13 ILE 10 3HG1 ILE 10 -2.556 6.843 -12.379 92 HG21 ILE 10 1HG2 ILE 10 -2.444 7.931 -15.770 93 HG22 ILE 10 2HG2 ILE 10 -1.294 6.929 -14.886 94 HG23 ILE 10 3HG2 ILE 10 -2.273 6.223 -16.173 95 HD11 ILE 10 3HD1 ILE 10 -2.828 9.181 -14.219 96 HD12 ILE 10 1HD1 ILE 10 -2.700 9.407 -12.474 97 HD13 ILE 10 2HD1 ILE 10 -1.406 8.596 -13.357 98 H ALA 11 H ALA 11 -6.115 4.732 -15.100 99 HA ALA 11 HA ALA 11 -5.078 3.374 -17.241 100 HB1 ALA 11 1HB ALA 11 -8.034 3.439 -16.719 101 HB2 ALA 11 2HB ALA 11 -7.043 2.094 -17.285 102 HB3 ALA 11 3HB ALA 11 -6.904 2.651 -15.618 103 H GLY 12 H GLY 12 -7.045 6.229 -17.281 104 HA2 GLY 12 2HA GLY 12 -7.576 5.967 -20.147 105 HA3 GLY 12 3HA GLY 12 -8.235 7.197 -19.078 106 H TYR 13 H TYR 13 -5.600 7.815 -17.927 107 HA TYR 13 HA TYR 13 -4.876 9.970 -19.493 108 HB2 TYR 13 2HB TYR 13 -3.473 8.420 -17.353 109 HB3 TYR 13 3HB TYR 13 -2.582 9.652 -18.239 110 HD1 TYR 13 HD2 TYR 13 -6.129 10.206 -17.789 111 HD2 TYR 13 HD1 TYR 13 -2.293 10.824 -16.056 112 HE1 TYR 13 HE2 TYR 13 -7.077 11.940 -16.324 113 HE2 TYR 13 HE1 TYR 13 -3.230 12.559 -14.585 114 HH TYR 13 HH TYR 13 -5.038 13.915 -14.257 115 H ASN 14 H ASN 14 -3.323 6.770 -19.353 116 HA ASN 14 HA ASN 14 -1.260 7.145 -21.123 117 HB2 ASN 14 2HB ASN 14 -2.766 4.868 -20.111 118 HB3 ASN 14 3HB ASN 14 -2.188 4.599 -21.752 119 HD21 ASN 14 1HD2 ASN 14 0.068 4.742 -22.158 120 HD22 ASN 14 2HD2 ASN 14 1.206 4.468 -20.888 121 H LEU 15 H LEU 15 -4.653 6.974 -21.793 122 HA LEU 15 HA LEU 15 -4.272 6.596 -24.644 123 HB2 LEU 15 2HB LEU 15 -6.430 6.338 -22.779 124 HB3 LEU 15 3HB LEU 15 -6.917 7.399 -24.100 125 HG LEU 15 HG LEU 15 -5.673 5.139 -25.260 126 HD11 LEU 15 1HD1 LEU 15 -5.974 3.662 -23.546 127 HD12 LEU 15 2HD1 LEU 15 -7.538 3.518 -24.347 128 HD13 LEU 15 3HD1 LEU 15 -7.376 4.518 -22.903 129 HD21 LEU 15 3HD2 LEU 15 -8.371 6.385 -25.176 130 HD22 LEU 15 1HD2 LEU 15 -8.215 4.770 -25.866 131 HD23 LEU 15 2HD2 LEU 15 -7.292 6.111 -26.545 132 H TYR 16 H TYR 16 -5.042 9.178 -22.392 133 HA TYR 16 HA TYR 16 -5.978 11.168 -24.002 134 HB2 TYR 16 2HB TYR 16 -4.911 11.023 -21.432 135 HB3 TYR 16 3HB TYR 16 -3.900 12.206 -22.254 136 HD1 TYR 16 HD2 TYR 16 -5.456 13.844 -23.833 137 HD2 TYR 16 HD1 TYR 16 -6.641 11.930 -20.222 138 HE1 TYR 16 HE2 TYR 16 -7.185 15.560 -23.497 139 HE2 TYR 16 HE1 TYR 16 -8.374 13.641 -19.877 140 HH TYR 16 HH TYR 16 -9.225 15.571 -20.596 141 H ARG 17 H ARG 17 -2.546 10.391 -23.461 142 HA ARG 17 HA ARG 17 -1.638 12.297 -25.396 143 HB2 ARG 17 2HB ARG 17 -0.470 10.737 -23.355 144 HB3 ARG 17 3HB ARG 17 0.307 10.247 -24.855 145 HG2 ARG 17 2HG ARG 17 0.451 12.877 -25.189 146 HG3 ARG 17 3HG ARG 17 0.395 12.837 -23.425 147 HD2 ARG 17 2HD ARG 17 2.662 12.712 -23.821 148 HD3 ARG 17 3HD ARG 17 2.230 11.008 -23.684 149 HE ARG 17 HE ARG 17 2.880 10.738 -25.850 150 HH11 ARG 17 1HH1 ARG 17 2.161 14.103 -25.325 151 HH12 ARG 17 2HH1 ARG 17 2.674 14.594 -26.905 152 HH21 ARG 17 1HH2 ARG 17 3.559 11.371 -27.933 153 HH22 ARG 17 2HH2 ARG 17 3.468 13.039 -28.388 154 H ALA 18 H ALA 18 -2.633 8.987 -25.466 155 HA ALA 18 HA ALA 18 -1.317 7.948 -27.646 156 HB1 ALA 18 1HB ALA 18 -4.255 7.511 -27.193 157 HB2 ALA 18 2HB ALA 18 -3.066 6.387 -27.852 158 HB3 ALA 18 3HB ALA 18 -3.020 6.817 -26.142 159 H ILE 19 H ILE 19 -3.993 10.228 -27.589 160 HA ILE 19 HA ILE 19 -4.314 10.168 -30.464 161 HB ILE 19 HB ILE 19 -5.543 12.024 -28.421 162 HG12 ILE 19 2HG1 ILE 19 -6.229 9.722 -28.044 163 HG13 ILE 19 3HG1 ILE 19 -7.567 10.627 -28.744 164 HG21 ILE 19 1HG2 ILE 19 -5.585 11.975 -31.326 165 HG22 ILE 19 2HG2 ILE 19 -7.200 11.913 -30.621 166 HG23 ILE 19 3HG2 ILE 19 -6.107 13.234 -30.207 167 HD11 ILE 19 3HD1 ILE 19 -7.066 9.663 -30.931 168 HD12 ILE 19 1HD1 ILE 19 -5.738 8.748 -30.218 169 HD13 ILE 19 2HD1 ILE 19 -7.400 8.421 -29.726 170 H LYS 20 H LYS 20 -2.450 11.891 -28.159 171 HA LYS 20 HA LYS 20 -2.044 14.251 -29.742 172 HB2 LYS 20 2HB LYS 20 -1.045 13.190 -27.163 173 HB3 LYS 20 3HB LYS 20 0.020 14.306 -28.008 174 HG2 LYS 20 2HG LYS 20 -1.263 15.615 -26.537 175 HG3 LYS 20 3HG LYS 20 -1.946 15.884 -28.142 176 HD2 LYS 20 2HD LYS 20 -3.218 13.640 -26.858 177 HD3 LYS 20 3HD LYS 20 -3.300 15.073 -25.831 178 HE2 LYS 20 2HE LYS 20 -3.992 16.232 -28.096 179 HE3 LYS 20 3HE LYS 20 -4.467 14.590 -28.528 180 HZ1 LYS 20 3HZ LYS 20 -6.074 14.533 -26.903 181 HZ2 LYS 20 1HZ LYS 20 -6.161 16.151 -27.390 182 HZ3 LYS 20 2HZ LYS 20 -5.347 15.740 -25.966 183 H LYS 21 H LYS 21 -0.463 11.161 -29.354 184 HA LYS 21 HA LYS 21 1.926 11.918 -30.757 185 HB2 LYS 21 2HB LYS 21 2.412 9.476 -30.720 186 HB3 LYS 21 3HB LYS 21 2.069 10.148 -29.131 187 HG2 LYS 21 2HG LYS 21 -0.189 9.254 -29.219 188 HG3 LYS 21 3HG LYS 21 0.113 8.619 -30.838 189 HD2 LYS 21 2HD LYS 21 1.689 7.837 -28.389 190 HD3 LYS 21 3HD LYS 21 0.314 6.925 -29.015 191 HE2 LYS 21 2HE LYS 21 1.902 7.274 -31.237 192 HE3 LYS 21 3HE LYS 21 3.075 7.031 -29.944 193 HZ1 LYS 21 3HZ LYS 21 2.065 5.010 -31.209 194 HZ2 LYS 21 1HZ LYS 21 0.777 5.216 -30.133 195 HZ3 LYS 21 2HZ LYS 21 2.334 4.920 -29.542 196 H LYS 22 H LYS 22 -1.082 10.262 -31.559 197 HA LYS 22 HA LYS 22 -2.005 9.619 -33.539 198 HB2 LYS 22 2HB LYS 22 -1.887 12.059 -33.912 199 HB3 LYS 22 3HB LYS 22 -0.293 11.863 -34.627 200 HG2 LYS 22 2HG LYS 22 -1.216 10.583 -36.446 201 HG3 LYS 22 3HG LYS 22 -2.816 10.620 -35.702 202 HD2 LYS 22 2HD LYS 22 -2.227 13.268 -35.807 203 HD3 LYS 22 3HD LYS 22 -1.396 12.680 -37.249 204 HE2 LYS 22 2HE LYS 22 -4.218 11.858 -36.693 205 HE3 LYS 22 3HE LYS 22 -3.879 13.433 -37.408 206 HZ1 LYS 22 3HZ LYS 22 -3.819 10.846 -38.615 207 HZ2 LYS 22 1HZ LYS 22 -2.371 11.685 -38.866 208 HZ3 LYS 22 2HZ LYS 22 -3.841 12.372 -39.344 209 H GLY 23 H GLY 23 -1.018 7.570 -33.613 210 HA2 GLY 23 2HA GLY 23 0.091 6.650 -35.850 211 HA3 GLY 23 3HA GLY 23 1.508 7.301 -35.041 212 H GLY 24 H GLY 24 -1.277 5.658 -33.592 213 HA2 GLY 24 2HA GLY 24 -0.595 3.094 -33.359 214 HA3 GLY 24 3HA GLY 24 0.556 3.832 -32.254 215 H GLY 25 H GLY 25 -0.180 3.102 -30.325 216 HA2 GLY 25 2HA GLY 25 -2.891 3.985 -29.565 217 HA3 GLY 25 3HA GLY 25 -2.331 2.367 -29.170 218 H GLY 26 H GLY 26 -2.798 2.963 -26.947 219 HA2 GLY 26 2HA GLY 26 -1.298 5.049 -25.677 220 HA3 GLY 26 3HA GLY 26 -2.267 3.824 -24.872 221 H GLY 27 H GLY 27 0.396 4.866 -24.193 222 HA2 GLY 27 2HA GLY 27 1.620 2.562 -23.286 223 HA3 GLY 27 3HA GLY 27 2.349 2.896 -24.849 224 H GLY 28 H GLY 28 2.634 5.561 -24.932 225 HA2 GLY 28 2HA GLY 28 3.430 7.422 -23.582 226 HA3 GLY 28 3HA GLY 28 4.134 6.244 -22.484 227 H GLY 29 H GLY 29 5.448 8.475 -23.786 228 HA2 GLY 29 2HA GLY 29 7.890 7.377 -24.422 229 HA3 GLY 29 3HA GLY 29 7.033 7.489 -25.952 230 H GLY 30 H GLY 30 8.634 8.978 -26.684 231 HA2 GLY 30 2HA GLY 30 9.055 11.465 -25.318 232 HA3 GLY 30 3HA GLY 30 9.620 11.051 -26.929 233 H GLY 31 H GLY 31 9.026 12.856 -28.031 234 HA2 GLY 31 2HA GLY 31 6.528 13.119 -29.127 235 HA3 GLY 31 3HA GLY 31 6.469 14.104 -27.673 236 H GLY 32 H GLY 32 6.048 15.801 -29.335 237 HA2 GLY 32 2HA GLY 32 8.166 17.546 -29.594 238 HA3 GLY 32 3HA GLY 32 8.157 16.610 -31.081 239 H VAL 33 H VAL 33 5.308 16.291 -31.231 240 HA VAL 33 HA VAL 33 4.539 18.339 -32.838 241 HB VAL 33 HB VAL 33 2.132 17.780 -31.741 242 HG11 VAL 33 1HG1 VAL 33 1.796 16.622 -33.646 243 HG12 VAL 33 2HG1 VAL 33 3.411 17.210 -34.049 244 HG13 VAL 33 3HG1 VAL 33 3.201 15.587 -33.390 245 HG21 VAL 33 3HG2 VAL 33 2.015 15.719 -30.703 246 HG22 VAL 33 1HG2 VAL 33 3.576 15.195 -31.335 247 HG23 VAL 33 2HG2 VAL 33 3.506 16.377 -30.028 248 H TRP 34 H TRP 34 2.874 18.151 -29.727 249 HA TRP 34 HA TRP 34 3.733 20.574 -28.639 250 HB2 TRP 34 2HB TRP 34 1.723 21.989 -29.127 251 HB3 TRP 34 3HB TRP 34 2.750 21.692 -30.527 252 HD1 TRP 34 HD1 TRP 34 1.814 19.683 -32.239 253 HE1 TRP 34 HE1 TRP 34 -0.616 19.171 -32.917 254 HE3 TRP 34 HE3 TRP 34 -0.612 22.048 -28.411 255 HZ2 TRP 34 HZ2 TRP 34 -3.217 19.701 -31.956 256 HZ3 TRP 34 HZ3 TRP 34 -3.072 21.999 -28.364 257 HH2 TRP 34 HH2 TRP 34 -4.345 20.849 -30.101 258 HA PRO 35 HA PRO 35 1.007 17.781 -26.093 259 HB2 PRO 35 2HB PRO 35 2.836 17.377 -24.129 260 HB3 PRO 35 3HB PRO 35 2.751 16.375 -25.582 261 HG2 PRO 35 2HG PRO 35 4.582 18.660 -24.961 262 HG3 PRO 35 3HG PRO 35 4.956 17.101 -25.719 263 HD2 PRO 35 2HD PRO 35 4.631 19.376 -27.151 264 HD3 PRO 35 3HD PRO 35 4.187 17.778 -27.784 265 H LEU 36 H LEU 36 0.396 20.348 -26.160 266 HA LEU 36 HA LEU 36 1.013 21.587 -23.594 267 HB2 LEU 36 2HB LEU 36 -0.565 22.571 -25.966 268 HB3 LEU 36 3HB LEU 36 -0.277 23.503 -24.498 269 HG LEU 36 HG LEU 36 2.042 22.478 -26.083 270 HD11 LEU 36 1HD1 LEU 36 1.418 23.631 -27.878 271 HD12 LEU 36 2HD1 LEU 36 1.649 25.091 -26.916 272 HD13 LEU 36 3HD1 LEU 36 0.051 24.354 -27.029 273 HD21 LEU 36 3HD2 LEU 36 1.974 23.728 -23.743 274 HD22 LEU 36 1HD2 LEU 36 1.901 25.145 -24.791 275 HD23 LEU 36 2HD2 LEU 36 3.252 24.019 -24.925 276 H VAL 37 H VAL 37 -1.476 19.778 -25.125 277 HA VAL 37 HA VAL 37 -3.532 20.614 -23.246 278 HB VAL 37 HB VAL 37 -4.984 19.018 -24.432 279 HG11 VAL 37 1HG1 VAL 37 -5.294 20.960 -25.524 280 HG12 VAL 37 2HG1 VAL 37 -3.564 21.237 -25.737 281 HG13 VAL 37 3HG1 VAL 37 -4.426 20.150 -26.827 282 HG21 VAL 37 3HG2 VAL 37 -2.447 18.378 -25.916 283 HG22 VAL 37 1HG2 VAL 37 -3.520 17.275 -25.054 284 HG23 VAL 37 2HG2 VAL 37 -4.046 18.015 -26.566 285 H ILE 38 H ILE 38 -1.610 17.731 -23.983 286 HA ILE 38 HA ILE 38 -2.726 15.894 -22.274 287 HB ILE 38 HB ILE 38 -0.401 14.936 -22.038 288 HG12 ILE 38 2HG1 ILE 38 0.995 16.244 -24.020 289 HG13 ILE 38 3HG1 ILE 38 0.224 17.572 -23.159 290 HG21 ILE 38 1HG2 ILE 38 -1.551 13.968 -23.766 291 HG22 ILE 38 2HG2 ILE 38 -1.774 15.495 -24.618 292 HG23 ILE 38 3HG2 ILE 38 -0.206 14.689 -24.650 293 HD11 ILE 38 3HD1 ILE 38 1.344 15.726 -21.283 294 HD12 ILE 38 1HD1 ILE 38 2.561 16.198 -22.468 295 HD13 ILE 38 2HD1 ILE 38 1.714 17.432 -21.534 296 H ARG 39 H ARG 39 -0.272 18.341 -21.497 297 HA ARG 39 HA ARG 39 0.215 17.653 -18.856 298 HB2 ARG 39 2HB ARG 39 0.784 20.087 -18.548 299 HB3 ARG 39 3HB ARG 39 1.594 19.295 -19.893 300 HG2 ARG 39 2HG ARG 39 -0.057 20.273 -21.434 301 HG3 ARG 39 3HG ARG 39 -0.798 21.114 -20.071 302 HD2 ARG 39 2HD ARG 39 1.544 22.078 -19.654 303 HD3 ARG 39 3HD ARG 39 1.915 21.524 -21.286 304 HE ARG 39 HE ARG 39 -0.390 22.969 -21.550 305 HH11 ARG 39 1HH1 ARG 39 2.793 23.595 -20.288 306 HH12 ARG 39 2HH1 ARG 39 2.763 25.281 -20.688 307 HH21 ARG 39 1HH2 ARG 39 -0.443 25.186 -22.082 308 HH22 ARG 39 2HH2 ARG 39 0.921 26.185 -21.708 309 H THR 40 H THR 40 -2.319 19.737 -20.192 310 HA THR 40 HA THR 40 -3.439 20.758 -17.905 311 HB THR 40 HB THR 40 -5.277 19.714 -20.023 312 HG1 THR 40 HG1 THR 40 -3.348 21.785 -20.333 313 HG21 THR 40 3HG2 THR 40 -6.398 21.827 -19.676 314 HG22 THR 40 1HG2 THR 40 -5.088 22.391 -18.640 315 HG23 THR 40 2HG2 THR 40 -6.117 21.059 -18.114 316 H VAL 41 H VAL 41 -3.786 17.519 -19.231 317 HA VAL 41 HA VAL 41 -5.838 16.713 -17.404 318 HB VAL 41 HB VAL 41 -4.004 14.822 -18.855 319 HG11 VAL 41 1HG1 VAL 41 -6.950 14.512 -18.444 320 HG12 VAL 41 2HG1 VAL 41 -5.713 13.272 -18.660 321 HG13 VAL 41 3HG1 VAL 41 -5.827 14.151 -17.134 322 HG21 VAL 41 3HG2 VAL 41 -4.729 16.523 -20.463 323 HG22 VAL 41 1HG2 VAL 41 -5.473 14.958 -20.795 324 HG23 VAL 41 2HG2 VAL 41 -6.409 16.231 -20.012 325 H ILE 42 H ILE 42 -2.350 16.044 -17.654 326 HA ILE 42 HA ILE 42 -2.103 14.440 -15.389 327 HB ILE 42 HB ILE 42 0.171 16.236 -15.823 328 HG12 ILE 42 2HG1 ILE 42 -0.849 16.238 -18.089 329 HG13 ILE 42 3HG1 ILE 42 0.722 15.445 -18.049 330 HG21 ILE 42 1HG2 ILE 42 -0.399 13.377 -15.417 331 HG22 ILE 42 2HG2 ILE 42 1.024 13.741 -16.392 332 HG23 ILE 42 3HG2 ILE 42 0.888 14.385 -14.756 333 HD11 ILE 42 3HD1 ILE 42 -1.815 13.875 -17.823 334 HD12 ILE 42 1HD1 ILE 42 -1.158 14.352 -19.389 335 HD13 ILE 42 2HD1 ILE 42 -0.209 13.331 -18.308 336 H ALA 43 H ALA 43 -2.648 17.819 -15.652 337 HA ALA 43 HA ALA 43 -1.510 18.916 -13.417 338 HB1 ALA 43 1HB ALA 43 -4.220 19.439 -14.618 339 HB2 ALA 43 2HB ALA 43 -3.510 20.433 -13.346 340 HB3 ALA 43 3HB ALA 43 -2.716 20.310 -14.916 341 H GLY 44 H GLY 44 -4.091 16.602 -13.570 342 HA2 GLY 44 2HA GLY 44 -4.767 17.001 -10.750 343 HA3 GLY 44 3HA GLY 44 -5.618 15.962 -11.884 344 H TYR 45 H TYR 45 -2.812 14.980 -12.708 345 HA TYR 45 HA TYR 45 -2.808 12.548 -11.456 346 HB2 TYR 45 2HB TYR 45 -0.986 12.160 -12.713 347 HB3 TYR 45 3HB TYR 45 -1.195 13.802 -13.310 348 HD1 TYR 45 HD2 TYR 45 0.529 11.814 -10.684 349 HD2 TYR 45 HD1 TYR 45 0.461 15.418 -12.946 350 HE1 TYR 45 HE2 TYR 45 2.737 12.416 -9.781 351 HE2 TYR 45 HE1 TYR 45 2.669 16.029 -12.050 352 HH TYR 45 HH TYR 45 4.034 15.483 -9.987 353 H ASN 46 H ASN 46 -1.168 15.502 -10.407 354 HA ASN 46 HA ASN 46 0.380 14.596 -8.345 355 HB2 ASN 46 2HB ASN 46 -0.468 17.074 -9.222 356 HB3 ASN 46 3HB ASN 46 -1.119 16.991 -7.588 357 HD21 ASN 46 1HD2 ASN 46 1.092 18.563 -8.838 358 HD22 ASN 46 2HD2 ASN 46 2.460 18.281 -7.821 359 H LEU 47 H LEU 47 -3.076 14.698 -8.510 360 HA LEU 47 HA LEU 47 -3.355 14.162 -5.653 361 HB2 LEU 47 2HB LEU 47 -4.926 15.495 -7.529 362 HB3 LEU 47 3HB LEU 47 -5.801 14.005 -7.185 363 HG LEU 47 HG LEU 47 -6.633 15.740 -5.757 364 HD11 LEU 47 1HD1 LEU 47 -5.107 14.516 -3.643 365 HD12 LEU 47 2HD1 LEU 47 -5.593 13.321 -4.845 366 HD13 LEU 47 3HD1 LEU 47 -6.810 14.324 -4.058 367 HD21 LEU 47 3HD2 LEU 47 -5.298 17.067 -4.322 368 HD22 LEU 47 1HD2 LEU 47 -4.530 17.127 -5.908 369 HD23 LEU 47 2HD2 LEU 47 -3.860 16.097 -4.643 370 H TYR 48 H TYR 48 -3.727 12.604 -8.775 371 HA TYR 48 HA TYR 48 -5.146 10.345 -8.176 372 HB2 TYR 48 2HB TYR 48 -4.505 9.689 -10.225 373 HB3 TYR 48 3HB TYR 48 -3.591 11.191 -10.303 374 HD1 TYR 48 HD2 TYR 48 -3.256 7.670 -9.109 375 HD2 TYR 48 HD1 TYR 48 -1.314 11.098 -10.716 376 HE1 TYR 48 HE2 TYR 48 -1.170 6.383 -9.320 377 HE2 TYR 48 HE1 TYR 48 0.776 9.820 -10.932 378 HH TYR 48 HH TYR 48 0.896 6.418 -10.565 379 H ARG 49 H ARG 49 -1.715 10.946 -7.549 380 HA ARG 49 HA ARG 49 -1.387 8.342 -6.312 381 HB2 ARG 49 2HB ARG 49 0.339 10.275 -7.489 382 HB3 ARG 49 3HB ARG 49 0.846 10.048 -5.821 383 HG2 ARG 49 2HG ARG 49 1.360 7.816 -6.142 384 HG3 ARG 49 3HG ARG 49 0.333 7.683 -7.572 385 HD2 ARG 49 2HD ARG 49 2.523 7.679 -8.408 386 HD3 ARG 49 3HD ARG 49 1.944 9.323 -8.674 387 HE ARG 49 HE ARG 49 3.231 9.267 -6.204 388 HH11 ARG 49 1HH1 ARG 49 4.005 8.856 -9.573 389 HH12 ARG 49 2HH1 ARG 49 5.633 9.423 -9.403 390 HH21 ARG 49 1HH2 ARG 49 5.373 10.015 -5.966 391 HH22 ARG 49 2HH2 ARG 49 6.410 10.081 -7.351 392 H ALA 50 H ALA 50 -2.112 11.574 -5.383 393 HA ALA 50 HA ALA 50 -1.156 11.773 -2.811 394 HB1 ALA 50 1HB ALA 50 -3.882 12.687 -3.719 395 HB2 ALA 50 2HB ALA 50 -2.937 13.332 -2.376 396 HB3 ALA 50 3HB ALA 50 -2.376 13.550 -4.034 397 H ILE 51 H ILE 51 -3.904 9.929 -3.988 398 HA ILE 51 HA ILE 51 -4.887 9.259 -1.380 399 HB ILE 51 HB ILE 51 -5.488 8.150 -4.118 400 HG12 ILE 51 2HG1 ILE 51 -6.326 10.416 -3.620 401 HG13 ILE 51 3HG1 ILE 51 -7.642 9.260 -3.798 402 HG21 ILE 51 1HG2 ILE 51 -6.220 7.135 -1.443 403 HG22 ILE 51 2HG2 ILE 51 -7.514 7.212 -2.637 404 HG23 ILE 51 3HG2 ILE 51 -6.056 6.281 -2.977 405 HD11 ILE 51 3HD1 ILE 51 -6.852 9.389 -1.056 406 HD12 ILE 51 1HD1 ILE 51 -7.158 11.014 -1.668 407 HD13 ILE 51 2HD1 ILE 51 -8.407 9.775 -1.792 408 H LYS 52 H LYS 52 -2.534 7.952 -3.560 409 HA LYS 52 HA LYS 52 -2.452 5.309 -2.536 410 HB2 LYS 52 2HB LYS 52 -1.353 6.517 -4.687 411 HB3 LYS 52 3HB LYS 52 0.043 6.485 -3.617 412 HG2 LYS 52 2HG LYS 52 -0.813 3.949 -3.344 413 HG3 LYS 52 3HG LYS 52 -1.343 4.284 -4.994 414 HD2 LYS 52 2HD LYS 52 0.796 3.489 -5.342 415 HD3 LYS 52 3HD LYS 52 1.071 5.231 -5.278 416 HE2 LYS 52 2HE LYS 52 2.689 4.602 -3.822 417 HE3 LYS 52 3HE LYS 52 1.345 4.666 -2.682 418 HZ1 LYS 52 3HZ LYS 52 2.920 2.447 -3.441 419 HZ2 LYS 52 1HZ LYS 52 1.299 2.141 -3.816 420 HZ3 LYS 52 2HZ LYS 52 1.739 2.548 -2.234 421 H LYS 53 H LYS 53 -0.613 8.247 -1.799 422 HA LYS 53 HA LYS 53 1.093 7.023 0.115 423 HB2 LYS 53 2HB LYS 53 1.600 9.368 0.795 424 HB3 LYS 53 3HB LYS 53 1.784 9.076 -0.929 425 HG2 LYS 53 2HG LYS 53 -0.363 10.126 -1.359 426 HG3 LYS 53 3HG LYS 53 -0.601 10.376 0.372 427 HD2 LYS 53 2HD LYS 53 1.684 11.625 0.221 428 HD3 LYS 53 3HD LYS 53 1.302 11.727 -1.499 429 HE2 LYS 53 2HE LYS 53 -1.017 12.577 -0.594 430 HE3 LYS 53 3HE LYS 53 -0.068 12.976 0.836 431 HZ1 LYS 53 3HZ LYS 53 0.191 14.884 -0.334 432 HZ2 LYS 53 1HZ LYS 53 0.030 14.136 -1.843 433 HZ3 LYS 53 2HZ LYS 53 1.489 14.024 -0.995 434 H LYS 54 H LYS 54 -1.991 8.716 0.315 435 HA LYS 54 HA LYS 54 -2.139 8.973 3.103 436 HB2 LYS 54 2HB LYS 54 -4.100 8.971 0.865 437 HB3 LYS 54 3HB LYS 54 -4.731 8.754 2.493 438 HG2 LYS 54 2HG LYS 54 -3.436 10.846 3.115 439 HG3 LYS 54 3HG LYS 54 -3.217 11.095 1.381 440 HD2 LYS 54 2HD LYS 54 -5.971 10.546 2.327 441 HD3 LYS 54 3HD LYS 54 -5.278 12.115 2.743 442 HE2 LYS 54 2HE LYS 54 -5.404 10.970 -0.044 443 HE3 LYS 54 3HE LYS 54 -6.554 12.130 0.617 444 HZ1 LYS 54 3HZ LYS 54 -3.652 12.560 0.170 445 HZ2 LYS 54 1HZ LYS 54 -4.659 13.656 0.974 446 HZ3 LYS 54 2HZ LYS 54 -4.929 13.299 -0.657 447 H GLY 55 H GLY 55 -4.164 6.701 1.257 448 HA2 GLY 55 2HA GLY 55 -3.937 4.286 1.678 449 HA3 GLY 55 3HA GLY 55 -3.633 4.693 3.360 450 H GLY 56 H GLY 56 -6.025 6.608 1.871 451 HA2 GLY 56 2HA GLY 56 -8.207 4.821 2.625 452 HA3 GLY 56 3HA GLY 56 -8.069 6.321 3.531 453 H GLY 57 H GLY 57 -9.267 7.946 2.813 454 HA2 GLY 57 2HA GLY 57 -9.392 8.943 0.251 455 HA3 GLY 57 3HA GLY 57 -10.683 7.753 0.337 456 H GLY 58 H GLY 58 -9.387 10.416 2.335 457 HA2 GLY 58 2HA GLY 58 -10.469 12.029 3.562 458 HA3 GLY 58 3HA GLY 58 -11.595 12.072 2.214 459 H GLY 59 H GLY 59 -10.896 9.661 4.750 460 HA2 GLY 59 2HA GLY 59 -12.275 8.911 6.463 461 HA3 GLY 59 3HA GLY 59 -13.498 10.061 5.943 462 H GLY 60 H GLY 60 -14.893 8.151 6.445 463 HA2 GLY 60 2HA GLY 60 -15.434 6.738 3.959 464 HA3 GLY 60 3HA GLY 60 -15.031 5.727 5.338 465 H GLY 61 H GLY 61 -16.625 5.135 6.677 466 HA2 GLY 61 2HA GLY 61 -19.318 5.803 6.051 467 HA3 GLY 61 3HA GLY 61 -18.780 4.851 7.427 468 H GLY 62 H GLY 62 -20.886 6.822 7.383 469 HA2 GLY 62 2HA GLY 62 -21.679 8.437 8.817 470 HA3 GLY 62 3HA GLY 62 -20.200 8.243 9.746 471 H GLY 63 H GLY 63 -19.001 10.011 9.895 472 HA2 GLY 63 2HA GLY 63 -19.529 12.298 8.244 473 HA3 GLY 63 3HA GLY 63 -18.317 12.184 9.511 474 H GLY 64 H GLY 64 -18.973 10.977 6.221 475 HA2 GLY 64 2HA GLY 64 -16.161 11.553 5.570 476 HA3 GLY 64 3HA GLY 64 -16.832 9.975 5.189 477 H VAL 65 H VAL 65 -16.791 13.358 4.368 478 HA VAL 65 HA VAL 65 -17.818 12.703 1.722 479 HB VAL 65 HB VAL 65 -19.841 13.340 2.916 480 HG11 VAL 65 1HG1 VAL 65 -18.599 14.736 4.623 481 HG12 VAL 65 2HG1 VAL 65 -18.603 16.033 3.427 482 HG13 VAL 65 3HG1 VAL 65 -20.128 15.396 4.043 483 HG21 VAL 65 3HG2 VAL 65 -19.095 14.254 0.515 484 HG22 VAL 65 1HG2 VAL 65 -20.659 14.626 1.239 485 HG23 VAL 65 2HG2 VAL 65 -19.341 15.793 1.340 486 H TRP 66 H TRP 66 -16.650 13.694 0.213 487 HA TRP 66 HA TRP 66 -15.779 16.374 0.353 488 HB2 TRP 66 2HB TRP 66 -14.213 15.174 2.002 489 HB3 TRP 66 3HB TRP 66 -13.493 14.425 0.580 490 HD1 TRP 66 HD1 TRP 66 -14.601 18.035 0.253 491 HE1 TRP 66 HE1 TRP 66 -12.522 19.545 0.105 492 HE3 TRP 66 HE3 TRP 66 -11.008 14.584 1.399 493 HZ2 TRP 66 HZ2 TRP 66 -9.728 19.305 0.431 494 HZ3 TRP 66 HZ3 TRP 66 -8.656 15.305 1.459 495 HH2 TRP 66 HH2 TRP 66 -8.032 17.618 0.984 496 HA PRO 67 HA PRO 67 -15.902 14.305 -3.807 497 HB2 PRO 67 2HB PRO 67 -17.560 16.137 -4.932 498 HB3 PRO 67 3HB PRO 67 -18.148 14.728 -4.041 499 HG2 PRO 67 2HG PRO 67 -17.844 17.560 -3.120 500 HG3 PRO 67 3HG PRO 67 -19.180 16.429 -2.837 501 HD2 PRO 67 2HD PRO 67 -17.277 16.931 -0.977 502 HD3 PRO 67 3HD PRO 67 -18.071 15.350 -1.129 503 H LEU 68 H LEU 68 -14.814 17.188 -2.458 504 HA LEU 68 HA LEU 68 -14.079 18.649 -4.763 505 HB2 LEU 68 2HB LEU 68 -13.809 18.897 -1.946 506 HB3 LEU 68 3HB LEU 68 -12.217 19.122 -2.668 507 HG LEU 68 HG LEU 68 -14.143 20.661 -4.123 508 HD11 LEU 68 1HD1 LEU 68 -14.620 22.266 -2.215 509 HD12 LEU 68 2HD1 LEU 68 -14.209 20.937 -1.132 510 HD13 LEU 68 3HD1 LEU 68 -15.562 20.775 -2.252 511 HD21 LEU 68 3HD2 LEU 68 -11.595 20.897 -3.753 512 HD22 LEU 68 1HD2 LEU 68 -12.053 21.759 -2.283 513 HD23 LEU 68 2HD2 LEU 68 -12.582 22.356 -3.856 514 H VAL 69 H VAL 69 -12.798 15.826 -3.319 515 HA VAL 69 HA VAL 69 -10.153 16.136 -4.475 516 HB VAL 69 HB VAL 69 -9.694 13.911 -3.537 517 HG11 VAL 69 1HG1 VAL 69 -9.500 16.019 -2.185 518 HG12 VAL 69 2HG1 VAL 69 -11.070 15.627 -1.480 519 HG13 VAL 69 3HG1 VAL 69 -9.699 14.541 -1.245 520 HG21 VAL 69 3HG2 VAL 69 -11.736 13.277 -1.866 521 HG22 VAL 69 1HG2 VAL 69 -12.618 13.889 -3.265 522 HG23 VAL 69 2HG2 VAL 69 -11.485 12.551 -3.453 523 H ILE 70 H ILE 70 -13.124 14.360 -5.081 524 HA ILE 70 HA ILE 70 -12.071 12.662 -7.103 525 HB ILE 70 HB ILE 70 -14.259 11.950 -7.506 526 HG12 ILE 70 2HG1 ILE 70 -16.069 13.641 -6.280 527 HG13 ILE 70 3HG1 ILE 70 -14.910 14.756 -6.996 528 HG21 ILE 70 1HG2 ILE 70 -15.158 11.480 -5.366 529 HG22 ILE 70 2HG2 ILE 70 -13.412 11.602 -5.158 530 HG23 ILE 70 3HG2 ILE 70 -14.453 12.939 -4.672 531 HD11 ILE 70 3HD1 ILE 70 -15.467 12.819 -8.951 532 HD12 ILE 70 1HD1 ILE 70 -17.012 13.289 -8.243 533 HD13 ILE 70 2HD1 ILE 70 -15.947 14.516 -8.930 534 H ARG 71 H ARG 71 -13.027 15.953 -7.047 535 HA ARG 71 HA ARG 71 -13.485 16.106 -9.911 536 HB2 ARG 71 2HB ARG 71 -13.756 18.562 -9.437 537 HB3 ARG 71 3HB ARG 71 -14.884 17.514 -8.587 538 HG2 ARG 71 2HG ARG 71 -13.685 17.753 -6.542 539 HG3 ARG 71 3HG ARG 71 -12.359 18.585 -7.356 540 HD2 ARG 71 2HD ARG 71 -15.184 19.590 -7.034 541 HD3 ARG 71 3HD ARG 71 -13.760 20.178 -6.178 542 HE ARG 71 HE ARG 71 -13.139 20.505 -8.810 543 HH11 ARG 71 1HH1 ARG 71 -15.772 21.523 -6.772 544 HH12 ARG 71 2HH1 ARG 71 -16.072 22.977 -7.664 545 HH21 ARG 71 1HH2 ARG 71 -13.525 22.416 -9.993 546 HH22 ARG 71 2HH2 ARG 71 -14.794 23.484 -9.497 547 H THR 72 H THR 72 -10.884 16.393 -7.714 548 HA THR 72 HA THR 72 -9.207 18.264 -8.825 549 HB THR 72 HB THR 72 -8.087 15.618 -7.959 550 HG1 THR 72 HG1 THR 72 -8.317 16.797 -5.765 551 HG21 THR 72 3HG2 THR 72 -6.270 16.930 -8.241 552 HG22 THR 72 1HG2 THR 72 -6.720 17.563 -6.658 553 HG23 THR 72 2HG2 THR 72 -7.201 18.422 -8.121 554 H VAL 73 H VAL 73 -9.353 14.808 -9.695 555 HA VAL 73 HA VAL 73 -7.524 15.013 -11.843 556 HB VAL 73 HB VAL 73 -9.684 12.925 -11.638 557 HG11 VAL 73 1HG1 VAL 73 -6.844 12.735 -12.629 558 HG12 VAL 73 2HG1 VAL 73 -8.106 11.507 -12.756 559 HG13 VAL 73 3HG1 VAL 73 -8.243 13.012 -13.666 560 HG21 VAL 73 3HG2 VAL 73 -7.339 13.394 -9.889 561 HG22 VAL 73 1HG2 VAL 73 -8.895 12.646 -9.526 562 HG23 VAL 73 2HG2 VAL 73 -7.655 11.730 -10.383 563 H ILE 74 H ILE 74 -11.012 15.345 -11.614 564 HA ILE 74 HA ILE 74 -11.653 15.222 -14.335 565 HB ILE 74 HB ILE 74 -13.039 16.989 -12.325 566 HG12 ILE 74 2HG1 ILE 74 -13.280 14.011 -12.775 567 HG13 ILE 74 3HG1 ILE 74 -12.827 14.832 -11.286 568 HG21 ILE 74 1HG2 ILE 74 -13.498 16.505 -15.032 569 HG22 ILE 74 2HG2 ILE 74 -14.708 15.547 -14.179 570 HG23 ILE 74 3HG2 ILE 74 -14.592 17.283 -13.888 571 HD11 ILE 74 3HD1 ILE 74 -15.284 15.901 -11.818 572 HD12 ILE 74 1HD1 ILE 74 -15.460 14.237 -12.374 573 HD13 ILE 74 2HD1 ILE 74 -14.960 14.564 -10.714 574 H ALA 75 H ALA 75 -9.982 17.616 -12.548 575 HA ALA 75 HA ALA 75 -10.561 19.984 -13.815 576 HB1 ALA 75 1HB ALA 75 -9.014 19.760 -11.916 577 HB2 ALA 75 2HB ALA 75 -7.812 19.053 -12.997 578 HB3 ALA 75 3HB ALA 75 -8.330 20.723 -13.226 579 H GLY 76 H GLY 76 -9.077 17.185 -15.146 580 HA2 GLY 76 2HA GLY 76 -7.934 18.645 -17.402 581 HA3 GLY 76 3HA GLY 76 -7.784 16.921 -17.095 582 H TYR 77 H TYR 77 -10.631 16.515 -16.681 583 HA TYR 77 HA TYR 77 -11.422 15.763 -19.213 584 HB2 TYR 77 2HB TYR 77 -12.911 14.773 -17.858 585 HB3 TYR 77 3HB TYR 77 -12.665 15.974 -16.595 586 HD1 TYR 77 HD2 TYR 77 -14.569 15.233 -19.681 587 HD2 TYR 77 HD1 TYR 77 -14.238 17.709 -16.236 588 HE1 TYR 77 HE2 TYR 77 -16.797 16.166 -20.145 589 HE2 TYR 77 HE1 TYR 77 -16.466 18.648 -16.690 590 HH TYR 77 HH TYR 77 -18.475 18.131 -17.873 591 H ASN 78 H ASN 78 -12.245 18.746 -17.469 592 HA ASN 78 HA ASN 78 -14.001 19.910 -19.220 593 HB2 ASN 78 2HB ASN 78 -11.816 21.183 -17.568 594 HB3 ASN 78 3HB ASN 78 -13.032 22.117 -18.434 595 HD21 ASN 78 1HD2 ASN 78 -12.456 19.877 -15.829 596 HD22 ASN 78 2HD2 ASN 78 -13.950 20.145 -15.005 597 H LEU 79 H LEU 79 -10.658 19.272 -19.706 598 HA LEU 79 HA LEU 79 -10.466 21.103 -21.969 599 HB2 LEU 79 2HB LEU 79 -8.579 20.935 -20.425 600 HB3 LEU 79 3HB LEU 79 -8.437 19.215 -20.780 601 HG LEU 79 HG LEU 79 -8.238 20.447 -23.263 602 HD11 LEU 79 1HD1 LEU 79 -7.154 22.396 -23.122 603 HD12 LEU 79 2HD1 LEU 79 -6.152 21.851 -21.778 604 HD13 LEU 79 3HD1 LEU 79 -7.778 22.461 -21.474 605 HD21 LEU 79 3HD2 LEU 79 -5.655 19.976 -22.546 606 HD22 LEU 79 1HD2 LEU 79 -6.783 18.747 -23.118 607 HD23 LEU 79 2HD2 LEU 79 -6.533 18.976 -21.387 608 H TYR 80 H TYR 80 -10.662 17.673 -21.259 609 HA TYR 80 HA TYR 80 -9.915 16.437 -23.542 610 HB2 TYR 80 2HB TYR 80 -11.438 15.722 -21.357 611 HB3 TYR 80 3HB TYR 80 -12.561 15.510 -22.696 612 HD1 TYR 80 HD2 TYR 80 -10.532 14.701 -24.798 613 HD2 TYR 80 HD1 TYR 80 -11.078 13.462 -20.765 614 HE1 TYR 80 HE2 TYR 80 -9.493 12.536 -25.329 615 HE2 TYR 80 HE1 TYR 80 -10.041 11.294 -21.284 616 HH TYR 80 HH TYR 80 -8.246 10.717 -23.996 617 H ARG 81 H ARG 81 -13.129 17.891 -23.034 618 HA ARG 81 HA ARG 81 -13.871 17.508 -25.786 619 HB2 ARG 81 2HB ARG 81 -15.163 18.797 -23.405 620 HB3 ARG 81 3HB ARG 81 -15.822 19.052 -25.015 621 HG2 ARG 81 2HG ARG 81 -16.057 16.616 -25.280 622 HG3 ARG 81 3HG ARG 81 -15.462 16.402 -23.632 623 HD2 ARG 81 2HD ARG 81 -17.966 16.350 -23.904 624 HD3 ARG 81 3HD ARG 81 -17.351 17.495 -22.712 625 HE ARG 81 HE ARG 81 -17.720 18.672 -25.295 626 HH11 ARG 81 1HH1 ARG 81 -19.323 17.764 -22.341 627 HH12 ARG 81 2HH1 ARG 81 -20.589 18.934 -22.516 628 HH21 ARG 81 1HH2 ARG 81 -19.381 20.217 -25.536 629 HH22 ARG 81 2HH2 ARG 81 -20.622 20.328 -24.334 630 H ALA 82 H ALA 82 -12.418 20.018 -23.888 631 HA ALA 82 HA ALA 82 -12.989 22.312 -25.287 632 HB1 ALA 82 1HB ALA 82 -11.603 22.133 -23.214 633 HB2 ALA 82 2HB ALA 82 -10.252 21.631 -24.231 634 HB3 ALA 82 3HB ALA 82 -10.961 23.233 -24.434 635 H ILE 83 H ILE 83 -10.596 19.826 -26.076 636 HA ILE 83 HA ILE 83 -9.691 21.235 -28.427 637 HB ILE 83 HB ILE 83 -9.113 18.411 -27.523 638 HG12 ILE 83 2HG1 ILE 83 -8.331 20.139 -25.942 639 HG13 ILE 83 3HG1 ILE 83 -6.989 19.307 -26.721 640 HG21 ILE 83 1HG2 ILE 83 -8.338 19.969 -29.894 641 HG22 ILE 83 2HG2 ILE 83 -7.023 19.124 -29.079 642 HG23 ILE 83 3HG2 ILE 83 -8.425 18.223 -29.658 643 HD11 ILE 83 3HD1 ILE 83 -6.188 21.211 -27.509 644 HD12 ILE 83 1HD1 ILE 83 -7.744 21.642 -28.218 645 HD13 ILE 83 2HD1 ILE 83 -7.398 22.049 -26.537 646 H LYS 84 H LYS 84 -12.169 18.998 -27.650 647 HA LYS 84 HA LYS 84 -12.449 17.851 -30.262 648 HB2 LYS 84 2HB LYS 84 -14.333 17.926 -27.899 649 HB3 LYS 84 3HB LYS 84 -14.621 17.006 -29.370 650 HG2 LYS 84 2HG LYS 84 -12.223 16.617 -27.596 651 HG3 LYS 84 3HG LYS 84 -13.714 15.681 -27.464 652 HD2 LYS 84 2HD LYS 84 -13.051 14.334 -29.104 653 HD3 LYS 84 3HD LYS 84 -12.853 15.710 -30.192 654 HE2 LYS 84 2HE LYS 84 -10.760 14.538 -30.026 655 HE3 LYS 84 3HE LYS 84 -10.608 16.096 -29.215 656 HZ1 LYS 84 3HZ LYS 84 -9.757 14.849 -27.575 657 HZ2 LYS 84 1HZ LYS 84 -10.485 13.421 -28.115 658 HZ3 LYS 84 2HZ LYS 84 -11.373 14.527 -27.194 659 H LYS 85 H LYS 85 -13.553 20.721 -28.687 660 HA LYS 85 HA LYS 85 -15.684 21.224 -30.578 661 HB2 LYS 85 2HB LYS 85 -14.482 22.975 -28.425 662 HB3 LYS 85 3HB LYS 85 -15.901 23.385 -29.380 663 HG2 LYS 85 2HG LYS 85 -17.226 21.811 -28.331 664 HG3 LYS 85 3HG LYS 85 -15.843 20.850 -27.801 665 HD2 LYS 85 2HD LYS 85 -15.831 21.913 -25.850 666 HD3 LYS 85 3HD LYS 85 -15.624 23.460 -26.676 667 HE2 LYS 85 2HE LYS 85 -18.162 23.343 -27.077 668 HE3 LYS 85 3HE LYS 85 -18.160 22.100 -25.827 669 HZ1 LYS 85 3HZ LYS 85 -18.578 24.073 -24.694 670 HZ2 LYS 85 1HZ LYS 85 -17.435 24.953 -25.579 671 HZ3 LYS 85 2HZ LYS 85 -16.926 23.816 -24.436 672 H LYS 86 H LYS 86 -12.422 22.425 -29.932 673 HA LYS 86 HA LYS 86 -11.118 23.942 -31.069 674 HB2 LYS 86 2HB LYS 86 -10.641 23.218 -33.345 675 HB3 LYS 86 3HB LYS 86 -10.800 21.825 -32.284 676 HG2 LYS 86 2HG LYS 86 -12.856 21.213 -33.193 677 HG3 LYS 86 3HG LYS 86 -13.116 22.805 -33.910 678 HD2 LYS 86 2HD LYS 86 -10.880 22.154 -35.197 679 HD3 LYS 86 3HD LYS 86 -11.475 20.524 -34.872 680 HE2 LYS 86 2HE LYS 86 -13.710 21.912 -35.758 681 HE3 LYS 86 3HE LYS 86 -12.402 22.493 -36.787 682 HZ1 LYS 86 3HZ LYS 86 -13.289 19.691 -36.405 683 HZ2 LYS 86 1HZ LYS 86 -11.843 20.102 -37.180 684 HZ3 LYS 86 2HZ LYS 86 -13.322 20.602 -37.831 685 H GLY 87 H GLY 87 -13.611 25.078 -30.564 686 HA2 GLY 87 2HA GLY 87 -13.793 26.899 -32.849 687 HA3 GLY 87 3HA GLY 87 -15.269 26.096 -32.334 688 H GLY 88 H GLY 88 -14.829 26.152 -29.544 689 HA2 GLY 88 2HA GLY 88 -14.364 28.910 -28.785 690 HA3 GLY 88 3HA GLY 88 -16.043 28.400 -28.694 691 H GLY 89 H GLY 89 -15.197 29.198 -26.390 692 HA2 GLY 89 2HA GLY 89 -14.017 26.957 -24.920 693 HA3 GLY 89 3HA GLY 89 -14.262 28.585 -24.305 694 H GLY 90 H GLY 90 -14.951 26.458 -22.746 695 HA2 GLY 90 2HA GLY 90 -17.843 26.835 -22.564 696 HA3 GLY 90 3HA GLY 90 -17.264 25.183 -22.719 697 H GLY 91 H GLY 91 -17.772 24.376 -20.746 698 HA2 GLY 91 2HA GLY 91 -16.068 24.821 -18.578 699 HA3 GLY 91 3HA GLY 91 -17.516 25.780 -18.310 700 H GLY 92 H GLY 92 -19.601 24.388 -18.879 701 HA2 GLY 92 2HA GLY 92 -19.491 22.154 -17.029 702 HA3 GLY 92 3HA GLY 92 -20.938 22.846 -17.748 703 H GLY 93 H GLY 93 -21.909 21.043 -18.532 704 HA2 GLY 93 2HA GLY 93 -20.491 19.678 -20.719 705 HA3 GLY 93 3HA GLY 93 -21.243 18.719 -19.453 706 H GLY 94 H GLY 94 -22.318 17.854 -21.475 707 HA2 GLY 94 2HA GLY 94 -24.904 19.189 -21.726 708 HA3 GLY 94 3HA GLY 94 -23.993 18.940 -23.208 709 H GLY 95 H GLY 95 -25.320 17.486 -24.200 710 HA2 GLY 95 2HA GLY 95 -25.366 14.811 -23.005 711 HA3 GLY 95 3HA GLY 95 -26.903 15.533 -23.457 712 H GLY 96 H GLY 96 -27.286 13.844 -24.948 713 HA2 GLY 96 2HA GLY 96 -27.400 13.086 -27.121 714 HA3 GLY 96 3HA GLY 96 -26.337 14.408 -27.580 715 H VAL 97 H VAL 97 -25.467 12.724 -29.040 716 HA VAL 97 HA VAL 97 -23.492 11.037 -27.642 717 HB VAL 97 HB VAL 97 -23.533 9.585 -29.687 718 HG11 VAL 97 1HG1 VAL 97 -25.948 9.901 -27.936 719 HG12 VAL 97 2HG1 VAL 97 -25.837 8.607 -29.130 720 HG13 VAL 97 3HG1 VAL 97 -24.650 8.712 -27.829 721 HG21 VAL 97 3HG2 VAL 97 -25.606 9.755 -31.091 722 HG22 VAL 97 1HG2 VAL 97 -25.897 11.329 -30.352 723 HG23 VAL 97 2HG2 VAL 97 -24.447 11.063 -31.319 724 H TRP 98 H TRP 98 -21.432 11.517 -28.003 725 HA TRP 98 HA TRP 98 -20.264 12.108 -30.449 726 HB2 TRP 98 2HB TRP 98 -21.185 14.203 -30.704 727 HB3 TRP 98 3HB TRP 98 -21.301 14.481 -28.969 728 HD1 TRP 98 HD1 TRP 98 -18.162 13.781 -31.152 729 HE1 TRP 98 HE1 TRP 98 -16.465 15.666 -30.716 730 HE3 TRP 98 HE3 TRP 98 -20.937 16.648 -27.956 731 HZ2 TRP 98 HZ2 TRP 98 -16.322 18.053 -29.215 732 HZ3 TRP 98 HZ3 TRP 98 -19.947 18.716 -27.065 733 HH2 TRP 98 HH2 TRP 98 -17.686 19.402 -27.682 734 HA PRO 99 HA PRO 99 -17.162 13.260 -26.928 735 HB2 PRO 99 2HB PRO 99 -18.135 13.358 -24.395 736 HB3 PRO 99 3HB PRO 99 -18.106 14.762 -25.468 737 HG2 PRO 99 2HG PRO 99 -20.372 12.915 -24.827 738 HG3 PRO 99 3HG PRO 99 -20.375 14.683 -24.966 739 HD2 PRO 99 2HD PRO 99 -21.256 13.064 -26.950 740 HD3 PRO 99 3HD PRO 99 -20.477 14.627 -27.268 741 H LEU 100 H LEU 100 -17.332 10.862 -27.846 742 HA LEU 100 HA LEU 100 -17.783 8.916 -25.730 743 HB2 LEU 100 2HB LEU 100 -17.358 7.245 -27.448 744 HB3 LEU 100 3HB LEU 100 -18.585 8.401 -27.963 745 HG LEU 100 HG LEU 100 -16.073 9.325 -28.908 746 HD11 LEU 100 1HD1 LEU 100 -15.459 7.437 -30.371 747 HD12 LEU 100 2HD1 LEU 100 -16.606 6.419 -29.502 748 HD13 LEU 100 3HD1 LEU 100 -15.207 7.086 -28.661 749 HD21 LEU 100 3HD2 LEU 100 -18.561 9.409 -29.771 750 HD22 LEU 100 1HD2 LEU 100 -18.055 7.980 -30.672 751 HD23 LEU 100 2HD2 LEU 100 -17.200 9.507 -30.890 752 H VAL 101 H VAL 101 -15.196 10.639 -27.196 753 HA VAL 101 HA VAL 101 -13.138 8.785 -26.359 754 HB VAL 101 HB VAL 101 -11.556 10.493 -27.164 755 HG11 VAL 101 1HG1 VAL 101 -12.074 9.059 -28.878 756 HG12 VAL 101 2HG1 VAL 101 -13.782 9.506 -28.883 757 HG13 VAL 101 3HG1 VAL 101 -12.582 10.596 -29.578 758 HG21 VAL 101 3HG2 VAL 101 -12.882 12.373 -28.527 759 HG22 VAL 101 1HG2 VAL 101 -14.017 12.135 -27.198 760 HG23 VAL 101 2HG2 VAL 101 -12.349 12.597 -26.861 761 H ILE 102 H ILE 102 -14.424 11.908 -25.323 762 HA ILE 102 HA ILE 102 -12.513 12.399 -23.299 763 HB ILE 102 HB ILE 102 -13.972 14.107 -22.492 764 HG12 ILE 102 2HG1 ILE 102 -16.315 14.075 -23.907 765 HG13 ILE 102 3HG1 ILE 102 -16.052 12.358 -23.624 766 HG21 ILE 102 1HG2 ILE 102 -13.775 15.424 -24.296 767 HG22 ILE 102 2HG2 ILE 102 -13.066 14.001 -25.057 768 HG23 ILE 102 3HG2 ILE 102 -14.774 14.369 -25.296 769 HD11 ILE 102 3HD1 ILE 102 -16.571 12.524 -21.465 770 HD12 ILE 102 1HD1 ILE 102 -15.641 14.007 -21.256 771 HD13 ILE 102 2HD1 ILE 102 -17.279 14.078 -21.906 772 H ARG 103 H ARG 103 -15.255 10.324 -23.465 773 HA ARG 103 HA ARG 103 -15.668 10.115 -20.630 774 HB2 ARG 103 2HB ARG 103 -17.354 8.568 -21.127 775 HB3 ARG 103 3HB ARG 103 -17.378 9.670 -22.497 776 HG2 ARG 103 2HG ARG 103 -17.277 7.864 -23.783 777 HG3 ARG 103 3HG ARG 103 -15.594 7.714 -23.274 778 HD2 ARG 103 2HD ARG 103 -16.873 6.551 -21.186 779 HD3 ARG 103 3HD ARG 103 -17.955 6.133 -22.514 780 HE ARG 103 HE ARG 103 -15.393 5.550 -23.375 781 HH11 ARG 103 1HH1 ARG 103 -17.537 4.529 -20.830 782 HH12 ARG 103 2HH1 ARG 103 -16.883 2.927 -20.744 783 HH21 ARG 103 1HH2 ARG 103 -14.523 3.444 -23.272 784 HH22 ARG 103 2HH2 ARG 103 -15.168 2.311 -22.132 785 H THR 104 H THR 104 -13.496 8.756 -22.884 786 HA THR 104 HA THR 104 -12.989 6.220 -21.942 787 HB THR 104 HB THR 104 -10.820 8.151 -22.774 788 HG1 THR 104 HG1 THR 104 -12.818 6.829 -24.255 789 HG21 THR 104 3HG2 THR 104 -11.072 5.150 -23.013 790 HG22 THR 104 1HG2 THR 104 -10.016 6.018 -21.900 791 HG23 THR 104 2HG2 THR 104 -9.738 6.120 -23.638 792 H VAL 105 H VAL 105 -11.201 9.144 -20.937 793 HA VAL 105 HA VAL 105 -9.894 7.881 -18.774 794 HB VAL 105 HB VAL 105 -10.385 10.788 -19.401 795 HG11 VAL 105 1HG1 VAL 105 -8.666 11.250 -17.641 796 HG12 VAL 105 2HG1 VAL 105 -10.220 10.689 -17.021 797 HG13 VAL 105 3HG1 VAL 105 -8.850 9.579 -17.107 798 HG21 VAL 105 3HG2 VAL 105 -8.725 9.074 -20.620 799 HG22 VAL 105 1HG2 VAL 105 -8.356 10.786 -20.409 800 HG23 VAL 105 2HG2 VAL 105 -7.681 9.595 -19.297 801 H ILE 106 H ILE 106 -12.831 9.846 -18.975 802 HA ILE 106 HA ILE 106 -13.383 10.207 -16.296 803 HB ILE 106 HB ILE 106 -15.467 9.578 -18.385 804 HG12 ILE 106 2HG1 ILE 106 -13.554 11.553 -18.578 805 HG13 ILE 106 3HG1 ILE 106 -15.121 11.567 -19.380 806 HG21 ILE 106 1HG2 ILE 106 -15.542 11.121 -15.799 807 HG22 ILE 106 2HG2 ILE 106 -16.836 11.141 -16.997 808 HG23 ILE 106 3HG2 ILE 106 -16.406 9.634 -16.189 809 HD11 ILE 106 3HD1 ILE 106 -16.065 12.928 -17.681 810 HD12 ILE 106 1HD1 ILE 106 -14.645 12.736 -16.654 811 HD13 ILE 106 2HD1 ILE 106 -14.530 13.658 -18.153 812 H ALA 107 H ALA 107 -13.614 7.314 -18.206 813 HA ALA 107 HA ALA 107 -15.392 5.754 -16.814 814 HB1 ALA 107 1HB ALA 107 -12.768 4.944 -18.054 815 HB2 ALA 107 2HB ALA 107 -14.012 3.812 -17.520 816 HB3 ALA 107 3HB ALA 107 -14.355 4.950 -18.823 817 H GLY 108 H GLY 108 -12.303 6.914 -15.775 818 HA2 GLY 108 2HA GLY 108 -12.210 5.032 -13.535 819 HA3 GLY 108 3HA GLY 108 -10.949 6.170 -13.986 820 H TYR 109 H TYR 109 -12.872 8.398 -14.204 821 HA TYR 109 HA TYR 109 -12.592 9.498 -11.672 822 HB2 TYR 109 2HB TYR 109 -14.595 10.167 -13.836 823 HB3 TYR 109 3HB TYR 109 -14.296 11.166 -12.419 824 HD1 TYR 109 HD2 TYR 109 -11.199 9.908 -13.038 825 HD2 TYR 109 HD1 TYR 109 -14.009 12.568 -14.808 826 HE1 TYR 109 HE2 TYR 109 -9.368 11.043 -14.225 827 HE2 TYR 109 HE1 TYR 109 -12.186 13.709 -16.001 828 HH TYR 109 HH TYR 109 -9.965 13.400 -16.698 829 H ASN 110 H ASN 110 -15.421 7.908 -13.115 830 HA ASN 110 HA ASN 110 -17.261 8.278 -11.095 831 HB2 ASN 110 2HB ASN 110 -16.932 5.745 -12.715 832 HB3 ASN 110 3HB ASN 110 -18.405 6.311 -11.935 833 HD21 ASN 110 1HD2 ASN 110 -18.352 5.690 -14.602 834 HD22 ASN 110 2HD2 ASN 110 -18.542 7.132 -15.535 835 H LEU 111 H LEU 111 -14.431 6.309 -11.103 836 HA LEU 111 HA LEU 111 -15.245 4.623 -8.916 837 HB2 LEU 111 2HB LEU 111 -13.246 4.557 -10.848 838 HB3 LEU 111 3HB LEU 111 -12.386 4.797 -9.329 839 HG LEU 111 HG LEU 111 -12.525 2.433 -9.932 840 HD11 LEU 111 1HD1 LEU 111 -12.831 3.463 -7.500 841 HD12 LEU 111 2HD1 LEU 111 -12.860 1.726 -7.803 842 HD13 LEU 111 3HD1 LEU 111 -14.373 2.615 -7.625 843 HD21 LEU 111 3HD2 LEU 111 -15.274 1.937 -9.347 844 HD22 LEU 111 1HD2 LEU 111 -14.361 1.545 -10.803 845 HD23 LEU 111 2HD2 LEU 111 -15.166 3.108 -10.663 846 H TYR 112 H TYR 112 -13.303 7.530 -9.339 847 HA TYR 112 HA TYR 112 -12.038 7.743 -6.918 848 HB2 TYR 112 2HB TYR 112 -12.678 9.490 -9.057 849 HB3 TYR 112 3HB TYR 112 -13.121 10.316 -7.567 850 HD1 TYR 112 HD2 TYR 112 -11.335 10.430 -5.716 851 HD2 TYR 112 HD1 TYR 112 -10.453 9.447 -9.760 852 HE1 TYR 112 HE2 TYR 112 -8.979 11.027 -5.340 853 HE2 TYR 112 HE1 TYR 112 -8.094 10.040 -9.396 854 HH TYR 112 HH TYR 112 -6.967 11.239 -6.246 855 H ARG 113 H ARG 113 -15.377 8.675 -7.678 856 HA ARG 113 HA ARG 113 -15.937 9.532 -4.998 857 HB2 ARG 113 2HB ARG 113 -17.966 8.848 -7.122 858 HB3 ARG 113 3HB ARG 113 -18.156 9.942 -5.758 859 HG2 ARG 113 2HG ARG 113 -17.600 11.616 -7.090 860 HG3 ARG 113 3HG ARG 113 -15.983 10.922 -7.227 861 HD2 ARG 113 2HD ARG 113 -16.712 11.146 -9.439 862 HD3 ARG 113 3HD ARG 113 -16.969 9.443 -9.062 863 HE ARG 113 HE ARG 113 -19.350 10.607 -8.465 864 HH11 ARG 113 1HH1 ARG 113 -17.305 10.567 -11.282 865 HH12 ARG 113 2HH1 ARG 113 -18.619 10.731 -12.399 866 HH21 ARG 113 1HH2 ARG 113 -21.089 10.823 -9.925 867 HH22 ARG 113 2HH2 ARG 113 -20.771 10.877 -11.626 868 H ALA 114 H ALA 114 -16.065 6.546 -6.727 869 HA ALA 114 HA ALA 114 -18.003 5.103 -5.409 870 HB1 ALA 114 1HB ALA 114 -16.984 3.181 -6.204 871 HB2 ALA 114 2HB ALA 114 -16.401 4.416 -7.321 872 HB3 ALA 114 3HB ALA 114 -15.359 3.843 -6.019 873 H ILE 115 H ILE 115 -14.759 5.924 -4.318 874 HA ILE 115 HA ILE 115 -15.007 4.329 -1.914 875 HB ILE 115 HB ILE 115 -12.862 6.295 -2.725 876 HG12 ILE 115 2HG1 ILE 115 -12.988 4.374 -4.235 877 HG13 ILE 115 3HG1 ILE 115 -11.537 4.284 -3.242 878 HG21 ILE 115 1HG2 ILE 115 -13.365 4.815 -0.265 879 HG22 ILE 115 2HG2 ILE 115 -11.758 4.534 -0.933 880 HG23 ILE 115 3HG2 ILE 115 -12.286 6.177 -0.569 881 HD11 ILE 115 3HD1 ILE 115 -14.086 2.751 -2.787 882 HD12 ILE 115 1HD1 ILE 115 -12.591 2.111 -3.467 883 HD13 ILE 115 2HD1 ILE 115 -12.634 2.659 -1.791 884 H LYS 116 H LYS 116 -15.693 7.536 -2.926 885 HA LYS 116 HA LYS 116 -15.570 8.731 -0.313 886 HB2 LYS 116 2HB LYS 116 -15.934 10.702 -1.374 887 HB3 LYS 116 3HB LYS 116 -15.482 9.771 -2.795 888 HG2 LYS 116 2HG LYS 116 -17.393 10.699 -3.576 889 HG3 LYS 116 3HG LYS 116 -18.084 9.260 -2.821 890 HD2 LYS 116 2HD LYS 116 -18.000 11.043 -0.738 891 HD3 LYS 116 3HD LYS 116 -18.381 12.081 -2.114 892 HE2 LYS 116 2HE LYS 116 -19.880 9.548 -1.963 893 HE3 LYS 116 3HE LYS 116 -20.225 10.717 -0.688 894 HZ1 LYS 116 3HZ LYS 116 -21.163 12.157 -2.135 895 HZ2 LYS 116 1HZ LYS 116 -21.460 10.743 -3.016 896 HZ3 LYS 116 2HZ LYS 116 -20.148 11.731 -3.420 897 H LYS 117 H LYS 117 -17.850 6.881 -2.068 898 HA LYS 117 HA LYS 117 -20.157 7.849 -0.611 899 HB2 LYS 117 2HB LYS 117 -19.668 6.176 -2.936 900 HB3 LYS 117 3HB LYS 117 -20.862 5.460 -1.862 901 HG2 LYS 117 2HG LYS 117 -22.004 7.745 -1.899 902 HG3 LYS 117 3HG LYS 117 -20.965 8.097 -3.282 903 HD2 LYS 117 2HD LYS 117 -21.897 6.300 -4.539 904 HD3 LYS 117 3HD LYS 117 -22.751 5.674 -3.126 905 HE2 LYS 117 2HE LYS 117 -23.275 8.411 -4.257 906 HE3 LYS 117 3HE LYS 117 -24.130 6.975 -4.817 907 HZ1 LYS 117 3HZ LYS 117 -25.336 8.201 -3.080 908 HZ2 LYS 117 1HZ LYS 117 -24.069 7.905 -1.998 909 HZ3 LYS 117 2HZ LYS 117 -24.974 6.616 -2.614 910 H LYS 118 H LYS 118 -18.115 4.961 -0.671 911 HA LYS 118 HA LYS 118 -19.594 3.596 1.360 912 HB2 LYS 118 2HB LYS 118 -17.100 3.132 -0.169 913 HB3 LYS 118 3HB LYS 118 -17.200 2.352 1.404 914 HG2 LYS 118 2HG LYS 118 -19.416 1.409 0.671 915 HG3 LYS 118 3HG LYS 118 -19.038 2.003 -0.948 916 HD2 LYS 118 2HD LYS 118 -16.747 0.644 -0.132 917 HD3 LYS 118 3HD LYS 118 -18.089 -0.362 0.419 918 HE2 LYS 118 2HE LYS 118 -18.952 0.228 -2.052 919 HE3 LYS 118 3HE LYS 118 -17.212 0.313 -2.324 920 HZ1 LYS 118 3HZ LYS 118 -17.806 -1.894 -2.750 921 HZ2 LYS 118 1HZ LYS 118 -18.805 -1.998 -1.389 922 HZ3 LYS 118 2HZ LYS 118 -17.125 -1.937 -1.203 Start of MODEL 14 1 H1 VAL 1 H VAL 1 2.299 -0.672 0.498 2 HA VAL 1 HA VAL 1 1.276 0.610 -1.200 3 HB VAL 1 HB VAL 1 4.082 0.143 -2.217 4 HG11 VAL 1 1HG1 VAL 1 1.925 1.918 -3.002 5 HG12 VAL 1 2HG1 VAL 1 3.395 2.798 -2.576 6 HG13 VAL 1 3HG1 VAL 1 3.442 1.551 -3.823 7 HG21 VAL 1 3HG2 VAL 1 3.047 1.541 0.161 8 HG22 VAL 1 1HG2 VAL 1 4.637 0.842 -0.145 9 HG23 VAL 1 2HG2 VAL 1 4.232 2.431 -0.795 10 H TRP 2 H TRP 2 -0.146 0.127 -2.724 11 HA TRP 2 HA TRP 2 0.706 -1.488 -5.012 12 HB2 TRP 2 2HB TRP 2 -1.452 -2.744 -4.938 13 HB3 TRP 2 3HB TRP 2 -0.381 -3.098 -3.584 14 HD1 TRP 2 HD1 TRP 2 -3.852 -1.994 -4.359 15 HE1 TRP 2 HE1 TRP 2 -5.095 -1.394 -2.187 16 HE3 TRP 2 HE3 TRP 2 0.119 -1.937 -1.139 17 HZ2 TRP 2 HZ2 TRP 2 -4.475 -0.954 0.531 18 HZ3 TRP 2 HZ3 TRP 2 -0.292 -1.417 1.231 19 HH2 TRP 2 HH2 TRP 2 -2.542 -0.936 2.047 20 HA PRO 3 HA PRO 3 -1.582 2.345 -6.244 21 HB2 PRO 3 2HB PRO 3 0.144 3.006 -8.233 22 HB3 PRO 3 3HB PRO 3 0.388 3.486 -6.549 23 HG2 PRO 3 2HG PRO 3 1.618 1.220 -8.070 24 HG3 PRO 3 3HG PRO 3 2.382 2.355 -6.942 25 HD2 PRO 3 2HD PRO 3 1.665 -0.155 -6.222 26 HD3 PRO 3 3HD PRO 3 1.634 1.209 -5.087 27 H LEU 4 H LEU 4 -2.715 0.028 -6.862 28 HA LEU 4 HA LEU 4 -2.582 -0.412 -9.738 29 HB2 LEU 4 2HB LEU 4 -3.845 -2.355 -9.385 30 HB3 LEU 4 3HB LEU 4 -2.720 -2.272 -8.031 31 HG LEU 4 HG LEU 4 -4.817 -1.093 -6.882 32 HD11 LEU 4 1HD1 LEU 4 -5.935 -2.741 -9.119 33 HD12 LEU 4 2HD1 LEU 4 -6.397 -1.125 -8.587 34 HD13 LEU 4 3HD1 LEU 4 -6.822 -2.530 -7.609 35 HD21 LEU 4 3HD2 LEU 4 -5.090 -3.041 -5.681 36 HD22 LEU 4 1HD2 LEU 4 -3.489 -3.279 -6.382 37 HD23 LEU 4 2HD2 LEU 4 -4.892 -4.071 -7.099 38 H VAL 5 H VAL 5 -4.767 0.867 -7.300 39 HA VAL 5 HA VAL 5 -7.011 1.166 -9.027 40 HB VAL 5 HB VAL 5 -7.914 2.653 -7.268 41 HG11 VAL 5 1HG1 VAL 5 -8.608 0.770 -6.322 42 HG12 VAL 5 2HG1 VAL 5 -7.259 -0.097 -7.059 43 HG13 VAL 5 3HG1 VAL 5 -7.078 0.625 -5.459 44 HG21 VAL 5 3HG2 VAL 5 -6.362 3.842 -6.159 45 HG22 VAL 5 1HG2 VAL 5 -6.259 2.419 -5.122 46 HG23 VAL 5 2HG2 VAL 5 -5.101 2.640 -6.434 47 H ILE 6 H ILE 6 -4.315 3.232 -8.111 48 HA ILE 6 HA ILE 6 -5.253 5.659 -9.138 49 HB ILE 6 HB ILE 6 -2.964 6.407 -9.172 50 HG12 ILE 6 2HG1 ILE 6 -1.323 4.374 -8.402 51 HG13 ILE 6 3HG1 ILE 6 -2.428 3.520 -9.473 52 HG21 ILE 6 1HG2 ILE 6 -3.150 6.532 -6.965 53 HG22 ILE 6 2HG2 ILE 6 -4.175 5.098 -6.937 54 HG23 ILE 6 3HG2 ILE 6 -2.423 4.931 -6.838 55 HD11 ILE 6 3HD1 ILE 6 -0.630 4.195 -10.813 56 HD12 ILE 6 1HD1 ILE 6 -1.935 5.323 -11.179 57 HD13 ILE 6 2HD1 ILE 6 -0.614 5.817 -10.120 58 H ARG 7 H ARG 7 -4.142 2.823 -10.736 59 HA ARG 7 HA ARG 7 -3.592 4.194 -13.237 60 HB2 ARG 7 2HB ARG 7 -3.783 1.253 -13.242 61 HB3 ARG 7 3HB ARG 7 -2.530 2.303 -13.889 62 HG2 ARG 7 2HG ARG 7 -1.860 2.678 -11.441 63 HG3 ARG 7 3HG ARG 7 -2.850 1.256 -11.104 64 HD2 ARG 7 2HD ARG 7 -0.478 1.410 -12.959 65 HD3 ARG 7 3HD ARG 7 -0.540 0.600 -11.394 66 HE ARG 7 HE ARG 7 -2.541 -0.463 -13.046 67 HH11 ARG 7 1HH1 ARG 7 0.928 -0.381 -12.763 68 HH12 ARG 7 2HH1 ARG 7 1.157 -1.919 -13.527 69 HH21 ARG 7 1HH2 ARG 7 -2.252 -2.490 -14.053 70 HH22 ARG 7 2HH2 ARG 7 -0.653 -3.117 -14.261 71 H THR 8 H THR 8 -6.209 2.628 -11.662 72 HA THR 8 HA THR 8 -7.725 1.608 -13.727 73 HB THR 8 HB THR 8 -8.942 3.186 -11.463 74 HG1 THR 8 HG1 THR 8 -7.614 0.694 -11.452 75 HG21 THR 8 3HG2 THR 8 -10.720 1.521 -11.634 76 HG22 THR 8 1HG2 THR 8 -9.846 0.702 -12.928 77 HG23 THR 8 2HG2 THR 8 -10.475 2.330 -13.182 78 H VAL 9 H VAL 9 -7.831 4.939 -12.457 79 HA VAL 9 HA VAL 9 -9.606 5.863 -14.488 80 HB VAL 9 HB VAL 9 -7.796 7.629 -12.857 81 HG11 VAL 9 1HG1 VAL 9 -10.545 8.454 -13.229 82 HG12 VAL 9 2HG1 VAL 9 -9.049 9.304 -13.622 83 HG13 VAL 9 3HG1 VAL 9 -9.739 8.155 -14.768 84 HG21 VAL 9 3HG2 VAL 9 -9.875 5.824 -11.923 85 HG22 VAL 9 1HG2 VAL 9 -8.675 6.737 -11.009 86 HG23 VAL 9 2HG2 VAL 9 -10.188 7.504 -11.489 87 H ILE 10 H ILE 10 -6.106 6.019 -14.003 88 HA ILE 10 HA ILE 10 -5.499 7.703 -16.166 89 HB ILE 10 HB ILE 10 -3.754 5.499 -15.066 90 HG12 ILE 10 2HG1 ILE 10 -4.761 7.234 -13.418 91 HG13 ILE 10 3HG1 ILE 10 -3.027 6.932 -13.371 92 HG21 ILE 10 1HG2 ILE 10 -3.183 7.986 -16.657 93 HG22 ILE 10 2HG2 ILE 10 -1.937 7.105 -15.774 94 HG23 ILE 10 3HG2 ILE 10 -2.819 6.313 -17.079 95 HD11 ILE 10 3HD1 ILE 10 -4.003 9.368 -13.350 96 HD12 ILE 10 1HD1 ILE 10 -2.510 8.985 -14.207 97 HD13 ILE 10 2HD1 ILE 10 -4.026 9.129 -15.097 98 H ALA 11 H ALA 11 -6.468 4.411 -16.061 99 HA ALA 11 HA ALA 11 -5.311 3.242 -18.248 100 HB1 ALA 11 1HB ALA 11 -7.342 1.892 -18.466 101 HB2 ALA 11 2HB ALA 11 -6.857 2.070 -16.779 102 HB3 ALA 11 3HB ALA 11 -8.201 3.018 -17.414 103 H GLY 12 H GLY 12 -7.587 5.857 -18.194 104 HA2 GLY 12 2HA GLY 12 -8.090 5.621 -21.070 105 HA3 GLY 12 3HA GLY 12 -8.906 6.715 -19.963 106 H TYR 13 H TYR 13 -6.370 7.623 -18.776 107 HA TYR 13 HA TYR 13 -5.927 9.892 -20.318 108 HB2 TYR 13 2HB TYR 13 -4.319 8.553 -18.159 109 HB3 TYR 13 3HB TYR 13 -3.728 10.006 -18.957 110 HD1 TYR 13 HD1 TYR 13 -6.908 8.789 -17.399 111 HD2 TYR 13 HD2 TYR 13 -4.156 11.998 -17.889 112 HE1 TYR 13 HE1 TYR 13 -8.254 10.169 -15.871 113 HE2 TYR 13 HE2 TYR 13 -5.494 13.386 -16.361 114 HH TYR 13 HH TYR 13 -8.632 12.397 -15.253 115 H ASN 14 H ASN 14 -4.095 6.860 -20.188 116 HA ASN 14 HA ASN 14 -1.944 7.491 -21.781 117 HB2 ASN 14 2HB ASN 14 -2.896 5.194 -20.646 118 HB3 ASN 14 3HB ASN 14 -3.110 4.850 -22.360 119 HD21 ASN 14 1HD2 ASN 14 -0.899 5.171 -19.782 120 HD22 ASN 14 2HD2 ASN 14 0.540 4.812 -20.669 121 H LEU 15 H LEU 15 -5.258 7.097 -22.692 122 HA LEU 15 HA LEU 15 -4.707 6.801 -25.511 123 HB2 LEU 15 2HB LEU 15 -6.810 6.117 -23.961 124 HB3 LEU 15 3HB LEU 15 -7.396 7.634 -24.639 125 HG LEU 15 HG LEU 15 -6.285 5.690 -26.567 126 HD11 LEU 15 1HD1 LEU 15 -8.278 4.904 -24.650 127 HD12 LEU 15 2HD1 LEU 15 -7.523 3.962 -25.935 128 HD13 LEU 15 3HD1 LEU 15 -8.958 4.928 -26.277 129 HD21 LEU 15 3HD2 LEU 15 -8.350 7.805 -26.428 130 HD22 LEU 15 1HD2 LEU 15 -8.647 6.468 -27.540 131 HD23 LEU 15 2HD2 LEU 15 -7.182 7.437 -27.698 132 H TYR 16 H TYR 16 -5.574 9.372 -23.290 133 HA TYR 16 HA TYR 16 -6.449 11.374 -24.911 134 HB2 TYR 16 2HB TYR 16 -5.452 11.214 -22.318 135 HB3 TYR 16 3HB TYR 16 -4.404 12.387 -23.107 136 HD1 TYR 16 HD2 TYR 16 -5.569 14.313 -24.380 137 HD2 TYR 16 HD1 TYR 16 -7.529 11.875 -21.497 138 HE1 TYR 16 HE2 TYR 16 -7.284 16.051 -24.086 139 HE2 TYR 16 HE1 TYR 16 -9.251 13.605 -21.195 140 HH TYR 16 HH TYR 16 -9.556 16.281 -23.310 141 H ARG 17 H ARG 17 -3.038 10.557 -24.306 142 HA ARG 17 HA ARG 17 -2.081 12.468 -26.220 143 HB2 ARG 17 2HB ARG 17 -0.956 10.794 -24.183 144 HB3 ARG 17 3HB ARG 17 -0.081 10.534 -25.686 145 HG2 ARG 17 2HG ARG 17 -0.274 13.256 -25.605 146 HG3 ARG 17 3HG ARG 17 -0.101 12.839 -23.899 147 HD2 ARG 17 2HD ARG 17 1.707 11.675 -25.992 148 HD3 ARG 17 3HD ARG 17 2.031 13.251 -25.270 149 HE ARG 17 HE ARG 17 1.687 11.629 -23.125 150 HH11 ARG 17 1HH1 ARG 17 3.701 11.481 -25.961 151 HH12 ARG 17 2HH1 ARG 17 4.974 10.610 -25.172 152 HH21 ARG 17 1HH2 ARG 17 3.356 10.483 -22.074 153 HH22 ARG 17 2HH2 ARG 17 4.776 10.042 -22.961 154 H ALA 18 H ALA 18 -3.047 9.146 -26.281 155 HA ALA 18 HA ALA 18 -1.674 8.101 -28.422 156 HB1 ALA 18 1HB ALA 18 -3.376 6.946 -26.958 157 HB2 ALA 18 2HB ALA 18 -4.617 7.647 -27.998 158 HB3 ALA 18 3HB ALA 18 -3.427 6.534 -28.673 159 H ILE 19 H ILE 19 -4.432 10.298 -28.457 160 HA ILE 19 HA ILE 19 -4.629 10.238 -31.342 161 HB ILE 19 HB ILE 19 -6.017 12.040 -29.355 162 HG12 ILE 19 2HG1 ILE 19 -6.609 9.708 -28.991 163 HG13 ILE 19 3HG1 ILE 19 -7.962 10.553 -29.734 164 HG21 ILE 19 1HG2 ILE 19 -5.943 11.978 -32.257 165 HG22 ILE 19 2HG2 ILE 19 -7.580 11.837 -31.620 166 HG23 ILE 19 3HG2 ILE 19 -6.575 13.213 -31.168 167 HD11 ILE 19 3HD1 ILE 19 -6.001 8.791 -31.182 168 HD12 ILE 19 1HD1 ILE 19 -7.627 8.328 -30.680 169 HD13 ILE 19 2HD1 ILE 19 -7.402 9.595 -31.887 170 H LYS 20 H LYS 20 -2.929 12.022 -28.961 171 HA LYS 20 HA LYS 20 -2.557 14.401 -30.531 172 HB2 LYS 20 2HB LYS 20 -1.618 13.387 -27.904 173 HB3 LYS 20 3HB LYS 20 -0.599 14.579 -28.702 174 HG2 LYS 20 2HG LYS 20 -2.004 15.825 -27.319 175 HG3 LYS 20 3HG LYS 20 -2.708 15.988 -28.929 176 HD2 LYS 20 2HD LYS 20 -4.002 13.786 -28.035 177 HD3 LYS 20 3HD LYS 20 -3.765 14.661 -26.521 178 HE2 LYS 20 2HE LYS 20 -5.774 15.528 -27.224 179 HE3 LYS 20 3HE LYS 20 -4.645 16.697 -27.906 180 HZ1 LYS 20 3HZ LYS 20 -6.251 14.655 -29.262 181 HZ2 LYS 20 1HZ LYS 20 -4.755 15.073 -29.934 182 HZ3 LYS 20 2HZ LYS 20 -5.943 16.257 -29.710 183 H LYS 21 H LYS 21 -0.934 11.354 -30.136 184 HA LYS 21 HA LYS 21 1.527 12.203 -31.360 185 HB2 LYS 21 2HB LYS 21 0.619 9.934 -29.918 186 HB3 LYS 21 3HB LYS 21 1.181 9.362 -31.484 187 HG2 LYS 21 2HG LYS 21 3.223 10.961 -30.886 188 HG3 LYS 21 3HG LYS 21 2.692 10.573 -29.248 189 HD2 LYS 21 2HD LYS 21 2.640 8.122 -30.444 190 HD3 LYS 21 3HD LYS 21 4.007 8.888 -31.256 191 HE2 LYS 21 2HE LYS 21 4.831 7.741 -29.324 192 HE3 LYS 21 3HE LYS 21 4.923 9.474 -29.015 193 HZ1 LYS 21 3HZ LYS 21 3.001 7.517 -27.912 194 HZ2 LYS 21 1HZ LYS 21 2.690 9.180 -27.879 195 HZ3 LYS 21 2HZ LYS 21 4.042 8.557 -27.076 196 H LYS 22 H LYS 22 -1.378 10.475 -32.379 197 HA LYS 22 HA LYS 22 -2.138 9.819 -34.425 198 HB2 LYS 22 2HB LYS 22 -2.318 12.197 -34.780 199 HB3 LYS 22 3HB LYS 22 -0.610 12.312 -35.186 200 HG2 LYS 22 2HG LYS 22 -1.860 10.417 -36.918 201 HG3 LYS 22 3HG LYS 22 -2.787 11.919 -36.921 202 HD2 LYS 22 2HD LYS 22 -0.269 12.892 -37.072 203 HD3 LYS 22 3HD LYS 22 -0.073 11.359 -37.926 204 HE2 LYS 22 2HE LYS 22 -2.394 12.282 -39.001 205 HE3 LYS 22 3HE LYS 22 -1.529 13.789 -38.702 206 HZ1 LYS 22 3HZ LYS 22 -0.387 11.483 -40.180 207 HZ2 LYS 22 1HZ LYS 22 0.298 13.020 -40.007 208 HZ3 LYS 22 2HZ LYS 22 -1.111 12.820 -40.921 209 H GLY 23 H GLY 23 -0.992 7.858 -34.544 210 HA2 GLY 23 2HA GLY 23 0.323 7.185 -36.780 211 HA3 GLY 23 3HA GLY 23 1.629 7.827 -35.795 212 H GLY 24 H GLY 24 0.886 6.909 -33.282 213 HA2 GLY 24 2HA GLY 24 0.063 4.541 -32.593 214 HA3 GLY 24 3HA GLY 24 1.386 4.036 -33.635 215 H GLY 25 H GLY 25 0.498 4.858 -30.502 216 HA2 GLY 25 2HA GLY 25 3.084 4.335 -29.466 217 HA3 GLY 25 3HA GLY 25 2.766 6.063 -29.432 218 H GLY 26 H GLY 26 3.214 4.542 -27.122 219 HA2 GLY 26 2HA GLY 26 0.606 4.890 -25.806 220 HA3 GLY 26 3HA GLY 26 1.492 3.390 -25.572 221 H GLY 27 H GLY 27 3.512 3.449 -24.449 222 HA2 GLY 27 2HA GLY 27 3.572 5.611 -22.472 223 HA3 GLY 27 3HA GLY 27 4.364 4.049 -22.322 224 H GLY 28 H GLY 28 5.740 6.320 -21.683 225 HA2 GLY 28 2HA GLY 28 8.108 6.077 -23.101 226 HA3 GLY 28 3HA GLY 28 7.228 7.399 -23.854 227 H GLY 29 H GLY 29 6.488 9.152 -22.372 228 HA2 GLY 29 2HA GLY 29 6.958 9.857 -19.920 229 HA3 GLY 29 3HA GLY 29 8.631 9.703 -20.437 230 H GLY 30 H GLY 30 9.338 11.764 -20.405 231 HA2 GLY 30 2HA GLY 30 7.683 13.902 -21.470 232 HA3 GLY 30 3HA GLY 30 9.258 14.080 -20.710 233 H GLY 31 H GLY 31 9.074 15.616 -22.765 234 HA2 GLY 31 2HA GLY 31 11.075 14.872 -24.528 235 HA3 GLY 31 3HA GLY 31 9.562 14.428 -25.304 236 H GLY 32 H GLY 32 10.883 17.211 -23.496 237 HA2 GLY 32 2HA GLY 32 10.978 19.440 -24.078 238 HA3 GLY 32 3HA GLY 32 10.536 18.977 -25.715 239 H VAL 33 H VAL 33 9.155 20.787 -25.876 240 HA VAL 33 HA VAL 33 6.798 20.788 -24.132 241 HB VAL 33 HB VAL 33 6.286 22.983 -25.177 242 HG11 VAL 33 1HG1 VAL 33 7.733 24.172 -23.823 243 HG12 VAL 33 2HG1 VAL 33 7.808 22.559 -23.111 244 HG13 VAL 33 3HG1 VAL 33 9.099 23.114 -24.176 245 HG21 VAL 33 3HG2 VAL 33 8.253 22.129 -27.042 246 HG22 VAL 33 1HG2 VAL 33 7.264 23.589 -27.075 247 HG23 VAL 33 2HG2 VAL 33 8.832 23.604 -26.266 248 H TRP 34 H TRP 34 4.828 20.217 -24.830 249 HA TRP 34 HA TRP 34 3.805 20.457 -27.395 250 HB2 TRP 34 2HB TRP 34 5.156 18.883 -28.394 251 HB3 TRP 34 3HB TRP 34 5.339 17.945 -26.914 252 HD1 TRP 34 HD1 TRP 34 2.132 18.837 -28.924 253 HE1 TRP 34 HE1 TRP 34 0.878 16.643 -29.415 254 HE3 TRP 34 HE3 TRP 34 5.431 15.533 -26.842 255 HZ2 TRP 34 HZ2 TRP 34 1.239 13.878 -28.977 256 HZ3 TRP 34 HZ3 TRP 34 4.902 13.131 -26.920 257 HH2 TRP 34 HH2 TRP 34 2.849 12.323 -27.965 258 HA PRO 35 HA PRO 35 1.051 17.365 -24.901 259 HB2 PRO 35 2HB PRO 35 2.035 16.453 -22.540 260 HB3 PRO 35 3HB PRO 35 2.312 15.629 -24.079 261 HG2 PRO 35 2HG PRO 35 4.116 17.481 -22.570 262 HG3 PRO 35 3HG PRO 35 4.510 15.962 -23.395 263 HD2 PRO 35 2HD PRO 35 5.000 18.387 -24.495 264 HD3 PRO 35 3HD PRO 35 4.585 16.962 -25.470 265 H LEU 36 H LEU 36 0.690 19.913 -24.778 266 HA LEU 36 HA LEU 36 0.701 20.877 -22.031 267 HB2 LEU 36 2HB LEU 36 0.237 22.992 -22.882 268 HB3 LEU 36 3HB LEU 36 1.310 22.270 -24.079 269 HG LEU 36 HG LEU 36 -1.126 21.638 -25.106 270 HD11 LEU 36 1HD1 LEU 36 -2.151 24.103 -24.969 271 HD12 LEU 36 2HD1 LEU 36 -1.448 23.997 -23.355 272 HD13 LEU 36 3HD1 LEU 36 -2.631 22.800 -23.881 273 HD21 LEU 36 3HD2 LEU 36 0.040 22.570 -26.755 274 HD22 LEU 36 1HD2 LEU 36 1.003 23.524 -25.627 275 HD23 LEU 36 2HD2 LEU 36 -0.555 24.132 -26.188 276 H VAL 37 H VAL 37 -1.452 19.458 -24.316 277 HA VAL 37 HA VAL 37 -3.845 20.315 -22.906 278 HB VAL 37 HB VAL 37 -5.062 18.968 -24.576 279 HG11 VAL 37 1HG1 VAL 37 -3.404 20.377 -26.456 280 HG12 VAL 37 2HG1 VAL 37 -5.030 20.761 -25.888 281 HG13 VAL 37 3HG1 VAL 37 -3.623 21.332 -24.990 282 HG21 VAL 37 3HG2 VAL 37 -3.691 18.095 -26.523 283 HG22 VAL 37 1HG2 VAL 37 -2.282 18.256 -25.474 284 HG23 VAL 37 2HG2 VAL 37 -3.597 17.170 -25.025 285 H ILE 38 H ILE 38 -2.021 17.332 -23.477 286 HA ILE 38 HA ILE 38 -3.756 15.596 -22.099 287 HB ILE 38 HB ILE 38 -1.881 14.035 -22.000 288 HG12 ILE 38 2HG1 ILE 38 0.227 15.119 -23.321 289 HG13 ILE 38 3HG1 ILE 38 -0.338 16.522 -22.420 290 HG21 ILE 38 1HG2 ILE 38 -2.454 13.601 -24.100 291 HG22 ILE 38 2HG2 ILE 38 -2.890 15.288 -24.368 292 HG23 ILE 38 3HG2 ILE 38 -1.232 14.753 -24.638 293 HD11 ILE 38 3HD1 ILE 38 -0.222 14.181 -20.743 294 HD12 ILE 38 1HD1 ILE 38 1.332 14.507 -21.510 295 HD13 ILE 38 2HD1 ILE 38 0.547 15.755 -20.541 296 H ARG 39 H ARG 39 -1.139 17.668 -21.021 297 HA ARG 39 HA ARG 39 -0.934 16.574 -18.402 298 HB2 ARG 39 2HB ARG 39 0.314 18.670 -17.893 299 HB3 ARG 39 3HB ARG 39 0.921 17.813 -19.303 300 HG2 ARG 39 2HG ARG 39 0.883 19.850 -20.238 301 HG3 ARG 39 3HG ARG 39 -0.829 19.493 -20.478 302 HD2 ARG 39 2HD ARG 39 -1.499 20.904 -18.812 303 HD3 ARG 39 3HD ARG 39 -0.011 20.695 -17.889 304 HE ARG 39 HE ARG 39 0.438 22.079 -20.342 305 HH11 ARG 39 1HH1 ARG 39 -0.708 22.461 -17.076 306 HH12 ARG 39 2HH1 ARG 39 -0.322 24.148 -17.000 307 HH21 ARG 39 1HH2 ARG 39 0.950 24.300 -20.253 308 HH22 ARG 39 2HH2 ARG 39 0.620 25.193 -18.808 309 H THR 40 H THR 40 -3.084 18.802 -19.912 310 HA THR 40 HA THR 40 -3.933 20.343 -17.753 311 HB THR 40 HB THR 40 -5.935 19.397 -19.766 312 HG1 THR 40 HG1 THR 40 -4.861 21.253 -21.045 313 HG21 THR 40 3HG2 THR 40 -5.344 21.907 -18.249 314 HG22 THR 40 1HG2 THR 40 -6.859 21.017 -18.391 315 HG23 THR 40 2HG2 THR 40 -6.274 21.983 -19.745 316 H VAL 41 H VAL 41 -5.323 17.293 -18.971 317 HA VAL 41 HA VAL 41 -7.192 17.048 -16.840 318 HB VAL 41 HB VAL 41 -7.481 14.713 -17.649 319 HG11 VAL 41 1HG1 VAL 41 -8.978 15.970 -18.779 320 HG12 VAL 41 2HG1 VAL 41 -7.761 17.129 -19.317 321 HG13 VAL 41 3HG1 VAL 41 -7.940 15.586 -20.152 322 HG21 VAL 41 3HG2 VAL 41 -5.272 15.491 -19.548 323 HG22 VAL 41 1HG2 VAL 41 -5.241 14.200 -18.347 324 HG23 VAL 41 2HG2 VAL 41 -6.306 14.076 -19.747 325 H ILE 42 H ILE 42 -3.973 15.732 -17.447 326 HA ILE 42 HA ILE 42 -3.851 13.888 -15.358 327 HB ILE 42 HB ILE 42 -1.562 15.553 -16.411 328 HG12 ILE 42 2HG1 ILE 42 -3.198 13.805 -17.835 329 HG13 ILE 42 3HG1 ILE 42 -1.598 14.363 -18.312 330 HG21 ILE 42 1HG2 ILE 42 -1.650 12.916 -14.956 331 HG22 ILE 42 2HG2 ILE 42 -0.212 13.572 -15.737 332 HG23 ILE 42 3HG2 ILE 42 -0.949 14.431 -14.384 333 HD11 ILE 42 3HD1 ILE 42 -0.574 12.428 -17.344 334 HD12 ILE 42 1HD1 ILE 42 -2.114 11.902 -16.664 335 HD13 ILE 42 2HD1 ILE 42 -1.878 11.911 -18.412 336 H ALA 43 H ALA 43 -3.924 17.300 -15.266 337 HA ALA 43 HA ALA 43 -2.442 18.006 -13.067 338 HB1 ALA 43 1HB ALA 43 -3.529 19.710 -14.297 339 HB2 ALA 43 2HB ALA 43 -5.122 19.017 -13.988 340 HB3 ALA 43 3HB ALA 43 -4.213 19.761 -12.672 341 H GLY 44 H GLY 44 -5.287 16.047 -13.174 342 HA2 GLY 44 2HA GLY 44 -5.730 16.295 -10.293 343 HA3 GLY 44 3HA GLY 44 -6.756 15.434 -11.430 344 H TYR 45 H TYR 45 -4.428 14.051 -12.628 345 HA TYR 45 HA TYR 45 -4.527 11.662 -11.265 346 HB2 TYR 45 2HB TYR 45 -3.669 11.551 -13.440 347 HB3 TYR 45 3HB TYR 45 -2.495 12.828 -13.145 348 HD1 TYR 45 HD2 TYR 45 -3.145 9.807 -11.079 349 HD2 TYR 45 HD1 TYR 45 -0.465 11.804 -13.712 350 HE1 TYR 45 HE2 TYR 45 -1.427 8.112 -10.606 351 HE2 TYR 45 HE1 TYR 45 1.261 10.114 -13.247 352 HH TYR 45 HH TYR 45 1.565 7.979 -12.396 353 H ASN 46 H ASN 46 -2.025 14.179 -11.019 354 HA ASN 46 HA ASN 46 -0.303 12.985 -9.242 355 HB2 ASN 46 2HB ASN 46 -0.853 15.670 -10.135 356 HB3 ASN 46 3HB ASN 46 -0.482 15.674 -8.413 357 HD21 ASN 46 1HD2 ASN 46 0.728 15.250 -11.592 358 HD22 ASN 46 2HD2 ASN 46 2.389 15.028 -11.170 359 H LEU 47 H LEU 47 -3.506 14.129 -8.672 360 HA LEU 47 HA LEU 47 -3.195 14.133 -5.781 361 HB2 LEU 47 2HB LEU 47 -4.920 15.394 -7.600 362 HB3 LEU 47 3HB LEU 47 -5.924 14.282 -6.672 363 HG LEU 47 HG LEU 47 -6.030 16.395 -5.598 364 HD11 LEU 47 1HD1 LEU 47 -5.695 15.664 -3.498 365 HD12 LEU 47 2HD1 LEU 47 -4.013 15.231 -3.802 366 HD13 LEU 47 3HD1 LEU 47 -5.307 14.142 -4.301 367 HD21 LEU 47 3HD2 LEU 47 -4.189 17.749 -5.035 368 HD22 LEU 47 1HD2 LEU 47 -3.893 17.222 -6.692 369 HD23 LEU 47 2HD2 LEU 47 -3.034 16.454 -5.356 370 H TYR 48 H TYR 48 -4.663 12.184 -8.314 371 HA TYR 48 HA TYR 48 -6.269 10.471 -6.925 372 HB2 TYR 48 2HB TYR 48 -4.705 10.316 -9.396 373 HB3 TYR 48 3HB TYR 48 -4.986 8.747 -8.651 374 HD1 TYR 48 HD2 TYR 48 -7.644 8.937 -7.550 375 HD2 TYR 48 HD1 TYR 48 -6.140 10.532 -11.196 376 HE1 TYR 48 HE2 TYR 48 -9.912 8.888 -8.500 377 HE2 TYR 48 HE1 TYR 48 -8.404 10.489 -12.156 378 HH TYR 48 HH TYR 48 -10.523 9.900 -11.849 379 H ARG 49 H ARG 49 -2.747 10.211 -7.302 380 HA ARG 49 HA ARG 49 -2.592 7.889 -5.609 381 HB2 ARG 49 2HB ARG 49 -0.604 9.625 -7.026 382 HB3 ARG 49 3HB ARG 49 -0.054 8.525 -5.769 383 HG2 ARG 49 2HG ARG 49 -0.828 6.629 -6.972 384 HG3 ARG 49 3HG ARG 49 -1.686 7.643 -8.134 385 HD2 ARG 49 2HD ARG 49 0.127 7.713 -9.411 386 HD3 ARG 49 3HD ARG 49 1.024 8.471 -8.096 387 HE ARG 49 HE ARG 49 1.147 5.713 -8.922 388 HH11 ARG 49 1HH1 ARG 49 1.726 7.982 -6.346 389 HH12 ARG 49 2HH1 ARG 49 2.900 6.983 -5.555 390 HH21 ARG 49 1HH2 ARG 49 2.691 4.389 -7.890 391 HH22 ARG 49 2HH2 ARG 49 3.449 4.941 -6.435 392 H ALA 50 H ALA 50 -2.457 11.315 -5.196 393 HA ALA 50 HA ALA 50 -0.943 11.644 -2.920 394 HB1 ALA 50 1HB ALA 50 -2.116 13.662 -2.537 395 HB2 ALA 50 2HB ALA 50 -2.088 13.430 -4.286 396 HB3 ALA 50 3HB ALA 50 -3.553 13.070 -3.371 397 H ILE 51 H ILE 51 -4.287 10.535 -3.187 398 HA ILE 51 HA ILE 51 -4.639 10.372 -0.331 399 HB ILE 51 HB ILE 51 -6.361 9.280 -2.559 400 HG12 ILE 51 2HG1 ILE 51 -6.189 11.713 -2.639 401 HG13 ILE 51 3HG1 ILE 51 -7.791 11.238 -2.086 402 HG21 ILE 51 1HG2 ILE 51 -6.488 9.035 0.340 403 HG22 ILE 51 2HG2 ILE 51 -7.965 9.688 -0.367 404 HG23 ILE 51 3HG2 ILE 51 -7.340 8.132 -0.912 405 HD11 ILE 51 3HD1 ILE 51 -7.039 13.089 -0.782 406 HD12 ILE 51 1HD1 ILE 51 -7.046 11.653 0.240 407 HD13 ILE 51 2HD1 ILE 51 -5.524 12.270 -0.404 408 H LYS 52 H LYS 52 -3.411 8.344 -2.810 409 HA LYS 52 HA LYS 52 -3.891 5.848 -1.472 410 HB2 LYS 52 2HB LYS 52 -2.718 6.739 -3.991 411 HB3 LYS 52 3HB LYS 52 -1.824 5.411 -3.263 412 HG2 LYS 52 2HG LYS 52 -4.775 5.412 -3.865 413 HG3 LYS 52 3HG LYS 52 -3.525 4.620 -4.826 414 HD2 LYS 52 2HD LYS 52 -3.295 3.839 -2.071 415 HD3 LYS 52 3HD LYS 52 -4.942 3.563 -2.644 416 HE2 LYS 52 2HE LYS 52 -4.191 2.173 -4.407 417 HE3 LYS 52 3HE LYS 52 -2.513 2.662 -4.174 418 HZ1 LYS 52 3HZ LYS 52 -4.083 0.689 -2.739 419 HZ2 LYS 52 1HZ LYS 52 -3.080 1.654 -1.777 420 HZ3 LYS 52 2HZ LYS 52 -2.419 0.741 -3.038 421 H LYS 53 H LYS 53 -1.449 8.295 -1.400 422 HA LYS 53 HA LYS 53 0.532 6.597 -0.143 423 HB2 LYS 53 2HB LYS 53 0.463 9.570 -0.681 424 HB3 LYS 53 3HB LYS 53 1.821 8.736 0.064 425 HG2 LYS 53 2HG LYS 53 2.076 7.372 -1.959 426 HG3 LYS 53 3HG LYS 53 0.739 8.250 -2.705 427 HD2 LYS 53 2HD LYS 53 3.182 9.649 -1.651 428 HD3 LYS 53 3HD LYS 53 3.103 9.007 -3.293 429 HE2 LYS 53 2HE LYS 53 2.333 11.090 -3.737 430 HE3 LYS 53 3HE LYS 53 0.800 10.366 -3.252 431 HZ1 LYS 53 3HZ LYS 53 2.062 12.555 -2.119 432 HZ2 LYS 53 1HZ LYS 53 2.181 11.312 -0.978 433 HZ3 LYS 53 2HZ LYS 53 0.666 11.776 -1.568 434 H LYS 54 H LYS 54 -1.711 9.158 0.793 435 HA LYS 54 HA LYS 54 -0.856 9.514 3.433 436 HB2 LYS 54 2HB LYS 54 -3.561 9.851 2.141 437 HB3 LYS 54 3HB LYS 54 -3.251 10.279 3.819 438 HG2 LYS 54 2HG LYS 54 -1.846 12.034 3.245 439 HG3 LYS 54 3HG LYS 54 -1.562 11.404 1.620 440 HD2 LYS 54 2HD LYS 54 -3.010 13.182 1.244 441 HD3 LYS 54 3HD LYS 54 -4.096 11.791 1.281 442 HE2 LYS 54 2HE LYS 54 -4.681 12.276 3.584 443 HE3 LYS 54 3HE LYS 54 -3.531 13.612 3.619 444 HZ1 LYS 54 3HZ LYS 54 -6.191 13.495 2.487 445 HZ2 LYS 54 1HZ LYS 54 -5.042 14.265 1.512 446 HZ3 LYS 54 2HZ LYS 54 -5.325 14.819 3.085 447 H GLY 55 H GLY 55 -2.684 6.970 1.953 448 HA2 GLY 55 2HA GLY 55 -2.425 5.261 4.184 449 HA3 GLY 55 3HA GLY 55 -4.048 5.935 4.164 450 H GLY 56 H GLY 56 -5.226 5.716 2.038 451 HA2 GLY 56 2HA GLY 56 -4.657 4.082 -0.045 452 HA3 GLY 56 3HA GLY 56 -5.077 2.948 1.230 453 H GLY 57 H GLY 57 -7.042 4.763 2.434 454 HA2 GLY 57 2HA GLY 57 -9.195 4.293 0.483 455 HA3 GLY 57 3HA GLY 57 -9.405 4.408 2.224 456 H GLY 58 H GLY 58 -9.102 6.534 3.219 457 HA2 GLY 58 2HA GLY 58 -8.703 8.958 2.143 458 HA3 GLY 58 3HA GLY 58 -10.314 8.579 1.551 459 H GLY 59 H GLY 59 -12.044 8.421 3.026 460 HA2 GLY 59 2HA GLY 59 -11.488 9.168 5.804 461 HA3 GLY 59 3HA GLY 59 -12.508 10.241 4.858 462 H GLY 60 H GLY 60 -14.360 9.951 6.064 463 HA2 GLY 60 2HA GLY 60 -15.358 7.248 6.502 464 HA3 GLY 60 3HA GLY 60 -16.072 8.735 7.108 465 H GLY 61 H GLY 61 -16.754 10.233 5.119 466 HA2 GLY 61 2HA GLY 61 -17.966 8.626 2.997 467 HA3 GLY 61 3HA GLY 61 -19.057 9.501 4.062 468 H GLY 62 H GLY 62 -19.865 11.097 2.841 469 HA2 GLY 62 2HA GLY 62 -18.111 13.224 2.018 470 HA3 GLY 62 3HA GLY 62 -18.804 12.348 0.661 471 H GLY 63 H GLY 63 -19.179 15.144 1.528 472 HA2 GLY 63 2HA GLY 63 -21.763 15.617 0.841 473 HA3 GLY 63 3HA GLY 63 -21.865 15.303 2.567 474 H GLY 64 H GLY 64 -20.706 16.705 4.022 475 HA2 GLY 64 2HA GLY 64 -21.028 19.421 3.453 476 HA3 GLY 64 3HA GLY 64 -20.081 18.776 4.785 477 H VAL 65 H VAL 65 -17.841 18.307 4.432 478 HA VAL 65 HA VAL 65 -16.576 19.115 1.979 479 HB VAL 65 HB VAL 65 -16.956 21.315 2.973 480 HG11 VAL 65 1HG1 VAL 65 -15.134 20.658 5.244 481 HG12 VAL 65 2HG1 VAL 65 -16.344 21.936 5.106 482 HG13 VAL 65 3HG1 VAL 65 -16.849 20.265 5.363 483 HG21 VAL 65 3HG2 VAL 65 -14.680 20.452 1.866 484 HG22 VAL 65 1HG2 VAL 65 -14.909 22.114 2.412 485 HG23 VAL 65 2HG2 VAL 65 -14.055 20.959 3.436 486 H TRP 66 H TRP 66 -14.723 18.029 1.726 487 HA TRP 66 HA TRP 66 -12.801 17.507 3.664 488 HB2 TRP 66 2HB TRP 66 -14.010 16.000 4.899 489 HB3 TRP 66 3HB TRP 66 -15.003 15.511 3.529 490 HD1 TRP 66 HD1 TRP 66 -14.626 13.025 3.096 491 HE1 TRP 66 HE1 TRP 66 -12.597 11.442 3.039 492 HE3 TRP 66 HE3 TRP 66 -10.979 16.331 4.475 493 HZ2 TRP 66 HZ2 TRP 66 -9.818 11.577 3.516 494 HZ3 TRP 66 HZ3 TRP 66 -8.661 15.524 4.652 495 HH2 TRP 66 HH2 TRP 66 -8.095 13.196 4.183 496 HA PRO 67 HA PRO 67 -12.009 14.619 -0.127 497 HB2 PRO 67 2HB PRO 67 -13.987 14.417 -1.975 498 HB3 PRO 67 3HB PRO 67 -13.863 13.340 -0.579 499 HG2 PRO 67 2HG PRO 67 -15.595 15.751 -0.963 500 HG3 PRO 67 3HG PRO 67 -16.007 14.179 -0.255 501 HD2 PRO 67 2HD PRO 67 -15.453 16.357 1.255 502 HD3 PRO 67 3HD PRO 67 -15.062 14.707 1.780 503 H LEU 68 H LEU 68 -10.572 16.168 -0.814 504 HA LEU 68 HA LEU 68 -11.526 18.382 -2.452 505 HB2 LEU 68 2HB LEU 68 -9.426 19.358 -2.171 506 HB3 LEU 68 3HB LEU 68 -9.774 18.595 -0.621 507 HG LEU 68 HG LEU 68 -7.468 18.242 -1.132 508 HD11 LEU 68 1HD1 LEU 68 -8.897 15.672 -1.776 509 HD12 LEU 68 2HD1 LEU 68 -8.794 16.358 -0.155 510 HD13 LEU 68 3HD1 LEU 68 -7.325 15.870 -1.000 511 HD21 LEU 68 3HD2 LEU 68 -8.163 18.383 -3.739 512 HD22 LEU 68 1HD2 LEU 68 -7.916 16.646 -3.562 513 HD23 LEU 68 2HD2 LEU 68 -6.615 17.767 -3.160 514 H VAL 69 H VAL 69 -10.343 15.239 -2.850 515 HA VAL 69 HA VAL 69 -9.001 15.626 -5.357 516 HB VAL 69 HB VAL 69 -9.037 13.161 -5.520 517 HG11 VAL 69 1HG1 VAL 69 -8.210 13.522 -2.726 518 HG12 VAL 69 2HG1 VAL 69 -7.281 12.986 -4.127 519 HG13 VAL 69 3HG1 VAL 69 -7.554 14.707 -3.855 520 HG21 VAL 69 3HG2 VAL 69 -10.994 13.486 -3.335 521 HG22 VAL 69 1HG2 VAL 69 -10.878 12.245 -4.583 522 HG23 VAL 69 2HG2 VAL 69 -9.844 12.161 -3.157 523 H ILE 70 H ILE 70 -12.222 14.606 -4.336 524 HA ILE 70 HA ILE 70 -13.336 13.618 -6.603 525 HB ILE 70 HB ILE 70 -15.479 14.766 -5.920 526 HG12 ILE 70 2HG1 ILE 70 -14.822 15.594 -3.337 527 HG13 ILE 70 3HG1 ILE 70 -13.567 16.294 -4.354 528 HG21 ILE 70 1HG2 ILE 70 -14.659 12.539 -5.083 529 HG22 ILE 70 2HG2 ILE 70 -14.078 13.380 -3.647 530 HG23 ILE 70 3HG2 ILE 70 -15.800 13.371 -4.027 531 HD11 ILE 70 3HD1 ILE 70 -15.865 16.826 -5.757 532 HD12 ILE 70 1HD1 ILE 70 -16.364 17.015 -4.076 533 HD13 ILE 70 2HD1 ILE 70 -15.006 17.949 -4.704 534 H ARG 71 H ARG 71 -12.684 17.017 -5.907 535 HA ARG 71 HA ARG 71 -13.861 17.906 -8.391 536 HB2 ARG 71 2HB ARG 71 -12.875 20.133 -7.678 537 HB3 ARG 71 3HB ARG 71 -14.073 19.434 -6.597 538 HG2 ARG 71 2HG ARG 71 -12.377 18.716 -5.072 539 HG3 ARG 71 3HG ARG 71 -11.102 19.183 -6.200 540 HD2 ARG 71 2HD ARG 71 -11.149 21.302 -5.509 541 HD3 ARG 71 3HD ARG 71 -12.906 21.379 -5.642 542 HE ARG 71 HE ARG 71 -11.370 20.933 -3.261 543 HH11 ARG 71 1HH1 ARG 71 -14.439 20.392 -4.814 544 HH12 ARG 71 2HH1 ARG 71 -15.310 20.227 -3.326 545 HH21 ARG 71 1HH2 ARG 71 -12.506 20.717 -1.295 546 HH22 ARG 71 2HH2 ARG 71 -14.210 20.413 -1.325 547 H THR 72 H THR 72 -10.612 17.503 -7.050 548 HA THR 72 HA THR 72 -9.076 18.647 -9.024 549 HB THR 72 HB THR 72 -8.228 16.012 -7.874 550 HG1 THR 72 HG1 THR 72 -8.473 18.478 -6.462 551 HG21 THR 72 3HG2 THR 72 -6.954 18.002 -9.318 552 HG22 THR 72 1HG2 THR 72 -6.170 16.721 -8.395 553 HG23 THR 72 2HG2 THR 72 -6.445 18.298 -7.656 554 H VAL 73 H VAL 73 -10.637 15.487 -9.022 555 HA VAL 73 HA VAL 73 -9.410 14.501 -11.375 556 HB VAL 73 HB VAL 73 -12.152 13.722 -10.396 557 HG11 VAL 73 1HG1 VAL 73 -10.132 11.846 -11.525 558 HG12 VAL 73 2HG1 VAL 73 -11.894 11.784 -11.595 559 HG13 VAL 73 3HG1 VAL 73 -11.008 12.914 -12.620 560 HG21 VAL 73 3HG2 VAL 73 -11.190 13.206 -8.442 561 HG22 VAL 73 1HG2 VAL 73 -10.413 11.890 -9.322 562 HG23 VAL 73 2HG2 VAL 73 -9.562 13.416 -9.087 563 H ILE 74 H ILE 74 -12.561 16.053 -10.810 564 HA ILE 74 HA ILE 74 -13.413 16.012 -13.493 565 HB ILE 74 HB ILE 74 -14.311 18.284 -11.829 566 HG12 ILE 74 2HG1 ILE 74 -14.585 15.407 -10.984 567 HG13 ILE 74 3HG1 ILE 74 -14.094 16.793 -10.016 568 HG21 ILE 74 1HG2 ILE 74 -15.246 16.760 -14.004 569 HG22 ILE 74 2HG2 ILE 74 -16.355 16.470 -12.665 570 HG23 ILE 74 3HG2 ILE 74 -16.041 18.118 -13.208 571 HD11 ILE 74 3HD1 ILE 74 -16.553 17.586 -10.626 572 HD12 ILE 74 1HD1 ILE 74 -16.795 15.843 -10.741 573 HD13 ILE 74 2HD1 ILE 74 -16.201 16.554 -9.240 574 H ALA 75 H ALA 75 -11.223 18.073 -11.784 575 HA ALA 75 HA ALA 75 -11.287 20.436 -13.171 576 HB1 ALA 75 1HB ALA 75 -8.783 18.994 -12.308 577 HB2 ALA 75 2HB ALA 75 -8.956 20.726 -12.597 578 HB3 ALA 75 3HB ALA 75 -9.809 19.967 -11.253 579 H GLY 76 H GLY 76 -10.274 17.322 -14.309 580 HA2 GLY 76 2HA GLY 76 -9.030 18.475 -16.696 581 HA3 GLY 76 3HA GLY 76 -9.004 16.781 -16.230 582 H TYR 77 H TYR 77 -11.956 16.899 -15.693 583 HA TYR 77 HA TYR 77 -12.898 15.792 -18.028 584 HB2 TYR 77 2HB TYR 77 -14.696 15.460 -16.744 585 HB3 TYR 77 3HB TYR 77 -13.981 16.504 -15.521 586 HD1 TYR 77 HD2 TYR 77 -16.180 16.505 -18.508 587 HD2 TYR 77 HD1 TYR 77 -14.922 18.605 -15.028 588 HE1 TYR 77 HE2 TYR 77 -18.005 18.123 -18.832 589 HE2 TYR 77 HE1 TYR 77 -16.744 20.227 -15.341 590 HH TYR 77 HH TYR 77 -18.152 20.988 -17.661 591 H ASN 78 H ASN 78 -13.063 19.181 -17.005 592 HA ASN 78 HA ASN 78 -14.636 20.234 -19.006 593 HB2 ASN 78 2HB ASN 78 -13.756 21.498 -17.048 594 HB3 ASN 78 3HB ASN 78 -12.177 21.545 -17.826 595 HD21 ASN 78 1HD2 ASN 78 -15.234 22.983 -17.566 596 HD22 ASN 78 2HD2 ASN 78 -15.040 24.182 -18.795 597 H LEU 79 H LEU 79 -11.515 18.855 -19.267 598 HA LEU 79 HA LEU 79 -10.962 20.135 -21.829 599 HB2 LEU 79 2HB LEU 79 -9.253 19.602 -19.943 600 HB3 LEU 79 3HB LEU 79 -9.289 17.973 -20.615 601 HG LEU 79 HG LEU 79 -8.837 19.495 -22.841 602 HD11 LEU 79 1HD1 LEU 79 -8.221 21.536 -22.177 603 HD12 LEU 79 2HD1 LEU 79 -6.718 20.767 -21.669 604 HD13 LEU 79 3HD1 LEU 79 -8.011 21.030 -20.500 605 HD21 LEU 79 3HD2 LEU 79 -6.935 18.135 -20.947 606 HD22 LEU 79 1HD2 LEU 79 -6.443 18.766 -22.519 607 HD23 LEU 79 2HD2 LEU 79 -7.655 17.487 -22.422 608 H TYR 80 H TYR 80 -11.975 17.069 -20.495 609 HA TYR 80 HA TYR 80 -11.519 15.251 -22.445 610 HB2 TYR 80 2HB TYR 80 -14.046 15.678 -20.850 611 HB3 TYR 80 3HB TYR 80 -13.781 14.265 -21.866 612 HD1 TYR 80 HD1 TYR 80 -10.661 15.151 -20.636 613 HD2 TYR 80 HD2 TYR 80 -14.319 13.383 -19.374 614 HE1 TYR 80 HE1 TYR 80 -9.480 14.043 -18.785 615 HE2 TYR 80 HE2 TYR 80 -13.149 12.271 -17.519 616 HH TYR 80 HH TYR 80 -10.153 13.129 -16.457 617 H ARG 81 H ARG 81 -14.253 17.532 -22.428 618 HA ARG 81 HA ARG 81 -15.029 16.779 -25.104 619 HB2 ARG 81 2HB ARG 81 -16.060 18.672 -23.034 620 HB3 ARG 81 3HB ARG 81 -16.550 18.900 -24.707 621 HG2 ARG 81 2HG ARG 81 -16.796 16.173 -23.578 622 HG3 ARG 81 3HG ARG 81 -17.927 17.402 -23.008 623 HD2 ARG 81 2HD ARG 81 -17.449 17.102 -25.937 624 HD3 ARG 81 3HD ARG 81 -18.482 15.937 -25.111 625 HE ARG 81 HE ARG 81 -19.482 18.318 -24.313 626 HH11 ARG 81 1HH1 ARG 81 -18.745 16.961 -27.433 627 HH12 ARG 81 2HH1 ARG 81 -19.989 17.843 -28.255 628 HH21 ARG 81 1HH2 ARG 81 -21.124 19.484 -25.384 629 HH22 ARG 81 2HH2 ARG 81 -21.341 19.278 -27.089 630 H ALA 82 H ALA 82 -13.057 19.193 -23.603 631 HA ALA 82 HA ALA 82 -13.064 21.261 -25.420 632 HB1 ALA 82 1HB ALA 82 -10.603 20.182 -24.053 633 HB2 ALA 82 2HB ALA 82 -10.866 21.826 -24.637 634 HB3 ALA 82 3HB ALA 82 -11.807 21.212 -23.278 635 H ILE 83 H ILE 83 -11.290 18.203 -25.596 636 HA ILE 83 HA ILE 83 -9.994 18.893 -28.069 637 HB ILE 83 HB ILE 83 -10.232 16.218 -26.685 638 HG12 ILE 83 2HG1 ILE 83 -9.033 17.836 -25.320 639 HG13 ILE 83 3HG1 ILE 83 -7.897 16.668 -25.984 640 HG21 ILE 83 1HG2 ILE 83 -9.107 17.022 -29.253 641 HG22 ILE 83 2HG2 ILE 83 -7.968 16.153 -28.226 642 HG23 ILE 83 3HG2 ILE 83 -9.515 15.418 -28.646 643 HD11 ILE 83 3HD1 ILE 83 -8.382 19.445 -27.034 644 HD12 ILE 83 1HD1 ILE 83 -7.006 18.926 -26.062 645 HD13 ILE 83 2HD1 ILE 83 -7.233 18.277 -27.687 646 H LYS 84 H LYS 84 -13.008 17.537 -27.154 647 HA LYS 84 HA LYS 84 -13.493 16.106 -29.596 648 HB2 LYS 84 2HB LYS 84 -14.692 16.247 -27.060 649 HB3 LYS 84 3HB LYS 84 -15.903 16.848 -28.186 650 HG2 LYS 84 2HG LYS 84 -14.444 14.246 -28.562 651 HG3 LYS 84 3HG LYS 84 -15.988 14.389 -27.720 652 HD2 LYS 84 2HD LYS 84 -17.089 14.403 -29.653 653 HD3 LYS 84 3HD LYS 84 -16.125 15.763 -30.233 654 HE2 LYS 84 2HE LYS 84 -15.436 14.283 -31.785 655 HE3 LYS 84 3HE LYS 84 -14.348 13.748 -30.506 656 HZ1 LYS 84 3HZ LYS 84 -16.008 12.075 -29.884 657 HZ2 LYS 84 1HZ LYS 84 -15.471 11.870 -31.475 658 HZ3 LYS 84 2HZ LYS 84 -16.986 12.560 -31.175 659 H LYS 85 H LYS 85 -14.045 19.336 -28.408 660 HA LYS 85 HA LYS 85 -15.895 20.081 -30.467 661 HB2 LYS 85 2HB LYS 85 -14.393 21.542 -28.327 662 HB3 LYS 85 3HB LYS 85 -15.163 22.453 -29.620 663 HG2 LYS 85 2HG LYS 85 -17.307 21.735 -28.999 664 HG3 LYS 85 3HG LYS 85 -16.669 20.440 -27.983 665 HD2 LYS 85 2HD LYS 85 -16.049 21.901 -26.291 666 HD3 LYS 85 3HD LYS 85 -16.011 23.296 -27.373 667 HE2 LYS 85 2HE LYS 85 -17.945 23.645 -26.137 668 HE3 LYS 85 3HE LYS 85 -18.549 22.891 -27.611 669 HZ1 LYS 85 3HZ LYS 85 -18.489 20.740 -26.392 670 HZ2 LYS 85 1HZ LYS 85 -19.602 21.853 -25.772 671 HZ3 LYS 85 2HZ LYS 85 -18.132 21.595 -24.976 672 H LYS 86 H LYS 86 -12.423 20.434 -29.938 673 HA LYS 86 HA LYS 86 -10.774 21.350 -31.256 674 HB2 LYS 86 2HB LYS 86 -10.572 20.215 -33.400 675 HB3 LYS 86 3HB LYS 86 -11.094 19.082 -32.161 676 HG2 LYS 86 2HG LYS 86 -13.261 18.962 -33.013 677 HG3 LYS 86 3HG LYS 86 -13.072 20.445 -33.951 678 HD2 LYS 86 2HD LYS 86 -11.299 18.119 -34.538 679 HD3 LYS 86 3HD LYS 86 -12.966 18.095 -35.116 680 HE2 LYS 86 2HE LYS 86 -11.832 20.652 -35.672 681 HE3 LYS 86 3HE LYS 86 -10.728 19.405 -36.251 682 HZ1 LYS 86 3HZ LYS 86 -13.413 20.077 -37.160 683 HZ2 LYS 86 1HZ LYS 86 -13.010 18.434 -37.151 684 HZ3 LYS 86 2HZ LYS 86 -12.077 19.529 -38.041 685 H GLY 87 H GLY 87 -12.847 23.194 -30.952 686 HA2 GLY 87 2HA GLY 87 -12.590 24.642 -33.489 687 HA3 GLY 87 3HA GLY 87 -14.203 24.398 -32.837 688 H GLY 88 H GLY 88 -14.306 25.025 -30.380 689 HA2 GLY 88 2HA GLY 88 -12.609 27.040 -29.387 690 HA3 GLY 88 3HA GLY 88 -13.952 27.800 -30.228 691 H GLY 89 H GLY 89 -12.964 25.989 -27.436 692 HA2 GLY 89 2HA GLY 89 -15.621 26.501 -26.256 693 HA3 GLY 89 3HA GLY 89 -14.804 24.963 -26.020 694 H GLY 90 H GLY 90 -15.545 26.249 -23.802 695 HA2 GLY 90 2HA GLY 90 -13.011 26.789 -22.537 696 HA3 GLY 90 3HA GLY 90 -14.056 28.199 -22.633 697 H GLY 91 H GLY 91 -16.257 27.957 -21.704 698 HA2 GLY 91 2HA GLY 91 -16.097 26.304 -19.267 699 HA3 GLY 91 3HA GLY 91 -17.011 27.798 -19.414 700 H GLY 92 H GLY 92 -17.665 24.876 -18.732 701 HA2 GLY 92 2HA GLY 92 -19.978 24.153 -18.837 702 HA3 GLY 92 3HA GLY 92 -20.029 24.740 -20.493 703 H GLY 93 H GLY 93 -20.908 22.211 -19.920 704 HA2 GLY 93 2HA GLY 93 -19.532 20.631 -21.754 705 HA3 GLY 93 3HA GLY 93 -18.925 20.203 -20.161 706 H GLY 94 H GLY 94 -20.142 18.284 -21.649 707 HA2 GLY 94 2HA GLY 94 -21.697 16.757 -20.330 708 HA3 GLY 94 3HA GLY 94 -22.852 18.071 -20.501 709 H GLY 95 H GLY 95 -24.036 16.116 -21.439 710 HA2 GLY 95 2HA GLY 95 -25.156 15.648 -23.459 711 HA3 GLY 95 3HA GLY 95 -23.782 16.292 -24.344 712 H GLY 96 H GLY 96 -24.958 13.937 -25.131 713 HA2 GLY 96 2HA GLY 96 -22.718 12.169 -25.095 714 HA3 GLY 96 3HA GLY 96 -24.027 11.558 -24.094 715 H VAL 97 H VAL 97 -23.629 13.026 -27.322 716 HA VAL 97 HA VAL 97 -25.050 10.753 -28.482 717 HB VAL 97 HB VAL 97 -26.490 12.246 -29.840 718 HG11 VAL 97 1HG1 VAL 97 -28.165 12.476 -28.223 719 HG12 VAL 97 2HG1 VAL 97 -27.153 11.164 -27.615 720 HG13 VAL 97 3HG1 VAL 97 -27.003 12.784 -26.933 721 HG21 VAL 97 3HG2 VAL 97 -26.783 14.567 -29.221 722 HG22 VAL 97 1HG2 VAL 97 -25.580 14.406 -27.941 723 HG23 VAL 97 2HG2 VAL 97 -25.093 14.272 -29.631 724 H TRP 98 H TRP 98 -22.297 11.600 -28.556 725 HA TRP 98 HA TRP 98 -21.711 11.235 -31.247 726 HB2 TRP 98 2HB TRP 98 -22.334 13.315 -31.983 727 HB3 TRP 98 3HB TRP 98 -22.039 14.074 -30.421 728 HD1 TRP 98 HD1 TRP 98 -20.222 15.843 -30.706 729 HE1 TRP 98 HE1 TRP 98 -17.978 16.007 -31.954 730 HE3 TRP 98 HE3 TRP 98 -20.266 11.302 -33.054 731 HZ2 TRP 98 HZ2 TRP 98 -16.430 14.421 -33.704 732 HZ3 TRP 98 HZ3 TRP 98 -18.366 10.703 -34.498 733 HH2 TRP 98 HH2 TRP 98 -16.489 12.231 -34.815 734 HA PRO 99 HA PRO 99 -17.692 12.629 -28.957 735 HB2 PRO 99 2HB PRO 99 -17.970 13.630 -26.449 736 HB3 PRO 99 3HB PRO 99 -18.014 14.642 -27.898 737 HG2 PRO 99 2HG PRO 99 -20.284 13.569 -26.267 738 HG3 PRO 99 3HG PRO 99 -20.071 15.188 -26.959 739 HD2 PRO 99 2HD PRO 99 -21.644 13.308 -28.108 740 HD3 PRO 99 3HD PRO 99 -20.757 14.519 -29.055 741 H LEU 100 H LEU 100 -17.702 10.285 -28.966 742 HA LEU 100 HA LEU 100 -18.397 8.959 -26.468 743 HB2 LEU 100 2HB LEU 100 -17.789 8.110 -29.236 744 HB3 LEU 100 3HB LEU 100 -17.350 6.989 -27.949 745 HG LEU 100 HG LEU 100 -20.112 8.081 -27.940 746 HD11 LEU 100 1HD1 LEU 100 -19.036 6.167 -29.983 747 HD12 LEU 100 2HD1 LEU 100 -20.063 7.580 -30.221 748 HD13 LEU 100 3HD1 LEU 100 -20.724 6.127 -29.471 749 HD21 LEU 100 3HD2 LEU 100 -18.643 6.035 -26.646 750 HD22 LEU 100 1HD2 LEU 100 -19.895 5.263 -27.619 751 HD23 LEU 100 2HD2 LEU 100 -20.336 6.481 -26.421 752 H VAL 101 H VAL 101 -15.649 10.223 -28.092 753 HA VAL 101 HA VAL 101 -13.644 8.605 -26.905 754 HB VAL 101 HB VAL 101 -12.091 10.456 -27.518 755 HG11 VAL 101 1HG1 VAL 101 -11.986 9.484 -29.513 756 HG12 VAL 101 2HG1 VAL 101 -13.548 8.733 -29.184 757 HG13 VAL 101 3HG1 VAL 101 -13.473 10.280 -30.028 758 HG21 VAL 101 3HG2 VAL 101 -13.673 12.309 -27.154 759 HG22 VAL 101 1HG2 VAL 101 -12.927 12.369 -28.750 760 HG23 VAL 101 2HG2 VAL 101 -14.583 11.791 -28.573 761 H ILE 102 H ILE 102 -15.511 11.284 -25.779 762 HA ILE 102 HA ILE 102 -13.746 12.153 -23.722 763 HB ILE 102 HB ILE 102 -15.497 13.516 -22.939 764 HG12 ILE 102 2HG1 ILE 102 -17.365 11.600 -24.343 765 HG13 ILE 102 3HG1 ILE 102 -17.234 11.886 -22.611 766 HG21 ILE 102 1HG2 ILE 102 -14.657 14.028 -25.230 767 HG22 ILE 102 2HG2 ILE 102 -16.066 13.192 -25.879 768 HG23 ILE 102 3HG2 ILE 102 -16.277 14.644 -24.901 769 HD11 ILE 102 3HD1 ILE 102 -17.799 14.380 -23.601 770 HD12 ILE 102 1HD1 ILE 102 -18.753 13.313 -24.632 771 HD13 ILE 102 2HD1 ILE 102 -18.957 13.261 -22.881 772 H ARG 103 H ARG 103 -16.209 9.685 -23.953 773 HA ARG 103 HA ARG 103 -16.485 9.225 -21.159 774 HB2 ARG 103 2HB ARG 103 -17.896 7.478 -21.726 775 HB3 ARG 103 3HB ARG 103 -18.030 8.519 -23.137 776 HG2 ARG 103 2HG ARG 103 -17.684 6.595 -24.244 777 HG3 ARG 103 3HG ARG 103 -15.988 6.957 -23.914 778 HD2 ARG 103 2HD ARG 103 -15.780 5.158 -22.620 779 HD3 ARG 103 3HD ARG 103 -17.211 5.592 -21.687 780 HE ARG 103 HE ARG 103 -18.428 4.095 -22.921 781 HH11 ARG 103 1HH1 ARG 103 -15.401 4.712 -24.527 782 HH12 ARG 103 2HH1 ARG 103 -15.625 3.465 -25.709 783 HH21 ARG 103 1HH2 ARG 103 -18.734 2.450 -24.471 784 HH22 ARG 103 2HH2 ARG 103 -17.521 2.180 -25.677 785 H THR 104 H THR 104 -14.220 8.198 -23.570 786 HA THR 104 HA THR 104 -13.220 5.845 -22.544 787 HB THR 104 HB THR 104 -11.246 7.857 -23.520 788 HG1 THR 104 HG1 THR 104 -13.012 6.584 -25.333 789 HG21 THR 104 3HG2 THR 104 -10.515 5.899 -24.867 790 HG22 THR 104 1HG2 THR 104 -11.797 4.949 -24.117 791 HG23 THR 104 2HG2 THR 104 -10.488 5.600 -23.130 792 H VAL 105 H VAL 105 -12.198 9.154 -21.714 793 HA VAL 105 HA VAL 105 -10.390 8.270 -19.676 794 HB VAL 105 HB VAL 105 -11.479 11.059 -19.794 795 HG11 VAL 105 1HG1 VAL 105 -9.915 10.487 -18.015 796 HG12 VAL 105 2HG1 VAL 105 -8.745 9.926 -19.211 797 HG13 VAL 105 3HG1 VAL 105 -9.190 11.632 -19.144 798 HG21 VAL 105 3HG2 VAL 105 -11.075 10.694 -22.085 799 HG22 VAL 105 1HG2 VAL 105 -9.630 11.505 -21.481 800 HG23 VAL 105 2HG2 VAL 105 -9.612 9.764 -21.762 801 H ILE 106 H ILE 106 -13.723 9.346 -19.780 802 HA ILE 106 HA ILE 106 -14.087 9.814 -17.026 803 HB ILE 106 HB ILE 106 -16.186 8.845 -18.967 804 HG12 ILE 106 2HG1 ILE 106 -14.631 11.172 -19.148 805 HG13 ILE 106 3HG1 ILE 106 -16.119 10.820 -20.020 806 HG21 ILE 106 1HG2 ILE 106 -16.355 10.399 -16.390 807 HG22 ILE 106 2HG2 ILE 106 -17.709 10.118 -17.482 808 HG23 ILE 106 3HG2 ILE 106 -16.927 8.756 -16.679 809 HD11 ILE 106 3HD1 ILE 106 -16.167 12.992 -18.884 810 HD12 ILE 106 1HD1 ILE 106 -17.422 11.898 -18.303 811 HD13 ILE 106 2HD1 ILE 106 -15.972 12.169 -17.336 812 H ALA 107 H ALA 107 -13.717 6.919 -18.810 813 HA ALA 107 HA ALA 107 -15.203 5.037 -17.491 814 HB1 ALA 107 1HB ALA 107 -13.995 4.158 -19.232 815 HB2 ALA 107 2HB ALA 107 -12.503 4.965 -18.749 816 HB3 ALA 107 3HB ALA 107 -13.072 3.555 -17.856 817 H GLY 108 H GLY 108 -12.540 6.876 -16.259 818 HA2 GLY 108 2HA GLY 108 -12.274 5.129 -13.922 819 HA3 GLY 108 3HA GLY 108 -11.216 6.469 -14.337 820 H TYR 109 H TYR 109 -13.571 8.224 -14.847 821 HA TYR 109 HA TYR 109 -13.686 9.597 -12.478 822 HB2 TYR 109 2HB TYR 109 -15.413 9.478 -14.889 823 HB3 TYR 109 3HB TYR 109 -16.105 10.240 -13.461 824 HD1 TYR 109 HD2 TYR 109 -12.518 10.344 -14.315 825 HD2 TYR 109 HD1 TYR 109 -16.209 12.460 -14.335 826 HE1 TYR 109 HE2 TYR 109 -11.316 12.423 -14.847 827 HE2 TYR 109 HE1 TYR 109 -15.018 14.545 -14.868 828 HH TYR 109 HH TYR 109 -11.487 14.656 -15.021 829 H ASN 110 H ASN 110 -15.915 7.076 -13.602 830 HA ASN 110 HA ASN 110 -17.831 7.122 -11.657 831 HB2 ASN 110 2HB ASN 110 -16.614 4.947 -13.287 832 HB3 ASN 110 3HB ASN 110 -17.643 4.472 -11.939 833 HD21 ASN 110 1HD2 ASN 110 -17.518 6.316 -14.918 834 HD22 ASN 110 2HD2 ASN 110 -19.216 6.279 -15.233 835 H LEU 111 H LEU 111 -14.511 6.205 -11.324 836 HA LEU 111 HA LEU 111 -14.960 5.024 -8.694 837 HB2 LEU 111 2HB LEU 111 -13.097 4.592 -10.731 838 HB3 LEU 111 3HB LEU 111 -12.188 5.348 -9.424 839 HG LEU 111 HG LEU 111 -12.029 2.945 -9.260 840 HD11 LEU 111 1HD1 LEU 111 -13.830 3.185 -7.029 841 HD12 LEU 111 2HD1 LEU 111 -12.871 4.652 -7.221 842 HD13 LEU 111 3HD1 LEU 111 -12.069 3.091 -7.047 843 HD21 LEU 111 3HD2 LEU 111 -14.482 1.992 -8.506 844 HD22 LEU 111 1HD2 LEU 111 -13.747 1.783 -10.096 845 HD23 LEU 111 2HD2 LEU 111 -14.891 3.097 -9.819 846 H TYR 112 H TYR 112 -13.541 7.861 -10.201 847 HA TYR 112 HA TYR 112 -12.085 8.985 -8.188 848 HB2 TYR 112 2HB TYR 112 -12.105 10.833 -9.477 849 HB3 TYR 112 3HB TYR 112 -13.042 9.859 -10.604 850 HD1 TYR 112 HD2 TYR 112 -13.571 12.010 -7.592 851 HD2 TYR 112 HD1 TYR 112 -15.038 10.726 -11.373 852 HE1 TYR 112 HE2 TYR 112 -15.440 13.598 -7.399 853 HE2 TYR 112 HE1 TYR 112 -16.910 12.310 -11.192 854 HH TYR 112 HH TYR 112 -17.860 13.908 -9.982 855 H ARG 113 H ARG 113 -15.604 9.006 -8.530 856 HA ARG 113 HA ARG 113 -15.928 10.501 -6.062 857 HB2 ARG 113 2HB ARG 113 -17.474 10.132 -8.385 858 HB3 ARG 113 3HB ARG 113 -18.380 9.380 -7.079 859 HG2 ARG 113 2HG ARG 113 -18.601 11.375 -5.912 860 HG3 ARG 113 3HG ARG 113 -17.262 12.137 -6.773 861 HD2 ARG 113 2HD ARG 113 -19.081 13.142 -7.767 862 HD3 ARG 113 3HD ARG 113 -18.778 11.795 -8.864 863 HE ARG 113 HE ARG 113 -20.563 10.757 -7.134 864 HH11 ARG 113 1HH1 ARG 113 -20.509 13.703 -8.989 865 HH12 ARG 113 2HH1 ARG 113 -22.232 13.786 -9.151 866 HH21 ARG 113 1HH2 ARG 113 -22.833 10.856 -7.340 867 HH22 ARG 113 2HH2 ARG 113 -23.553 12.167 -8.212 868 H ALA 114 H ALA 114 -15.925 7.225 -7.148 869 HA ALA 114 HA ALA 114 -17.526 5.923 -5.325 870 HB1 ALA 114 1HB ALA 114 -14.830 4.930 -6.235 871 HB2 ALA 114 2HB ALA 114 -16.210 3.963 -5.714 872 HB3 ALA 114 3HB ALA 114 -16.291 4.875 -7.222 873 H ILE 115 H ILE 115 -14.334 7.301 -4.849 874 HA ILE 115 HA ILE 115 -13.930 6.127 -2.267 875 HB ILE 115 HB ILE 115 -12.538 8.420 -3.650 876 HG12 ILE 115 2HG1 ILE 115 -12.162 6.273 -4.723 877 HG13 ILE 115 3HG1 ILE 115 -10.700 6.767 -3.876 878 HG21 ILE 115 1HG2 ILE 115 -12.347 7.412 -0.900 879 HG22 ILE 115 2HG2 ILE 115 -10.805 7.581 -1.739 880 HG23 ILE 115 3HG2 ILE 115 -11.877 8.972 -1.575 881 HD11 ILE 115 3HD1 ILE 115 -12.711 4.726 -2.963 882 HD12 ILE 115 1HD1 ILE 115 -11.072 4.423 -3.539 883 HD13 ILE 115 2HD1 ILE 115 -11.328 5.273 -2.014 884 H LYS 116 H LYS 116 -15.511 8.951 -3.478 885 HA LYS 116 HA LYS 116 -15.479 10.435 -1.032 886 HB2 LYS 116 2HB LYS 116 -15.893 11.928 -2.683 887 HB3 LYS 116 3HB LYS 116 -16.657 10.727 -3.716 888 HG2 LYS 116 2HG LYS 116 -18.738 10.977 -2.644 889 HG3 LYS 116 3HG LYS 116 -18.023 11.872 -1.300 890 HD2 LYS 116 2HD LYS 116 -17.786 13.807 -2.546 891 HD3 LYS 116 3HD LYS 116 -17.804 12.941 -4.084 892 HE2 LYS 116 2HE LYS 116 -20.124 12.671 -4.036 893 HE3 LYS 116 3HE LYS 116 -20.218 12.998 -2.306 894 HZ1 LYS 116 3HZ LYS 116 -20.792 14.792 -4.194 895 HZ2 LYS 116 1HZ LYS 116 -19.163 15.159 -3.922 896 HZ3 LYS 116 2HZ LYS 116 -20.265 15.203 -2.640 897 H LYS 117 H LYS 117 -17.715 8.197 -2.582 898 HA LYS 117 HA LYS 117 -19.871 8.582 -0.787 899 HB2 LYS 117 2HB LYS 117 -19.146 6.630 -2.889 900 HB3 LYS 117 3HB LYS 117 -20.264 6.051 -1.661 901 HG2 LYS 117 2HG LYS 117 -21.920 7.519 -2.277 902 HG3 LYS 117 3HG LYS 117 -20.784 8.672 -2.981 903 HD2 LYS 117 2HD LYS 117 -21.067 7.771 -4.994 904 HD3 LYS 117 3HD LYS 117 -20.596 6.184 -4.381 905 HE2 LYS 117 2HE LYS 117 -23.322 7.081 -3.697 906 HE3 LYS 117 3HE LYS 117 -23.028 6.743 -5.402 907 HZ1 LYS 117 3HZ LYS 117 -23.302 4.925 -3.214 908 HZ2 LYS 117 1HZ LYS 117 -21.885 4.641 -4.094 909 HZ3 LYS 117 2HZ LYS 117 -23.383 4.627 -4.878 910 H LYS 118 H LYS 118 -17.102 6.403 -0.807 911 HA LYS 118 HA LYS 118 -17.824 5.581 1.930 912 HB2 LYS 118 2HB LYS 118 -16.367 3.910 -0.126 913 HB3 LYS 118 3HB LYS 118 -16.796 3.411 1.505 914 HG2 LYS 118 2HG LYS 118 -18.612 2.520 0.583 915 HG3 LYS 118 3HG LYS 118 -19.212 4.175 0.452 916 HD2 LYS 118 2HD LYS 118 -18.435 4.357 -1.796 917 HD3 LYS 118 3HD LYS 118 -17.550 2.835 -1.675 918 HE2 LYS 118 2HE LYS 118 -20.382 2.562 -1.050 919 HE3 LYS 118 3HE LYS 118 -20.094 3.161 -2.683 920 HZ1 LYS 118 3HZ LYS 118 -19.724 0.541 -1.639 921 HZ2 LYS 118 1HZ LYS 118 -18.296 1.117 -2.341 922 HZ3 LYS 118 2HZ LYS 118 -19.723 1.063 -3.248 Start of MODEL 15 1 H1 VAL 1 H VAL 1 5.469 0.229 -6.482 2 HA VAL 1 HA VAL 1 3.180 1.194 -7.992 3 HB VAL 1 HB VAL 1 2.752 -1.049 -8.990 4 HG11 VAL 1 1HG1 VAL 1 4.668 -0.832 -10.716 5 HG12 VAL 1 2HG1 VAL 1 3.527 0.501 -10.533 6 HG13 VAL 1 3HG1 VAL 1 5.122 0.596 -9.787 7 HG21 VAL 1 3HG2 VAL 1 5.528 -1.577 -7.957 8 HG22 VAL 1 1HG2 VAL 1 4.055 -2.498 -7.651 9 HG23 VAL 1 2HG2 VAL 1 4.794 -2.522 -9.253 10 H TRP 2 H TRP 2 1.198 0.411 -7.240 11 HA TRP 2 HA TRP 2 0.790 -1.695 -5.476 12 HB2 TRP 2 2HB TRP 2 1.919 -0.825 -3.681 13 HB3 TRP 2 3HB TRP 2 1.666 0.841 -4.193 14 HD1 TRP 2 HD1 TRP 2 0.324 2.049 -2.390 15 HE1 TRP 2 HE1 TRP 2 -1.712 1.497 -0.916 16 HE3 TRP 2 HE3 TRP 2 -0.450 -2.788 -3.854 17 HZ2 TRP 2 HZ2 TRP 2 -3.420 -0.698 -0.437 18 HZ3 TRP 2 HZ3 TRP 2 -2.307 -4.044 -2.839 19 HH2 TRP 2 HH2 TRP 2 -3.759 -3.019 -1.166 20 HA PRO 3 HA PRO 3 -3.009 1.281 -5.244 21 HB2 PRO 3 2HB PRO 3 -2.742 3.733 -6.377 22 HB3 PRO 3 3HB PRO 3 -2.345 3.408 -4.686 23 HG2 PRO 3 2HG PRO 3 -0.526 3.603 -7.055 24 HG3 PRO 3 3HG PRO 3 -0.312 4.262 -5.423 25 HD2 PRO 3 2HD PRO 3 0.902 1.986 -6.245 26 HD3 PRO 3 3HD PRO 3 0.394 2.243 -4.563 27 H LEU 4 H LEU 4 -4.010 -0.029 -6.718 28 HA LEU 4 HA LEU 4 -3.534 0.351 -9.562 29 HB2 LEU 4 2HB LEU 4 -5.026 -1.567 -9.850 30 HB3 LEU 4 3HB LEU 4 -3.701 -1.915 -8.741 31 HG LEU 4 HG LEU 4 -5.612 -1.196 -6.980 32 HD11 LEU 4 1HD1 LEU 4 -7.126 -1.065 -9.128 33 HD12 LEU 4 2HD1 LEU 4 -7.745 -1.717 -7.611 34 HD13 LEU 4 3HD1 LEU 4 -7.221 -2.810 -8.891 35 HD21 LEU 4 3HD2 LEU 4 -6.022 -3.640 -6.712 36 HD22 LEU 4 1HD2 LEU 4 -4.316 -3.199 -6.794 37 HD23 LEU 4 2HD2 LEU 4 -5.111 -3.906 -8.200 38 H VAL 5 H VAL 5 -5.763 1.322 -7.142 39 HA VAL 5 HA VAL 5 -8.013 1.792 -8.831 40 HB VAL 5 HB VAL 5 -8.827 3.219 -6.940 41 HG11 VAL 5 1HG1 VAL 5 -8.730 0.510 -7.166 42 HG12 VAL 5 2HG1 VAL 5 -8.016 0.757 -5.571 43 HG13 VAL 5 3HG1 VAL 5 -9.626 1.384 -5.924 44 HG21 VAL 5 3HG2 VAL 5 -6.088 3.188 -6.241 45 HG22 VAL 5 1HG2 VAL 5 -7.418 3.995 -5.410 46 HG23 VAL 5 2HG2 VAL 5 -6.966 2.350 -4.962 47 H ILE 6 H ILE 6 -5.111 3.521 -8.128 48 HA ILE 6 HA ILE 6 -6.063 6.112 -8.884 49 HB ILE 6 HB ILE 6 -3.763 6.825 -8.804 50 HG12 ILE 6 2HG1 ILE 6 -2.217 4.681 -8.055 51 HG13 ILE 6 3HG1 ILE 6 -3.263 3.970 -9.279 52 HG21 ILE 6 1HG2 ILE 6 -4.822 6.597 -6.667 53 HG22 ILE 6 2HG2 ILE 6 -4.458 4.872 -6.618 54 HG23 ILE 6 3HG2 ILE 6 -3.151 6.053 -6.517 55 HD11 ILE 6 3HD1 ILE 6 -0.942 5.504 -9.653 56 HD12 ILE 6 1HD1 ILE 6 -2.036 4.866 -10.880 57 HD13 ILE 6 2HD1 ILE 6 -2.296 6.481 -10.220 58 H ARG 7 H ARG 7 -4.878 3.346 -10.571 59 HA ARG 7 HA ARG 7 -4.133 4.766 -12.962 60 HB2 ARG 7 2HB ARG 7 -3.483 2.710 -13.825 61 HB3 ARG 7 3HB ARG 7 -3.245 2.483 -12.098 62 HG2 ARG 7 2HG ARG 7 -4.416 0.608 -12.368 63 HG3 ARG 7 3HG ARG 7 -5.829 1.662 -12.434 64 HD2 ARG 7 2HD ARG 7 -5.924 0.200 -14.317 65 HD3 ARG 7 3HD ARG 7 -5.505 1.808 -14.907 66 HE ARG 7 HE ARG 7 -3.187 0.237 -14.397 67 HH11 ARG 7 1HH1 ARG 7 -5.754 0.759 -16.689 68 HH12 ARG 7 2HH1 ARG 7 -4.838 0.187 -18.043 69 HH21 ARG 7 1HH2 ARG 7 -1.970 -0.519 -16.172 70 HH22 ARG 7 2HH2 ARG 7 -2.686 -0.540 -17.748 71 H THR 8 H THR 8 -7.023 3.509 -11.620 72 HA THR 8 HA THR 8 -8.540 2.791 -13.805 73 HB THR 8 HB THR 8 -9.800 4.484 -11.681 74 HG1 THR 8 HG1 THR 8 -8.592 1.937 -11.337 75 HG21 THR 8 3HG2 THR 8 -10.560 2.254 -13.473 76 HG22 THR 8 1HG2 THR 8 -11.502 3.642 -12.930 77 HG23 THR 8 2HG2 THR 8 -11.280 2.254 -11.863 78 H VAL 9 H VAL 9 -8.143 6.058 -12.445 79 HA VAL 9 HA VAL 9 -9.730 7.341 -14.417 80 HB VAL 9 HB VAL 9 -8.695 9.440 -13.594 81 HG11 VAL 9 1HG1 VAL 9 -9.584 9.300 -11.314 82 HG12 VAL 9 2HG1 VAL 9 -10.656 8.522 -12.480 83 HG13 VAL 9 3HG1 VAL 9 -9.622 7.542 -11.440 84 HG21 VAL 9 3HG2 VAL 9 -7.215 9.196 -11.547 85 HG22 VAL 9 1HG2 VAL 9 -6.995 7.514 -12.030 86 HG23 VAL 9 2HG2 VAL 9 -6.472 8.816 -13.100 87 H ILE 10 H ILE 10 -6.236 6.870 -14.046 88 HA ILE 10 HA ILE 10 -5.374 8.406 -16.206 89 HB ILE 10 HB ILE 10 -4.085 5.821 -15.341 90 HG12 ILE 10 2HG1 ILE 10 -4.154 8.517 -14.022 91 HG13 ILE 10 3HG1 ILE 10 -4.334 6.924 -13.295 92 HG21 ILE 10 1HG2 ILE 10 -3.394 7.407 -17.385 93 HG22 ILE 10 2HG2 ILE 10 -2.524 8.217 -16.083 94 HG23 ILE 10 3HG2 ILE 10 -2.219 6.513 -16.420 95 HD11 ILE 10 3HD1 ILE 10 -1.869 6.598 -14.012 96 HD12 ILE 10 1HD1 ILE 10 -1.852 8.358 -14.114 97 HD13 ILE 10 2HD1 ILE 10 -2.243 7.567 -12.587 98 H ALA 11 H ALA 11 -7.072 5.432 -16.162 99 HA ALA 11 HA ALA 11 -6.278 4.118 -18.437 100 HB1 ALA 11 1HB ALA 11 -9.111 4.494 -17.475 101 HB2 ALA 11 2HB ALA 11 -8.556 3.244 -18.589 102 HB3 ALA 11 3HB ALA 11 -7.982 3.258 -16.922 103 H GLY 12 H GLY 12 -7.845 7.186 -18.192 104 HA2 GLY 12 2HA GLY 12 -8.624 7.182 -21.008 105 HA3 GLY 12 3HA GLY 12 -8.980 8.439 -19.832 106 H TYR 13 H TYR 13 -6.212 8.592 -18.893 107 HA TYR 13 HA TYR 13 -5.277 10.660 -20.483 108 HB2 TYR 13 2HB TYR 13 -4.301 10.654 -18.395 109 HB3 TYR 13 3HB TYR 13 -4.045 8.912 -18.401 110 HD1 TYR 13 HD2 TYR 13 -2.917 11.869 -20.402 111 HD2 TYR 13 HD1 TYR 13 -1.848 8.235 -18.465 112 HE1 TYR 13 HE2 TYR 13 -0.570 12.224 -21.045 113 HE2 TYR 13 HE1 TYR 13 0.502 8.580 -19.101 114 HH TYR 13 HH TYR 13 1.562 10.298 -21.364 115 H ASN 14 H ASN 14 -4.248 7.256 -20.459 116 HA ASN 14 HA ASN 14 -2.231 7.322 -22.314 117 HB2 ASN 14 2HB ASN 14 -3.757 5.333 -21.070 118 HB3 ASN 14 3HB ASN 14 -3.938 5.029 -22.795 119 HD21 ASN 14 1HD2 ASN 14 -2.671 3.315 -23.107 120 HD22 ASN 14 2HD2 ASN 14 -0.985 3.247 -22.735 121 H LEU 15 H LEU 15 -5.577 7.900 -22.824 122 HA LEU 15 HA LEU 15 -5.384 7.509 -25.707 123 HB2 LEU 15 2HB LEU 15 -7.401 6.958 -24.106 124 HB3 LEU 15 3HB LEU 15 -7.793 8.653 -24.381 125 HG LEU 15 HG LEU 15 -7.560 7.939 -26.913 126 HD11 LEU 15 1HD1 LEU 15 -8.652 5.380 -25.837 127 HD12 LEU 15 2HD1 LEU 15 -6.909 5.577 -26.018 128 HD13 LEU 15 3HD1 LEU 15 -7.964 5.734 -27.422 129 HD21 LEU 15 3HD2 LEU 15 -9.678 8.582 -26.745 130 HD22 LEU 15 1HD2 LEU 15 -9.714 8.163 -25.032 131 HD23 LEU 15 2HD2 LEU 15 -10.098 6.943 -26.246 132 H TYR 16 H TYR 16 -5.681 10.078 -23.330 133 HA TYR 16 HA TYR 16 -6.336 12.249 -24.861 134 HB2 TYR 16 2HB TYR 16 -5.221 11.826 -22.307 135 HB3 TYR 16 3HB TYR 16 -4.168 12.985 -23.112 136 HD1 TYR 16 HD2 TYR 16 -6.198 14.410 -24.787 137 HD2 TYR 16 HD1 TYR 16 -6.313 13.166 -20.720 138 HE1 TYR 16 HE2 TYR 16 -7.795 16.213 -24.287 139 HE2 TYR 16 HE1 TYR 16 -7.912 14.964 -20.209 140 HH TYR 16 HH TYR 16 -8.887 17.311 -22.678 141 H ARG 17 H ARG 17 -3.076 10.907 -24.390 142 HA ARG 17 HA ARG 17 -1.871 12.751 -26.225 143 HB2 ARG 17 2HB ARG 17 -0.981 10.553 -24.485 144 HB3 ARG 17 3HB ARG 17 -0.057 10.720 -25.971 145 HG2 ARG 17 2HG ARG 17 -0.140 13.291 -25.169 146 HG3 ARG 17 3HG ARG 17 -0.179 12.466 -23.610 147 HD2 ARG 17 2HD ARG 17 1.894 12.214 -25.779 148 HD3 ARG 17 3HD ARG 17 2.106 12.873 -24.158 149 HE ARG 17 HE ARG 17 1.260 10.261 -23.838 150 HH11 ARG 17 1HH1 ARG 17 3.967 11.921 -25.266 151 HH12 ARG 17 2HH1 ARG 17 5.080 10.624 -24.981 152 HH21 ARG 17 1HH2 ARG 17 2.716 8.546 -23.457 153 HH22 ARG 17 2HH2 ARG 17 4.367 8.705 -23.953 154 H ALA 18 H ALA 18 -3.405 9.670 -26.465 155 HA ALA 18 HA ALA 18 -2.260 8.532 -28.696 156 HB1 ALA 18 1HB ALA 18 -5.234 8.567 -28.266 157 HB2 ALA 18 2HB ALA 18 -4.239 7.292 -28.972 158 HB3 ALA 18 3HB ALA 18 -4.142 7.632 -27.244 159 H ILE 19 H ILE 19 -4.625 11.149 -28.537 160 HA ILE 19 HA ILE 19 -4.864 11.313 -31.411 161 HB ILE 19 HB ILE 19 -5.884 13.180 -29.267 162 HG12 ILE 19 2HG1 ILE 19 -6.876 10.947 -29.125 163 HG13 ILE 19 3HG1 ILE 19 -8.061 12.114 -29.702 164 HG21 ILE 19 1HG2 ILE 19 -5.870 13.330 -32.182 165 HG22 ILE 19 2HG2 ILE 19 -7.473 13.515 -31.471 166 HG23 ILE 19 3HG2 ILE 19 -6.163 14.589 -30.982 167 HD11 ILE 19 3HD1 ILE 19 -8.248 10.056 -30.936 168 HD12 ILE 19 1HD1 ILE 19 -7.667 11.338 -31.999 169 HD13 ILE 19 2HD1 ILE 19 -6.542 10.130 -31.377 170 H LYS 20 H LYS 20 -2.830 12.620 -28.983 171 HA LYS 20 HA LYS 20 -2.084 15.012 -30.367 172 HB2 LYS 20 2HB LYS 20 -1.222 13.580 -27.920 173 HB3 LYS 20 3HB LYS 20 -0.017 14.609 -28.683 174 HG2 LYS 20 2HG LYS 20 -1.040 15.996 -27.125 175 HG3 LYS 20 3HG LYS 20 -1.821 16.425 -28.648 176 HD2 LYS 20 2HD LYS 20 -3.460 14.455 -27.798 177 HD3 LYS 20 3HD LYS 20 -2.926 15.112 -26.249 178 HE2 LYS 20 2HE LYS 20 -3.493 17.406 -27.302 179 HE3 LYS 20 3HE LYS 20 -4.427 16.463 -28.463 180 HZ1 LYS 20 3HZ LYS 20 -5.533 17.346 -26.300 181 HZ2 LYS 20 1HZ LYS 20 -4.817 15.987 -25.591 182 HZ3 LYS 20 2HZ LYS 20 -5.909 15.798 -26.868 183 H LYS 21 H LYS 21 -0.984 11.702 -30.330 184 HA LYS 21 HA LYS 21 1.472 12.261 -31.731 185 HB2 LYS 21 2HB LYS 21 0.187 9.940 -30.504 186 HB3 LYS 21 3HB LYS 21 0.994 9.554 -32.019 187 HG2 LYS 21 2HG LYS 21 3.085 10.293 -31.203 188 HG3 LYS 21 3HG LYS 21 2.345 11.052 -29.791 189 HD2 LYS 21 2HD LYS 21 2.088 9.069 -28.690 190 HD3 LYS 21 3HD LYS 21 1.907 8.140 -30.180 191 HE2 LYS 21 2HE LYS 21 4.108 7.730 -30.329 192 HE3 LYS 21 3HE LYS 21 4.542 9.371 -29.854 193 HZ1 LYS 21 3HZ LYS 21 5.262 8.321 -28.016 194 HZ2 LYS 21 1HZ LYS 21 4.241 6.988 -28.223 195 HZ3 LYS 21 2HZ LYS 21 3.639 8.416 -27.546 196 H LYS 22 H LYS 22 -1.729 11.004 -32.536 197 HA LYS 22 HA LYS 22 -2.761 10.587 -34.523 198 HB2 LYS 22 2HB LYS 22 -2.091 13.129 -34.574 199 HB3 LYS 22 3HB LYS 22 -0.987 12.607 -35.840 200 HG2 LYS 22 2HG LYS 22 -2.622 12.443 -37.339 201 HG3 LYS 22 3HG LYS 22 -3.678 11.580 -36.218 202 HD2 LYS 22 2HD LYS 22 -4.068 13.851 -35.114 203 HD3 LYS 22 3HD LYS 22 -3.329 14.547 -36.558 204 HE2 LYS 22 2HE LYS 22 -5.316 14.448 -37.548 205 HE3 LYS 22 3HE LYS 22 -5.208 12.690 -37.485 206 HZ1 LYS 22 3HZ LYS 22 -6.068 13.124 -35.052 207 HZ2 LYS 22 1HZ LYS 22 -7.137 13.004 -36.357 208 HZ3 LYS 22 2HZ LYS 22 -6.697 14.524 -35.763 209 H GLY 23 H GLY 23 -0.375 9.032 -33.917 210 HA2 GLY 23 2HA GLY 23 0.167 8.109 -36.644 211 HA3 GLY 23 3HA GLY 23 1.543 8.514 -35.630 212 H GLY 24 H GLY 24 1.958 7.247 -33.748 213 HA2 GLY 24 2HA GLY 24 0.392 4.920 -33.165 214 HA3 GLY 24 3HA GLY 24 1.844 4.525 -34.074 215 H GLY 25 H GLY 25 1.381 3.533 -31.515 216 HA2 GLY 25 2HA GLY 25 3.776 3.928 -30.227 217 HA3 GLY 25 3HA GLY 25 2.692 5.125 -29.532 218 H GLY 26 H GLY 26 4.015 2.625 -28.459 219 HA2 GLY 26 2HA GLY 26 1.570 1.213 -27.596 220 HA3 GLY 26 3HA GLY 26 3.170 0.487 -27.650 221 H GLY 27 H GLY 27 3.406 -0.089 -25.543 222 HA2 GLY 27 2HA GLY 27 2.723 1.714 -23.400 223 HA3 GLY 27 3HA GLY 27 3.484 0.138 -23.238 224 H GLY 28 H GLY 28 4.449 1.920 -21.581 225 HA2 GLY 28 2HA GLY 28 7.040 2.012 -21.538 226 HA3 GLY 28 3HA GLY 28 6.795 3.163 -22.844 227 H GLY 29 H GLY 29 7.689 4.901 -21.749 228 HA2 GLY 29 2HA GLY 29 6.057 6.604 -20.364 229 HA3 GLY 29 3HA GLY 29 6.819 5.632 -19.114 230 H GLY 30 H GLY 30 7.016 8.546 -20.021 231 HA2 GLY 30 2HA GLY 30 9.697 8.961 -19.312 232 HA3 GLY 30 3HA GLY 30 9.588 9.005 -21.065 233 H GLY 31 H GLY 31 9.276 10.943 -21.928 234 HA2 GLY 31 2HA GLY 31 7.750 12.932 -20.374 235 HA3 GLY 31 3HA GLY 31 9.299 13.355 -21.089 236 H GLY 32 H GLY 32 9.079 14.530 -22.865 237 HA2 GLY 32 2HA GLY 32 8.165 13.995 -25.265 238 HA3 GLY 32 3HA GLY 32 6.631 14.262 -24.452 239 H VAL 33 H VAL 33 7.181 15.821 -26.566 240 HA VAL 33 HA VAL 33 7.476 18.443 -25.320 241 HB VAL 33 HB VAL 33 8.887 19.199 -27.291 242 HG11 VAL 33 1HG1 VAL 33 10.879 18.797 -26.150 243 HG12 VAL 33 2HG1 VAL 33 9.650 18.673 -24.890 244 HG13 VAL 33 3HG1 VAL 33 10.350 17.212 -25.589 245 HG21 VAL 33 3HG2 VAL 33 9.825 17.733 -28.749 246 HG22 VAL 33 1HG2 VAL 33 9.896 16.429 -27.564 247 HG23 VAL 33 2HG2 VAL 33 8.373 16.808 -28.368 248 H TRP 34 H TRP 34 5.098 18.030 -25.773 249 HA TRP 34 HA TRP 34 4.218 19.678 -27.831 250 HB2 TRP 34 2HB TRP 34 4.619 18.236 -29.569 251 HB3 TRP 34 3HB TRP 34 4.461 16.803 -28.558 252 HD1 TRP 34 HD1 TRP 34 2.514 15.404 -29.433 253 HE1 TRP 34 HE1 TRP 34 0.132 15.875 -30.287 254 HE3 TRP 34 HE3 TRP 34 2.571 20.511 -29.221 255 HZ2 TRP 34 HZ2 TRP 34 -1.506 18.115 -30.803 256 HZ3 TRP 34 HZ3 TRP 34 0.556 21.743 -29.912 257 HH2 TRP 34 HH2 TRP 34 -1.438 20.568 -30.687 258 HA PRO 35 HA PRO 35 0.422 17.315 -26.003 259 HB2 PRO 35 2HB PRO 35 0.933 15.203 -24.375 260 HB3 PRO 35 3HB PRO 35 0.740 15.042 -26.125 261 HG2 PRO 35 2HG PRO 35 3.251 15.175 -24.501 262 HG3 PRO 35 3HG PRO 35 2.855 14.112 -25.864 263 HD2 PRO 35 2HD PRO 35 4.396 16.321 -26.140 264 HD3 PRO 35 3HD PRO 35 3.326 15.735 -27.431 265 H LEU 36 H LEU 36 0.888 19.441 -24.906 266 HA LEU 36 HA LEU 36 1.763 19.238 -22.139 267 HB2 LEU 36 2HB LEU 36 1.336 21.398 -24.091 268 HB3 LEU 36 3HB LEU 36 0.938 21.803 -22.422 269 HG LEU 36 HG LEU 36 3.608 20.659 -23.200 270 HD11 LEU 36 1HD1 LEU 36 3.063 23.587 -22.837 271 HD12 LEU 36 2HD1 LEU 36 3.004 22.816 -24.422 272 HD13 LEU 36 3HD1 LEU 36 4.501 22.801 -23.490 273 HD21 LEU 36 3HD2 LEU 36 3.945 20.697 -21.009 274 HD22 LEU 36 1HD2 LEU 36 2.333 21.363 -20.747 275 HD23 LEU 36 2HD2 LEU 36 3.701 22.444 -21.014 276 H VAL 37 H VAL 37 -1.146 19.259 -23.948 277 HA VAL 37 HA VAL 37 -2.877 20.279 -21.923 278 HB VAL 37 HB VAL 37 -4.707 19.360 -23.289 279 HG11 VAL 37 1HG1 VAL 37 -2.994 20.527 -25.376 280 HG12 VAL 37 2HG1 VAL 37 -4.568 21.049 -24.772 281 HG13 VAL 37 3HG1 VAL 37 -3.101 21.455 -23.880 282 HG21 VAL 37 3HG2 VAL 37 -4.021 17.354 -24.187 283 HG22 VAL 37 1HG2 VAL 37 -3.866 18.420 -25.583 284 HG23 VAL 37 2HG2 VAL 37 -2.437 17.978 -24.649 285 H ILE 38 H ILE 38 -1.606 17.128 -22.723 286 HA ILE 38 HA ILE 38 -3.421 15.528 -21.302 287 HB ILE 38 HB ILE 38 -1.739 13.798 -21.329 288 HG12 ILE 38 2HG1 ILE 38 0.524 14.665 -22.503 289 HG13 ILE 38 3HG1 ILE 38 0.091 16.119 -21.610 290 HG21 ILE 38 1HG2 ILE 38 -2.572 15.264 -23.621 291 HG22 ILE 38 2HG2 ILE 38 -0.942 14.653 -23.904 292 HG23 ILE 38 3HG2 ILE 38 -2.239 13.538 -23.474 293 HD11 ILE 38 3HD1 ILE 38 1.263 15.155 -19.968 294 HD12 ILE 38 1HD1 ILE 38 -0.219 14.238 -19.696 295 HD13 ILE 38 2HD1 ILE 38 1.089 13.538 -20.651 296 H ARG 39 H ARG 39 -0.598 17.342 -20.269 297 HA ARG 39 HA ARG 39 -0.495 16.200 -17.648 298 HB2 ARG 39 2HB ARG 39 1.268 17.676 -17.224 299 HB3 ARG 39 3HB ARG 39 1.396 17.366 -18.950 300 HG2 ARG 39 2HG ARG 39 1.442 19.565 -19.226 301 HG3 ARG 39 3HG ARG 39 -0.268 19.571 -18.789 302 HD2 ARG 39 2HD ARG 39 0.155 20.227 -16.616 303 HD3 ARG 39 3HD ARG 39 1.802 19.599 -16.638 304 HE ARG 39 HE ARG 39 1.733 21.658 -18.477 305 HH11 ARG 39 1HH1 ARG 39 1.201 21.268 -15.059 306 HH12 ARG 39 2HH1 ARG 39 1.715 22.875 -14.663 307 HH21 ARG 39 1HH2 ARG 39 2.412 23.776 -17.969 308 HH22 ARG 39 2HH2 ARG 39 2.403 24.300 -16.320 309 H THR 40 H THR 40 -2.376 18.632 -19.149 310 HA THR 40 HA THR 40 -2.927 20.317 -16.972 311 HB THR 40 HB THR 40 -5.006 19.694 -19.046 312 HG1 THR 40 HG1 THR 40 -2.660 21.273 -19.429 313 HG21 THR 40 3HG2 THR 40 -4.473 21.789 -17.116 314 HG22 THR 40 1HG2 THR 40 -5.940 21.456 -18.037 315 HG23 THR 40 2HG2 THR 40 -4.657 22.438 -18.745 316 H VAL 41 H VAL 41 -4.760 17.523 -18.216 317 HA VAL 41 HA VAL 41 -6.644 17.557 -16.075 318 HB VAL 41 HB VAL 41 -7.372 15.367 -16.935 319 HG11 VAL 41 1HG1 VAL 41 -8.462 16.271 -18.704 320 HG12 VAL 41 2HG1 VAL 41 -7.762 17.759 -18.065 321 HG13 VAL 41 3HG1 VAL 41 -6.990 16.929 -19.417 322 HG21 VAL 41 3HG2 VAL 41 -6.279 14.528 -19.033 323 HG22 VAL 41 1HG2 VAL 41 -4.961 15.656 -18.716 324 HG23 VAL 41 2HG2 VAL 41 -5.307 14.360 -17.571 325 H ILE 42 H ILE 42 -3.725 15.687 -16.775 326 HA ILE 42 HA ILE 42 -3.893 13.832 -14.700 327 HB ILE 42 HB ILE 42 -1.523 15.036 -16.107 328 HG12 ILE 42 2HG1 ILE 42 -3.190 12.587 -16.352 329 HG13 ILE 42 3HG1 ILE 42 -2.445 13.571 -17.607 330 HG21 ILE 42 1HG2 ILE 42 -0.840 14.459 -13.826 331 HG22 ILE 42 2HG2 ILE 42 -1.467 12.828 -14.055 332 HG23 ILE 42 3HG2 ILE 42 -0.101 13.390 -15.018 333 HD11 ILE 42 3HD1 ILE 42 -1.340 11.515 -17.686 334 HD12 ILE 42 1HD1 ILE 42 -0.233 12.595 -16.839 335 HD13 ILE 42 2HD1 ILE 42 -1.194 11.427 -15.931 336 H ALA 43 H ALA 43 -3.295 17.200 -14.594 337 HA ALA 43 HA ALA 43 -1.664 17.614 -12.445 338 HB1 ALA 43 1HB ALA 43 -3.106 19.630 -11.958 339 HB2 ALA 43 2HB ALA 43 -2.498 19.495 -13.608 340 HB3 ALA 43 3HB ALA 43 -4.170 19.070 -13.247 341 H GLY 44 H GLY 44 -4.800 16.160 -12.446 342 HA2 GLY 44 2HA GLY 44 -5.048 16.414 -9.538 343 HA3 GLY 44 3HA GLY 44 -6.281 15.805 -10.632 344 H TYR 45 H TYR 45 -4.435 14.008 -12.013 345 HA TYR 45 HA TYR 45 -4.874 11.669 -10.611 346 HB2 TYR 45 2HB TYR 45 -2.767 12.325 -12.674 347 HB3 TYR 45 3HB TYR 45 -3.059 10.695 -12.076 348 HD1 TYR 45 HD1 TYR 45 -6.179 12.064 -11.986 349 HD2 TYR 45 HD2 TYR 45 -3.265 10.847 -14.837 350 HE1 TYR 45 HE1 TYR 45 -7.953 11.769 -13.664 351 HE2 TYR 45 HE2 TYR 45 -5.031 10.549 -16.523 352 HH TYR 45 HH TYR 45 -8.147 10.235 -15.886 353 H ASN 46 H ASN 46 -1.939 13.666 -10.686 354 HA ASN 46 HA ASN 46 -0.241 12.118 -9.176 355 HB2 ASN 46 2HB ASN 46 0.353 14.279 -10.270 356 HB3 ASN 46 3HB ASN 46 -0.495 15.127 -8.980 357 HD21 ASN 46 1HD2 ASN 46 1.589 16.152 -8.659 358 HD22 ASN 46 2HD2 ASN 46 2.775 15.360 -7.683 359 H LEU 47 H LEU 47 -3.072 13.817 -8.160 360 HA LEU 47 HA LEU 47 -2.404 13.728 -5.347 361 HB2 LEU 47 2HB LEU 47 -4.268 15.110 -6.976 362 HB3 LEU 47 3HB LEU 47 -5.180 14.190 -5.781 363 HG LEU 47 HG LEU 47 -4.835 16.388 -4.921 364 HD11 LEU 47 1HD1 LEU 47 -4.299 15.715 -2.856 365 HD12 LEU 47 2HD1 LEU 47 -2.709 15.137 -3.351 366 HD13 LEU 47 3HD1 LEU 47 -4.129 14.118 -3.584 367 HD21 LEU 47 3HD2 LEU 47 -1.878 15.974 -5.350 368 HD22 LEU 47 1HD2 LEU 47 -2.660 17.405 -4.677 369 HD23 LEU 47 2HD2 LEU 47 -2.919 16.972 -6.367 370 H TYR 48 H TYR 48 -4.407 11.946 -7.623 371 HA TYR 48 HA TYR 48 -5.991 10.434 -5.991 372 HB2 TYR 48 2HB TYR 48 -5.090 10.285 -8.674 373 HB3 TYR 48 3HB TYR 48 -4.885 8.684 -7.973 374 HD1 TYR 48 HD2 TYR 48 -6.828 7.429 -7.149 375 HD2 TYR 48 HD1 TYR 48 -7.281 11.212 -9.043 376 HE1 TYR 48 HE2 TYR 48 -9.227 6.981 -7.458 377 HE2 TYR 48 HE1 TYR 48 -9.681 10.776 -9.356 378 HH TYR 48 HH TYR 48 -11.341 8.399 -7.750 379 H ARG 49 H ARG 49 -2.609 9.774 -6.851 380 HA ARG 49 HA ARG 49 -2.475 7.444 -5.173 381 HB2 ARG 49 2HB ARG 49 -0.139 8.959 -6.330 382 HB3 ARG 49 3HB ARG 49 -0.204 7.265 -5.864 383 HG2 ARG 49 2HG ARG 49 -0.670 6.765 -7.967 384 HG3 ARG 49 3HG ARG 49 -2.213 7.600 -7.782 385 HD2 ARG 49 2HD ARG 49 -1.475 9.487 -8.833 386 HD3 ARG 49 3HD ARG 49 0.195 9.249 -8.318 387 HE ARG 49 HE ARG 49 -1.034 8.272 -10.725 388 HH11 ARG 49 1HH1 ARG 49 1.537 7.797 -8.426 389 HH12 ARG 49 2HH1 ARG 49 2.555 6.949 -9.543 390 HH21 ARG 49 1HH2 ARG 49 0.297 7.157 -12.205 391 HH22 ARG 49 2HH2 ARG 49 1.849 6.587 -11.692 392 H ALA 50 H ALA 50 -1.927 10.833 -4.800 393 HA ALA 50 HA ALA 50 -0.101 10.986 -2.747 394 HB1 ALA 50 1HB ALA 50 -0.985 13.111 -2.233 395 HB2 ALA 50 2HB ALA 50 -1.257 12.885 -3.961 396 HB3 ALA 50 3HB ALA 50 -2.588 12.673 -2.824 397 H ILE 51 H ILE 51 -3.545 10.221 -2.557 398 HA ILE 51 HA ILE 51 -3.509 10.051 0.323 399 HB ILE 51 HB ILE 51 -5.644 9.215 -1.643 400 HG12 ILE 51 2HG1 ILE 51 -5.187 11.621 -1.708 401 HG13 ILE 51 3HG1 ILE 51 -6.756 11.307 -0.973 402 HG21 ILE 51 1HG2 ILE 51 -5.393 8.930 1.250 403 HG22 ILE 51 2HG2 ILE 51 -6.880 9.731 0.745 404 HG23 ILE 51 3HG2 ILE 51 -6.486 8.129 0.122 405 HD11 ILE 51 3HD1 ILE 51 -5.623 13.030 0.249 406 HD12 ILE 51 1HD1 ILE 51 -5.723 11.581 1.249 407 HD13 ILE 51 2HD1 ILE 51 -4.204 12.003 0.457 408 H LYS 52 H LYS 52 -2.886 7.952 -2.316 409 HA LYS 52 HA LYS 52 -3.471 5.495 -0.960 410 HB2 LYS 52 2HB LYS 52 -2.052 6.204 -3.513 411 HB3 LYS 52 3HB LYS 52 -2.021 4.558 -2.892 412 HG2 LYS 52 2HG LYS 52 -4.504 6.127 -3.558 413 HG3 LYS 52 3HG LYS 52 -3.771 4.879 -4.568 414 HD2 LYS 52 2HD LYS 52 -4.947 3.343 -3.476 415 HD3 LYS 52 3HD LYS 52 -4.093 3.771 -1.992 416 HE2 LYS 52 2HE LYS 52 -5.753 5.485 -1.514 417 HE3 LYS 52 3HE LYS 52 -6.588 5.119 -3.023 418 HZ1 LYS 52 3HZ LYS 52 -6.164 3.041 -0.967 419 HZ2 LYS 52 1HZ LYS 52 -7.301 3.073 -2.220 420 HZ3 LYS 52 2HZ LYS 52 -7.484 4.095 -0.885 421 H LYS 53 H LYS 53 -0.756 7.635 -1.175 422 HA LYS 53 HA LYS 53 1.140 5.695 -0.171 423 HB2 LYS 53 2HB LYS 53 1.284 8.617 -0.860 424 HB3 LYS 53 3HB LYS 53 2.595 7.829 0.009 425 HG2 LYS 53 2HG LYS 53 3.390 6.913 -1.850 426 HG3 LYS 53 3HG LYS 53 1.798 6.312 -2.321 427 HD2 LYS 53 2HD LYS 53 2.274 7.770 -4.045 428 HD3 LYS 53 3HD LYS 53 1.356 8.806 -2.950 429 HE2 LYS 53 2HE LYS 53 3.365 9.792 -2.098 430 HE3 LYS 53 3HE LYS 53 4.364 8.633 -2.973 431 HZ1 LYS 53 3HZ LYS 53 2.667 10.760 -4.158 432 HZ2 LYS 53 1HZ LYS 53 3.483 9.581 -5.056 433 HZ3 LYS 53 2HZ LYS 53 4.358 10.703 -4.142 434 H LYS 54 H LYS 54 -0.617 8.509 1.051 435 HA LYS 54 HA LYS 54 0.423 7.993 3.742 436 HB2 LYS 54 2HB LYS 54 -0.892 10.343 2.428 437 HB3 LYS 54 3HB LYS 54 -0.936 10.189 4.180 438 HG2 LYS 54 2HG LYS 54 0.922 11.520 3.793 439 HG3 LYS 54 3HG LYS 54 1.610 9.910 4.018 440 HD2 LYS 54 2HD LYS 54 2.305 9.767 1.872 441 HD3 LYS 54 3HD LYS 54 0.886 10.612 1.248 442 HE2 LYS 54 2HE LYS 54 2.794 12.208 2.850 443 HE3 LYS 54 3HE LYS 54 3.346 11.677 1.262 444 HZ1 LYS 54 3HZ LYS 54 0.948 12.592 0.631 445 HZ2 LYS 54 1HZ LYS 54 2.325 13.576 0.645 446 HZ3 LYS 54 2HZ LYS 54 1.264 13.587 1.962 447 H GLY 55 H GLY 55 -1.387 8.641 5.472 448 HA2 GLY 55 2HA GLY 55 -3.301 6.543 5.361 449 HA3 GLY 55 3HA GLY 55 -3.205 7.792 6.594 450 H GLY 56 H GLY 56 -5.664 7.031 5.963 451 HA2 GLY 56 2HA GLY 56 -6.897 8.261 3.762 452 HA3 GLY 56 3HA GLY 56 -7.707 7.791 5.249 453 H GLY 57 H GLY 57 -8.475 10.045 3.835 454 HA2 GLY 57 2HA GLY 57 -7.241 12.376 5.024 455 HA3 GLY 57 3HA GLY 57 -8.623 12.363 3.938 456 H GLY 58 H GLY 58 -9.891 13.749 5.137 457 HA2 GLY 58 2HA GLY 58 -10.937 12.588 7.635 458 HA3 GLY 58 3HA GLY 58 -10.464 14.280 7.582 459 H GLY 59 H GLY 59 -12.452 12.024 5.654 460 HA2 GLY 59 2HA GLY 59 -14.185 14.071 4.710 461 HA3 GLY 59 3HA GLY 59 -14.474 12.341 4.605 462 H GLY 60 H GLY 60 -16.190 11.625 5.672 463 HA2 GLY 60 2HA GLY 60 -16.811 12.326 8.336 464 HA3 GLY 60 3HA GLY 60 -17.832 13.250 7.243 465 H GLY 61 H GLY 61 -16.691 9.879 7.567 466 HA2 GLY 61 2HA GLY 61 -18.016 7.978 7.882 467 HA3 GLY 61 3HA GLY 61 -19.450 8.965 7.646 468 H GLY 62 H GLY 62 -20.396 7.514 6.207 469 HA2 GLY 62 2HA GLY 62 -18.943 6.889 3.746 470 HA3 GLY 62 3HA GLY 62 -20.473 6.189 4.253 471 H GLY 63 H GLY 63 -21.062 6.625 1.985 472 HA2 GLY 63 2HA GLY 63 -22.361 7.808 0.503 473 HA3 GLY 63 3HA GLY 63 -22.675 8.950 1.802 474 H GLY 64 H GLY 64 -22.399 10.870 0.800 475 HA2 GLY 64 2HA GLY 64 -19.724 11.368 -0.344 476 HA3 GLY 64 3HA GLY 64 -21.178 11.958 -1.136 477 H VAL 65 H VAL 65 -18.699 13.134 0.363 478 HA VAL 65 HA VAL 65 -20.039 15.481 1.265 479 HB VAL 65 HB VAL 65 -20.400 13.993 3.229 480 HG11 VAL 65 1HG1 VAL 65 -17.977 12.990 2.789 481 HG12 VAL 65 2HG1 VAL 65 -17.541 14.218 3.980 482 HG13 VAL 65 3HG1 VAL 65 -18.727 12.977 4.385 483 HG21 VAL 65 3HG2 VAL 65 -20.151 16.511 3.341 484 HG22 VAL 65 1HG2 VAL 65 -19.875 15.635 4.846 485 HG23 VAL 65 2HG2 VAL 65 -18.505 16.230 3.908 486 H TRP 66 H TRP 66 -18.656 17.218 1.476 487 HA TRP 66 HA TRP 66 -16.768 18.455 1.195 488 HB2 TRP 66 2HB TRP 66 -16.067 16.658 3.048 489 HB3 TRP 66 3HB TRP 66 -14.959 16.165 1.771 490 HD1 TRP 66 HD1 TRP 66 -15.418 19.782 1.456 491 HE1 TRP 66 HE1 TRP 66 -13.472 21.061 2.551 492 HE3 TRP 66 HE3 TRP 66 -13.327 15.952 4.119 493 HZ2 TRP 66 HZ2 TRP 66 -11.332 20.518 4.311 494 HZ3 TRP 66 HZ3 TRP 66 -11.331 16.415 5.483 495 HH2 TRP 66 HH2 TRP 66 -10.356 18.652 5.574 496 HA PRO 67 HA PRO 67 -16.199 16.361 -2.945 497 HB2 PRO 67 2HB PRO 67 -17.250 18.392 -4.408 498 HB3 PRO 67 3HB PRO 67 -18.232 17.087 -3.734 499 HG2 PRO 67 2HG PRO 67 -17.793 19.859 -2.693 500 HG3 PRO 67 3HG PRO 67 -19.298 18.925 -2.790 501 HD2 PRO 67 2HD PRO 67 -17.886 19.179 -0.493 502 HD3 PRO 67 3HD PRO 67 -18.820 17.721 -0.883 503 H LEU 68 H LEU 68 -14.949 18.863 -1.205 504 HA LEU 68 HA LEU 68 -13.600 20.456 -3.057 505 HB2 LEU 68 2HB LEU 68 -12.642 21.401 -1.264 506 HB3 LEU 68 3HB LEU 68 -13.800 20.420 -0.369 507 HG LEU 68 HG LEU 68 -10.959 19.581 -0.931 508 HD11 LEU 68 1HD1 LEU 68 -11.022 20.037 1.717 509 HD12 LEU 68 2HD1 LEU 68 -12.116 21.304 1.162 510 HD13 LEU 68 3HD1 LEU 68 -10.470 21.223 0.534 511 HD21 LEU 68 3HD2 LEU 68 -11.910 18.295 1.319 512 HD22 LEU 68 1HD2 LEU 68 -11.751 17.598 -0.293 513 HD23 LEU 68 2HD2 LEU 68 -13.291 18.289 0.222 514 H VAL 69 H VAL 69 -13.112 17.186 -2.193 515 HA VAL 69 HA VAL 69 -10.345 17.115 -3.076 516 HB VAL 69 HB VAL 69 -11.004 14.505 -2.831 517 HG11 VAL 69 1HG1 VAL 69 -9.291 16.076 -1.630 518 HG12 VAL 69 2HG1 VAL 69 -10.473 16.027 -0.321 519 HG13 VAL 69 3HG1 VAL 69 -9.743 14.532 -0.909 520 HG21 VAL 69 3HG2 VAL 69 -12.727 15.906 -0.793 521 HG22 VAL 69 1HG2 VAL 69 -13.347 15.134 -2.252 522 HG23 VAL 69 2HG2 VAL 69 -12.536 14.168 -1.020 523 H ILE 70 H ILE 70 -13.390 15.530 -4.050 524 HA ILE 70 HA ILE 70 -12.534 14.285 -6.346 525 HB ILE 70 HB ILE 70 -14.904 14.676 -7.209 526 HG12 ILE 70 2HG1 ILE 70 -15.142 15.960 -4.480 527 HG13 ILE 70 3HG1 ILE 70 -15.371 16.757 -6.032 528 HG21 ILE 70 1HG2 ILE 70 -14.319 13.385 -4.560 529 HG22 ILE 70 2HG2 ILE 70 -15.881 13.237 -5.362 530 HG23 ILE 70 3HG2 ILE 70 -14.425 12.628 -6.149 531 HD11 ILE 70 3HD1 ILE 70 -17.156 14.704 -6.182 532 HD12 ILE 70 1HD1 ILE 70 -17.209 15.122 -4.470 533 HD13 ILE 70 2HD1 ILE 70 -17.534 16.354 -5.689 534 H ARG 71 H ARG 71 -13.718 17.618 -6.014 535 HA ARG 71 HA ARG 71 -13.717 18.413 -8.645 536 HB2 ARG 71 2HB ARG 71 -13.368 20.689 -7.839 537 HB3 ARG 71 3HB ARG 71 -14.487 19.827 -6.792 538 HG2 ARG 71 2HG ARG 71 -12.715 19.462 -5.167 539 HG3 ARG 71 3HG ARG 71 -11.564 20.281 -6.226 540 HD2 ARG 71 2HD ARG 71 -14.061 21.572 -5.140 541 HD3 ARG 71 3HD ARG 71 -12.482 21.688 -4.365 542 HE ARG 71 HE ARG 71 -12.366 22.483 -7.094 543 HH11 ARG 71 1HH1 ARG 71 -13.328 23.547 -3.922 544 HH12 ARG 71 2HH1 ARG 71 -13.117 25.229 -4.279 545 HH21 ARG 71 1HH2 ARG 71 -12.084 24.695 -7.577 546 HH22 ARG 71 2HH2 ARG 71 -12.411 25.881 -6.359 547 H THR 72 H THR 72 -10.979 18.052 -6.470 548 HA THR 72 HA THR 72 -8.985 19.361 -7.839 549 HB THR 72 HB THR 72 -8.497 16.656 -6.614 550 HG1 THR 72 HG1 THR 72 -8.334 17.891 -4.600 551 HG21 THR 72 3HG2 THR 72 -6.430 17.358 -7.215 552 HG22 THR 72 1HG2 THR 72 -6.545 18.295 -5.726 553 HG23 THR 72 2HG2 THR 72 -6.908 19.054 -7.276 554 H VAL 73 H VAL 73 -9.954 15.956 -8.268 555 HA VAL 73 HA VAL 73 -8.241 15.578 -10.528 556 HB VAL 73 HB VAL 73 -10.588 13.807 -9.951 557 HG11 VAL 73 1HG1 VAL 73 -9.098 13.399 -11.897 558 HG12 VAL 73 2HG1 VAL 73 -7.757 13.175 -10.772 559 HG13 VAL 73 3HG1 VAL 73 -9.130 12.069 -10.739 560 HG21 VAL 73 3HG2 VAL 73 -8.935 12.601 -8.370 561 HG22 VAL 73 1HG2 VAL 73 -8.136 14.171 -8.271 562 HG23 VAL 73 2HG2 VAL 73 -9.818 14.004 -7.767 563 H ILE 74 H ILE 74 -11.615 16.411 -10.055 564 HA ILE 74 HA ILE 74 -12.549 15.972 -12.661 565 HB ILE 74 HB ILE 74 -13.502 18.163 -10.820 566 HG12 ILE 74 2HG1 ILE 74 -13.503 15.310 -10.425 567 HG13 ILE 74 3HG1 ILE 74 -14.085 16.577 -9.351 568 HG21 ILE 74 1HG2 ILE 74 -14.337 18.147 -13.164 569 HG22 ILE 74 2HG2 ILE 74 -15.010 16.545 -12.865 570 HG23 ILE 74 3HG2 ILE 74 -15.602 17.933 -11.954 571 HD11 ILE 74 3HD1 ILE 74 -16.229 16.572 -10.561 572 HD12 ILE 74 1HD1 ILE 74 -15.638 15.238 -11.551 573 HD13 ILE 74 2HD1 ILE 74 -15.854 15.019 -9.814 574 H ALA 75 H ALA 75 -10.585 18.493 -11.327 575 HA ALA 75 HA ALA 75 -10.991 20.645 -12.956 576 HB1 ALA 75 1HB ALA 75 -9.390 20.827 -11.229 577 HB2 ALA 75 2HB ALA 75 -8.415 19.514 -11.892 578 HB3 ALA 75 3HB ALA 75 -8.507 21.059 -12.738 579 H GLY 76 H GLY 76 -9.613 17.566 -13.818 580 HA2 GLY 76 2HA GLY 76 -8.706 18.571 -16.410 581 HA3 GLY 76 3HA GLY 76 -8.436 16.957 -15.770 582 H TYR 77 H TYR 77 -11.282 16.662 -15.026 583 HA TYR 77 HA TYR 77 -12.214 15.284 -17.227 584 HB2 TYR 77 2HB TYR 77 -13.293 14.793 -15.213 585 HB3 TYR 77 3HB TYR 77 -13.599 16.488 -14.851 586 HD1 TYR 77 HD2 TYR 77 -14.343 14.495 -17.916 587 HD2 TYR 77 HD1 TYR 77 -15.899 16.706 -14.631 588 HE1 TYR 77 HE2 TYR 77 -16.608 14.280 -18.851 589 HE2 TYR 77 HE1 TYR 77 -18.168 16.497 -15.557 590 HH TYR 77 HH TYR 77 -19.153 16.130 -17.950 591 H ASN 78 H ASN 78 -13.151 18.563 -16.194 592 HA ASN 78 HA ASN 78 -14.924 19.158 -18.232 593 HB2 ASN 78 2HB ASN 78 -13.564 20.591 -16.176 594 HB3 ASN 78 3HB ASN 78 -13.414 21.512 -17.670 595 HD21 ASN 78 1HD2 ASN 78 -15.672 21.248 -18.959 596 HD22 ASN 78 2HD2 ASN 78 -17.027 21.770 -18.021 597 H LEU 79 H LEU 79 -11.554 18.680 -18.417 598 HA LEU 79 HA LEU 79 -11.247 20.187 -20.887 599 HB2 LEU 79 2HB LEU 79 -9.531 19.656 -18.861 600 HB3 LEU 79 3HB LEU 79 -9.085 18.394 -20.007 601 HG LEU 79 HG LEU 79 -9.141 20.654 -21.576 602 HD11 LEU 79 1HD1 LEU 79 -9.209 22.350 -20.072 603 HD12 LEU 79 2HD1 LEU 79 -7.471 22.051 -20.052 604 HD13 LEU 79 3HD1 LEU 79 -8.495 21.385 -18.779 605 HD21 LEU 79 3HD2 LEU 79 -6.514 20.431 -20.787 606 HD22 LEU 79 1HD2 LEU 79 -7.295 19.502 -22.066 607 HD23 LEU 79 2HD2 LEU 79 -7.176 18.834 -20.438 608 H TYR 80 H TYR 80 -11.553 16.881 -19.783 609 HA TYR 80 HA TYR 80 -10.664 15.344 -21.810 610 HB2 TYR 80 2HB TYR 80 -13.314 15.094 -20.378 611 HB3 TYR 80 3HB TYR 80 -12.623 13.831 -21.392 612 HD1 TYR 80 HD1 TYR 80 -9.829 15.209 -20.042 613 HD2 TYR 80 HD2 TYR 80 -13.222 12.955 -18.813 614 HE1 TYR 80 HE1 TYR 80 -8.559 14.358 -18.116 615 HE2 TYR 80 HE2 TYR 80 -11.962 12.099 -16.883 616 HH TYR 80 HH TYR 80 -8.651 13.184 -16.222 617 H ARG 81 H ARG 81 -13.859 16.924 -21.800 618 HA ARG 81 HA ARG 81 -14.290 16.247 -24.577 619 HB2 ARG 81 2HB ARG 81 -15.886 17.653 -22.464 620 HB3 ARG 81 3HB ARG 81 -16.353 17.792 -24.154 621 HG2 ARG 81 2HG ARG 81 -17.074 15.654 -24.276 622 HG3 ARG 81 3HG ARG 81 -15.855 15.063 -23.145 623 HD2 ARG 81 2HD ARG 81 -17.143 16.232 -21.324 624 HD3 ARG 81 3HD ARG 81 -18.419 16.508 -22.509 625 HE ARG 81 HE ARG 81 -17.708 13.764 -22.403 626 HH11 ARG 81 1HH1 ARG 81 -19.457 16.231 -20.680 627 HH12 ARG 81 2HH1 ARG 81 -20.552 15.116 -19.932 628 HH21 ARG 81 1HH2 ARG 81 -19.144 12.286 -21.426 629 HH22 ARG 81 2HH2 ARG 81 -20.373 12.872 -20.357 630 H ALA 82 H ALA 82 -13.069 18.910 -22.749 631 HA ALA 82 HA ALA 82 -13.548 21.088 -24.364 632 HB1 ALA 82 1HB ALA 82 -12.421 21.193 -22.181 633 HB2 ALA 82 2HB ALA 82 -10.973 20.497 -22.910 634 HB3 ALA 82 3HB ALA 82 -11.547 22.082 -23.428 635 H ILE 83 H ILE 83 -10.924 18.710 -24.654 636 HA ILE 83 HA ILE 83 -9.743 19.920 -26.939 637 HB ILE 83 HB ILE 83 -9.509 17.112 -25.858 638 HG12 ILE 83 2HG1 ILE 83 -8.625 18.789 -24.344 639 HG13 ILE 83 3HG1 ILE 83 -7.288 17.920 -25.090 640 HG21 ILE 83 1HG2 ILE 83 -8.430 18.368 -28.294 641 HG22 ILE 83 2HG2 ILE 83 -7.275 17.455 -27.325 642 HG23 ILE 83 3HG2 ILE 83 -8.733 16.670 -27.930 643 HD11 ILE 83 3HD1 ILE 83 -7.891 20.727 -25.114 644 HD12 ILE 83 1HD1 ILE 83 -6.425 19.885 -25.615 645 HD13 ILE 83 2HD1 ILE 83 -7.753 20.099 -26.756 646 H LYS 84 H LYS 84 -12.456 17.866 -26.485 647 HA LYS 84 HA LYS 84 -12.490 16.721 -29.108 648 HB2 LYS 84 2HB LYS 84 -13.796 16.193 -26.750 649 HB3 LYS 84 3HB LYS 84 -15.067 16.928 -27.719 650 HG2 LYS 84 2HG LYS 84 -13.912 15.157 -29.471 651 HG3 LYS 84 3HG LYS 84 -13.835 14.301 -27.930 652 HD2 LYS 84 2HD LYS 84 -15.980 13.768 -28.171 653 HD3 LYS 84 3HD LYS 84 -16.384 15.482 -28.051 654 HE2 LYS 84 2HE LYS 84 -17.339 14.611 -30.072 655 HE3 LYS 84 3HE LYS 84 -16.005 15.681 -30.499 656 HZ1 LYS 84 3HZ LYS 84 -16.360 12.998 -31.202 657 HZ2 LYS 84 1HZ LYS 84 -14.995 13.088 -30.207 658 HZ3 LYS 84 2HZ LYS 84 -15.080 14.026 -31.612 659 H LYS 85 H LYS 85 -13.861 19.574 -27.595 660 HA LYS 85 HA LYS 85 -15.606 20.251 -29.743 661 HB2 LYS 85 2HB LYS 85 -14.785 21.415 -27.192 662 HB3 LYS 85 3HB LYS 85 -15.046 22.625 -28.441 663 HG2 LYS 85 2HG LYS 85 -17.257 21.191 -28.807 664 HG3 LYS 85 3HG LYS 85 -16.976 20.828 -27.103 665 HD2 LYS 85 2HD LYS 85 -16.559 23.567 -27.303 666 HD3 LYS 85 3HD LYS 85 -17.952 23.259 -28.343 667 HE2 LYS 85 2HE LYS 85 -17.746 22.189 -25.539 668 HE3 LYS 85 3HE LYS 85 -18.438 23.769 -25.904 669 HZ1 LYS 85 3HZ LYS 85 -19.442 21.101 -26.680 670 HZ2 LYS 85 1HZ LYS 85 -19.932 22.496 -27.503 671 HZ3 LYS 85 2HZ LYS 85 -20.251 22.334 -25.850 672 H LYS 86 H LYS 86 -12.311 21.162 -28.859 673 HA LYS 86 HA LYS 86 -10.693 22.333 -29.959 674 HB2 LYS 86 2HB LYS 86 -10.761 20.389 -31.406 675 HB3 LYS 86 3HB LYS 86 -12.109 21.066 -32.309 676 HG2 LYS 86 2HG LYS 86 -10.032 21.291 -33.542 677 HG3 LYS 86 3HG LYS 86 -10.678 22.874 -33.105 678 HD2 LYS 86 2HD LYS 86 -8.951 23.343 -31.720 679 HD3 LYS 86 3HD LYS 86 -8.798 21.671 -31.175 680 HE2 LYS 86 2HE LYS 86 -7.131 21.306 -32.598 681 HE3 LYS 86 3HE LYS 86 -8.107 21.869 -33.954 682 HZ1 LYS 86 3HZ LYS 86 -7.479 24.189 -32.885 683 HZ2 LYS 86 1HZ LYS 86 -6.479 23.420 -34.012 684 HZ3 LYS 86 2HZ LYS 86 -6.133 23.309 -32.360 685 H GLY 87 H GLY 87 -11.439 24.410 -29.363 686 HA2 GLY 87 2HA GLY 87 -11.660 26.298 -31.322 687 HA3 GLY 87 3HA GLY 87 -13.324 25.828 -31.006 688 H GLY 88 H GLY 88 -14.219 26.216 -28.919 689 HA2 GLY 88 2HA GLY 88 -12.864 28.439 -27.540 690 HA3 GLY 88 3HA GLY 88 -14.598 28.155 -27.542 691 H GLY 89 H GLY 89 -14.414 28.402 -25.206 692 HA2 GLY 89 2HA GLY 89 -12.942 26.472 -23.681 693 HA3 GLY 89 3HA GLY 89 -14.121 27.615 -23.056 694 H GLY 90 H GLY 90 -14.730 25.769 -21.683 695 HA2 GLY 90 2HA GLY 90 -16.337 23.756 -23.110 696 HA3 GLY 90 3HA GLY 90 -15.713 23.583 -21.477 697 H GLY 91 H GLY 91 -18.083 22.918 -21.277 698 HA2 GLY 91 2HA GLY 91 -19.524 24.323 -19.588 699 HA3 GLY 91 3HA GLY 91 -19.883 25.217 -21.058 700 H GLY 92 H GLY 92 -21.425 24.474 -22.417 701 HA2 GLY 92 2HA GLY 92 -23.085 22.317 -21.484 702 HA3 GLY 92 3HA GLY 92 -23.364 23.310 -22.907 703 H GLY 93 H GLY 93 -24.023 20.894 -23.416 704 HA2 GLY 93 2HA GLY 93 -22.325 20.007 -25.455 705 HA3 GLY 93 3HA GLY 93 -22.002 19.027 -24.033 706 H GLY 94 H GLY 94 -22.919 17.106 -24.383 707 HA2 GLY 94 2HA GLY 94 -25.084 15.959 -24.095 708 HA3 GLY 94 3HA GLY 94 -25.741 17.096 -25.263 709 H GLY 95 H GLY 95 -26.385 15.717 -26.844 710 HA2 GLY 95 2HA GLY 95 -25.980 14.638 -28.872 711 HA3 GLY 95 3HA GLY 95 -24.281 14.518 -28.441 712 H GLY 96 H GLY 96 -23.785 12.420 -28.602 713 HA2 GLY 96 2HA GLY 96 -23.970 10.452 -26.959 714 HA3 GLY 96 3HA GLY 96 -25.656 10.457 -27.452 715 H VAL 97 H VAL 97 -24.824 11.235 -30.231 716 HA VAL 97 HA VAL 97 -23.952 8.554 -31.090 717 HB VAL 97 HB VAL 97 -25.093 9.149 -33.273 718 HG11 VAL 97 1HG1 VAL 97 -26.786 8.923 -30.786 719 HG12 VAL 97 2HG1 VAL 97 -27.332 8.584 -32.430 720 HG13 VAL 97 3HG1 VAL 97 -26.076 7.589 -31.694 721 HG21 VAL 97 3HG2 VAL 97 -25.224 11.657 -32.268 722 HG22 VAL 97 1HG2 VAL 97 -26.275 11.047 -33.547 723 HG23 VAL 97 2HG2 VAL 97 -26.838 11.063 -31.876 724 H TRP 98 H TRP 98 -21.851 9.967 -30.506 725 HA TRP 98 HA TRP 98 -20.370 10.180 -32.842 726 HB2 TRP 98 2HB TRP 98 -21.343 12.124 -33.608 727 HB3 TRP 98 3HB TRP 98 -21.697 12.712 -31.986 728 HD1 TRP 98 HD1 TRP 98 -20.271 14.717 -31.315 729 HE1 TRP 98 HE1 TRP 98 -17.946 15.629 -31.936 730 HE3 TRP 98 HE3 TRP 98 -18.788 11.034 -34.537 731 HZ2 TRP 98 HZ2 TRP 98 -15.771 14.887 -33.575 732 HZ3 TRP 98 HZ3 TRP 98 -16.571 11.211 -35.589 733 HH2 TRP 98 HH2 TRP 98 -15.096 13.098 -35.118 734 HA PRO 99 HA PRO 99 -17.858 12.164 -29.223 735 HB2 PRO 99 2HB PRO 99 -19.188 12.654 -26.907 736 HB3 PRO 99 3HB PRO 99 -19.066 13.838 -28.213 737 HG2 PRO 99 2HG PRO 99 -21.320 11.986 -27.541 738 HG3 PRO 99 3HG PRO 99 -21.378 13.695 -28.012 739 HD2 PRO 99 2HD PRO 99 -21.894 11.686 -29.753 740 HD3 PRO 99 3HD PRO 99 -21.145 13.216 -30.254 741 H LEU 100 H LEU 100 -17.805 9.629 -29.688 742 HA LEU 100 HA LEU 100 -18.449 8.089 -27.300 743 HB2 LEU 100 2HB LEU 100 -17.801 6.149 -28.599 744 HB3 LEU 100 3HB LEU 100 -18.959 7.137 -29.487 745 HG LEU 100 HG LEU 100 -16.480 8.035 -30.361 746 HD11 LEU 100 1HD1 LEU 100 -15.222 6.264 -29.492 747 HD12 LEU 100 2HD1 LEU 100 -15.509 5.820 -31.174 748 HD13 LEU 100 3HD1 LEU 100 -16.459 5.071 -29.890 749 HD21 LEU 100 3HD2 LEU 100 -18.398 6.052 -31.579 750 HD22 LEU 100 1HD2 LEU 100 -17.119 6.893 -32.456 751 HD23 LEU 100 2HD2 LEU 100 -18.447 7.808 -31.741 752 H VAL 101 H VAL 101 -15.798 9.717 -28.710 753 HA VAL 101 HA VAL 101 -13.716 8.145 -27.524 754 HB VAL 101 HB VAL 101 -12.230 10.022 -28.151 755 HG11 VAL 101 1HG1 VAL 101 -13.182 9.971 -30.699 756 HG12 VAL 101 2HG1 VAL 101 -12.215 8.692 -29.961 757 HG13 VAL 101 3HG1 VAL 101 -13.974 8.559 -30.000 758 HG21 VAL 101 3HG2 VAL 101 -13.313 12.017 -28.001 759 HG22 VAL 101 1HG2 VAL 101 -13.547 11.719 -29.724 760 HG23 VAL 101 2HG2 VAL 101 -14.842 11.358 -28.583 761 H ILE 102 H ILE 102 -15.337 11.191 -26.723 762 HA ILE 102 HA ILE 102 -13.790 11.989 -24.566 763 HB ILE 102 HB ILE 102 -15.932 13.044 -23.692 764 HG12 ILE 102 2HG1 ILE 102 -17.526 12.959 -25.955 765 HG13 ILE 102 3HG1 ILE 102 -16.996 11.290 -25.772 766 HG21 ILE 102 1HG2 ILE 102 -14.456 14.352 -25.008 767 HG22 ILE 102 2HG2 ILE 102 -14.953 13.543 -26.492 768 HG23 ILE 102 3HG2 ILE 102 -16.075 14.615 -25.655 769 HD11 ILE 102 3HD1 ILE 102 -18.726 11.098 -24.386 770 HD12 ILE 102 1HD1 ILE 102 -17.711 11.950 -23.223 771 HD13 ILE 102 2HD1 ILE 102 -18.883 12.844 -24.191 772 H ARG 103 H ARG 103 -16.655 9.879 -24.563 773 HA ARG 103 HA ARG 103 -16.944 9.420 -21.877 774 HB2 ARG 103 2HB ARG 103 -18.178 7.519 -22.424 775 HB3 ARG 103 3HB ARG 103 -18.291 8.497 -23.881 776 HG2 ARG 103 2HG ARG 103 -17.775 6.526 -24.852 777 HG3 ARG 103 3HG ARG 103 -16.131 7.071 -24.514 778 HD2 ARG 103 2HD ARG 103 -16.539 5.857 -22.224 779 HD3 ARG 103 3HD ARG 103 -17.765 4.987 -23.144 780 HE ARG 103 HE ARG 103 -15.485 4.865 -24.669 781 HH11 ARG 103 1HH1 ARG 103 -16.407 3.909 -21.451 782 HH12 ARG 103 2HH1 ARG 103 -15.306 2.572 -21.393 783 HH21 ARG 103 1HH2 ARG 103 -14.033 3.108 -24.605 784 HH22 ARG 103 2HH2 ARG 103 -13.956 2.117 -23.187 785 H THR 104 H THR 104 -14.509 8.142 -24.038 786 HA THR 104 HA THR 104 -13.521 6.045 -22.486 787 HB THR 104 HB THR 104 -11.663 7.779 -24.080 788 HG1 THR 104 HG1 THR 104 -13.865 6.296 -25.006 789 HG21 THR 104 3HG2 THR 104 -11.950 4.805 -23.651 790 HG22 THR 104 1HG2 THR 104 -10.682 5.854 -23.018 791 HG23 THR 104 2HG2 THR 104 -10.786 5.542 -24.751 792 H VAL 105 H VAL 105 -12.904 9.504 -22.326 793 HA VAL 105 HA VAL 105 -10.847 9.198 -20.310 794 HB VAL 105 HB VAL 105 -12.044 11.863 -20.785 795 HG11 VAL 105 1HG1 VAL 105 -10.085 11.583 -19.372 796 HG12 VAL 105 2HG1 VAL 105 -9.212 10.825 -20.705 797 HG13 VAL 105 3HG1 VAL 105 -9.681 12.523 -20.808 798 HG21 VAL 105 3HG2 VAL 105 -12.182 11.214 -23.025 799 HG22 VAL 105 1HG2 VAL 105 -10.615 12.015 -22.912 800 HG23 VAL 105 2HG2 VAL 105 -10.705 10.254 -22.935 801 H ILE 106 H ILE 106 -14.256 9.921 -20.479 802 HA ILE 106 HA ILE 106 -14.488 10.911 -17.807 803 HB ILE 106 HB ILE 106 -16.855 9.696 -19.117 804 HG12 ILE 106 2HG1 ILE 106 -15.672 10.648 -21.038 805 HG13 ILE 106 3HG1 ILE 106 -17.101 11.603 -20.656 806 HG21 ILE 106 1HG2 ILE 106 -16.242 11.714 -17.163 807 HG22 ILE 106 2HG2 ILE 106 -17.282 12.371 -18.426 808 HG23 ILE 106 3HG2 ILE 106 -17.784 10.939 -17.528 809 HD11 ILE 106 3HD1 ILE 106 -14.278 12.342 -20.627 810 HD12 ILE 106 1HD1 ILE 106 -15.717 13.342 -20.825 811 HD13 ILE 106 2HD1 ILE 106 -15.181 12.877 -19.210 812 H ALA 107 H ALA 107 -14.315 7.790 -19.222 813 HA ALA 107 HA ALA 107 -15.787 6.186 -17.537 814 HB1 ALA 107 1HB ALA 107 -13.964 4.459 -17.960 815 HB2 ALA 107 2HB ALA 107 -14.756 5.153 -19.375 816 HB3 ALA 107 3HB ALA 107 -13.153 5.712 -18.900 817 H GLY 108 H GLY 108 -12.958 8.024 -16.813 818 HA2 GLY 108 2HA GLY 108 -12.436 6.529 -14.355 819 HA3 GLY 108 3HA GLY 108 -11.458 7.838 -15.002 820 H TYR 109 H TYR 109 -13.942 9.474 -15.408 821 HA TYR 109 HA TYR 109 -13.818 11.056 -13.154 822 HB2 TYR 109 2HB TYR 109 -15.168 12.347 -14.380 823 HB3 TYR 109 3HB TYR 109 -15.288 11.039 -15.552 824 HD1 TYR 109 HD2 TYR 109 -16.860 12.422 -12.485 825 HD2 TYR 109 HD1 TYR 109 -17.325 9.921 -15.896 826 HE1 TYR 109 HE2 TYR 109 -19.263 12.216 -12.000 827 HE2 TYR 109 HE1 TYR 109 -19.729 9.710 -15.421 828 HH TYR 109 HH TYR 109 -21.440 11.627 -13.708 829 H ASN 110 H ASN 110 -16.053 8.400 -13.854 830 HA ASN 110 HA ASN 110 -17.730 8.659 -11.645 831 HB2 ASN 110 2HB ASN 110 -17.597 6.949 -13.758 832 HB3 ASN 110 3HB ASN 110 -17.090 5.891 -12.444 833 HD21 ASN 110 1HD2 ASN 110 -19.688 7.546 -13.923 834 HD22 ASN 110 2HD2 ASN 110 -20.937 7.004 -12.859 835 H LEU 111 H LEU 111 -14.453 7.698 -11.808 836 HA LEU 111 HA LEU 111 -14.470 6.203 -9.335 837 HB2 LEU 111 2HB LEU 111 -12.774 6.380 -11.533 838 HB3 LEU 111 3HB LEU 111 -11.865 7.109 -10.211 839 HG LEU 111 HG LEU 111 -11.391 4.701 -10.534 840 HD11 LEU 111 1HD1 LEU 111 -12.413 4.299 -7.972 841 HD12 LEU 111 2HD1 LEU 111 -12.131 6.035 -8.091 842 HD13 LEU 111 3HD1 LEU 111 -10.813 4.905 -8.401 843 HD21 LEU 111 3HD2 LEU 111 -14.128 4.146 -9.441 844 HD22 LEU 111 1HD2 LEU 111 -12.982 3.031 -10.185 845 HD23 LEU 111 2HD2 LEU 111 -13.827 4.218 -11.178 846 H TYR 112 H TYR 112 -13.766 9.454 -10.406 847 HA TYR 112 HA TYR 112 -12.246 10.555 -8.470 848 HB2 TYR 112 2HB TYR 112 -14.791 11.723 -9.611 849 HB3 TYR 112 3HB TYR 112 -13.578 12.644 -8.728 850 HD1 TYR 112 HD1 TYR 112 -11.564 10.475 -10.316 851 HD2 TYR 112 HD2 TYR 112 -14.234 13.639 -11.298 852 HE1 TYR 112 HE1 TYR 112 -10.331 10.858 -12.410 853 HE2 TYR 112 HE2 TYR 112 -13.010 14.029 -13.395 854 HH TYR 112 HH TYR 112 -11.449 13.210 -14.796 855 H ARG 113 H ARG 113 -15.768 10.093 -8.189 856 HA ARG 113 HA ARG 113 -15.742 10.829 -5.400 857 HB2 ARG 113 2HB ARG 113 -17.841 9.996 -7.363 858 HB3 ARG 113 3HB ARG 113 -18.198 9.930 -5.643 859 HG2 ARG 113 2HG ARG 113 -17.803 12.279 -5.406 860 HG3 ARG 113 3HG ARG 113 -17.223 12.393 -7.069 861 HD2 ARG 113 2HD ARG 113 -19.298 12.521 -7.894 862 HD3 ARG 113 3HD ARG 113 -19.878 11.213 -6.864 863 HE ARG 113 HE ARG 113 -19.481 13.664 -5.437 864 HH11 ARG 113 1HH1 ARG 113 -21.688 11.885 -7.458 865 HH12 ARG 113 2HH1 ARG 113 -23.096 12.703 -6.864 866 HH21 ARG 113 1HH2 ARG 113 -21.326 14.747 -4.647 867 HH22 ARG 113 2HH2 ARG 113 -22.889 14.331 -5.266 868 H ALA 114 H ALA 114 -15.560 7.923 -7.270 869 HA ALA 114 HA ALA 114 -16.505 5.987 -5.558 870 HB1 ALA 114 1HB ALA 114 -15.047 4.432 -6.668 871 HB2 ALA 114 2HB ALA 114 -15.648 5.593 -7.852 872 HB3 ALA 114 3HB ALA 114 -14.006 5.742 -7.225 873 H ILE 115 H ILE 115 -13.369 7.618 -5.494 874 HA ILE 115 HA ILE 115 -12.422 6.063 -3.260 875 HB ILE 115 HB ILE 115 -11.286 8.564 -4.516 876 HG12 ILE 115 2HG1 ILE 115 -11.288 6.701 -6.072 877 HG13 ILE 115 3HG1 ILE 115 -9.644 6.986 -5.511 878 HG21 ILE 115 1HG2 ILE 115 -10.506 6.979 -2.169 879 HG22 ILE 115 2HG2 ILE 115 -9.201 7.338 -3.298 880 HG23 ILE 115 3HG2 ILE 115 -10.137 8.652 -2.585 881 HD11 ILE 115 3HD1 ILE 115 -10.705 5.120 -3.738 882 HD12 ILE 115 1HD1 ILE 115 -11.255 4.616 -5.336 883 HD13 ILE 115 2HD1 ILE 115 -9.532 4.834 -5.023 884 H LYS 116 H LYS 116 -14.266 8.919 -3.704 885 HA LYS 116 HA LYS 116 -13.648 10.124 -1.173 886 HB2 LYS 116 2HB LYS 116 -14.397 11.753 -2.592 887 HB3 LYS 116 3HB LYS 116 -15.508 10.671 -3.422 888 HG2 LYS 116 2HG LYS 116 -17.163 10.932 -1.799 889 HG3 LYS 116 3HG LYS 116 -16.026 11.578 -0.614 890 HD2 LYS 116 2HD LYS 116 -16.423 13.655 -1.303 891 HD3 LYS 116 3HD LYS 116 -16.011 13.221 -2.964 892 HE2 LYS 116 2HE LYS 116 -18.167 13.039 -3.580 893 HE3 LYS 116 3HE LYS 116 -18.642 12.282 -2.061 894 HZ1 LYS 116 3HZ LYS 116 -18.527 15.124 -2.764 895 HZ2 LYS 116 1HZ LYS 116 -18.230 14.687 -1.157 896 HZ3 LYS 116 2HZ LYS 116 -19.699 14.278 -1.887 897 H LYS 117 H LYS 117 -15.926 7.782 -2.348 898 HA LYS 117 HA LYS 117 -17.717 7.963 -0.115 899 HB2 LYS 117 2HB LYS 117 -17.384 6.077 -2.422 900 HB3 LYS 117 3HB LYS 117 -18.428 5.637 -1.076 901 HG2 LYS 117 2HG LYS 117 -19.912 7.383 -1.500 902 HG3 LYS 117 3HG LYS 117 -18.744 8.257 -2.494 903 HD2 LYS 117 2HD LYS 117 -18.864 6.278 -4.092 904 HD3 LYS 117 3HD LYS 117 -20.282 5.762 -3.175 905 HE2 LYS 117 2HE LYS 117 -21.585 7.380 -4.044 906 HE3 LYS 117 3HE LYS 117 -20.297 8.583 -3.996 907 HZ1 LYS 117 3HZ LYS 117 -19.481 7.908 -6.040 908 HZ2 LYS 117 1HZ LYS 117 -21.155 7.796 -6.262 909 HZ3 LYS 117 2HZ LYS 117 -20.244 6.399 -5.979 910 H LYS 118 H LYS 118 -15.014 5.881 -1.029 911 HA LYS 118 HA LYS 118 -15.289 4.160 1.246 912 HB2 LYS 118 2HB LYS 118 -13.196 4.518 -0.881 913 HB3 LYS 118 3HB LYS 118 -12.900 3.479 0.507 914 HG2 LYS 118 2HG LYS 118 -14.854 2.137 -0.075 915 HG3 LYS 118 3HG LYS 118 -15.160 3.183 -1.463 916 HD2 LYS 118 2HD LYS 118 -13.368 2.366 -2.645 917 HD3 LYS 118 3HD LYS 118 -12.476 1.918 -1.189 918 HE2 LYS 118 2HE LYS 118 -14.936 0.432 -1.376 919 HE3 LYS 118 3HE LYS 118 -13.986 0.245 -2.849 920 HZ1 LYS 118 3HZ LYS 118 -12.389 -0.895 -1.779 921 HZ2 LYS 118 1HZ LYS 118 -13.620 -1.226 -0.666 922 HZ3 LYS 118 2HZ LYS 118 -12.513 0.015 -0.359 Start of MODEL 16 1 H1 VAL 1 H VAL 1 -1.502 1.764 2.745 2 HA VAL 1 HA VAL 1 0.763 0.589 1.452 3 HB VAL 1 HB VAL 1 -1.242 -0.820 3.212 4 HG11 VAL 1 1HG1 VAL 1 0.145 -2.433 2.258 5 HG12 VAL 1 2HG1 VAL 1 1.567 -1.391 2.332 6 HG13 VAL 1 3HG1 VAL 1 0.910 -2.094 3.810 7 HG21 VAL 1 3HG2 VAL 1 -0.628 0.921 4.596 8 HG22 VAL 1 1HG2 VAL 1 0.604 -0.282 4.976 9 HG23 VAL 1 2HG2 VAL 1 0.983 1.055 3.891 10 H TRP 2 H TRP 2 -2.469 0.857 0.599 11 HA TRP 2 HA TRP 2 -2.250 -1.463 -1.206 12 HB2 TRP 2 2HB TRP 2 -4.751 -1.544 -1.157 13 HB3 TRP 2 3HB TRP 2 -3.994 -1.913 0.391 14 HD1 TRP 2 HD1 TRP 2 -6.508 0.350 -1.181 15 HE1 TRP 2 HE1 TRP 2 -7.368 2.050 0.550 16 HE3 TRP 2 HE3 TRP 2 -3.074 -0.453 2.520 17 HZ2 TRP 2 HZ2 TRP 2 -6.681 2.934 3.142 18 HZ3 TRP 2 HZ3 TRP 2 -3.245 0.861 4.593 19 HH2 TRP 2 HH2 TRP 2 -5.011 2.519 4.895 20 HA PRO 3 HA PRO 3 -2.462 2.395 -3.761 21 HB2 PRO 3 2HB PRO 3 -0.575 1.590 -5.539 22 HB3 PRO 3 3HB PRO 3 -0.179 2.411 -4.024 23 HG2 PRO 3 2HG PRO 3 -0.103 -0.511 -4.672 24 HG3 PRO 3 3HG PRO 3 1.071 0.466 -3.771 25 HD2 PRO 3 2HD PRO 3 -0.747 -1.124 -2.546 26 HD3 PRO 3 3HD PRO 3 -0.171 0.395 -1.830 27 H LEU 4 H LEU 4 -4.508 0.685 -3.912 28 HA LEU 4 HA LEU 4 -4.520 -0.569 -6.545 29 HB2 LEU 4 2HB LEU 4 -6.486 -1.664 -5.898 30 HB3 LEU 4 3HB LEU 4 -5.464 -1.658 -4.462 31 HG LEU 4 HG LEU 4 -6.922 0.561 -4.007 32 HD11 LEU 4 1HD1 LEU 4 -8.389 0.533 -5.805 33 HD12 LEU 4 2HD1 LEU 4 -9.318 -0.238 -4.521 34 HD13 LEU 4 3HD1 LEU 4 -8.557 -1.222 -5.771 35 HD21 LEU 4 3HD2 LEU 4 -7.829 -2.239 -3.351 36 HD22 LEU 4 1HD2 LEU 4 -8.201 -0.765 -2.456 37 HD23 LEU 4 2HD2 LEU 4 -6.545 -1.371 -2.506 38 H VAL 5 H VAL 5 -5.582 2.297 -4.973 39 HA VAL 5 HA VAL 5 -7.598 2.935 -6.953 40 HB VAL 5 HB VAL 5 -7.818 5.070 -5.752 41 HG11 VAL 5 1HG1 VAL 5 -8.372 2.479 -4.755 42 HG12 VAL 5 2HG1 VAL 5 -7.917 3.495 -3.385 43 HG13 VAL 5 3HG1 VAL 5 -9.241 3.981 -4.444 44 HG21 VAL 5 3HG2 VAL 5 -6.472 4.955 -3.445 45 HG22 VAL 5 1HG2 VAL 5 -5.316 4.127 -4.487 46 HG23 VAL 5 2HG2 VAL 5 -5.841 5.764 -4.880 47 H ILE 6 H ILE 6 -4.312 3.930 -6.129 48 HA ILE 6 HA ILE 6 -3.942 6.131 -7.702 49 HB ILE 6 HB ILE 6 -1.570 5.289 -8.053 50 HG12 ILE 6 2HG1 ILE 6 -1.406 3.306 -6.134 51 HG13 ILE 6 3HG1 ILE 6 -2.861 2.874 -7.026 52 HG21 ILE 6 1HG2 ILE 6 -1.746 6.716 -6.268 53 HG22 ILE 6 2HG2 ILE 6 -2.907 5.693 -5.424 54 HG23 ILE 6 3HG2 ILE 6 -1.201 5.250 -5.454 55 HD11 ILE 6 3HD1 ILE 6 -1.510 1.865 -8.464 56 HD12 ILE 6 1HD1 ILE 6 -1.039 3.475 -9.006 57 HD13 ILE 6 2HD1 ILE 6 -0.080 2.640 -7.783 58 H ARG 7 H ARG 7 -3.672 2.741 -8.744 59 HA ARG 7 HA ARG 7 -2.991 3.255 -11.414 60 HB2 ARG 7 2HB ARG 7 -3.947 0.938 -11.820 61 HB3 ARG 7 3HB ARG 7 -2.671 1.051 -10.615 62 HG2 ARG 7 2HG ARG 7 -4.258 0.898 -8.828 63 HG3 ARG 7 3HG ARG 7 -5.607 0.993 -9.961 64 HD2 ARG 7 2HD ARG 7 -3.557 -1.187 -10.154 65 HD3 ARG 7 3HD ARG 7 -4.929 -1.317 -9.055 66 HE ARG 7 HE ARG 7 -5.937 -0.648 -11.556 67 HH11 ARG 7 1HH1 ARG 7 -4.214 -3.281 -10.066 68 HH12 ARG 7 2HH1 ARG 7 -4.878 -4.485 -11.122 69 HH21 ARG 7 1HH2 ARG 7 -6.817 -2.223 -12.951 70 HH22 ARG 7 2HH2 ARG 7 -6.357 -3.881 -12.763 71 H THR 8 H THR 8 -6.128 2.938 -9.826 72 HA THR 8 HA THR 8 -7.830 2.816 -11.978 73 HB THR 8 HB THR 8 -8.549 4.665 -9.741 74 HG1 THR 8 HG1 THR 8 -8.379 1.833 -9.460 75 HG21 THR 8 3HG2 THR 8 -10.378 2.527 -10.203 76 HG22 THR 8 1HG2 THR 8 -9.912 3.211 -11.759 77 HG23 THR 8 2HG2 THR 8 -10.597 4.250 -10.510 78 H VAL 9 H VAL 9 -6.276 5.681 -10.601 79 HA VAL 9 HA VAL 9 -7.594 7.559 -12.274 80 HB VAL 9 HB VAL 9 -4.876 7.996 -11.064 81 HG11 VAL 9 1HG1 VAL 9 -5.829 9.722 -12.556 82 HG12 VAL 9 2HG1 VAL 9 -7.213 9.859 -11.469 83 HG13 VAL 9 3HG1 VAL 9 -5.599 10.292 -10.903 84 HG21 VAL 9 3HG2 VAL 9 -6.043 7.087 -9.239 85 HG22 VAL 9 1HG2 VAL 9 -6.197 8.833 -9.049 86 HG23 VAL 9 2HG2 VAL 9 -7.545 7.894 -9.688 87 H ILE 10 H ILE 10 -4.407 5.998 -12.435 88 HA ILE 10 HA ILE 10 -3.502 7.291 -14.756 89 HB ILE 10 HB ILE 10 -2.638 4.495 -14.429 90 HG12 ILE 10 2HG1 ILE 10 -3.118 5.049 -12.092 91 HG13 ILE 10 3HG1 ILE 10 -1.381 4.947 -12.362 92 HG21 ILE 10 1HG2 ILE 10 -1.617 6.995 -15.350 93 HG22 ILE 10 2HG2 ILE 10 -0.545 6.358 -14.103 94 HG23 ILE 10 3HG2 ILE 10 -0.924 5.383 -15.522 95 HD11 ILE 10 3HD1 ILE 10 -1.910 7.602 -12.792 96 HD12 ILE 10 1HD1 ILE 10 -3.008 7.184 -11.478 97 HD13 ILE 10 2HD1 ILE 10 -1.276 6.898 -11.305 98 H ALA 11 H ALA 11 -5.790 4.753 -14.305 99 HA ALA 11 HA ALA 11 -5.710 3.302 -16.624 100 HB1 ALA 11 1HB ALA 11 -8.118 2.968 -16.374 101 HB2 ALA 11 2HB ALA 11 -7.289 2.859 -14.820 102 HB3 ALA 11 3HB ALA 11 -8.190 4.316 -15.239 103 H GLY 12 H GLY 12 -6.584 6.638 -16.234 104 HA2 GLY 12 2HA GLY 12 -7.730 6.790 -18.917 105 HA3 GLY 12 3HA GLY 12 -7.670 8.091 -17.736 106 H TYR 13 H TYR 13 -4.747 7.427 -17.289 107 HA TYR 13 HA TYR 13 -3.592 9.415 -18.787 108 HB2 TYR 13 2HB TYR 13 -1.738 8.854 -17.654 109 HB3 TYR 13 3HB TYR 13 -2.706 7.589 -16.904 110 HD1 TYR 13 HD2 TYR 13 -0.526 8.247 -19.852 111 HD2 TYR 13 HD1 TYR 13 -2.097 5.354 -17.157 112 HE1 TYR 13 HE2 TYR 13 0.958 6.543 -20.824 113 HE2 TYR 13 HE1 TYR 13 -0.616 3.643 -18.120 114 HH TYR 13 HH TYR 13 1.409 3.456 -19.375 115 H ASN 14 H ASN 14 -3.709 5.948 -19.552 116 HA ASN 14 HA ASN 14 -2.194 5.862 -21.832 117 HB2 ASN 14 2HB ASN 14 -3.689 4.047 -20.563 118 HB3 ASN 14 3HB ASN 14 -4.777 4.384 -21.907 119 HD21 ASN 14 1HD2 ASN 14 -4.246 2.029 -22.202 120 HD22 ASN 14 2HD2 ASN 14 -2.898 1.657 -23.217 121 H LEU 15 H LEU 15 -5.200 7.460 -21.367 122 HA LEU 15 HA LEU 15 -5.648 7.747 -24.243 123 HB2 LEU 15 2HB LEU 15 -7.358 7.499 -22.067 124 HB3 LEU 15 3HB LEU 15 -7.481 9.195 -22.531 125 HG LEU 15 HG LEU 15 -9.215 7.770 -23.561 126 HD11 LEU 15 1HD1 LEU 15 -8.316 8.413 -26.035 127 HD12 LEU 15 2HD1 LEU 15 -7.314 9.457 -25.028 128 HD13 LEU 15 3HD1 LEU 15 -9.071 9.550 -24.918 129 HD21 LEU 15 3HD2 LEU 15 -7.234 6.593 -25.424 130 HD22 LEU 15 1HD2 LEU 15 -8.783 5.962 -24.864 131 HD23 LEU 15 2HD2 LEU 15 -7.365 5.872 -23.819 132 H TYR 16 H TYR 16 -4.733 9.578 -21.404 133 HA TYR 16 HA TYR 16 -5.050 12.175 -22.164 134 HB2 TYR 16 2HB TYR 16 -3.706 12.653 -20.416 135 HB3 TYR 16 3HB TYR 16 -3.707 10.914 -20.143 136 HD1 TYR 16 HD2 TYR 16 -1.861 13.481 -22.138 137 HD2 TYR 16 HD1 TYR 16 -1.670 9.850 -19.928 138 HE1 TYR 16 HE2 TYR 16 0.581 13.440 -22.428 139 HE2 TYR 16 HE1 TYR 16 0.773 9.800 -20.210 140 HH TYR 16 HH TYR 16 2.614 11.612 -20.633 141 H ARG 17 H ARG 17 -2.474 9.973 -23.182 142 HA ARG 17 HA ARG 17 -1.286 12.008 -24.880 143 HB2 ARG 17 2HB ARG 17 -0.401 9.579 -23.658 144 HB3 ARG 17 3HB ARG 17 -0.162 9.451 -25.396 145 HG2 ARG 17 2HG ARG 17 0.696 12.013 -24.312 146 HG3 ARG 17 3HG ARG 17 1.551 10.636 -23.616 147 HD2 ARG 17 2HD ARG 17 1.257 10.371 -26.482 148 HD3 ARG 17 3HD ARG 17 2.070 11.875 -26.052 149 HE ARG 17 HE ARG 17 3.105 9.211 -25.787 150 HH11 ARG 17 1HH1 ARG 17 3.281 12.473 -24.583 151 HH12 ARG 17 2HH1 ARG 17 4.902 12.307 -23.995 152 HH21 ARG 17 1HH2 ARG 17 5.239 8.980 -25.017 153 HH22 ARG 17 2HH2 ARG 17 6.015 10.321 -24.243 154 H ALA 18 H ALA 18 -3.481 9.350 -25.123 155 HA ALA 18 HA ALA 18 -3.258 8.563 -27.754 156 HB1 ALA 18 1HB ALA 18 -5.880 8.957 -26.326 157 HB2 ALA 18 2HB ALA 18 -5.519 7.817 -27.623 158 HB3 ALA 18 3HB ALA 18 -4.793 7.599 -26.031 159 H ILE 19 H ILE 19 -4.723 11.474 -26.445 160 HA ILE 19 HA ILE 19 -5.878 12.290 -28.947 161 HB ILE 19 HB ILE 19 -5.424 13.842 -26.396 162 HG12 ILE 19 2HG1 ILE 19 -6.990 12.009 -26.095 163 HG13 ILE 19 3HG1 ILE 19 -7.871 13.533 -26.109 164 HG21 ILE 19 1HG2 ILE 19 -6.382 14.646 -29.044 165 HG22 ILE 19 2HG2 ILE 19 -7.441 15.109 -27.713 166 HG23 ILE 19 3HG2 ILE 19 -5.755 15.624 -27.717 167 HD11 ILE 19 3HD1 ILE 19 -7.648 11.587 -28.392 168 HD12 ILE 19 1HD1 ILE 19 -9.057 11.842 -27.363 169 HD13 ILE 19 2HD1 ILE 19 -8.505 13.127 -28.438 170 H LYS 20 H LYS 20 -2.810 12.585 -27.419 171 HA LYS 20 HA LYS 20 -1.926 14.926 -28.794 172 HB2 LYS 20 2HB LYS 20 -0.980 13.414 -26.688 173 HB3 LYS 20 3HB LYS 20 0.167 13.052 -27.972 174 HG2 LYS 20 2HG LYS 20 -0.572 15.824 -27.056 175 HG3 LYS 20 3HG LYS 20 0.867 14.935 -26.550 176 HD2 LYS 20 2HD LYS 20 0.756 14.866 -29.383 177 HD3 LYS 20 3HD LYS 20 0.485 16.534 -28.874 178 HE2 LYS 20 2HE LYS 20 2.729 16.634 -28.799 179 HE3 LYS 20 3HE LYS 20 2.536 15.817 -27.249 180 HZ1 LYS 20 3HZ LYS 20 3.209 14.606 -29.867 181 HZ2 LYS 20 1HZ LYS 20 2.712 13.684 -28.539 182 HZ3 LYS 20 2HZ LYS 20 4.131 14.599 -28.449 183 H LYS 21 H LYS 21 -1.627 11.450 -29.352 184 HA LYS 21 HA LYS 21 0.110 11.638 -31.581 185 HB2 LYS 21 2HB LYS 21 -1.234 9.570 -30.121 186 HB3 LYS 21 3HB LYS 21 -1.492 9.314 -31.841 187 HG2 LYS 21 2HG LYS 21 1.238 9.962 -31.475 188 HG3 LYS 21 3HG LYS 21 0.806 8.738 -30.279 189 HD2 LYS 21 2HD LYS 21 0.489 7.141 -31.842 190 HD3 LYS 21 3HD LYS 21 -0.231 8.267 -32.994 191 HE2 LYS 21 2HE LYS 21 2.160 9.191 -33.250 192 HE3 LYS 21 3HE LYS 21 2.667 7.689 -32.477 193 HZ1 LYS 21 3HZ LYS 21 1.420 8.095 -35.106 194 HZ2 LYS 21 1HZ LYS 21 1.170 6.630 -34.297 195 HZ3 LYS 21 2HZ LYS 21 2.740 7.126 -34.682 196 H LYS 22 H LYS 22 -3.401 11.563 -31.251 197 HA LYS 22 HA LYS 22 -5.094 11.902 -32.738 198 HB2 LYS 22 2HB LYS 22 -4.031 14.134 -32.763 199 HB3 LYS 22 3HB LYS 22 -3.014 13.621 -34.103 200 HG2 LYS 22 2HG LYS 22 -4.666 14.753 -35.209 201 HG3 LYS 22 3HG LYS 22 -5.298 13.106 -35.260 202 HD2 LYS 22 2HD LYS 22 -6.852 13.534 -33.551 203 HD3 LYS 22 3HD LYS 22 -6.025 15.011 -33.053 204 HE2 LYS 22 2HE LYS 22 -7.398 14.635 -35.711 205 HE3 LYS 22 3HE LYS 22 -8.139 15.405 -34.308 206 HZ1 LYS 22 3HZ LYS 22 -6.251 16.468 -36.185 207 HZ2 LYS 22 1HZ LYS 22 -5.774 16.712 -34.580 208 HZ3 LYS 22 2HZ LYS 22 -7.277 17.277 -35.111 209 H GLY 23 H GLY 23 -4.780 9.594 -33.342 210 HA2 GLY 23 2HA GLY 23 -5.313 8.838 -35.774 211 HA3 GLY 23 3HA GLY 23 -3.618 9.234 -36.015 212 H GLY 24 H GLY 24 -5.480 7.489 -33.516 213 HA2 GLY 24 2HA GLY 24 -4.218 4.994 -34.148 214 HA3 GLY 24 3HA GLY 24 -3.547 5.728 -32.699 215 H GLY 25 H GLY 25 -4.412 3.614 -31.836 216 HA2 GLY 25 2HA GLY 25 -7.292 3.836 -31.229 217 HA3 GLY 25 3HA GLY 25 -6.381 2.333 -31.222 218 H GLY 26 H GLY 26 -4.491 2.336 -29.610 219 HA2 GLY 26 2HA GLY 26 -5.256 3.791 -27.162 220 HA3 GLY 26 3HA GLY 26 -4.995 2.054 -27.118 221 H GLY 27 H GLY 27 -3.370 2.505 -25.499 222 HA2 GLY 27 2HA GLY 27 -1.166 2.636 -24.865 223 HA3 GLY 27 3HA GLY 27 -0.756 2.520 -26.570 224 H GLY 28 H GLY 28 0.929 4.021 -26.368 225 HA2 GLY 28 2HA GLY 28 0.161 6.729 -26.787 226 HA3 GLY 28 3HA GLY 28 0.834 6.517 -25.177 227 H GLY 29 H GLY 29 1.949 8.148 -27.224 228 HA2 GLY 29 2HA GLY 29 4.519 8.129 -27.110 229 HA3 GLY 29 3HA GLY 29 4.347 6.632 -28.015 230 H GLY 30 H GLY 30 4.950 9.856 -28.303 231 HA2 GLY 30 2HA GLY 30 4.669 9.758 -31.170 232 HA3 GLY 30 3HA GLY 30 3.558 10.882 -30.401 233 H GLY 31 H GLY 31 4.692 12.505 -31.688 234 HA2 GLY 31 2HA GLY 31 7.415 13.122 -30.823 235 HA3 GLY 31 3HA GLY 31 6.546 13.888 -32.144 236 H GLY 32 H GLY 32 5.998 15.928 -31.790 237 HA2 GLY 32 2HA GLY 32 4.708 16.805 -29.419 238 HA3 GLY 32 3HA GLY 32 6.398 17.290 -29.403 239 H VAL 33 H VAL 33 3.294 18.088 -30.428 240 HA VAL 33 HA VAL 33 4.369 20.153 -32.239 241 HB VAL 33 HB VAL 33 2.072 20.170 -33.282 242 HG11 VAL 33 1HG1 VAL 33 4.280 18.704 -33.884 243 HG12 VAL 33 2HG1 VAL 33 3.042 17.449 -33.799 244 HG13 VAL 33 3HG1 VAL 33 2.842 18.814 -34.899 245 HG21 VAL 33 3HG2 VAL 33 0.800 19.076 -31.565 246 HG22 VAL 33 1HG2 VAL 33 0.753 18.073 -33.015 247 HG23 VAL 33 2HG2 VAL 33 1.808 17.633 -31.672 248 H TRP 34 H TRP 34 1.974 19.384 -29.765 249 HA TRP 34 HA TRP 34 2.147 21.921 -28.553 250 HB2 TRP 34 2HB TRP 34 0.880 22.602 -30.575 251 HB3 TRP 34 3HB TRP 34 -0.392 21.466 -30.134 252 HD1 TRP 34 HD1 TRP 34 1.040 23.266 -27.184 253 HE1 TRP 34 HE1 TRP 34 -0.604 25.075 -26.381 254 HE3 TRP 34 HE3 TRP 34 -2.199 23.232 -31.139 255 HZ2 TRP 34 HZ2 TRP 34 -2.963 26.323 -27.302 256 HZ3 TRP 34 HZ3 TRP 34 -4.124 24.763 -31.100 257 HH2 TRP 34 HH2 TRP 34 -4.497 26.276 -29.220 258 HA PRO 35 HA PRO 35 0.233 18.342 -26.212 259 HB2 PRO 35 2HB PRO 35 2.169 18.195 -24.314 260 HB3 PRO 35 3HB PRO 35 2.254 17.312 -25.843 261 HG2 PRO 35 2HG PRO 35 3.572 19.885 -25.067 262 HG3 PRO 35 3HG PRO 35 4.246 18.505 -25.954 263 HD2 PRO 35 2HD PRO 35 3.395 20.758 -27.192 264 HD3 PRO 35 3HD PRO 35 3.284 19.155 -27.945 265 H LEU 36 H LEU 36 -0.911 20.717 -26.062 266 HA LEU 36 HA LEU 36 -0.496 21.853 -23.408 267 HB2 LEU 36 2HB LEU 36 -0.786 23.583 -24.883 268 HB3 LEU 36 3HB LEU 36 -1.935 22.686 -25.874 269 HG LEU 36 HG LEU 36 -3.646 23.022 -24.109 270 HD11 LEU 36 1HD1 LEU 36 -2.475 25.233 -22.768 271 HD12 LEU 36 2HD1 LEU 36 -1.394 23.850 -22.604 272 HD13 LEU 36 3HD1 LEU 36 -3.075 23.721 -22.088 273 HD21 LEU 36 3HD2 LEU 36 -2.346 25.432 -25.358 274 HD22 LEU 36 1HD2 LEU 36 -3.895 25.496 -24.516 275 HD23 LEU 36 2HD2 LEU 36 -3.718 24.500 -25.960 276 H VAL 37 H VAL 37 -2.609 19.709 -25.077 277 HA VAL 37 HA VAL 37 -4.752 19.943 -23.135 278 HB VAL 37 HB VAL 37 -5.844 18.150 -24.419 279 HG11 VAL 37 1HG1 VAL 37 -4.820 20.597 -25.790 280 HG12 VAL 37 2HG1 VAL 37 -5.802 19.438 -26.689 281 HG13 VAL 37 3HG1 VAL 37 -6.453 20.214 -25.244 282 HG21 VAL 37 3HG2 VAL 37 -3.244 18.149 -25.930 283 HG22 VAL 37 1HG2 VAL 37 -4.053 16.795 -25.140 284 HG23 VAL 37 2HG2 VAL 37 -4.736 17.497 -26.607 285 H ILE 38 H ILE 38 -2.261 17.597 -24.048 286 HA ILE 38 HA ILE 38 -2.915 15.448 -22.487 287 HB ILE 38 HB ILE 38 -0.405 15.093 -22.224 288 HG12 ILE 38 2HG1 ILE 38 0.562 16.782 -24.197 289 HG13 ILE 38 3HG1 ILE 38 -0.475 17.832 -23.236 290 HG21 ILE 38 1HG2 ILE 38 -1.347 13.919 -23.971 291 HG22 ILE 38 2HG2 ILE 38 -1.850 15.380 -24.820 292 HG23 ILE 38 3HG2 ILE 38 -0.151 14.908 -24.809 293 HD11 ILE 38 3HD1 ILE 38 1.349 18.100 -21.979 294 HD12 ILE 38 1HD1 ILE 38 0.910 16.533 -21.300 295 HD13 ILE 38 2HD1 ILE 38 2.109 16.630 -22.590 296 H ARG 39 H ARG 39 -0.985 18.264 -21.470 297 HA ARG 39 HA ARG 39 -0.473 17.509 -18.857 298 HB2 ARG 39 2HB ARG 39 -0.447 20.024 -18.403 299 HB3 ARG 39 3HB ARG 39 0.642 19.424 -19.646 300 HG2 ARG 39 2HG ARG 39 -0.794 20.209 -21.383 301 HG3 ARG 39 3HG ARG 39 -2.057 20.619 -20.221 302 HD2 ARG 39 2HD ARG 39 -0.892 22.624 -20.903 303 HD3 ARG 39 3HD ARG 39 -0.547 22.282 -19.208 304 HE ARG 39 HE ARG 39 1.406 21.217 -21.029 305 HH11 ARG 39 1HH1 ARG 39 0.422 24.001 -19.185 306 HH12 ARG 39 2HH1 ARG 39 2.014 24.681 -19.116 307 HH21 ARG 39 1HH2 ARG 39 3.507 22.102 -20.945 308 HH22 ARG 39 2HH2 ARG 39 3.768 23.600 -20.118 309 H THR 40 H THR 40 -3.335 19.074 -20.210 310 HA THR 40 HA THR 40 -4.700 19.808 -17.947 311 HB THR 40 HB THR 40 -6.239 18.418 -20.100 312 HG1 THR 40 HG1 THR 40 -5.100 21.000 -20.461 313 HG21 THR 40 3HG2 THR 40 -6.743 20.325 -18.029 314 HG22 THR 40 1HG2 THR 40 -7.889 19.549 -19.121 315 HG23 THR 40 2HG2 THR 40 -7.107 21.058 -19.591 316 H VAL 41 H VAL 41 -4.501 16.585 -19.398 317 HA VAL 41 HA VAL 41 -6.300 15.366 -17.551 318 HB VAL 41 HB VAL 41 -4.176 13.878 -19.072 319 HG11 VAL 41 1HG1 VAL 41 -6.962 13.220 -18.133 320 HG12 VAL 41 2HG1 VAL 41 -6.021 12.189 -19.213 321 HG13 VAL 41 3HG1 VAL 41 -5.443 12.516 -17.579 322 HG21 VAL 41 3HG2 VAL 41 -5.901 13.747 -20.924 323 HG22 VAL 41 1HG2 VAL 41 -6.712 15.098 -20.133 324 HG23 VAL 41 2HG2 VAL 41 -5.069 15.291 -20.743 325 H ILE 42 H ILE 42 -2.790 15.694 -17.739 326 HA ILE 42 HA ILE 42 -2.170 13.983 -15.579 327 HB ILE 42 HB ILE 42 -0.414 16.321 -16.104 328 HG12 ILE 42 2HG1 ILE 42 -1.252 15.810 -18.345 329 HG13 ILE 42 3HG1 ILE 42 0.429 15.313 -18.189 330 HG21 ILE 42 1HG2 ILE 42 -0.218 13.640 -15.076 331 HG22 ILE 42 2HG2 ILE 42 0.948 13.898 -16.373 332 HG23 ILE 42 3HG2 ILE 42 0.938 14.969 -14.972 333 HD11 ILE 42 3HD1 ILE 42 -0.966 13.054 -17.473 334 HD12 ILE 42 1HD1 ILE 42 -1.931 13.740 -18.781 335 HD13 ILE 42 2HD1 ILE 42 -0.225 13.373 -19.042 336 H ALA 43 H ALA 43 -3.373 17.211 -15.729 337 HA ALA 43 HA ALA 43 -2.493 18.381 -13.407 338 HB1 ALA 43 1HB ALA 43 -4.643 19.601 -13.369 339 HB2 ALA 43 2HB ALA 43 -3.899 19.565 -14.968 340 HB3 ALA 43 3HB ALA 43 -5.258 18.502 -14.604 341 H GLY 44 H GLY 44 -4.559 15.637 -13.753 342 HA2 GLY 44 2HA GLY 44 -5.479 15.798 -10.983 343 HA3 GLY 44 3HA GLY 44 -5.999 14.624 -12.184 344 H TYR 45 H TYR 45 -3.106 14.152 -12.898 345 HA TYR 45 HA TYR 45 -2.659 11.827 -11.508 346 HB2 TYR 45 2HB TYR 45 -0.879 11.681 -12.861 347 HB3 TYR 45 3HB TYR 45 -1.312 13.276 -13.468 348 HD1 TYR 45 HD2 TYR 45 0.721 11.555 -10.875 349 HD2 TYR 45 HD1 TYR 45 0.127 15.098 -13.155 350 HE1 TYR 45 HE2 TYR 45 2.854 12.447 -10.035 351 HE2 TYR 45 HE1 TYR 45 2.259 15.999 -12.322 352 HH TYR 45 HH TYR 45 3.827 15.735 -10.613 353 H ASN 46 H ASN 46 -1.404 15.061 -10.755 354 HA ASN 46 HA ASN 46 0.242 14.479 -8.631 355 HB2 ASN 46 2HB ASN 46 -0.640 16.777 -9.786 356 HB3 ASN 46 3HB ASN 46 -1.468 16.852 -8.233 357 HD21 ASN 46 1HD2 ASN 46 1.656 16.631 -9.797 358 HD22 ASN 46 2HD2 ASN 46 2.576 17.244 -8.469 359 H LEU 47 H LEU 47 -3.187 14.242 -8.800 360 HA LEU 47 HA LEU 47 -3.478 14.111 -5.899 361 HB2 LEU 47 2HB LEU 47 -5.128 14.991 -7.940 362 HB3 LEU 47 3HB LEU 47 -5.834 13.448 -7.463 363 HG LEU 47 HG LEU 47 -6.869 15.357 -6.313 364 HD11 LEU 47 1HD1 LEU 47 -5.719 14.283 -3.952 365 HD12 LEU 47 2HD1 LEU 47 -5.838 12.989 -5.144 366 HD13 LEU 47 3HD1 LEU 47 -7.275 13.906 -4.692 367 HD21 LEU 47 3HD2 LEU 47 -5.735 16.942 -5.186 368 HD22 LEU 47 1HD2 LEU 47 -4.392 16.435 -6.211 369 HD23 LEU 47 2HD2 LEU 47 -4.538 15.800 -4.572 370 H TYR 48 H TYR 48 -3.534 12.058 -8.735 371 HA TYR 48 HA TYR 48 -4.731 9.770 -7.859 372 HB2 TYR 48 2HB TYR 48 -3.832 8.834 -9.700 373 HB3 TYR 48 3HB TYR 48 -3.176 10.437 -10.018 374 HD1 TYR 48 HD2 TYR 48 -2.313 7.377 -8.046 375 HD2 TYR 48 HD1 TYR 48 -0.922 10.585 -10.470 376 HE1 TYR 48 HE2 TYR 48 -0.034 6.458 -7.943 377 HE2 TYR 48 HE1 TYR 48 1.361 9.675 -10.374 378 HH TYR 48 HH TYR 48 2.706 8.178 -9.353 379 H ARG 49 H ARG 49 -1.462 10.879 -7.104 380 HA ARG 49 HA ARG 49 -0.953 8.545 -5.451 381 HB2 ARG 49 2HB ARG 49 0.657 10.366 -6.867 382 HB3 ARG 49 3HB ARG 49 1.010 10.638 -5.166 383 HG2 ARG 49 2HG ARG 49 1.813 8.486 -4.854 384 HG3 ARG 49 3HG ARG 49 0.987 7.867 -6.285 385 HD2 ARG 49 2HD ARG 49 3.133 7.988 -7.072 386 HD3 ARG 49 3HD ARG 49 2.543 9.587 -7.523 387 HE ARG 49 HE ARG 49 3.722 9.607 -4.936 388 HH11 ARG 49 1HH1 ARG 49 4.478 9.565 -8.334 389 HH12 ARG 49 2HH1 ARG 49 6.015 10.338 -8.135 390 HH21 ARG 49 1HH2 ARG 49 5.744 10.626 -4.661 391 HH22 ARG 49 2HH2 ARG 49 6.735 10.940 -6.045 392 H ALA 50 H ALA 50 -2.016 11.815 -5.110 393 HA ALA 50 HA ALA 50 -1.314 12.467 -2.530 394 HB1 ALA 50 1HB ALA 50 -4.017 13.028 -3.735 395 HB2 ALA 50 2HB ALA 50 -3.172 13.965 -2.502 396 HB3 ALA 50 3HB ALA 50 -2.550 13.915 -4.151 397 H ILE 51 H ILE 51 -3.814 10.261 -3.631 398 HA ILE 51 HA ILE 51 -4.919 9.893 -0.992 399 HB ILE 51 HB ILE 51 -5.401 8.380 -3.561 400 HG12 ILE 51 2HG1 ILE 51 -6.189 10.674 -3.675 401 HG13 ILE 51 3HG1 ILE 51 -7.569 9.592 -3.528 402 HG21 ILE 51 1HG2 ILE 51 -6.264 7.892 -0.803 403 HG22 ILE 51 2HG2 ILE 51 -7.566 7.898 -1.991 404 HG23 ILE 51 3HG2 ILE 51 -6.202 6.799 -2.185 405 HD11 ILE 51 3HD1 ILE 51 -8.269 10.828 -1.838 406 HD12 ILE 51 1HD1 ILE 51 -6.869 10.285 -0.913 407 HD13 ILE 51 2HD1 ILE 51 -6.781 11.775 -1.854 408 H LYS 52 H LYS 52 -2.382 8.532 -2.861 409 HA LYS 52 HA LYS 52 -2.302 5.982 -1.561 410 HB2 LYS 52 2HB LYS 52 -1.216 5.778 -3.549 411 HB3 LYS 52 3HB LYS 52 -0.660 7.446 -3.539 412 HG2 LYS 52 2HG LYS 52 1.214 6.952 -2.275 413 HG3 LYS 52 3HG LYS 52 0.521 5.453 -1.652 414 HD2 LYS 52 2HD LYS 52 0.577 4.682 -4.122 415 HD3 LYS 52 3HD LYS 52 1.720 6.009 -4.342 416 HE2 LYS 52 2HE LYS 52 2.369 4.437 -2.006 417 HE3 LYS 52 3HE LYS 52 2.284 3.429 -3.450 418 HZ1 LYS 52 3HZ LYS 52 4.131 5.605 -2.809 419 HZ2 LYS 52 1HZ LYS 52 3.699 5.394 -4.431 420 HZ3 LYS 52 2HZ LYS 52 4.428 4.128 -3.578 421 H LYS 53 H LYS 53 -0.732 9.097 -1.096 422 HA LYS 53 HA LYS 53 1.135 8.216 0.856 423 HB2 LYS 53 2HB LYS 53 0.035 10.945 0.183 424 HB3 LYS 53 3HB LYS 53 1.272 10.686 1.406 425 HG2 LYS 53 2HG LYS 53 2.894 10.309 -0.118 426 HG3 LYS 53 3HG LYS 53 1.798 9.516 -1.251 427 HD2 LYS 53 2HD LYS 53 1.241 11.460 -2.281 428 HD3 LYS 53 3HD LYS 53 1.367 12.407 -0.797 429 HE2 LYS 53 2HE LYS 53 3.411 13.074 -1.352 430 HE3 LYS 53 3HE LYS 53 3.950 11.402 -1.507 431 HZ1 LYS 53 3HZ LYS 53 3.094 11.394 -3.780 432 HZ2 LYS 53 1HZ LYS 53 4.269 12.592 -3.568 433 HZ3 LYS 53 2HZ LYS 53 2.633 13.014 -3.625 434 H LYS 54 H LYS 54 -2.122 9.560 1.019 435 HA LYS 54 HA LYS 54 -2.117 9.600 3.910 436 HB2 LYS 54 2HB LYS 54 -4.252 10.162 1.852 437 HB3 LYS 54 3HB LYS 54 -4.550 10.223 3.584 438 HG2 LYS 54 2HG LYS 54 -3.140 12.070 3.876 439 HG3 LYS 54 3HG LYS 54 -2.385 11.850 2.295 440 HD2 LYS 54 2HD LYS 54 -3.836 13.324 1.476 441 HD3 LYS 54 3HD LYS 54 -5.120 12.152 1.784 442 HE2 LYS 54 2HE LYS 54 -5.176 13.085 4.153 443 HE3 LYS 54 3HE LYS 54 -4.184 14.406 3.540 444 HZ1 LYS 54 3HZ LYS 54 -5.890 15.251 2.330 445 HZ2 LYS 54 1HZ LYS 54 -6.798 14.533 3.564 446 HZ3 LYS 54 2HZ LYS 54 -6.626 13.750 2.074 447 H GLY 55 H GLY 55 -4.495 8.143 1.694 448 HA2 GLY 55 2HA GLY 55 -4.521 5.597 1.803 449 HA3 GLY 55 3HA GLY 55 -4.633 5.845 3.539 450 H GLY 56 H GLY 56 -6.442 4.788 1.214 451 HA2 GLY 56 2HA GLY 56 -8.891 5.803 2.417 452 HA3 GLY 56 3HA GLY 56 -8.682 6.140 0.705 453 H GLY 57 H GLY 57 -10.329 4.219 2.634 454 HA2 GLY 57 2HA GLY 57 -10.131 1.918 0.791 455 HA3 GLY 57 3HA GLY 57 -10.371 1.710 2.519 456 H GLY 58 H GLY 58 -12.012 0.962 0.109 457 HA2 GLY 58 2HA GLY 58 -14.527 1.031 1.111 458 HA3 GLY 58 3HA GLY 58 -14.387 2.593 0.317 459 H GLY 59 H GLY 59 -15.662 2.397 -1.432 460 HA2 GLY 59 2HA GLY 59 -15.174 1.598 -3.826 461 HA3 GLY 59 3HA GLY 59 -15.337 0.000 -3.114 462 H GLY 60 H GLY 60 -17.102 3.078 -3.425 463 HA2 GLY 60 2HA GLY 60 -19.553 1.485 -3.830 464 HA3 GLY 60 3HA GLY 60 -19.551 2.879 -2.760 465 H GLY 61 H GLY 61 -19.776 4.901 -3.598 466 HA2 GLY 61 2HA GLY 61 -19.185 6.139 -5.818 467 HA3 GLY 61 3HA GLY 61 -20.370 5.016 -6.470 468 H GLY 62 H GLY 62 -19.915 8.058 -5.174 469 HA2 GLY 62 2HA GLY 62 -22.754 8.576 -5.200 470 HA3 GLY 62 3HA GLY 62 -22.034 8.690 -3.601 471 H GLY 63 H GLY 63 -23.131 10.926 -4.297 472 HA2 GLY 63 2HA GLY 63 -20.860 12.675 -4.848 473 HA3 GLY 63 3HA GLY 63 -22.232 12.802 -5.938 474 H GLY 64 H GLY 64 -21.476 15.019 -4.587 475 HA2 GLY 64 2HA GLY 64 -23.701 16.096 -3.515 476 HA3 GLY 64 3HA GLY 64 -22.999 15.265 -2.135 477 H VAL 65 H VAL 65 -22.918 17.451 -1.224 478 HA VAL 65 HA VAL 65 -20.775 19.129 -2.317 479 HB VAL 65 HB VAL 65 -22.752 19.775 -0.126 480 HG11 VAL 65 1HG1 VAL 65 -21.999 22.069 -0.398 481 HG12 VAL 65 2HG1 VAL 65 -20.640 21.022 0.018 482 HG13 VAL 65 3HG1 VAL 65 -20.860 21.566 -1.646 483 HG21 VAL 65 3HG2 VAL 65 -23.355 21.407 -2.225 484 HG22 VAL 65 1HG2 VAL 65 -22.924 19.907 -3.047 485 HG23 VAL 65 2HG2 VAL 65 -24.204 19.911 -1.833 486 H TRP 66 H TRP 66 -18.948 18.040 -1.621 487 HA TRP 66 HA TRP 66 -17.906 18.687 0.869 488 HB2 TRP 66 2HB TRP 66 -19.196 17.233 2.101 489 HB3 TRP 66 3HB TRP 66 -19.359 16.084 0.775 490 HD1 TRP 66 HD1 TRP 66 -16.150 17.359 2.559 491 HE1 TRP 66 HE1 TRP 66 -14.826 15.303 3.359 492 HE3 TRP 66 HE3 TRP 66 -19.395 13.688 1.102 493 HZ2 TRP 66 HZ2 TRP 66 -15.118 12.495 3.370 494 HZ3 TRP 66 HZ3 TRP 66 -18.797 11.342 1.544 495 HH2 TRP 66 HH2 TRP 66 -16.702 10.760 2.654 496 HA PRO 67 HA PRO 67 -15.071 15.356 -1.186 497 HB2 PRO 67 2HB PRO 67 -16.048 14.065 -3.365 498 HB3 PRO 67 3HB PRO 67 -16.277 13.473 -1.716 499 HG2 PRO 67 2HG PRO 67 -18.165 15.013 -3.456 500 HG3 PRO 67 3HG PRO 67 -18.493 13.623 -2.404 501 HD2 PRO 67 2HD PRO 67 -19.059 16.168 -1.673 502 HD3 PRO 67 3HD PRO 67 -18.581 14.922 -0.503 503 H LEU 68 H LEU 68 -14.359 17.596 -1.708 504 HA LEU 68 HA LEU 68 -14.744 18.447 -4.460 505 HB2 LEU 68 2HB LEU 68 -13.806 20.480 -3.850 506 HB3 LEU 68 3HB LEU 68 -14.686 19.976 -2.408 507 HG LEU 68 HG LEU 68 -12.212 18.989 -1.879 508 HD11 LEU 68 1HD1 LEU 68 -10.702 20.983 -2.380 509 HD12 LEU 68 2HD1 LEU 68 -11.891 21.422 -3.606 510 HD13 LEU 68 3HD1 LEU 68 -11.050 19.875 -3.707 511 HD21 LEU 68 3HD2 LEU 68 -13.169 20.139 -0.158 512 HD22 LEU 68 1HD2 LEU 68 -13.666 21.484 -1.185 513 HD23 LEU 68 2HD2 LEU 68 -11.983 21.338 -0.678 514 H VAL 69 H VAL 69 -12.448 16.730 -2.561 515 HA VAL 69 HA VAL 69 -10.119 17.217 -4.091 516 HB VAL 69 HB VAL 69 -9.237 15.148 -3.059 517 HG11 VAL 69 1HG1 VAL 69 -10.350 16.223 -0.653 518 HG12 VAL 69 2HG1 VAL 69 -8.728 16.427 -1.318 519 HG13 VAL 69 3HG1 VAL 69 -10.019 17.534 -1.785 520 HG21 VAL 69 3HG2 VAL 69 -12.088 14.867 -2.173 521 HG22 VAL 69 1HG2 VAL 69 -11.042 13.674 -2.943 522 HG23 VAL 69 2HG2 VAL 69 -10.770 14.132 -1.262 523 H ILE 70 H ILE 70 -12.703 14.832 -4.338 524 HA ILE 70 HA ILE 70 -11.510 13.181 -6.281 525 HB ILE 70 HB ILE 70 -13.699 12.282 -6.694 526 HG12 ILE 70 2HG1 ILE 70 -15.576 13.555 -5.238 527 HG13 ILE 70 3HG1 ILE 70 -14.569 14.929 -5.678 528 HG21 ILE 70 1HG2 ILE 70 -14.332 11.618 -4.477 529 HG22 ILE 70 2HG2 ILE 70 -12.577 11.765 -4.539 530 HG23 ILE 70 3HG2 ILE 70 -13.541 13.031 -3.780 531 HD11 ILE 70 3HD1 ILE 70 -15.290 13.083 -7.860 532 HD12 ILE 70 1HD1 ILE 70 -16.596 14.049 -7.174 533 HD13 ILE 70 2HD1 ILE 70 -15.171 14.842 -7.847 534 H ARG 71 H ARG 71 -13.041 16.275 -6.490 535 HA ARG 71 HA ARG 71 -13.581 16.142 -9.311 536 HB2 ARG 71 2HB ARG 71 -13.354 18.751 -7.888 537 HB3 ARG 71 3HB ARG 71 -14.525 18.228 -9.091 538 HG2 ARG 71 2HG ARG 71 -15.516 16.733 -7.341 539 HG3 ARG 71 3HG ARG 71 -14.454 17.519 -6.171 540 HD2 ARG 71 2HD ARG 71 -16.582 18.833 -7.855 541 HD3 ARG 71 3HD ARG 71 -16.632 18.558 -6.114 542 HE ARG 71 HE ARG 71 -14.360 20.094 -6.811 543 HH11 ARG 71 1HH1 ARG 71 -17.817 20.312 -6.462 544 HH12 ARG 71 2HH1 ARG 71 -17.804 22.005 -6.097 545 HH21 ARG 71 1HH2 ARG 71 -14.330 22.324 -6.332 546 HH22 ARG 71 2HH2 ARG 71 -15.820 23.149 -6.024 547 H THR 72 H THR 72 -10.853 16.802 -7.371 548 HA THR 72 HA THR 72 -9.404 18.670 -8.771 549 HB THR 72 HB THR 72 -8.217 16.144 -7.613 550 HG1 THR 72 HG1 THR 72 -9.046 18.567 -6.372 551 HG21 THR 72 3HG2 THR 72 -6.404 17.953 -7.050 552 HG22 THR 72 1HG2 THR 72 -7.142 18.819 -8.397 553 HG23 THR 72 2HG2 THR 72 -6.455 17.214 -8.650 554 H VAL 73 H VAL 73 -9.382 15.148 -9.333 555 HA VAL 73 HA VAL 73 -7.723 15.250 -11.615 556 HB VAL 73 HB VAL 73 -8.662 12.958 -12.099 557 HG11 VAL 73 1HG1 VAL 73 -7.155 12.072 -10.682 558 HG12 VAL 73 2HG1 VAL 73 -6.800 13.758 -10.301 559 HG13 VAL 73 3HG1 VAL 73 -7.886 12.829 -9.267 560 HG21 VAL 73 3HG2 VAL 73 -10.000 11.949 -10.236 561 HG22 VAL 73 1HG2 VAL 73 -10.237 13.580 -9.608 562 HG23 VAL 73 2HG2 VAL 73 -10.864 13.147 -11.198 563 H ILE 74 H ILE 74 -11.253 15.072 -11.261 564 HA ILE 74 HA ILE 74 -11.875 14.955 -13.995 565 HB ILE 74 HB ILE 74 -13.699 16.397 -12.126 566 HG12 ILE 74 2HG1 ILE 74 -12.896 13.499 -11.924 567 HG13 ILE 74 3HG1 ILE 74 -12.952 14.706 -10.644 568 HG21 ILE 74 1HG2 ILE 74 -13.878 15.159 -14.657 569 HG22 ILE 74 2HG2 ILE 74 -14.857 14.209 -13.540 570 HG23 ILE 74 3HG2 ILE 74 -15.161 15.935 -13.729 571 HD11 ILE 74 3HD1 ILE 74 -14.867 13.669 -10.123 572 HD12 ILE 74 1HD1 ILE 74 -15.535 14.684 -11.401 573 HD13 ILE 74 2HD1 ILE 74 -15.081 13.015 -11.746 574 H ALA 75 H ALA 75 -10.767 17.548 -12.040 575 HA ALA 75 HA ALA 75 -11.841 19.797 -13.212 576 HB1 ALA 75 1HB ALA 75 -10.244 19.670 -11.256 577 HB2 ALA 75 2HB ALA 75 -8.941 19.589 -12.442 578 HB3 ALA 75 3HB ALA 75 -9.990 21.005 -12.380 579 H GLY 76 H GLY 76 -9.677 17.493 -14.586 580 HA2 GLY 76 2HA GLY 76 -8.870 19.292 -16.741 581 HA3 GLY 76 3HA GLY 76 -8.293 17.652 -16.485 582 H TYR 77 H TYR 77 -11.035 16.609 -16.171 583 HA TYR 77 HA TYR 77 -11.511 15.698 -18.726 584 HB2 TYR 77 2HB TYR 77 -13.009 14.461 -17.625 585 HB3 TYR 77 3HB TYR 77 -12.756 15.459 -16.197 586 HD1 TYR 77 HD2 TYR 77 -14.823 15.083 -19.245 587 HD2 TYR 77 HD1 TYR 77 -14.421 16.966 -15.451 588 HE1 TYR 77 HE2 TYR 77 -17.140 15.892 -19.407 589 HE2 TYR 77 HE1 TYR 77 -16.737 17.780 -15.602 590 HH TYR 77 HH TYR 77 -18.553 17.940 -16.875 591 H ASN 78 H ASN 78 -13.001 18.472 -17.090 592 HA ASN 78 HA ASN 78 -14.879 19.233 -18.933 593 HB2 ASN 78 2HB ASN 78 -13.591 20.428 -16.715 594 HB3 ASN 78 3HB ASN 78 -13.507 21.591 -18.035 595 HD21 ASN 78 1HD2 ASN 78 -15.779 21.324 -19.363 596 HD22 ASN 78 2HD2 ASN 78 -17.145 21.634 -18.352 597 H LEU 79 H LEU 79 -11.454 19.280 -19.272 598 HA LEU 79 HA LEU 79 -11.550 21.056 -21.586 599 HB2 LEU 79 2HB LEU 79 -9.666 20.627 -19.624 600 HB3 LEU 79 3HB LEU 79 -9.003 19.762 -21.009 601 HG LEU 79 HG LEU 79 -9.828 22.298 -21.940 602 HD11 LEU 79 1HD1 LEU 79 -9.197 23.854 -20.453 603 HD12 LEU 79 2HD1 LEU 79 -7.841 22.892 -19.866 604 HD13 LEU 79 3HD1 LEU 79 -9.469 22.578 -19.266 605 HD21 LEU 79 3HD2 LEU 79 -7.143 22.457 -21.858 606 HD22 LEU 79 1HD2 LEU 79 -8.031 21.529 -23.067 607 HD23 LEU 79 2HD2 LEU 79 -7.355 20.717 -21.654 608 H TYR 80 H TYR 80 -11.007 17.686 -20.759 609 HA TYR 80 HA TYR 80 -9.941 16.640 -23.041 610 HB2 TYR 80 2HB TYR 80 -11.276 15.624 -20.794 611 HB3 TYR 80 3HB TYR 80 -12.143 14.972 -22.181 612 HD1 TYR 80 HD2 TYR 80 -10.478 14.094 -24.114 613 HD2 TYR 80 HD1 TYR 80 -9.540 14.357 -19.973 614 HE1 TYR 80 HE2 TYR 80 -8.733 12.385 -24.406 615 HE2 TYR 80 HE1 TYR 80 -7.791 12.650 -20.254 616 HH TYR 80 HH TYR 80 -7.307 11.009 -23.346 617 H ARG 81 H ARG 81 -13.377 17.337 -22.462 618 HA ARG 81 HA ARG 81 -14.117 16.585 -25.143 619 HB2 ARG 81 2HB ARG 81 -15.488 17.314 -22.670 620 HB3 ARG 81 3HB ARG 81 -16.244 18.010 -24.097 621 HG2 ARG 81 2HG ARG 81 -15.739 15.378 -24.808 622 HG3 ARG 81 3HG ARG 81 -16.277 15.290 -23.129 623 HD2 ARG 81 2HD ARG 81 -18.374 15.549 -23.808 624 HD3 ARG 81 3HD ARG 81 -17.956 17.140 -24.442 625 HE ARG 81 HE ARG 81 -18.328 14.708 -25.947 626 HH11 ARG 81 1HH1 ARG 81 -16.939 17.901 -25.909 627 HH12 ARG 81 2HH1 ARG 81 -16.886 18.040 -27.635 628 HH21 ARG 81 1HH2 ARG 81 -18.263 14.880 -28.221 629 HH22 ARG 81 2HH2 ARG 81 -17.640 16.322 -28.949 630 H ALA 82 H ALA 82 -13.132 19.461 -23.510 631 HA ALA 82 HA ALA 82 -14.285 21.483 -24.980 632 HB1 ALA 82 1HB ALA 82 -11.403 21.490 -24.106 633 HB2 ALA 82 2HB ALA 82 -12.475 22.876 -24.313 634 HB3 ALA 82 3HB ALA 82 -12.759 21.730 -23.003 635 H ILE 83 H ILE 83 -11.551 19.430 -25.840 636 HA ILE 83 HA ILE 83 -11.055 20.866 -28.301 637 HB ILE 83 HB ILE 83 -9.895 18.269 -27.286 638 HG12 ILE 83 2HG1 ILE 83 -9.332 20.242 -25.910 639 HG13 ILE 83 3HG1 ILE 83 -7.922 19.600 -26.745 640 HG21 ILE 83 1HG2 ILE 83 -9.653 19.685 -29.836 641 HG22 ILE 83 2HG2 ILE 83 -8.112 19.271 -29.087 642 HG23 ILE 83 3HG2 ILE 83 -9.293 18.007 -29.429 643 HD11 ILE 83 3HD1 ILE 83 -9.087 21.559 -28.417 644 HD12 ILE 83 1HD1 ILE 83 -8.970 22.231 -26.791 645 HD13 ILE 83 2HD1 ILE 83 -7.530 21.599 -27.590 646 H LYS 84 H LYS 84 -13.006 18.250 -27.250 647 HA LYS 84 HA LYS 84 -13.224 16.907 -29.766 648 HB2 LYS 84 2HB LYS 84 -14.749 16.793 -27.180 649 HB3 LYS 84 3HB LYS 84 -15.333 15.941 -28.604 650 HG2 LYS 84 2HG LYS 84 -12.629 15.551 -27.336 651 HG3 LYS 84 3HG LYS 84 -14.028 14.498 -27.113 652 HD2 LYS 84 2HD LYS 84 -13.477 13.379 -28.951 653 HD3 LYS 84 3HD LYS 84 -13.637 14.857 -29.902 654 HE2 LYS 84 2HE LYS 84 -11.282 15.423 -29.146 655 HE3 LYS 84 3HE LYS 84 -11.178 13.765 -28.554 656 HZ1 LYS 84 3HZ LYS 84 -12.051 14.179 -31.315 657 HZ2 LYS 84 1HZ LYS 84 -11.140 12.920 -30.648 658 HZ3 LYS 84 2HZ LYS 84 -10.413 14.414 -30.967 659 H LYS 85 H LYS 85 -14.871 19.555 -28.206 660 HA LYS 85 HA LYS 85 -17.041 19.579 -30.124 661 HB2 LYS 85 2HB LYS 85 -17.779 21.598 -28.913 662 HB3 LYS 85 3HB LYS 85 -17.513 20.236 -27.832 663 HG2 LYS 85 2HG LYS 85 -15.325 21.170 -27.220 664 HG3 LYS 85 3HG LYS 85 -15.642 22.555 -28.268 665 HD2 LYS 85 2HD LYS 85 -17.758 21.960 -26.315 666 HD3 LYS 85 3HD LYS 85 -16.218 22.470 -25.617 667 HE2 LYS 85 2HE LYS 85 -17.155 24.048 -27.920 668 HE3 LYS 85 3HE LYS 85 -18.148 24.167 -26.468 669 HZ1 LYS 85 3HZ LYS 85 -15.259 24.786 -26.726 670 HZ2 LYS 85 1HZ LYS 85 -16.058 24.682 -25.239 671 HZ3 LYS 85 2HZ LYS 85 -16.514 25.861 -26.362 672 H LYS 86 H LYS 86 -14.115 21.429 -29.437 673 HA LYS 86 HA LYS 86 -12.957 22.973 -30.640 674 HB2 LYS 86 2HB LYS 86 -13.160 20.985 -32.278 675 HB3 LYS 86 3HB LYS 86 -14.359 21.971 -33.105 676 HG2 LYS 86 2HG LYS 86 -12.305 22.317 -34.217 677 HG3 LYS 86 3HG LYS 86 -12.615 23.772 -33.268 678 HD2 LYS 86 2HD LYS 86 -10.942 23.299 -31.751 679 HD3 LYS 86 3HD LYS 86 -10.990 21.566 -32.081 680 HE2 LYS 86 2HE LYS 86 -10.278 22.922 -34.479 681 HE3 LYS 86 3HE LYS 86 -9.260 23.531 -33.175 682 HZ1 LYS 86 3HZ LYS 86 -8.292 21.508 -32.859 683 HZ2 LYS 86 1HZ LYS 86 -8.611 21.395 -34.517 684 HZ3 LYS 86 2HZ LYS 86 -9.634 20.635 -33.405 685 H GLY 87 H GLY 87 -14.069 24.749 -29.721 686 HA2 GLY 87 2HA GLY 87 -15.818 26.118 -31.656 687 HA3 GLY 87 3HA GLY 87 -16.297 26.010 -29.969 688 H GLY 88 H GLY 88 -13.844 26.450 -28.722 689 HA2 GLY 88 2HA GLY 88 -12.169 28.422 -29.463 690 HA3 GLY 88 3HA GLY 88 -13.634 29.318 -29.088 691 H GLY 89 H GLY 89 -11.099 27.273 -27.778 692 HA2 GLY 89 2HA GLY 89 -10.104 27.518 -25.676 693 HA3 GLY 89 3HA GLY 89 -11.426 28.573 -25.199 694 H GLY 90 H GLY 90 -10.849 26.995 -23.268 695 HA2 GLY 90 2HA GLY 90 -12.994 25.001 -23.283 696 HA3 GLY 90 3HA GLY 90 -11.374 24.452 -22.884 697 H GLY 91 H GLY 91 -12.077 23.814 -20.805 698 HA2 GLY 91 2HA GLY 91 -12.200 24.140 -18.531 699 HA3 GLY 91 3HA GLY 91 -11.747 25.815 -18.813 700 H GLY 92 H GLY 92 -14.574 24.222 -20.183 701 HA2 GLY 92 2HA GLY 92 -16.565 24.699 -18.426 702 HA3 GLY 92 3HA GLY 92 -16.267 26.298 -19.089 703 H GLY 93 H GLY 93 -18.715 24.923 -19.331 704 HA2 GLY 93 2HA GLY 93 -20.087 25.218 -21.331 705 HA3 GLY 93 3HA GLY 93 -18.770 24.510 -22.255 706 H GLY 94 H GLY 94 -20.929 23.319 -22.878 707 HA2 GLY 94 2HA GLY 94 -20.771 20.734 -21.533 708 HA3 GLY 94 3HA GLY 94 -22.341 21.525 -21.528 709 H GLY 95 H GLY 95 -23.113 19.655 -22.694 710 HA2 GLY 95 2HA GLY 95 -23.842 18.663 -24.633 711 HA3 GLY 95 3HA GLY 95 -23.293 20.107 -25.472 712 H GLY 96 H GLY 96 -23.084 17.727 -26.747 713 HA2 GLY 96 2HA GLY 96 -20.329 17.616 -27.382 714 HA3 GLY 96 3HA GLY 96 -20.754 16.243 -26.371 715 H VAL 97 H VAL 97 -20.158 14.915 -28.193 716 HA VAL 97 HA VAL 97 -22.430 14.491 -29.974 717 HB VAL 97 HB VAL 97 -19.619 14.640 -31.063 718 HG11 VAL 97 1HG1 VAL 97 -21.314 13.105 -32.147 719 HG12 VAL 97 2HG1 VAL 97 -22.217 14.559 -32.577 720 HG13 VAL 97 3HG1 VAL 97 -20.582 14.319 -33.196 721 HG21 VAL 97 3HG2 VAL 97 -20.480 16.689 -32.248 722 HG22 VAL 97 1HG2 VAL 97 -21.853 16.656 -31.142 723 HG23 VAL 97 2HG2 VAL 97 -20.219 16.872 -30.514 724 H TRP 98 H TRP 98 -19.081 13.287 -29.770 725 HA TRP 98 HA TRP 98 -20.158 10.627 -29.127 726 HB2 TRP 98 2HB TRP 98 -18.391 9.645 -30.603 727 HB3 TRP 98 3HB TRP 98 -19.625 10.553 -31.473 728 HD1 TRP 98 HD1 TRP 98 -18.848 13.167 -32.160 729 HE1 TRP 98 HE1 TRP 98 -16.548 13.967 -32.994 730 HE3 TRP 98 HE3 TRP 98 -15.985 9.263 -30.518 731 HZ2 TRP 98 HZ2 TRP 98 -13.874 13.063 -32.961 732 HZ3 TRP 98 HZ3 TRP 98 -13.565 9.307 -30.960 733 HH2 TRP 98 HH2 TRP 98 -12.534 11.169 -32.157 734 HA PRO 99 HA PRO 99 -16.777 11.979 -26.201 735 HB2 PRO 99 2HB PRO 99 -18.189 11.486 -23.935 736 HB3 PRO 99 3HB PRO 99 -18.254 13.031 -24.790 737 HG2 PRO 99 2HG PRO 99 -20.175 10.736 -24.876 738 HG3 PRO 99 3HG PRO 99 -20.512 12.475 -24.786 739 HD2 PRO 99 2HD PRO 99 -20.673 11.079 -27.100 740 HD3 PRO 99 3HD PRO 99 -20.185 12.785 -27.046 741 H LEU 100 H LEU 100 -16.309 9.765 -27.443 742 HA LEU 100 HA LEU 100 -16.706 7.459 -25.709 743 HB2 LEU 100 2HB LEU 100 -15.187 7.541 -28.301 744 HB3 LEU 100 3HB LEU 100 -15.882 6.137 -27.494 745 HG LEU 100 HG LEU 100 -17.482 8.365 -28.751 746 HD11 LEU 100 1HD1 LEU 100 -17.255 7.364 -30.714 747 HD12 LEU 100 2HD1 LEU 100 -17.771 5.824 -30.028 748 HD13 LEU 100 3HD1 LEU 100 -16.067 6.276 -29.997 749 HD21 LEU 100 3HD2 LEU 100 -19.316 6.658 -28.540 750 HD22 LEU 100 1HD2 LEU 100 -18.747 7.347 -27.020 751 HD23 LEU 100 2HD2 LEU 100 -18.233 5.730 -27.502 752 H VAL 101 H VAL 101 -14.219 9.699 -26.663 753 HA VAL 101 HA VAL 101 -12.097 8.124 -25.458 754 HB VAL 101 HB VAL 101 -10.623 9.989 -26.088 755 HG11 VAL 101 1HG1 VAL 101 -10.983 9.831 -28.571 756 HG12 VAL 101 2HG1 VAL 101 -10.903 8.285 -27.723 757 HG13 VAL 101 3HG1 VAL 101 -12.463 8.937 -28.226 758 HG21 VAL 101 3HG2 VAL 101 -11.589 11.817 -27.501 759 HG22 VAL 101 1HG2 VAL 101 -13.191 11.265 -27.011 760 HG23 VAL 101 2HG2 VAL 101 -12.060 11.875 -25.803 761 H ILE 102 H ILE 102 -13.942 11.055 -24.787 762 HA ILE 102 HA ILE 102 -12.465 11.900 -22.537 763 HB ILE 102 HB ILE 102 -14.324 13.327 -22.003 764 HG12 ILE 102 2HG1 ILE 102 -16.357 12.969 -23.742 765 HG13 ILE 102 3HG1 ILE 102 -15.839 11.298 -23.545 766 HG21 ILE 102 1HG2 ILE 102 -13.933 14.662 -23.746 767 HG22 ILE 102 2HG2 ILE 102 -12.993 13.330 -24.416 768 HG23 ILE 102 3HG2 ILE 102 -14.682 13.537 -24.879 769 HD11 ILE 102 3HD1 ILE 102 -16.047 12.660 -21.006 770 HD12 ILE 102 1HD1 ILE 102 -17.562 12.703 -21.908 771 HD13 ILE 102 2HD1 ILE 102 -16.791 11.157 -21.550 772 H ARG 103 H ARG 103 -15.003 9.542 -22.955 773 HA ARG 103 HA ARG 103 -15.641 9.289 -20.180 774 HB2 ARG 103 2HB ARG 103 -16.806 7.201 -20.912 775 HB3 ARG 103 3HB ARG 103 -17.298 8.644 -21.789 776 HG2 ARG 103 2HG ARG 103 -15.960 8.008 -23.685 777 HG3 ARG 103 3HG ARG 103 -15.306 6.628 -22.801 778 HD2 ARG 103 2HD ARG 103 -17.910 6.092 -22.550 779 HD3 ARG 103 3HD ARG 103 -17.961 7.001 -24.060 780 HE ARG 103 HE ARG 103 -15.937 4.991 -24.088 781 HH11 ARG 103 1HH1 ARG 103 -19.355 5.535 -24.465 782 HH12 ARG 103 2HH1 ARG 103 -19.595 4.153 -25.483 783 HH21 ARG 103 1HH2 ARG 103 -16.240 3.170 -25.427 784 HH22 ARG 103 2HH2 ARG 103 -17.823 2.808 -26.028 785 H THR 104 H THR 104 -13.236 7.958 -22.284 786 HA THR 104 HA THR 104 -12.568 5.588 -21.021 787 HB THR 104 HB THR 104 -10.350 7.346 -21.973 788 HG1 THR 104 HG1 THR 104 -11.093 6.543 -24.168 789 HG21 THR 104 3HG2 THR 104 -9.509 5.256 -21.582 790 HG22 THR 104 1HG2 THR 104 -10.025 5.043 -23.254 791 HG23 THR 104 2HG2 THR 104 -11.038 4.454 -21.937 792 H VAL 105 H VAL 105 -11.075 8.779 -20.439 793 HA VAL 105 HA VAL 105 -9.572 7.950 -18.200 794 HB VAL 105 HB VAL 105 -10.519 10.759 -18.768 795 HG11 VAL 105 1HG1 VAL 105 -9.324 9.986 -16.555 796 HG12 VAL 105 2HG1 VAL 105 -7.882 10.072 -17.568 797 HG13 VAL 105 3HG1 VAL 105 -8.889 11.503 -17.341 798 HG21 VAL 105 3HG2 VAL 105 -9.448 10.492 -20.727 799 HG22 VAL 105 1HG2 VAL 105 -7.989 10.645 -19.747 800 HG23 VAL 105 2HG2 VAL 105 -8.597 9.047 -20.181 801 H ILE 106 H ILE 106 -12.735 9.516 -18.493 802 HA ILE 106 HA ILE 106 -13.241 10.042 -15.817 803 HB ILE 106 HB ILE 106 -15.248 9.155 -17.893 804 HG12 ILE 106 2HG1 ILE 106 -13.608 11.387 -17.940 805 HG13 ILE 106 3HG1 ILE 106 -15.115 11.193 -18.828 806 HG21 ILE 106 1HG2 ILE 106 -16.175 9.015 -15.670 807 HG22 ILE 106 2HG2 ILE 106 -15.600 10.638 -15.292 808 HG23 ILE 106 3HG2 ILE 106 -16.862 10.409 -16.503 809 HD11 ILE 106 3HD1 ILE 106 -14.938 12.349 -16.060 810 HD12 ILE 106 1HD1 ILE 106 -14.926 13.310 -17.539 811 HD13 ILE 106 2HD1 ILE 106 -16.338 12.333 -17.132 812 H ALA 107 H ALA 107 -13.395 7.024 -17.574 813 HA ALA 107 HA ALA 107 -14.956 5.431 -15.994 814 HB1 ALA 107 1HB ALA 107 -12.307 4.578 -17.151 815 HB2 ALA 107 2HB ALA 107 -13.689 3.549 -16.776 816 HB3 ALA 107 3HB ALA 107 -13.798 4.732 -18.080 817 H GLY 108 H GLY 108 -11.888 6.834 -15.204 818 HA2 GLY 108 2HA GLY 108 -11.559 5.106 -12.866 819 HA3 GLY 108 3HA GLY 108 -10.401 6.292 -13.451 820 H TYR 109 H TYR 109 -12.356 8.429 -13.678 821 HA TYR 109 HA TYR 109 -12.074 9.616 -11.181 822 HB2 TYR 109 2HB TYR 109 -14.112 10.202 -13.338 823 HB3 TYR 109 3HB TYR 109 -13.763 11.257 -11.974 824 HD1 TYR 109 HD2 TYR 109 -10.668 10.177 -12.399 825 HD2 TYR 109 HD1 TYR 109 -13.564 12.325 -14.657 826 HE1 TYR 109 HE2 TYR 109 -8.864 11.246 -13.685 827 HE2 TYR 109 HE1 TYR 109 -11.769 13.399 -15.950 828 HH TYR 109 HH TYR 109 -8.522 13.304 -15.017 829 H ASN 110 H ASN 110 -14.910 7.991 -12.577 830 HA ASN 110 HA ASN 110 -16.734 8.394 -10.549 831 HB2 ASN 110 2HB ASN 110 -16.688 6.924 -12.871 832 HB3 ASN 110 3HB ASN 110 -16.805 5.670 -11.640 833 HD21 ASN 110 1HD2 ASN 110 -18.875 5.068 -12.013 834 HD22 ASN 110 2HD2 ASN 110 -20.239 6.097 -11.754 835 H LEU 111 H LEU 111 -13.904 6.424 -10.545 836 HA LEU 111 HA LEU 111 -14.716 4.811 -8.291 837 HB2 LEU 111 2HB LEU 111 -12.624 4.780 -10.242 838 HB3 LEU 111 3HB LEU 111 -11.917 4.700 -8.630 839 HG LEU 111 HG LEU 111 -12.194 2.471 -9.436 840 HD11 LEU 111 1HD1 LEU 111 -13.295 3.398 -7.072 841 HD12 LEU 111 2HD1 LEU 111 -12.900 1.725 -7.465 842 HD13 LEU 111 3HD1 LEU 111 -14.533 2.333 -7.737 843 HD21 LEU 111 3HD2 LEU 111 -15.125 2.548 -9.640 844 HD22 LEU 111 1HD2 LEU 111 -13.936 1.700 -10.630 845 HD23 LEU 111 2HD2 LEU 111 -14.259 3.411 -10.912 846 H TYR 112 H TYR 112 -12.709 7.639 -8.883 847 HA TYR 112 HA TYR 112 -11.326 7.898 -6.538 848 HB2 TYR 112 2HB TYR 112 -12.023 9.591 -8.688 849 HB3 TYR 112 3HB TYR 112 -12.430 10.466 -7.216 850 HD1 TYR 112 HD2 TYR 112 -10.539 10.363 -5.345 851 HD2 TYR 112 HD1 TYR 112 -9.878 9.800 -9.510 852 HE1 TYR 112 HE2 TYR 112 -8.174 10.969 -5.045 853 HE2 TYR 112 HE1 TYR 112 -7.511 10.403 -9.222 854 HH TYR 112 HH TYR 112 -5.996 10.529 -6.247 855 H ARG 113 H ARG 113 -14.690 8.852 -7.141 856 HA ARG 113 HA ARG 113 -15.091 9.781 -4.455 857 HB2 ARG 113 2HB ARG 113 -17.269 9.082 -6.414 858 HB3 ARG 113 3HB ARG 113 -17.314 10.258 -5.107 859 HG2 ARG 113 2HG ARG 113 -16.801 11.829 -6.575 860 HG3 ARG 113 3HG ARG 113 -15.224 11.065 -6.785 861 HD2 ARG 113 2HD ARG 113 -15.811 10.076 -8.743 862 HD3 ARG 113 3HD ARG 113 -17.493 9.867 -8.256 863 HE ARG 113 HE ARG 113 -16.381 12.066 -9.709 864 HH11 ARG 113 1HH1 ARG 113 -18.901 11.121 -7.500 865 HH12 ARG 113 2HH1 ARG 113 -19.974 12.396 -7.975 866 HH21 ARG 113 1HH2 ARG 113 -17.786 13.748 -10.343 867 HH22 ARG 113 2HH2 ARG 113 -19.340 13.889 -9.592 868 H ALA 114 H ALA 114 -15.397 6.768 -6.128 869 HA ALA 114 HA ALA 114 -17.275 5.391 -4.666 870 HB1 ALA 114 1HB ALA 114 -15.838 4.625 -6.660 871 HB2 ALA 114 2HB ALA 114 -14.691 4.084 -5.434 872 HB3 ALA 114 3HB ALA 114 -16.326 3.423 -5.464 873 H ILE 115 H ILE 115 -13.915 6.068 -3.816 874 HA ILE 115 HA ILE 115 -14.064 4.546 -1.367 875 HB ILE 115 HB ILE 115 -11.931 6.463 -2.317 876 HG12 ILE 115 2HG1 ILE 115 -12.169 4.572 -3.835 877 HG13 ILE 115 3HG1 ILE 115 -10.685 4.406 -2.903 878 HG21 ILE 115 1HG2 ILE 115 -12.324 5.020 0.170 879 HG22 ILE 115 2HG2 ILE 115 -10.786 4.630 -0.598 880 HG23 ILE 115 3HG2 ILE 115 -11.185 6.307 -0.222 881 HD11 ILE 115 3HD1 ILE 115 -11.850 2.284 -3.130 882 HD12 ILE 115 1HD1 ILE 115 -11.773 2.794 -1.444 883 HD13 ILE 115 2HD1 ILE 115 -13.274 2.975 -2.353 884 H LYS 116 H LYS 116 -14.746 7.754 -2.376 885 HA LYS 116 HA LYS 116 -14.432 8.980 0.206 886 HB2 LYS 116 2HB LYS 116 -15.331 9.833 -2.488 887 HB3 LYS 116 3HB LYS 116 -15.978 10.737 -1.124 888 HG2 LYS 116 2HG LYS 116 -13.050 10.292 -1.669 889 HG3 LYS 116 3HG LYS 116 -13.952 11.755 -2.072 890 HD2 LYS 116 2HD LYS 116 -13.485 12.525 -0.038 891 HD3 LYS 116 3HD LYS 116 -14.500 11.243 0.628 892 HE2 LYS 116 2HE LYS 116 -12.601 9.768 0.795 893 HE3 LYS 116 3HE LYS 116 -11.570 10.943 -0.020 894 HZ1 LYS 116 3HZ LYS 116 -11.348 12.169 1.839 895 HZ2 LYS 116 1HZ LYS 116 -11.722 10.715 2.619 896 HZ3 LYS 116 2HZ LYS 116 -12.926 11.877 2.374 897 H LYS 117 H LYS 117 -16.913 7.256 -1.458 898 HA LYS 117 HA LYS 117 -19.049 8.239 0.234 899 HB2 LYS 117 2HB LYS 117 -19.942 7.749 -1.820 900 HB3 LYS 117 3HB LYS 117 -18.834 6.412 -2.104 901 HG2 LYS 117 2HG LYS 117 -20.146 4.904 -0.979 902 HG3 LYS 117 3HG LYS 117 -20.909 6.145 0.017 903 HD2 LYS 117 2HD LYS 117 -21.733 6.906 -2.444 904 HD3 LYS 117 3HD LYS 117 -21.623 5.158 -2.667 905 HE2 LYS 117 2HE LYS 117 -22.954 6.154 -0.208 906 HE3 LYS 117 3HE LYS 117 -23.815 6.343 -1.735 907 HZ1 LYS 117 3HZ LYS 117 -22.643 3.729 -1.246 908 HZ2 LYS 117 1HZ LYS 117 -24.136 4.137 -1.929 909 HZ3 LYS 117 2HZ LYS 117 -23.944 4.150 -0.249 910 H LYS 118 H LYS 118 -17.108 5.313 -0.125 911 HA LYS 118 HA LYS 118 -18.416 4.146 2.224 912 HB2 LYS 118 2HB LYS 118 -16.906 3.065 -0.088 913 HB3 LYS 118 3HB LYS 118 -16.694 2.227 1.444 914 HG2 LYS 118 2HG LYS 118 -19.145 1.972 1.604 915 HG3 LYS 118 3HG LYS 118 -19.297 2.723 0.013 916 HD2 LYS 118 2HD LYS 118 -19.105 0.672 -0.843 917 HD3 LYS 118 3HD LYS 118 -17.409 0.725 -0.357 918 HE2 LYS 118 2HE LYS 118 -17.830 -1.037 0.936 919 HE3 LYS 118 3HE LYS 118 -18.777 0.040 1.961 920 HZ1 LYS 118 3HZ LYS 118 -20.468 -0.609 -0.079 921 HZ2 LYS 118 1HZ LYS 118 -20.490 -1.267 1.479 922 HZ3 LYS 118 2HZ LYS 118 -19.659 -2.060 0.238 Start of MODEL 17 1 H1 VAL 1 H VAL 1 -2.824 -7.145 -2.386 2 HA VAL 1 HA VAL 1 -4.557 -6.252 -3.825 3 HB VAL 1 HB VAL 1 -5.696 -4.606 -2.281 4 HG11 VAL 1 1HG1 VAL 1 -4.820 -7.019 -0.744 5 HG12 VAL 1 2HG1 VAL 1 -6.419 -6.282 -0.853 6 HG13 VAL 1 3HG1 VAL 1 -5.774 -7.195 -2.217 7 HG21 VAL 1 3HG2 VAL 1 -4.758 -3.965 -0.261 8 HG22 VAL 1 1HG2 VAL 1 -3.567 -5.266 -0.285 9 HG23 VAL 1 2HG2 VAL 1 -3.380 -3.878 -1.358 10 H TRP 2 H TRP 2 -2.234 -5.178 -4.932 11 HA TRP 2 HA TRP 2 -1.666 -2.579 -5.006 12 HB2 TRP 2 2HB TRP 2 -0.634 -3.930 -6.640 13 HB3 TRP 2 3HB TRP 2 -2.178 -4.431 -7.324 14 HD1 TRP 2 HD1 TRP 2 0.234 -1.439 -7.273 15 HE1 TRP 2 HE1 TRP 2 -0.278 0.051 -9.308 16 HE3 TRP 2 HE3 TRP 2 -3.968 -3.803 -8.973 17 HZ2 TRP 2 HZ2 TRP 2 -2.208 0.205 -11.362 18 HZ3 TRP 2 HZ3 TRP 2 -5.087 -2.920 -10.979 19 HH2 TRP 2 HH2 TRP 2 -4.224 -0.957 -12.147 20 HA PRO 3 HA PRO 3 -5.443 -0.341 -5.530 21 HB2 PRO 3 2HB PRO 3 -4.345 2.082 -6.069 22 HB3 PRO 3 3HB PRO 3 -4.381 1.384 -4.446 23 HG2 PRO 3 2HG PRO 3 -2.146 1.434 -6.437 24 HG3 PRO 3 3HG PRO 3 -2.094 1.727 -4.689 25 HD2 PRO 3 2HD PRO 3 -1.363 -0.635 -5.793 26 HD3 PRO 3 3HD PRO 3 -2.107 -0.522 -4.185 27 H LEU 4 H LEU 4 -6.740 -0.289 -7.247 28 HA LEU 4 HA LEU 4 -5.659 -0.413 -9.915 29 HB2 LEU 4 2HB LEU 4 -7.975 -0.661 -10.621 30 HB3 LEU 4 3HB LEU 4 -7.582 -1.767 -9.307 31 HG LEU 4 HG LEU 4 -8.768 0.747 -8.402 32 HD11 LEU 4 1HD1 LEU 4 -9.929 0.446 -10.576 33 HD12 LEU 4 2HD1 LEU 4 -10.997 0.324 -9.177 34 HD13 LEU 4 3HD1 LEU 4 -10.476 -1.136 -10.019 35 HD21 LEU 4 3HD2 LEU 4 -8.351 -1.661 -7.316 36 HD22 LEU 4 1HD2 LEU 4 -9.995 -1.898 -7.909 37 HD23 LEU 4 2HD2 LEU 4 -9.643 -0.581 -6.790 38 H VAL 5 H VAL 5 -6.887 2.018 -7.815 39 HA VAL 5 HA VAL 5 -7.875 3.901 -9.618 40 HB VAL 5 HB VAL 5 -7.201 5.609 -7.900 41 HG11 VAL 5 1HG1 VAL 5 -9.317 5.000 -7.422 42 HG12 VAL 5 2HG1 VAL 5 -8.945 3.275 -7.475 43 HG13 VAL 5 3HG1 VAL 5 -8.564 4.217 -6.032 44 HG21 VAL 5 3HG2 VAL 5 -5.369 4.975 -6.734 45 HG22 VAL 5 1HG2 VAL 5 -6.572 4.242 -5.672 46 HG23 VAL 5 2HG2 VAL 5 -5.741 3.257 -6.876 47 H ILE 6 H ILE 6 -4.565 3.499 -8.374 48 HA ILE 6 HA ILE 6 -3.292 5.611 -9.545 49 HB ILE 6 HB ILE 6 -1.267 4.452 -9.364 50 HG12 ILE 6 2HG1 ILE 6 -1.532 1.797 -9.059 51 HG13 ILE 6 3HG1 ILE 6 -2.916 2.093 -10.105 52 HG21 ILE 6 1HG2 ILE 6 -2.667 4.658 -7.249 53 HG22 ILE 6 2HG2 ILE 6 -2.971 2.930 -7.415 54 HG23 ILE 6 3HG2 ILE 6 -1.322 3.519 -7.208 55 HD11 ILE 6 3HD1 ILE 6 -0.313 1.681 -10.901 56 HD12 ILE 6 1HD1 ILE 6 -1.624 2.320 -11.892 57 HD13 ILE 6 2HD1 ILE 6 -0.529 3.424 -11.058 58 H ARG 7 H ARG 7 -4.473 2.709 -11.096 59 HA ARG 7 HA ARG 7 -3.224 3.439 -13.631 60 HB2 ARG 7 2HB ARG 7 -3.419 1.270 -14.214 61 HB3 ARG 7 3HB ARG 7 -3.692 1.010 -12.496 62 HG2 ARG 7 2HG ARG 7 -5.449 -0.137 -13.411 63 HG3 ARG 7 3HG ARG 7 -6.188 1.438 -13.118 64 HD2 ARG 7 2HD ARG 7 -5.124 1.752 -15.618 65 HD3 ARG 7 3HD ARG 7 -5.622 0.060 -15.636 66 HE ARG 7 HE ARG 7 -7.330 2.370 -15.610 67 HH11 ARG 7 1HH1 ARG 7 -7.080 -1.013 -14.829 68 HH12 ARG 7 2HH1 ARG 7 -8.788 -1.294 -14.919 69 HH21 ARG 7 1HH2 ARG 7 -9.580 2.014 -15.731 70 HH22 ARG 7 2HH2 ARG 7 -10.208 0.429 -15.433 71 H THR 8 H THR 8 -6.319 3.448 -12.040 72 HA THR 8 HA THR 8 -7.962 3.745 -14.318 73 HB THR 8 HB THR 8 -8.581 4.903 -11.604 74 HG1 THR 8 HG1 THR 8 -8.545 2.213 -12.481 75 HG21 THR 8 3HG2 THR 8 -10.602 5.255 -12.470 76 HG22 THR 8 1HG2 THR 8 -10.744 3.547 -12.885 77 HG23 THR 8 2HG2 THR 8 -10.020 4.676 -14.031 78 H VAL 9 H VAL 9 -6.381 6.096 -12.193 79 HA VAL 9 HA VAL 9 -7.505 8.416 -13.311 80 HB VAL 9 HB VAL 9 -5.216 9.427 -12.472 81 HG11 VAL 9 1HG1 VAL 9 -7.167 10.013 -11.336 82 HG12 VAL 9 2HG1 VAL 9 -7.488 8.352 -10.836 83 HG13 VAL 9 3HG1 VAL 9 -6.170 9.259 -10.092 84 HG21 VAL 9 3HG2 VAL 9 -5.150 7.197 -10.567 85 HG22 VAL 9 1HG2 VAL 9 -4.595 6.793 -12.192 86 HG23 VAL 9 2HG2 VAL 9 -3.827 8.106 -11.299 87 H ILE 10 H ILE 10 -4.284 6.987 -13.884 88 HA ILE 10 HA ILE 10 -3.671 8.709 -16.052 89 HB ILE 10 HB ILE 10 -2.444 5.998 -15.575 90 HG12 ILE 10 2HG1 ILE 10 -2.042 8.601 -14.127 91 HG13 ILE 10 3HG1 ILE 10 -2.252 6.987 -13.457 92 HG21 ILE 10 1HG2 ILE 10 -2.025 7.729 -17.602 93 HG22 ILE 10 2HG2 ILE 10 -0.833 8.304 -16.439 94 HG23 ILE 10 3HG2 ILE 10 -0.798 6.626 -16.980 95 HD11 ILE 10 3HD1 ILE 10 -0.014 7.422 -13.102 96 HD12 ILE 10 1HD1 ILE 10 0.004 6.474 -14.589 97 HD13 ILE 10 2HD1 ILE 10 0.182 8.227 -14.659 98 H ALA 11 H ALA 11 -5.491 5.799 -15.791 99 HA ALA 11 HA ALA 11 -5.262 4.605 -18.248 100 HB1 ALA 11 1HB ALA 11 -8.019 4.614 -17.665 101 HB2 ALA 11 2HB ALA 11 -6.837 3.352 -17.316 102 HB3 ALA 11 3HB ALA 11 -7.168 4.604 -16.120 103 H GLY 12 H GLY 12 -6.589 7.707 -17.516 104 HA2 GLY 12 2HA GLY 12 -7.929 7.906 -20.107 105 HA3 GLY 12 3HA GLY 12 -7.990 9.093 -18.813 106 H TYR 13 H TYR 13 -5.109 9.155 -18.428 107 HA TYR 13 HA TYR 13 -4.441 11.261 -20.117 108 HB2 TYR 13 2HB TYR 13 -3.107 11.232 -18.248 109 HB3 TYR 13 3HB TYR 13 -2.919 9.482 -18.275 110 HD1 TYR 13 HD2 TYR 13 -1.904 12.543 -20.149 111 HD2 TYR 13 HD1 TYR 13 -0.922 8.560 -19.021 112 HE1 TYR 13 HE2 TYR 13 0.315 12.804 -21.179 113 HE2 TYR 13 HE1 TYR 13 1.300 8.810 -20.046 114 HH TYR 13 HH TYR 13 2.788 11.354 -20.611 115 H ASN 14 H ASN 14 -3.449 7.849 -20.307 116 HA ASN 14 HA ASN 14 -1.798 7.953 -22.505 117 HB2 ASN 14 2HB ASN 14 -3.732 5.810 -21.622 118 HB3 ASN 14 3HB ASN 14 -2.604 5.581 -22.955 119 HD21 ASN 14 1HD2 ASN 14 -2.950 5.979 -19.524 120 HD22 ASN 14 2HD2 ASN 14 -1.349 5.485 -19.101 121 H LEU 15 H LEU 15 -5.161 8.540 -22.372 122 HA LEU 15 HA LEU 15 -5.588 8.039 -25.205 123 HB2 LEU 15 2HB LEU 15 -7.238 7.753 -23.139 124 HB3 LEU 15 3HB LEU 15 -7.615 9.427 -23.539 125 HG LEU 15 HG LEU 15 -9.232 8.064 -24.614 126 HD11 LEU 15 1HD1 LEU 15 -8.168 9.939 -25.924 127 HD12 LEU 15 2HD1 LEU 15 -8.988 8.703 -26.876 128 HD13 LEU 15 3HD1 LEU 15 -7.228 8.705 -26.764 129 HD21 LEU 15 3HD2 LEU 15 -7.699 6.002 -24.485 130 HD22 LEU 15 1HD2 LEU 15 -7.105 6.525 -26.061 131 HD23 LEU 15 2HD2 LEU 15 -8.812 6.134 -25.848 132 H TYR 16 H TYR 16 -5.308 10.751 -22.974 133 HA TYR 16 HA TYR 16 -6.101 12.844 -24.592 134 HB2 TYR 16 2HB TYR 16 -4.452 12.528 -22.208 135 HB3 TYR 16 3HB TYR 16 -3.930 13.877 -23.210 136 HD1 TYR 16 HD1 TYR 16 -7.022 12.422 -21.708 137 HD2 TYR 16 HD2 TYR 16 -4.973 15.932 -22.963 138 HE1 TYR 16 HE1 TYR 16 -8.832 13.804 -20.778 139 HE2 TYR 16 HE2 TYR 16 -6.776 17.324 -22.036 140 HH TYR 16 HH TYR 16 -9.338 16.924 -21.540 141 H ARG 17 H ARG 17 -2.943 11.252 -24.425 142 HA ARG 17 HA ARG 17 -1.751 12.974 -26.383 143 HB2 ARG 17 2HB ARG 17 -0.902 10.813 -24.644 144 HB3 ARG 17 3HB ARG 17 -0.231 10.635 -26.260 145 HG2 ARG 17 2HG ARG 17 0.104 13.330 -25.623 146 HG3 ARG 17 3HG ARG 17 0.516 12.443 -24.154 147 HD2 ARG 17 2HD ARG 17 1.589 11.428 -26.729 148 HD3 ARG 17 3HD ARG 17 2.288 12.910 -26.079 149 HE ARG 17 HE ARG 17 2.259 11.128 -23.986 150 HH11 ARG 17 1HH1 ARG 17 3.641 11.240 -27.180 151 HH12 ARG 17 2HH1 ARG 17 5.008 10.261 -26.764 152 HH21 ARG 17 1HH2 ARG 17 4.055 9.838 -23.427 153 HH22 ARG 17 2HH2 ARG 17 5.242 9.463 -24.630 154 H ALA 18 H ALA 18 -3.652 10.106 -26.457 155 HA ALA 18 HA ALA 18 -2.870 8.851 -28.784 156 HB1 ALA 18 1HB ALA 18 -4.911 8.517 -27.033 157 HB2 ALA 18 2HB ALA 18 -5.780 9.079 -28.462 158 HB3 ALA 18 3HB ALA 18 -4.754 7.648 -28.560 159 H ILE 19 H ILE 19 -4.807 11.766 -28.394 160 HA ILE 19 HA ILE 19 -5.358 11.964 -31.227 161 HB ILE 19 HB ILE 19 -5.881 13.931 -28.996 162 HG12 ILE 19 2HG1 ILE 19 -7.159 11.877 -28.722 163 HG13 ILE 19 3HG1 ILE 19 -8.229 13.178 -29.235 164 HG21 ILE 19 1HG2 ILE 19 -6.207 14.086 -31.908 165 HG22 ILE 19 2HG2 ILE 19 -7.629 14.553 -30.977 166 HG23 ILE 19 3HG2 ILE 19 -6.090 15.372 -30.706 167 HD11 ILE 19 3HD1 ILE 19 -7.352 11.952 -31.586 168 HD12 ILE 19 1HD1 ILE 19 -7.722 10.642 -30.465 169 HD13 ILE 19 2HD1 ILE 19 -8.949 11.850 -30.847 170 H LYS 20 H LYS 20 -2.916 12.983 -29.048 171 HA LYS 20 HA LYS 20 -2.015 15.251 -30.551 172 HB2 LYS 20 2HB LYS 20 -1.096 13.743 -28.168 173 HB3 LYS 20 3HB LYS 20 0.138 14.616 -29.066 174 HG2 LYS 20 2HG LYS 20 -0.635 16.043 -27.336 175 HG3 LYS 20 3HG LYS 20 -1.275 16.666 -28.859 176 HD2 LYS 20 2HD LYS 20 -3.151 14.803 -27.839 177 HD3 LYS 20 3HD LYS 20 -2.691 15.875 -26.514 178 HE2 LYS 20 2HE LYS 20 -4.531 16.905 -27.576 179 HE3 LYS 20 3HE LYS 20 -3.105 17.799 -28.101 180 HZ1 LYS 20 3HZ LYS 20 -4.778 17.194 -29.872 181 HZ2 LYS 20 1HZ LYS 20 -4.260 15.593 -29.701 182 HZ3 LYS 20 2HZ LYS 20 -3.169 16.786 -30.199 183 H LYS 21 H LYS 21 -1.363 11.827 -30.546 184 HA LYS 21 HA LYS 21 1.017 12.011 -32.145 185 HB2 LYS 21 2HB LYS 21 -0.584 9.878 -30.906 186 HB3 LYS 21 3HB LYS 21 0.161 9.429 -32.434 187 HG2 LYS 21 2HG LYS 21 2.348 10.160 -31.528 188 HG3 LYS 21 3HG LYS 21 1.562 10.456 -29.975 189 HD2 LYS 21 2HD LYS 21 0.835 7.851 -30.817 190 HD3 LYS 21 3HD LYS 21 2.581 8.009 -31.026 191 HE2 LYS 21 2HE LYS 21 2.941 8.417 -28.771 192 HE3 LYS 21 3HE LYS 21 1.275 8.925 -28.495 193 HZ1 LYS 21 3HZ LYS 21 2.302 6.173 -28.865 194 HZ2 LYS 21 1HZ LYS 21 0.657 6.547 -28.992 195 HZ3 LYS 21 2HZ LYS 21 1.473 6.810 -27.534 196 H LYS 22 H LYS 22 -2.397 11.327 -32.723 197 HA LYS 22 HA LYS 22 -3.628 11.149 -34.631 198 HB2 LYS 22 2HB LYS 22 -2.854 13.505 -34.809 199 HB3 LYS 22 3HB LYS 22 -1.482 12.954 -35.762 200 HG2 LYS 22 2HG LYS 22 -3.001 13.701 -37.350 201 HG3 LYS 22 3HG LYS 22 -3.231 11.951 -37.344 202 HD2 LYS 22 2HD LYS 22 -4.917 13.386 -35.427 203 HD3 LYS 22 3HD LYS 22 -5.226 13.806 -37.113 204 HE2 LYS 22 2HE LYS 22 -5.241 11.253 -37.502 205 HE3 LYS 22 3HE LYS 22 -5.449 11.143 -35.755 206 HZ1 LYS 22 3HZ LYS 22 -7.388 11.679 -37.710 207 HZ2 LYS 22 1HZ LYS 22 -7.258 13.039 -36.713 208 HZ3 LYS 22 2HZ LYS 22 -7.596 11.525 -36.039 209 H GLY 23 H GLY 23 -3.079 8.892 -34.827 210 HA2 GLY 23 2HA GLY 23 -2.292 8.127 -37.383 211 HA3 GLY 23 3HA GLY 23 -0.873 7.982 -36.357 212 H GLY 24 H GLY 24 -0.994 6.555 -34.503 213 HA2 GLY 24 2HA GLY 24 -2.994 4.918 -33.689 214 HA3 GLY 24 3HA GLY 24 -2.431 4.139 -35.160 215 H GLY 25 H GLY 25 -2.328 3.371 -32.248 216 HA2 GLY 25 2HA GLY 25 -0.313 1.728 -31.989 217 HA3 GLY 25 3HA GLY 25 0.573 3.238 -31.832 218 H GLY 26 H GLY 26 1.113 2.144 -29.726 219 HA2 GLY 26 2HA GLY 26 -0.833 3.039 -27.709 220 HA3 GLY 26 3HA GLY 26 -0.163 1.418 -27.604 221 H GLY 27 H GLY 27 2.009 1.135 -27.017 222 HA2 GLY 27 2HA GLY 27 3.107 3.435 -25.562 223 HA3 GLY 27 3HA GLY 27 3.532 1.750 -25.297 224 H GLY 28 H GLY 28 5.579 3.446 -25.428 225 HA2 GLY 28 2HA GLY 28 7.652 3.512 -26.456 226 HA3 GLY 28 3HA GLY 28 7.000 2.520 -27.752 227 H GLY 29 H GLY 29 7.147 5.822 -26.492 228 HA2 GLY 29 2HA GLY 29 7.330 6.838 -29.198 229 HA3 GLY 29 3HA GLY 29 5.871 7.311 -28.339 230 H GLY 30 H GLY 30 7.370 9.331 -29.148 231 HA2 GLY 30 2HA GLY 30 8.133 10.597 -26.703 232 HA3 GLY 30 3HA GLY 30 9.535 10.197 -27.684 233 H GLY 31 H GLY 31 7.100 12.459 -27.101 234 HA2 GLY 31 2HA GLY 31 8.151 14.388 -28.823 235 HA3 GLY 31 3HA GLY 31 6.809 13.622 -29.660 236 H GLY 32 H GLY 32 6.955 16.367 -28.876 237 HA2 GLY 32 2HA GLY 32 4.402 16.780 -27.869 238 HA3 GLY 32 3HA GLY 32 5.488 16.836 -26.489 239 H VAL 33 H VAL 33 4.019 18.648 -28.851 240 HA VAL 33 HA VAL 33 6.110 20.703 -28.887 241 HB VAL 33 HB VAL 33 5.190 20.151 -31.062 242 HG11 VAL 33 1HG1 VAL 33 2.553 21.253 -30.802 243 HG12 VAL 33 2HG1 VAL 33 3.047 19.664 -31.389 244 HG13 VAL 33 3HG1 VAL 33 2.768 19.922 -29.666 245 HG21 VAL 33 3HG2 VAL 33 5.733 22.570 -30.317 246 HG22 VAL 33 1HG2 VAL 33 4.878 22.315 -31.838 247 HG23 VAL 33 2HG2 VAL 33 3.988 22.812 -30.399 248 H TRP 34 H TRP 34 2.976 19.994 -27.591 249 HA TRP 34 HA TRP 34 3.104 22.264 -25.847 250 HB2 TRP 34 2HB TRP 34 0.911 23.225 -26.565 251 HB3 TRP 34 3HB TRP 34 2.197 23.427 -27.752 252 HD1 TRP 34 HD1 TRP 34 1.056 19.952 -27.961 253 HE1 TRP 34 HE1 TRP 34 -0.589 19.636 -29.915 254 HE3 TRP 34 HE3 TRP 34 0.039 24.860 -28.966 255 HZ2 TRP 34 HZ2 TRP 34 -2.116 21.254 -31.653 256 HZ3 TRP 34 HZ3 TRP 34 -1.525 25.390 -30.791 257 HH2 TRP 34 HH2 TRP 34 -2.578 23.623 -32.106 258 HA PRO 35 HA PRO 35 0.808 18.454 -24.402 259 HB2 PRO 35 2HB PRO 35 2.380 18.007 -22.235 260 HB3 PRO 35 3HB PRO 35 2.738 17.345 -23.834 261 HG2 PRO 35 2HG PRO 35 3.883 19.759 -22.485 262 HG3 PRO 35 3HG PRO 35 4.712 18.505 -23.425 263 HD2 PRO 35 2HD PRO 35 4.077 20.924 -24.463 264 HD3 PRO 35 3HD PRO 35 4.110 19.444 -25.443 265 H LEU 36 H LEU 36 -0.345 20.822 -24.123 266 HA LEU 36 HA LEU 36 -0.418 21.557 -21.302 267 HB2 LEU 36 2HB LEU 36 -1.707 23.445 -21.969 268 HB3 LEU 36 3HB LEU 36 -0.349 23.288 -23.081 269 HG LEU 36 HG LEU 36 -2.368 21.920 -24.364 270 HD11 LEU 36 1HD1 LEU 36 -3.556 24.427 -23.190 271 HD12 LEU 36 2HD1 LEU 36 -3.962 22.791 -22.673 272 HD13 LEU 36 3HD1 LEU 36 -4.321 23.309 -24.319 273 HD21 LEU 36 3HD2 LEU 36 -2.074 24.820 -24.905 274 HD22 LEU 36 1HD2 LEU 36 -2.013 23.446 -26.010 275 HD23 LEU 36 2HD2 LEU 36 -0.620 23.823 -24.995 276 H VAL 37 H VAL 37 -2.171 19.692 -23.590 277 HA VAL 37 HA VAL 37 -4.622 19.694 -22.022 278 HB VAL 37 HB VAL 37 -5.491 18.167 -23.754 279 HG11 VAL 37 1HG1 VAL 37 -5.953 20.397 -24.222 280 HG12 VAL 37 2HG1 VAL 37 -4.262 20.781 -24.549 281 HG13 VAL 37 3HG1 VAL 37 -5.191 19.826 -25.706 282 HG21 VAL 37 3HG2 VAL 37 -4.035 17.933 -25.836 283 HG22 VAL 37 1HG2 VAL 37 -2.682 18.379 -24.796 284 HG23 VAL 37 2HG2 VAL 37 -3.621 16.926 -24.449 285 H ILE 38 H ILE 38 -2.065 17.427 -22.972 286 HA ILE 38 HA ILE 38 -3.089 15.153 -21.696 287 HB ILE 38 HB ILE 38 -0.905 14.193 -21.873 288 HG12 ILE 38 2HG1 ILE 38 0.119 16.996 -22.377 289 HG13 ILE 38 3HG1 ILE 38 0.359 16.074 -20.897 290 HG21 ILE 38 1HG2 ILE 38 -2.215 15.477 -24.024 291 HG22 ILE 38 2HG2 ILE 38 -0.480 15.638 -24.288 292 HG23 ILE 38 3HG2 ILE 38 -1.193 14.041 -24.067 293 HD11 ILE 38 3HD1 ILE 38 2.354 15.800 -22.025 294 HD12 ILE 38 1HD1 ILE 38 1.469 14.331 -22.434 295 HD13 ILE 38 2HD1 ILE 38 1.565 15.655 -23.596 296 H ARG 39 H ARG 39 -1.301 17.888 -20.468 297 HA ARG 39 HA ARG 39 -0.521 16.736 -17.996 298 HB2 ARG 39 2HB ARG 39 -0.239 19.136 -17.283 299 HB3 ARG 39 3HB ARG 39 0.644 18.678 -18.733 300 HG2 ARG 39 2HG ARG 39 -0.774 19.882 -20.128 301 HG3 ARG 39 3HG ARG 39 -2.056 19.954 -18.917 302 HD2 ARG 39 2HD ARG 39 -1.155 22.107 -18.912 303 HD3 ARG 39 3HD ARG 39 -0.396 21.325 -17.526 304 HE ARG 39 HE ARG 39 1.257 20.971 -19.754 305 HH11 ARG 39 1HH1 ARG 39 0.107 23.522 -17.683 306 HH12 ARG 39 2HH1 ARG 39 1.514 24.509 -17.899 307 HH21 ARG 39 1HH2 ARG 39 3.115 22.261 -20.046 308 HH22 ARG 39 2HH2 ARG 39 3.225 23.792 -19.243 309 H THR 40 H THR 40 -3.479 18.067 -19.171 310 HA THR 40 HA THR 40 -4.731 18.946 -16.867 311 HB THR 40 HB THR 40 -6.048 17.411 -19.116 312 HG1 THR 40 HG1 THR 40 -5.245 20.110 -18.836 313 HG21 THR 40 3HG2 THR 40 -8.024 17.899 -18.188 314 HG22 THR 40 1HG2 THR 40 -7.549 19.568 -17.879 315 HG23 THR 40 2HG2 THR 40 -7.129 18.304 -16.724 316 H VAL 41 H VAL 41 -4.952 15.667 -18.265 317 HA VAL 41 HA VAL 41 -6.404 14.486 -16.213 318 HB VAL 41 HB VAL 41 -4.270 13.101 -17.838 319 HG11 VAL 41 1HG1 VAL 41 -6.757 11.703 -17.191 320 HG12 VAL 41 2HG1 VAL 41 -5.084 11.154 -17.081 321 HG13 VAL 41 3HG1 VAL 41 -5.781 12.125 -15.784 322 HG21 VAL 41 3HG2 VAL 41 -5.464 13.492 -19.669 323 HG22 VAL 41 1HG2 VAL 41 -6.851 12.694 -18.928 324 HG23 VAL 41 2HG2 VAL 41 -6.624 14.432 -18.731 325 H ILE 42 H ILE 42 -2.885 14.754 -16.597 326 HA ILE 42 HA ILE 42 -2.128 13.278 -14.352 327 HB ILE 42 HB ILE 42 -0.471 15.646 -14.935 328 HG12 ILE 42 2HG1 ILE 42 -1.442 15.226 -17.154 329 HG13 ILE 42 3HG1 ILE 42 0.267 14.806 -17.118 330 HG21 ILE 42 1HG2 ILE 42 -0.180 12.852 -14.177 331 HG22 ILE 42 2HG2 ILE 42 0.984 13.357 -15.401 332 HG23 ILE 42 3HG2 ILE 42 0.882 14.226 -13.869 333 HD11 ILE 42 3HD1 ILE 42 -1.132 12.472 -16.439 334 HD12 ILE 42 1HD1 ILE 42 -1.980 13.188 -17.809 335 HD13 ILE 42 2HD1 ILE 42 -0.259 12.822 -17.930 336 H ALA 43 H ALA 43 -3.308 16.547 -14.644 337 HA ALA 43 HA ALA 43 -2.468 17.750 -12.331 338 HB1 ALA 43 1HB ALA 43 -3.936 18.728 -14.131 339 HB2 ALA 43 2HB ALA 43 -5.301 17.952 -13.326 340 HB3 ALA 43 3HB ALA 43 -4.355 19.175 -12.477 341 H GLY 44 H GLY 44 -4.708 15.114 -12.675 342 HA2 GLY 44 2HA GLY 44 -5.577 15.344 -9.890 343 HA3 GLY 44 3HA GLY 44 -6.216 14.228 -11.088 344 H TYR 45 H TYR 45 -3.313 13.594 -11.806 345 HA TYR 45 HA TYR 45 -3.052 11.186 -10.519 346 HB2 TYR 45 2HB TYR 45 -1.213 10.988 -11.790 347 HB3 TYR 45 3HB TYR 45 -1.571 12.607 -12.379 348 HD1 TYR 45 HD2 TYR 45 0.248 10.837 -9.649 349 HD2 TYR 45 HD1 TYR 45 -0.007 14.305 -12.100 350 HE1 TYR 45 HE2 TYR 45 2.383 11.637 -8.728 351 HE2 TYR 45 HE1 TYR 45 2.129 15.114 -11.188 352 HH TYR 45 HH TYR 45 4.277 13.738 -10.037 353 H ASN 46 H ASN 46 -1.608 14.289 -9.572 354 HA ASN 46 HA ASN 46 -0.071 13.520 -7.437 355 HB2 ASN 46 2HB ASN 46 -0.947 15.932 -8.468 356 HB3 ASN 46 3HB ASN 46 -1.614 15.929 -6.838 357 HD21 ASN 46 1HD2 ASN 46 0.694 17.314 -8.313 358 HD22 ASN 46 2HD2 ASN 46 2.013 17.169 -7.206 359 H LEU 47 H LEU 47 -3.508 13.476 -7.697 360 HA LEU 47 HA LEU 47 -3.862 13.155 -4.815 361 HB2 LEU 47 2HB LEU 47 -5.426 14.257 -6.851 362 HB3 LEU 47 3HB LEU 47 -6.252 12.773 -6.383 363 HG LEU 47 HG LEU 47 -7.152 14.664 -5.169 364 HD11 LEU 47 1HD1 LEU 47 -7.424 13.433 -3.333 365 HD12 LEU 47 2HD1 LEU 47 -5.709 13.502 -2.932 366 HD13 LEU 47 3HD1 LEU 47 -6.300 12.287 -4.064 367 HD21 LEU 47 3HD2 LEU 47 -4.924 15.934 -5.299 368 HD22 LEU 47 1HD2 LEU 47 -4.497 15.054 -3.831 369 HD23 LEU 47 2HD2 LEU 47 -5.902 16.120 -3.843 370 H TYR 48 H TYR 48 -4.044 11.346 -7.812 371 HA TYR 48 HA TYR 48 -5.403 9.087 -7.135 372 HB2 TYR 48 2HB TYR 48 -4.520 8.206 -9.018 373 HB3 TYR 48 3HB TYR 48 -3.808 9.802 -9.228 374 HD1 TYR 48 HD2 TYR 48 -3.044 6.624 -7.404 375 HD2 TYR 48 HD1 TYR 48 -1.562 9.867 -9.726 376 HE1 TYR 48 HE2 TYR 48 -0.799 5.622 -7.360 377 HE2 TYR 48 HE1 TYR 48 0.687 8.872 -9.690 378 HH TYR 48 HH TYR 48 1.992 7.306 -8.680 379 H ARG 49 H ARG 49 -2.053 9.861 -6.295 380 HA ARG 49 HA ARG 49 -1.766 7.386 -4.802 381 HB2 ARG 49 2HB ARG 49 0.008 9.218 -6.050 382 HB3 ARG 49 3HB ARG 49 0.393 9.204 -4.334 383 HG2 ARG 49 2HG ARG 49 -0.006 6.535 -5.410 384 HG3 ARG 49 3HG ARG 49 1.292 7.416 -6.219 385 HD2 ARG 49 2HD ARG 49 1.311 7.693 -3.310 386 HD3 ARG 49 3HD ARG 49 1.526 6.034 -3.864 387 HE ARG 49 HE ARG 49 3.251 7.482 -5.398 388 HH11 ARG 49 1HH1 ARG 49 2.739 7.104 -1.975 389 HH12 ARG 49 2HH1 ARG 49 4.400 7.380 -1.564 390 HH21 ARG 49 1HH2 ARG 49 5.439 7.847 -4.870 391 HH22 ARG 49 2HH2 ARG 49 5.935 7.804 -3.211 392 H ALA 50 H ALA 50 -2.520 10.714 -4.239 393 HA ALA 50 HA ALA 50 -1.783 11.120 -1.620 394 HB1 ALA 50 1HB ALA 50 -4.405 12.009 -2.809 395 HB2 ALA 50 2HB ALA 50 -3.516 12.767 -1.487 396 HB3 ALA 50 3HB ALA 50 -2.856 12.793 -3.122 397 H ILE 51 H ILE 51 -4.532 9.302 -2.865 398 HA ILE 51 HA ILE 51 -5.730 8.869 -0.305 399 HB ILE 51 HB ILE 51 -6.138 7.412 -2.919 400 HG12 ILE 51 2HG1 ILE 51 -6.766 9.762 -3.049 401 HG13 ILE 51 3HG1 ILE 51 -8.212 8.758 -3.036 402 HG21 ILE 51 1HG2 ILE 51 -7.134 6.903 -0.236 403 HG22 ILE 51 2HG2 ILE 51 -8.426 7.120 -1.415 404 HG23 ILE 51 3HG2 ILE 51 -7.192 5.888 -1.677 405 HD11 ILE 51 3HD1 ILE 51 -8.505 9.244 -0.651 406 HD12 ILE 51 1HD1 ILE 51 -7.086 10.291 -0.706 407 HD13 ILE 51 2HD1 ILE 51 -8.522 10.701 -1.644 408 H LYS 52 H LYS 52 -3.222 7.343 -2.123 409 HA LYS 52 HA LYS 52 -3.338 4.809 -0.795 410 HB2 LYS 52 2HB LYS 52 -1.154 6.114 -2.427 411 HB3 LYS 52 3HB LYS 52 -1.094 4.458 -1.838 412 HG2 LYS 52 2HG LYS 52 -3.005 5.627 -3.842 413 HG3 LYS 52 3HG LYS 52 -1.779 4.385 -4.106 414 HD2 LYS 52 2HD LYS 52 -4.259 4.126 -2.406 415 HD3 LYS 52 3HD LYS 52 -3.983 3.375 -3.980 416 HE2 LYS 52 2HE LYS 52 -3.080 1.628 -2.950 417 HE3 LYS 52 3HE LYS 52 -1.793 2.675 -2.353 418 HZ1 LYS 52 3HZ LYS 52 -2.783 2.896 -0.327 419 HZ2 LYS 52 1HZ LYS 52 -3.308 1.335 -0.718 420 HZ3 LYS 52 2HZ LYS 52 -4.349 2.653 -0.920 421 H LYS 53 H LYS 53 -1.620 7.830 -0.304 422 HA LYS 53 HA LYS 53 0.103 6.783 1.743 423 HB2 LYS 53 2HB LYS 53 -0.411 9.446 0.521 424 HB3 LYS 53 3HB LYS 53 0.292 9.421 2.132 425 HG2 LYS 53 2HG LYS 53 1.587 7.597 0.254 426 HG3 LYS 53 3HG LYS 53 1.687 9.298 -0.207 427 HD2 LYS 53 2HD LYS 53 2.283 9.486 2.413 428 HD3 LYS 53 3HD LYS 53 2.906 7.870 2.073 429 HE2 LYS 53 2HE LYS 53 4.579 8.649 0.772 430 HE3 LYS 53 3HE LYS 53 3.590 9.941 0.094 431 HZ1 LYS 53 3HZ LYS 53 3.940 10.598 2.740 432 HZ2 LYS 53 1HZ LYS 53 4.700 11.316 1.410 433 HZ3 LYS 53 2HZ LYS 53 5.456 10.046 2.233 434 H LYS 54 H LYS 54 -2.921 8.589 1.631 435 HA LYS 54 HA LYS 54 -4.404 9.210 3.249 436 HB2 LYS 54 2HB LYS 54 -4.054 6.517 3.389 437 HB3 LYS 54 3HB LYS 54 -3.668 6.984 5.041 438 HG2 LYS 54 2HG LYS 54 -5.809 7.258 5.534 439 HG3 LYS 54 3HG LYS 54 -6.054 8.318 4.144 440 HD2 LYS 54 2HD LYS 54 -5.905 5.924 2.907 441 HD3 LYS 54 3HD LYS 54 -6.597 5.435 4.456 442 HE2 LYS 54 2HE LYS 54 -8.079 7.639 3.873 443 HE3 LYS 54 3HE LYS 54 -7.772 6.993 2.261 444 HZ1 LYS 54 3HZ LYS 54 -8.457 4.829 3.828 445 HZ2 LYS 54 1HZ LYS 54 -9.406 5.566 2.636 446 HZ3 LYS 54 2HZ LYS 54 -9.553 6.047 4.251 447 H GLY 55 H GLY 55 -4.500 9.016 5.971 448 HA2 GLY 55 2HA GLY 55 -3.276 9.529 7.956 449 HA3 GLY 55 3HA GLY 55 -1.978 10.160 6.954 450 H GLY 56 H GLY 56 -5.150 11.080 6.040 451 HA2 GLY 56 2HA GLY 56 -6.265 13.007 7.228 452 HA3 GLY 56 3HA GLY 56 -4.672 13.747 7.215 453 H GLY 57 H GLY 57 -7.108 14.804 6.079 454 HA2 GLY 57 2HA GLY 57 -6.074 15.425 3.452 455 HA3 GLY 57 3HA GLY 57 -7.585 14.527 3.432 456 H GLY 58 H GLY 58 -6.931 16.752 6.017 457 HA2 GLY 58 2HA GLY 58 -7.969 18.701 6.644 458 HA3 GLY 58 3HA GLY 58 -7.928 19.124 4.939 459 H GLY 59 H GLY 59 -9.977 20.220 5.569 460 HA2 GLY 59 2HA GLY 59 -12.202 18.512 4.848 461 HA3 GLY 59 3HA GLY 59 -12.291 19.178 6.472 462 H GLY 60 H GLY 60 -13.931 19.608 3.990 463 HA2 GLY 60 2HA GLY 60 -14.942 22.035 4.253 464 HA3 GLY 60 3HA GLY 60 -13.440 22.435 3.434 465 H GLY 61 H GLY 61 -16.581 22.121 2.870 466 HA2 GLY 61 2HA GLY 61 -16.663 22.288 0.203 467 HA3 GLY 61 3HA GLY 61 -16.448 20.558 0.422 468 H GLY 62 H GLY 62 -18.337 19.606 0.022 469 HA2 GLY 62 2HA GLY 62 -20.855 20.848 0.311 470 HA3 GLY 62 3HA GLY 62 -20.581 19.128 0.080 471 H GLY 63 H GLY 63 -22.544 19.149 1.540 472 HA2 GLY 63 2HA GLY 63 -21.771 19.467 4.365 473 HA3 GLY 63 3HA GLY 63 -23.422 19.448 3.763 474 H GLY 64 H GLY 64 -21.469 17.749 5.623 475 HA2 GLY 64 2HA GLY 64 -22.157 15.619 6.474 476 HA3 GLY 64 3HA GLY 64 -22.750 15.211 4.872 477 H VAL 65 H VAL 65 -20.175 16.390 3.757 478 HA VAL 65 HA VAL 65 -18.211 14.430 4.649 479 HB VAL 65 HB VAL 65 -17.767 13.779 2.238 480 HG11 VAL 65 1HG1 VAL 65 -20.300 12.939 3.632 481 HG12 VAL 65 2HG1 VAL 65 -19.651 12.113 2.214 482 HG13 VAL 65 3HG1 VAL 65 -18.715 12.170 3.708 483 HG21 VAL 65 3HG2 VAL 65 -19.711 15.702 1.728 484 HG22 VAL 65 1HG2 VAL 65 -19.016 14.565 0.572 485 HG23 VAL 65 2HG2 VAL 65 -20.512 14.162 1.415 486 H TRP 66 H TRP 66 -16.160 14.697 3.173 487 HA TRP 66 HA TRP 66 -15.751 17.577 2.704 488 HB2 TRP 66 2HB TRP 66 -13.384 17.206 3.464 489 HB3 TRP 66 3HB TRP 66 -14.595 17.023 4.730 490 HD1 TRP 66 HD1 TRP 66 -15.275 14.356 5.289 491 HE1 TRP 66 HE1 TRP 66 -13.719 12.308 5.384 492 HE3 TRP 66 HE3 TRP 66 -11.350 16.193 2.577 493 HZ2 TRP 66 HZ2 TRP 66 -11.166 11.569 4.435 494 HZ3 TRP 66 HZ3 TRP 66 -9.389 14.752 2.217 495 HH2 TRP 66 HH2 TRP 66 -9.300 12.488 3.128 496 HA PRO 67 HA PRO 67 -14.770 15.188 -1.158 497 HB2 PRO 67 2HB PRO 67 -16.085 16.883 -2.822 498 HB3 PRO 67 3HB PRO 67 -16.879 15.534 -2.001 499 HG2 PRO 67 2HG PRO 67 -16.837 18.436 -1.270 500 HG3 PRO 67 3HG PRO 67 -18.196 17.297 -1.250 501 HD2 PRO 67 2HD PRO 67 -16.846 17.993 0.991 502 HD3 PRO 67 3HD PRO 67 -17.566 16.385 0.770 503 H LEU 68 H LEU 68 -12.741 16.424 -0.091 504 HA LEU 68 HA LEU 68 -12.032 18.794 -1.630 505 HB2 LEU 68 2HB LEU 68 -11.331 17.732 0.913 506 HB3 LEU 68 3HB LEU 68 -9.862 17.861 -0.053 507 HG LEU 68 HG LEU 68 -11.709 20.203 0.162 508 HD11 LEU 68 1HD1 LEU 68 -11.001 20.840 2.229 509 HD12 LEU 68 2HD1 LEU 68 -9.484 19.949 2.109 510 HD13 LEU 68 3HD1 LEU 68 -10.986 19.090 2.452 511 HD21 LEU 68 3HD2 LEU 68 -9.944 21.406 -0.606 512 HD22 LEU 68 1HD2 LEU 68 -9.516 19.844 -1.305 513 HD23 LEU 68 2HD2 LEU 68 -8.752 20.379 0.192 514 H VAL 69 H VAL 69 -11.460 15.393 -1.595 515 HA VAL 69 HA VAL 69 -9.043 15.468 -3.147 516 HB VAL 69 HB VAL 69 -9.369 13.027 -3.381 517 HG11 VAL 69 1HG1 VAL 69 -8.134 13.703 -1.488 518 HG12 VAL 69 2HG1 VAL 69 -9.583 14.244 -0.640 519 HG13 VAL 69 3HG1 VAL 69 -9.303 12.522 -0.898 520 HG21 VAL 69 3HG2 VAL 69 -11.553 12.442 -3.440 521 HG22 VAL 69 1HG2 VAL 69 -11.319 12.262 -1.701 522 HG23 VAL 69 2HG2 VAL 69 -12.042 13.736 -2.346 523 H ILE 70 H ILE 70 -12.474 14.938 -3.797 524 HA ILE 70 HA ILE 70 -12.288 14.155 -6.470 525 HB ILE 70 HB ILE 70 -14.612 15.092 -6.696 526 HG12 ILE 70 2HG1 ILE 70 -15.383 15.511 -4.089 527 HG13 ILE 70 3HG1 ILE 70 -13.812 16.303 -4.145 528 HG21 ILE 70 1HG2 ILE 70 -14.265 12.796 -6.040 529 HG22 ILE 70 2HG2 ILE 70 -14.029 13.278 -4.361 530 HG23 ILE 70 3HG2 ILE 70 -15.609 13.471 -5.120 531 HD11 ILE 70 3HD1 ILE 70 -15.005 18.058 -4.848 532 HD12 ILE 70 1HD1 ILE 70 -14.931 17.248 -6.413 533 HD13 ILE 70 2HD1 ILE 70 -16.354 17.059 -5.387 534 H ARG 71 H ARG 71 -12.548 17.394 -5.050 535 HA ARG 71 HA ARG 71 -12.736 18.845 -7.433 536 HB2 ARG 71 2HB ARG 71 -12.235 20.770 -6.156 537 HB3 ARG 71 3HB ARG 71 -13.080 19.686 -5.060 538 HG2 ARG 71 2HG ARG 71 -11.406 19.915 -3.634 539 HG3 ARG 71 3HG ARG 71 -10.362 19.077 -4.784 540 HD2 ARG 71 2HD ARG 71 -9.314 21.146 -4.245 541 HD3 ARG 71 3HD ARG 71 -9.948 21.286 -5.884 542 HE ARG 71 HE ARG 71 -11.858 22.254 -4.062 543 HH11 ARG 71 1HH1 ARG 71 -8.746 23.071 -5.391 544 HH12 ARG 71 2HH1 ARG 71 -8.969 24.779 -5.204 545 HH21 ARG 71 1HH2 ARG 71 -12.163 24.501 -3.811 546 HH22 ARG 71 2HH2 ARG 71 -10.913 25.591 -4.305 547 H THR 72 H THR 72 -10.100 17.153 -6.064 548 HA THR 72 HA THR 72 -8.078 18.665 -7.505 549 HB THR 72 HB THR 72 -7.097 16.177 -6.427 550 HG1 THR 72 HG1 THR 72 -8.764 17.763 -4.771 551 HG21 THR 72 3HG2 THR 72 -6.620 19.104 -6.024 552 HG22 THR 72 1HG2 THR 72 -5.534 17.872 -6.666 553 HG23 THR 72 2HG2 THR 72 -5.876 17.932 -4.937 554 H VAL 73 H VAL 73 -9.132 15.255 -7.410 555 HA VAL 73 HA VAL 73 -7.744 14.554 -9.790 556 HB VAL 73 HB VAL 73 -9.552 12.586 -9.633 557 HG11 VAL 73 1HG1 VAL 73 -7.750 12.075 -7.507 558 HG12 VAL 73 2HG1 VAL 73 -7.658 11.523 -9.181 559 HG13 VAL 73 3HG1 VAL 73 -6.903 13.046 -8.710 560 HG21 VAL 73 3HG2 VAL 73 -10.604 14.026 -7.710 561 HG22 VAL 73 1HG2 VAL 73 -10.518 12.270 -7.572 562 HG23 VAL 73 2HG2 VAL 73 -9.335 13.279 -6.740 563 H ILE 74 H ILE 74 -11.215 14.998 -9.104 564 HA ILE 74 HA ILE 74 -12.110 14.659 -11.737 565 HB ILE 74 HB ILE 74 -13.412 16.429 -9.670 566 HG12 ILE 74 2HG1 ILE 74 -13.343 13.436 -9.950 567 HG13 ILE 74 3HG1 ILE 74 -13.090 14.413 -8.508 568 HG21 ILE 74 1HG2 ILE 74 -14.125 16.121 -12.230 569 HG22 ILE 74 2HG2 ILE 74 -14.965 14.738 -11.530 570 HG23 ILE 74 3HG2 ILE 74 -15.292 16.364 -10.930 571 HD11 ILE 74 3HD1 ILE 74 -15.578 13.429 -9.720 572 HD12 ILE 74 1HD1 ILE 74 -15.174 13.736 -8.031 573 HD13 ILE 74 2HD1 ILE 74 -15.629 15.074 -9.086 574 H ALA 75 H ALA 75 -10.522 17.303 -10.215 575 HA ALA 75 HA ALA 75 -11.380 19.529 -11.555 576 HB1 ALA 75 1HB ALA 75 -9.211 18.895 -9.957 577 HB2 ALA 75 2HB ALA 75 -8.484 19.467 -11.459 578 HB3 ALA 75 3HB ALA 75 -9.623 20.491 -10.584 579 H GLY 76 H GLY 76 -9.645 16.816 -12.842 580 HA2 GLY 76 2HA GLY 76 -9.032 18.242 -15.324 581 HA3 GLY 76 3HA GLY 76 -8.479 16.631 -14.892 582 H TYR 77 H TYR 77 -11.221 15.838 -14.068 583 HA TYR 77 HA TYR 77 -12.051 14.554 -16.364 584 HB2 TYR 77 2HB TYR 77 -13.079 13.633 -14.548 585 HB3 TYR 77 3HB TYR 77 -13.300 15.186 -13.750 586 HD1 TYR 77 HD2 TYR 77 -14.589 13.175 -16.613 587 HD2 TYR 77 HD1 TYR 77 -15.412 16.155 -13.690 588 HE1 TYR 77 HE2 TYR 77 -16.953 13.180 -17.292 589 HE2 TYR 77 HE1 TYR 77 -17.779 16.167 -14.361 590 HH TYR 77 HH TYR 77 -18.895 14.538 -17.192 591 H ASN 78 H ASN 78 -13.347 17.572 -14.992 592 HA ASN 78 HA ASN 78 -15.322 18.107 -16.836 593 HB2 ASN 78 2HB ASN 78 -14.336 19.433 -14.697 594 HB3 ASN 78 3HB ASN 78 -13.702 20.439 -15.996 595 HD21 ASN 78 1HD2 ASN 78 -16.449 19.529 -14.191 596 HD22 ASN 78 2HD2 ASN 78 -17.593 20.555 -14.981 597 H LEU 79 H LEU 79 -11.940 18.055 -17.318 598 HA LEU 79 HA LEU 79 -12.068 19.689 -19.732 599 HB2 LEU 79 2HB LEU 79 -10.043 18.982 -17.845 600 HB3 LEU 79 3HB LEU 79 -9.531 18.477 -19.454 601 HG LEU 79 HG LEU 79 -10.493 21.101 -19.736 602 HD11 LEU 79 1HD1 LEU 79 -8.640 22.046 -18.070 603 HD12 LEU 79 2HD1 LEU 79 -9.154 20.640 -17.139 604 HD13 LEU 79 3HD1 LEU 79 -10.333 21.864 -17.609 605 HD21 LEU 79 3HD2 LEU 79 -7.782 21.332 -19.752 606 HD22 LEU 79 1HD2 LEU 79 -8.753 20.760 -21.109 607 HD23 LEU 79 2HD2 LEU 79 -7.991 19.601 -20.019 608 H TYR 80 H TYR 80 -11.701 16.353 -18.726 609 HA TYR 80 HA TYR 80 -10.746 15.061 -20.901 610 HB2 TYR 80 2HB TYR 80 -13.107 14.281 -19.184 611 HB3 TYR 80 3HB TYR 80 -12.351 13.196 -20.346 612 HD1 TYR 80 HD2 TYR 80 -9.771 15.153 -19.144 613 HD2 TYR 80 HD1 TYR 80 -12.348 12.002 -17.905 614 HE1 TYR 80 HE2 TYR 80 -8.124 14.482 -17.445 615 HE2 TYR 80 HE1 TYR 80 -10.709 11.323 -16.202 616 HH TYR 80 HH TYR 80 -8.372 11.527 -15.710 617 H ARG 81 H ARG 81 -14.148 16.034 -20.487 618 HA ARG 81 HA ARG 81 -14.797 15.296 -23.198 619 HB2 ARG 81 2HB ARG 81 -16.293 16.394 -20.862 620 HB3 ARG 81 3HB ARG 81 -16.979 16.612 -22.466 621 HG2 ARG 81 2HG ARG 81 -16.107 13.893 -22.084 622 HG3 ARG 81 3HG ARG 81 -17.228 14.390 -20.815 623 HD2 ARG 81 2HD ARG 81 -18.778 15.195 -22.584 624 HD3 ARG 81 3HD ARG 81 -17.678 14.534 -23.793 625 HE ARG 81 HE ARG 81 -18.527 12.461 -23.358 626 HH11 ARG 81 1HH1 ARG 81 -19.288 14.564 -20.689 627 HH12 ARG 81 2HH1 ARG 81 -20.283 13.397 -19.884 628 HH21 ARG 81 1HH2 ARG 81 -19.835 10.916 -22.307 629 HH22 ARG 81 2HH2 ARG 81 -20.593 11.322 -20.804 630 H ALA 82 H ALA 82 -13.781 18.137 -21.514 631 HA ALA 82 HA ALA 82 -14.760 20.194 -23.065 632 HB1 ALA 82 1HB ALA 82 -11.960 20.065 -21.958 633 HB2 ALA 82 2HB ALA 82 -12.906 21.512 -22.312 634 HB3 ALA 82 3HB ALA 82 -13.393 20.439 -21.000 635 H ILE 83 H ILE 83 -12.008 18.074 -23.708 636 HA ILE 83 HA ILE 83 -11.166 19.457 -26.058 637 HB ILE 83 HB ILE 83 -10.570 16.642 -25.140 638 HG12 ILE 83 2HG1 ILE 83 -9.744 18.299 -23.573 639 HG13 ILE 83 3HG1 ILE 83 -8.387 17.630 -24.474 640 HG21 ILE 83 1HG2 ILE 83 -9.892 18.094 -27.582 641 HG22 ILE 83 2HG2 ILE 83 -8.496 17.416 -26.746 642 HG23 ILE 83 3HG2 ILE 83 -9.828 16.367 -27.233 643 HD11 ILE 83 3HD1 ILE 83 -9.222 19.860 -25.929 644 HD12 ILE 83 1HD1 ILE 83 -9.258 20.350 -24.235 645 HD13 ILE 83 2HD1 ILE 83 -7.774 19.702 -24.935 646 H LYS 84 H LYS 84 -13.569 17.080 -25.374 647 HA LYS 84 HA LYS 84 -13.795 15.993 -27.998 648 HB2 LYS 84 2HB LYS 84 -14.839 15.381 -25.511 649 HB3 LYS 84 3HB LYS 84 -16.243 15.947 -26.405 650 HG2 LYS 84 2HG LYS 84 -14.399 13.690 -27.150 651 HG3 LYS 84 3HG LYS 84 -16.087 13.577 -26.647 652 HD2 LYS 84 2HD LYS 84 -16.566 13.582 -28.833 653 HD3 LYS 84 3HD LYS 84 -16.202 15.308 -28.778 654 HE2 LYS 84 2HE LYS 84 -13.731 14.004 -29.011 655 HE3 LYS 84 3HE LYS 84 -14.813 13.188 -30.138 656 HZ1 LYS 84 3HZ LYS 84 -15.260 15.203 -31.245 657 HZ2 LYS 84 1HZ LYS 84 -13.581 15.161 -31.038 658 HZ3 LYS 84 2HZ LYS 84 -14.532 16.135 -30.035 659 H LYS 85 H LYS 85 -15.425 18.599 -26.255 660 HA LYS 85 HA LYS 85 -17.328 19.164 -28.285 661 HB2 LYS 85 2HB LYS 85 -16.303 20.684 -25.903 662 HB3 LYS 85 3HB LYS 85 -17.420 21.430 -27.038 663 HG2 LYS 85 2HG LYS 85 -19.167 20.331 -26.204 664 HG3 LYS 85 3HG LYS 85 -18.293 18.798 -26.159 665 HD2 LYS 85 2HD LYS 85 -17.065 20.079 -24.142 666 HD3 LYS 85 3HD LYS 85 -18.652 20.848 -24.058 667 HE2 LYS 85 2HE LYS 85 -18.877 17.986 -24.405 668 HE3 LYS 85 3HE LYS 85 -17.917 18.387 -22.981 669 HZ1 LYS 85 3HZ LYS 85 -19.846 18.693 -21.952 670 HZ2 LYS 85 1HZ LYS 85 -20.730 18.630 -23.393 671 HZ3 LYS 85 2HZ LYS 85 -20.053 20.092 -22.879 672 H LYS 86 H LYS 86 -14.113 20.409 -27.539 673 HA LYS 86 HA LYS 86 -14.032 22.581 -29.269 674 HB2 LYS 86 2HB LYS 86 -11.824 20.684 -28.456 675 HB3 LYS 86 3HB LYS 86 -11.556 22.202 -29.304 676 HG2 LYS 86 2HG LYS 86 -13.105 22.931 -27.137 677 HG3 LYS 86 3HG LYS 86 -12.017 21.702 -26.488 678 HD2 LYS 86 2HD LYS 86 -10.977 23.932 -28.201 679 HD3 LYS 86 3HD LYS 86 -11.254 24.169 -26.473 680 HE2 LYS 86 2HE LYS 86 -9.568 22.741 -25.870 681 HE3 LYS 86 3HE LYS 86 -9.711 21.778 -27.340 682 HZ1 LYS 86 3HZ LYS 86 -8.069 24.078 -26.810 683 HZ2 LYS 86 1HZ LYS 86 -8.917 24.188 -28.270 684 HZ3 LYS 86 2HZ LYS 86 -7.894 22.872 -27.983 685 H GLY 87 H GLY 87 -12.485 22.618 -31.252 686 HA2 GLY 87 2HA GLY 87 -11.692 21.390 -33.188 687 HA3 GLY 87 3HA GLY 87 -13.031 20.275 -32.959 688 H GLY 88 H GLY 88 -14.772 22.718 -32.377 689 HA2 GLY 88 2HA GLY 88 -14.863 24.198 -34.825 690 HA3 GLY 88 3HA GLY 88 -16.075 22.925 -34.786 691 H GLY 89 H GLY 89 -14.995 24.689 -31.948 692 HA2 GLY 89 2HA GLY 89 -16.544 26.829 -31.671 693 HA3 GLY 89 3HA GLY 89 -17.743 25.555 -31.501 694 H GLY 90 H GLY 90 -18.281 25.662 -29.394 695 HA2 GLY 90 2HA GLY 90 -16.671 24.520 -27.434 696 HA3 GLY 90 3HA GLY 90 -16.460 26.260 -27.307 697 H GLY 91 H GLY 91 -17.494 24.836 -25.200 698 HA2 GLY 91 2HA GLY 91 -19.200 25.101 -23.669 699 HA3 GLY 91 3HA GLY 91 -19.987 26.186 -24.806 700 H GLY 92 H GLY 92 -22.042 25.404 -24.695 701 HA2 GLY 92 2HA GLY 92 -22.583 22.574 -24.824 702 HA3 GLY 92 3HA GLY 92 -23.774 23.866 -24.799 703 H GLY 93 H GLY 93 -24.816 22.422 -26.413 704 HA2 GLY 93 2HA GLY 93 -25.521 22.175 -28.589 705 HA3 GLY 93 3HA GLY 93 -24.397 23.451 -29.034 706 H GLY 94 H GLY 94 -23.686 22.440 -30.904 707 HA2 GLY 94 2HA GLY 94 -22.933 19.786 -31.203 708 HA3 GLY 94 3HA GLY 94 -22.272 21.118 -32.138 709 H GLY 95 H GLY 95 -20.821 18.809 -31.379 710 HA2 GLY 95 2HA GLY 95 -18.391 19.777 -30.642 711 HA3 GLY 95 3HA GLY 95 -19.177 19.460 -29.102 712 H GLY 96 H GLY 96 -18.405 17.904 -32.207 713 HA2 GLY 96 2HA GLY 96 -17.683 15.775 -32.675 714 HA3 GLY 96 3HA GLY 96 -17.185 15.668 -30.994 715 H VAL 97 H VAL 97 -19.354 14.566 -33.332 716 HA VAL 97 HA VAL 97 -21.382 13.690 -31.448 717 HB VAL 97 HB VAL 97 -21.952 14.446 -33.771 718 HG11 VAL 97 1HG1 VAL 97 -20.600 11.853 -34.499 719 HG12 VAL 97 2HG1 VAL 97 -21.666 12.751 -35.580 720 HG13 VAL 97 3HG1 VAL 97 -20.157 13.477 -35.025 721 HG21 VAL 97 3HG2 VAL 97 -23.804 13.119 -33.823 722 HG22 VAL 97 1HG2 VAL 97 -22.882 11.635 -33.581 723 HG23 VAL 97 2HG2 VAL 97 -23.214 12.700 -32.215 724 H TRP 98 H TRP 98 -18.394 12.662 -31.970 725 HA TRP 98 HA TRP 98 -19.114 9.814 -31.721 726 HB2 TRP 98 2HB TRP 98 -16.883 9.297 -32.674 727 HB3 TRP 98 3HB TRP 98 -17.907 10.191 -33.794 728 HD1 TRP 98 HD1 TRP 98 -14.587 10.346 -32.051 729 HE1 TRP 98 HE1 TRP 98 -13.363 12.513 -32.707 730 HE3 TRP 98 HE3 TRP 98 -18.427 12.767 -34.403 731 HZ2 TRP 98 HZ2 TRP 98 -13.948 14.929 -34.045 732 HZ3 TRP 98 HZ3 TRP 98 -18.012 15.002 -35.343 733 HH2 TRP 98 HH2 TRP 98 -15.818 16.059 -35.167 734 HA PRO 99 HA PRO 99 -17.080 11.285 -27.789 735 HB2 PRO 99 2HB PRO 99 -18.950 10.225 -26.130 736 HB3 PRO 99 3HB PRO 99 -19.091 11.843 -26.828 737 HG2 PRO 99 2HG PRO 99 -20.371 9.283 -27.706 738 HG3 PRO 99 3HG PRO 99 -21.081 10.903 -27.579 739 HD2 PRO 99 2HD PRO 99 -20.264 9.852 -29.937 740 HD3 PRO 99 3HD PRO 99 -20.185 11.591 -29.588 741 H LEU 100 H LEU 100 -15.958 9.291 -29.147 742 HA LEU 100 HA LEU 100 -16.264 6.798 -27.670 743 HB2 LEU 100 2HB LEU 100 -15.259 7.587 -30.271 744 HB3 LEU 100 3HB LEU 100 -14.139 6.514 -29.435 745 HG LEU 100 HG LEU 100 -16.756 5.417 -29.216 746 HD11 LEU 100 1HD1 LEU 100 -17.572 5.288 -31.364 747 HD12 LEU 100 2HD1 LEU 100 -16.021 5.697 -32.095 748 HD13 LEU 100 3HD1 LEU 100 -16.983 6.950 -31.311 749 HD21 LEU 100 3HD2 LEU 100 -15.729 3.520 -30.270 750 HD22 LEU 100 1HD2 LEU 100 -14.567 4.243 -29.158 751 HD23 LEU 100 2HD2 LEU 100 -14.416 4.520 -30.893 752 H VAL 101 H VAL 101 -14.070 9.487 -27.979 753 HA VAL 101 HA VAL 101 -11.898 8.218 -26.586 754 HB VAL 101 HB VAL 101 -10.889 10.475 -26.538 755 HG11 VAL 101 1HG1 VAL 101 -10.110 9.954 -28.548 756 HG12 VAL 101 2HG1 VAL 101 -11.492 8.887 -28.803 757 HG13 VAL 101 3HG1 VAL 101 -11.579 10.578 -29.296 758 HG21 VAL 101 3HG2 VAL 101 -12.386 12.151 -26.417 759 HG22 VAL 101 1HG2 VAL 101 -12.369 12.050 -28.177 760 HG23 VAL 101 2HG2 VAL 101 -13.635 11.235 -27.259 761 H ILE 102 H ILE 102 -14.535 10.400 -25.757 762 HA ILE 102 HA ILE 102 -13.695 11.110 -23.179 763 HB ILE 102 HB ILE 102 -16.132 11.512 -22.723 764 HG12 ILE 102 2HG1 ILE 102 -17.282 11.422 -25.218 765 HG13 ILE 102 3HG1 ILE 102 -16.329 9.942 -25.195 766 HG21 ILE 102 1HG2 ILE 102 -14.885 13.334 -23.543 767 HG22 ILE 102 2HG2 ILE 102 -14.813 12.655 -25.169 768 HG23 ILE 102 3HG2 ILE 102 -16.340 13.273 -24.538 769 HD11 ILE 102 3HD1 ILE 102 -17.977 8.979 -24.086 770 HD12 ILE 102 1HD1 ILE 102 -17.630 10.044 -22.724 771 HD13 ILE 102 2HD1 ILE 102 -18.830 10.515 -23.929 772 H ARG 103 H ARG 103 -15.706 8.410 -24.300 773 HA ARG 103 HA ARG 103 -16.359 7.353 -21.794 774 HB2 ARG 103 2HB ARG 103 -17.022 5.385 -22.937 775 HB3 ARG 103 3HB ARG 103 -17.336 6.715 -24.043 776 HG2 ARG 103 2HG ARG 103 -16.164 5.648 -25.584 777 HG3 ARG 103 3HG ARG 103 -14.723 5.857 -24.586 778 HD2 ARG 103 2HD ARG 103 -15.877 3.750 -23.352 779 HD3 ARG 103 3HD ARG 103 -16.414 3.482 -25.010 780 HE ARG 103 HE ARG 103 -13.724 3.987 -25.195 781 HH11 ARG 103 1HH1 ARG 103 -15.729 1.670 -23.542 782 HH12 ARG 103 2HH1 ARG 103 -14.534 0.416 -23.577 783 HH21 ARG 103 1HH2 ARG 103 -12.142 2.344 -25.247 784 HH22 ARG 103 2HH2 ARG 103 -12.494 0.800 -24.546 785 H THR 104 H THR 104 -13.385 7.399 -23.479 786 HA THR 104 HA THR 104 -12.266 5.097 -22.124 787 HB THR 104 HB THR 104 -10.392 6.958 -23.420 788 HG1 THR 104 HG1 THR 104 -11.179 6.299 -25.538 789 HG21 THR 104 3HG2 THR 104 -10.045 4.644 -24.677 790 HG22 THR 104 1HG2 THR 104 -10.929 4.036 -23.278 791 HG23 THR 104 2HG2 THR 104 -9.420 4.920 -23.051 792 H VAL 105 H VAL 105 -11.573 8.598 -22.174 793 HA VAL 105 HA VAL 105 -9.819 8.472 -19.930 794 HB VAL 105 HB VAL 105 -11.215 10.971 -20.854 795 HG11 VAL 105 1HG1 VAL 105 -8.352 10.762 -20.044 796 HG12 VAL 105 2HG1 VAL 105 -9.472 12.118 -19.889 797 HG13 VAL 105 3HG1 VAL 105 -9.604 10.734 -18.803 798 HG21 VAL 105 3HG2 VAL 105 -8.923 11.022 -22.269 799 HG22 VAL 105 1HG2 VAL 105 -9.275 9.294 -22.309 800 HG23 VAL 105 2HG2 VAL 105 -10.460 10.450 -22.919 801 H ILE 106 H ILE 106 -13.144 9.674 -20.351 802 HA ILE 106 HA ILE 106 -13.573 10.418 -17.682 803 HB ILE 106 HB ILE 106 -15.709 9.399 -19.550 804 HG12 ILE 106 2HG1 ILE 106 -13.918 11.520 -20.024 805 HG13 ILE 106 3HG1 ILE 106 -15.395 11.150 -20.907 806 HG21 ILE 106 1HG2 ILE 106 -15.751 11.367 -17.267 807 HG22 ILE 106 2HG2 ILE 106 -17.116 11.017 -18.325 808 HG23 ILE 106 3HG2 ILE 106 -16.462 9.754 -17.284 809 HD11 ILE 106 3HD1 ILE 106 -15.298 13.475 -20.138 810 HD12 ILE 106 1HD1 ILE 106 -16.665 12.596 -19.454 811 HD13 ILE 106 2HD1 ILE 106 -15.234 12.906 -18.470 812 H ALA 107 H ALA 107 -13.639 7.321 -19.247 813 HA ALA 107 HA ALA 107 -15.247 5.796 -17.632 814 HB1 ALA 107 1HB ALA 107 -14.450 4.258 -19.016 815 HB2 ALA 107 2HB ALA 107 -13.115 5.315 -19.475 816 HB3 ALA 107 3HB ALA 107 -12.949 4.236 -18.090 817 H GLY 108 H GLY 108 -12.211 7.275 -16.842 818 HA2 GLY 108 2HA GLY 108 -11.938 5.691 -14.398 819 HA3 GLY 108 3HA GLY 108 -10.770 6.847 -15.021 820 H TYR 109 H TYR 109 -12.907 8.872 -15.439 821 HA TYR 109 HA TYR 109 -12.608 10.351 -13.128 822 HB2 TYR 109 2HB TYR 109 -13.411 11.754 -14.704 823 HB3 TYR 109 3HB TYR 109 -14.323 10.482 -15.509 824 HD1 TYR 109 HD2 TYR 109 -14.414 12.552 -12.400 825 HD2 TYR 109 HD1 TYR 109 -16.633 10.562 -15.437 826 HE1 TYR 109 HE2 TYR 109 -16.499 13.465 -11.467 827 HE2 TYR 109 HE1 TYR 109 -18.724 11.471 -14.513 828 HH TYR 109 HH TYR 109 -18.703 13.783 -11.849 829 H ASN 110 H ASN 110 -15.363 8.305 -14.062 830 HA ASN 110 HA ASN 110 -17.003 8.766 -11.876 831 HB2 ASN 110 2HB ASN 110 -17.298 7.290 -14.061 832 HB3 ASN 110 3HB ASN 110 -16.827 5.992 -12.967 833 HD21 ASN 110 1HD2 ASN 110 -18.043 6.012 -10.841 834 HD22 ASN 110 2HD2 ASN 110 -19.745 6.296 -10.936 835 H LEU 111 H LEU 111 -14.011 7.104 -12.025 836 HA LEU 111 HA LEU 111 -14.435 5.527 -9.644 837 HB2 LEU 111 2HB LEU 111 -12.670 5.437 -11.780 838 HB3 LEU 111 3HB LEU 111 -11.666 5.923 -10.415 839 HG LEU 111 HG LEU 111 -13.127 3.796 -9.421 840 HD11 LEU 111 1HD1 LEU 111 -13.969 2.842 -11.304 841 HD12 LEU 111 2HD1 LEU 111 -12.369 2.100 -11.315 842 HD13 LEU 111 3HD1 LEU 111 -12.700 3.496 -12.341 843 HD21 LEU 111 3HD2 LEU 111 -10.990 3.659 -8.751 844 HD22 LEU 111 1HD2 LEU 111 -10.372 4.371 -10.242 845 HD23 LEU 111 2HD2 LEU 111 -10.777 2.655 -10.186 846 H TYR 112 H TYR 112 -12.905 8.568 -10.507 847 HA TYR 112 HA TYR 112 -11.344 9.154 -8.363 848 HB2 TYR 112 2HB TYR 112 -13.294 11.024 -9.723 849 HB3 TYR 112 3HB TYR 112 -11.959 11.534 -8.695 850 HD1 TYR 112 HD2 TYR 112 -10.530 8.871 -10.163 851 HD2 TYR 112 HD1 TYR 112 -12.023 12.696 -11.277 852 HE1 TYR 112 HE2 TYR 112 -9.031 8.882 -12.113 853 HE2 TYR 112 HE1 TYR 112 -10.529 12.717 -13.231 854 HH TYR 112 HH TYR 112 -7.995 11.154 -13.625 855 H ARG 113 H ARG 113 -14.868 9.625 -8.521 856 HA ARG 113 HA ARG 113 -15.024 10.411 -5.759 857 HB2 ARG 113 2HB ARG 113 -17.286 9.613 -7.596 858 HB3 ARG 113 3HB ARG 113 -17.402 10.555 -6.115 859 HG2 ARG 113 2HG ARG 113 -16.355 12.424 -7.106 860 HG3 ARG 113 3HG ARG 113 -15.840 11.482 -8.506 861 HD2 ARG 113 2HD ARG 113 -18.697 12.106 -7.765 862 HD3 ARG 113 3HD ARG 113 -17.761 12.930 -9.012 863 HE ARG 113 HE ARG 113 -17.640 10.308 -9.723 864 HH11 ARG 113 1HH1 ARG 113 -20.230 12.526 -9.025 865 HH12 ARG 113 2HH1 ARG 113 -21.353 11.756 -10.096 866 HH21 ARG 113 1HH2 ARG 113 -19.109 9.285 -11.137 867 HH22 ARG 113 2HH2 ARG 113 -20.715 9.912 -11.296 868 H ALA 114 H ALA 114 -15.212 7.457 -7.544 869 HA ALA 114 HA ALA 114 -16.755 5.827 -5.949 870 HB1 ALA 114 1HB ALA 114 -14.164 4.955 -7.210 871 HB2 ALA 114 2HB ALA 114 -15.590 3.972 -6.874 872 HB3 ALA 114 3HB ALA 114 -15.651 5.219 -8.120 873 H ILE 115 H ILE 115 -13.378 6.775 -5.494 874 HA ILE 115 HA ILE 115 -13.031 5.138 -3.160 875 HB ILE 115 HB ILE 115 -11.325 7.408 -4.191 876 HG12 ILE 115 2HG1 ILE 115 -11.473 5.596 -5.810 877 HG13 ILE 115 3HG1 ILE 115 -9.880 5.593 -5.062 878 HG21 ILE 115 1HG2 ILE 115 -11.013 5.475 -1.940 879 HG22 ILE 115 2HG2 ILE 115 -9.584 6.033 -2.810 880 HG23 ILE 115 3HG2 ILE 115 -10.637 7.197 -2.006 881 HD11 ILE 115 3HD1 ILE 115 -11.483 3.904 -3.500 882 HD12 ILE 115 1HD1 ILE 115 -11.827 3.509 -5.184 883 HD13 ILE 115 2HD1 ILE 115 -10.168 3.456 -4.587 884 H LYS 116 H LYS 116 -14.280 8.267 -3.805 885 HA LYS 116 HA LYS 116 -13.769 9.462 -1.276 886 HB2 LYS 116 2HB LYS 116 -14.793 10.317 -3.701 887 HB3 LYS 116 3HB LYS 116 -16.184 10.395 -2.628 888 HG2 LYS 116 2HG LYS 116 -13.519 11.687 -2.084 889 HG3 LYS 116 3HG LYS 116 -14.930 12.511 -2.751 890 HD2 LYS 116 2HD LYS 116 -14.809 11.135 -0.067 891 HD3 LYS 116 3HD LYS 116 -14.702 12.878 -0.331 892 HE2 LYS 116 2HE LYS 116 -17.047 11.079 -0.925 893 HE3 LYS 116 3HE LYS 116 -16.950 12.327 0.316 894 HZ1 LYS 116 3HZ LYS 116 -16.363 13.645 -1.994 895 HZ2 LYS 116 1HZ LYS 116 -17.855 13.661 -1.195 896 HZ3 LYS 116 2HZ LYS 116 -17.586 12.574 -2.462 897 H LYS 117 H LYS 117 -16.391 7.516 -2.585 898 HA LYS 117 HA LYS 117 -18.170 7.883 -0.398 899 HB2 LYS 117 2HB LYS 117 -18.293 6.679 -2.906 900 HB3 LYS 117 3HB LYS 117 -18.481 5.342 -1.778 901 HG2 LYS 117 2HG LYS 117 -20.327 6.542 -0.689 902 HG3 LYS 117 3HG LYS 117 -20.155 7.845 -1.868 903 HD2 LYS 117 2HD LYS 117 -20.351 5.681 -3.498 904 HD3 LYS 117 3HD LYS 117 -21.374 5.184 -2.149 905 HE2 LYS 117 2HE LYS 117 -22.992 6.379 -3.113 906 HE3 LYS 117 3HE LYS 117 -22.107 7.809 -2.582 907 HZ1 LYS 117 3HZ LYS 117 -22.627 6.975 -5.198 908 HZ2 LYS 117 1HZ LYS 117 -20.954 6.885 -4.961 909 HZ3 LYS 117 2HZ LYS 117 -21.769 8.341 -4.688 910 H LYS 118 H LYS 118 -15.730 5.454 -1.190 911 HA LYS 118 HA LYS 118 -16.045 4.358 1.528 912 HB2 LYS 118 2HB LYS 118 -15.271 2.985 -1.044 913 HB3 LYS 118 3HB LYS 118 -15.010 2.259 0.537 914 HG2 LYS 118 2HG LYS 118 -17.515 2.632 0.912 915 HG3 LYS 118 3HG LYS 118 -17.598 2.889 -0.833 916 HD2 LYS 118 2HD LYS 118 -16.482 0.665 -1.124 917 HD3 LYS 118 3HD LYS 118 -16.655 0.417 0.615 918 HE2 LYS 118 2HE LYS 118 -18.805 -0.144 0.410 919 HE3 LYS 118 3HE LYS 118 -19.144 1.246 -0.621 920 HZ1 LYS 118 3HZ LYS 118 -19.548 -0.887 -1.734 921 HZ2 LYS 118 1HZ LYS 118 -17.915 -1.292 -1.553 922 HZ3 LYS 118 2HZ LYS 118 -18.358 0.023 -2.520 Start of MODEL 18 1 H1 VAL 1 H VAL 1 -0.977 -0.572 1.104 2 HA VAL 1 HA VAL 1 -1.729 1.938 0.894 3 HB VAL 1 HB VAL 1 -0.747 3.011 -1.053 4 HG11 VAL 1 1HG1 VAL 1 1.184 2.077 1.053 5 HG12 VAL 1 2HG1 VAL 1 1.620 3.271 -0.171 6 HG13 VAL 1 3HG1 VAL 1 0.314 3.608 0.966 7 HG21 VAL 1 3HG2 VAL 1 1.573 1.646 -1.636 8 HG22 VAL 1 1HG2 VAL 1 0.378 0.359 -1.471 9 HG23 VAL 1 2HG2 VAL 1 0.111 1.669 -2.621 10 H TRP 2 H TRP 2 -1.277 -1.043 -0.715 11 HA TRP 2 HA TRP 2 -2.352 -2.051 -2.493 12 HB2 TRP 2 2HB TRP 2 -4.819 -2.183 -2.051 13 HB3 TRP 2 3HB TRP 2 -3.812 -2.568 -0.658 14 HD1 TRP 2 HD1 TRP 2 -6.478 -0.178 -1.830 15 HE1 TRP 2 HE1 TRP 2 -7.112 1.411 0.094 16 HE3 TRP 2 HE3 TRP 2 -2.731 -1.338 1.449 17 HZ2 TRP 2 HZ2 TRP 2 -6.150 2.083 2.661 18 HZ3 TRP 2 HZ3 TRP 2 -2.659 -0.176 3.617 19 HH2 TRP 2 HH2 TRP 2 -4.334 1.499 4.208 20 HA PRO 3 HA PRO 3 -3.045 1.784 -4.977 21 HB2 PRO 3 2HB PRO 3 -1.521 0.967 -7.070 22 HB3 PRO 3 3HB PRO 3 -0.850 1.787 -5.655 23 HG2 PRO 3 2HG PRO 3 -0.908 -1.136 -6.299 24 HG3 PRO 3 3HG PRO 3 0.416 -0.164 -5.631 25 HD2 PRO 3 2HD PRO 3 -1.155 -1.743 -4.090 26 HD3 PRO 3 3HD PRO 3 -0.450 -0.226 -3.495 27 H LEU 4 H LEU 4 -5.079 0.044 -4.738 28 HA LEU 4 HA LEU 4 -5.583 -1.191 -7.330 29 HB2 LEU 4 2HB LEU 4 -7.164 -1.168 -4.766 30 HB3 LEU 4 3HB LEU 4 -7.676 -1.989 -6.239 31 HG LEU 4 HG LEU 4 -5.139 -2.643 -4.748 32 HD11 LEU 4 1HD1 LEU 4 -7.732 -3.119 -3.880 33 HD12 LEU 4 2HD1 LEU 4 -6.266 -3.929 -3.330 34 HD13 LEU 4 3HD1 LEU 4 -7.228 -4.634 -4.629 35 HD21 LEU 4 3HD2 LEU 4 -4.779 -3.536 -6.808 36 HD22 LEU 4 1HD2 LEU 4 -6.499 -3.669 -7.176 37 HD23 LEU 4 2HD2 LEU 4 -5.732 -4.846 -6.110 38 H VAL 5 H VAL 5 -6.366 1.653 -5.553 39 HA VAL 5 HA VAL 5 -8.677 2.295 -7.195 40 HB VAL 5 HB VAL 5 -8.788 4.371 -5.873 41 HG11 VAL 5 1HG1 VAL 5 -8.552 2.672 -3.599 42 HG12 VAL 5 2HG1 VAL 5 -10.011 3.188 -4.448 43 HG13 VAL 5 3HG1 VAL 5 -9.168 1.723 -4.952 44 HG21 VAL 5 3HG2 VAL 5 -6.531 4.882 -5.419 45 HG22 VAL 5 1HG2 VAL 5 -7.251 4.494 -3.856 46 HG23 VAL 5 2HG2 VAL 5 -6.240 3.307 -4.681 47 H ILE 6 H ILE 6 -5.368 3.455 -6.688 48 HA ILE 6 HA ILE 6 -5.341 5.687 -8.291 49 HB ILE 6 HB ILE 6 -2.923 5.093 -8.779 50 HG12 ILE 6 2HG1 ILE 6 -2.432 3.159 -6.864 51 HG13 ILE 6 3HG1 ILE 6 -3.885 2.567 -7.662 52 HG21 ILE 6 1HG2 ILE 6 -3.139 6.514 -6.992 53 HG22 ILE 6 2HG2 ILE 6 -4.124 5.380 -6.070 54 HG23 ILE 6 3HG2 ILE 6 -2.385 5.124 -6.211 55 HD11 ILE 6 3HD1 ILE 6 -1.150 2.974 -8.759 56 HD12 ILE 6 1HD1 ILE 6 -2.240 1.598 -8.922 57 HD13 ILE 6 2HD1 ILE 6 -2.541 3.074 -9.838 58 H ARG 7 H ARG 7 -4.786 2.320 -9.297 59 HA ARG 7 HA ARG 7 -4.224 2.703 -11.964 60 HB2 ARG 7 2HB ARG 7 -5.265 0.440 -12.318 61 HB3 ARG 7 3HB ARG 7 -4.060 0.510 -11.039 62 HG2 ARG 7 2HG ARG 7 -5.859 0.641 -9.373 63 HG3 ARG 7 3HG ARG 7 -7.049 0.515 -10.671 64 HD2 ARG 7 2HD ARG 7 -5.196 -1.599 -11.002 65 HD3 ARG 7 3HD ARG 7 -5.659 -1.565 -9.301 66 HE ARG 7 HE ARG 7 -8.004 -1.349 -10.740 67 HH11 ARG 7 1HH1 ARG 7 -5.409 -3.649 -10.425 68 HH12 ARG 7 2HH1 ARG 7 -6.408 -5.021 -10.775 69 HH21 ARG 7 1HH2 ARG 7 -9.329 -3.148 -11.202 70 HH22 ARG 7 2HH2 ARG 7 -8.637 -4.734 -11.217 71 H THR 8 H THR 8 -7.397 2.540 -10.402 72 HA THR 8 HA THR 8 -9.056 2.526 -12.599 73 HB THR 8 HB THR 8 -9.825 4.348 -10.376 74 HG1 THR 8 HG1 THR 8 -9.572 1.529 -10.026 75 HG21 THR 8 3HG2 THR 8 -11.096 2.263 -12.094 76 HG22 THR 8 1HG2 THR 8 -11.625 3.908 -11.747 77 HG23 THR 8 2HG2 THR 8 -11.818 2.645 -10.531 78 H VAL 9 H VAL 9 -7.471 5.302 -11.076 79 HA VAL 9 HA VAL 9 -8.677 7.257 -12.752 80 HB VAL 9 HB VAL 9 -6.053 7.526 -11.287 81 HG11 VAL 9 1HG1 VAL 9 -6.227 9.776 -11.577 82 HG12 VAL 9 2HG1 VAL 9 -7.077 9.250 -13.032 83 HG13 VAL 9 3HG1 VAL 9 -7.990 9.748 -11.607 84 HG21 VAL 9 3HG2 VAL 9 -8.150 8.691 -9.806 85 HG22 VAL 9 1HG2 VAL 9 -8.661 7.054 -10.220 86 HG23 VAL 9 2HG2 VAL 9 -7.142 7.314 -9.363 87 H ILE 10 H ILE 10 -5.441 5.771 -12.739 88 HA ILE 10 HA ILE 10 -4.416 7.076 -14.977 89 HB ILE 10 HB ILE 10 -3.600 4.262 -14.700 90 HG12 ILE 10 2HG1 ILE 10 -3.512 6.189 -12.386 91 HG13 ILE 10 3HG1 ILE 10 -4.081 4.524 -12.399 92 HG21 ILE 10 1HG2 ILE 10 -2.497 6.793 -15.443 93 HG22 ILE 10 2HG2 ILE 10 -1.506 6.068 -14.178 94 HG23 ILE 10 3HG2 ILE 10 -1.825 5.177 -15.666 95 HD11 ILE 10 3HD1 ILE 10 -1.321 5.589 -12.237 96 HD12 ILE 10 1HD1 ILE 10 -2.075 4.249 -11.373 97 HD13 ILE 10 2HD1 ILE 10 -1.573 4.046 -13.052 98 H ALA 11 H ALA 11 -6.815 4.641 -14.760 99 HA ALA 11 HA ALA 11 -6.621 3.204 -17.080 100 HB1 ALA 11 1HB ALA 11 -9.063 3.013 -17.039 101 HB2 ALA 11 2HB ALA 11 -8.366 2.824 -15.429 102 HB3 ALA 11 3HB ALA 11 -9.144 4.341 -15.881 103 H GLY 12 H GLY 12 -7.293 6.582 -16.736 104 HA2 GLY 12 2HA GLY 12 -8.226 6.817 -19.496 105 HA3 GLY 12 3HA GLY 12 -8.179 8.106 -18.303 106 H TYR 13 H TYR 13 -5.337 7.206 -17.658 107 HA TYR 13 HA TYR 13 -3.934 9.143 -18.996 108 HB2 TYR 13 2HB TYR 13 -2.169 8.375 -17.826 109 HB3 TYR 13 3HB TYR 13 -3.313 7.242 -17.116 110 HD1 TYR 13 HD2 TYR 13 -0.974 7.598 -19.997 111 HD2 TYR 13 HD1 TYR 13 -2.928 4.956 -17.295 112 HE1 TYR 13 HE2 TYR 13 0.340 5.721 -20.892 113 HE2 TYR 13 HE1 TYR 13 -1.619 3.072 -18.181 114 HH TYR 13 HH TYR 13 -0.374 2.708 -20.678 115 H ASN 14 H ASN 14 -4.364 5.756 -19.946 116 HA ASN 14 HA ASN 14 -2.686 5.554 -22.091 117 HB2 ASN 14 2HB ASN 14 -4.253 3.783 -21.165 118 HB3 ASN 14 3HB ASN 14 -5.518 4.509 -22.152 119 HD21 ASN 14 1HD2 ASN 14 -2.174 3.363 -22.461 120 HD22 ASN 14 2HD2 ASN 14 -2.400 2.594 -23.992 121 H LEU 15 H LEU 15 -5.486 7.538 -21.806 122 HA LEU 15 HA LEU 15 -5.586 8.038 -24.686 123 HB2 LEU 15 2HB LEU 15 -7.668 7.667 -23.333 124 HB3 LEU 15 3HB LEU 15 -7.337 9.199 -22.529 125 HG LEU 15 HG LEU 15 -7.302 9.929 -25.161 126 HD11 LEU 15 1HD1 LEU 15 -9.797 8.625 -25.416 127 HD12 LEU 15 2HD1 LEU 15 -8.587 7.393 -25.060 128 HD13 LEU 15 3HD1 LEU 15 -8.369 8.470 -26.439 129 HD21 LEU 15 3HD2 LEU 15 -9.946 9.934 -23.846 130 HD22 LEU 15 1HD2 LEU 15 -9.022 11.261 -24.550 131 HD23 LEU 15 2HD2 LEU 15 -8.618 10.662 -22.941 132 H TYR 16 H TYR 16 -4.755 9.587 -21.654 133 HA TYR 16 HA TYR 16 -4.622 12.232 -22.286 134 HB2 TYR 16 2HB TYR 16 -3.427 12.438 -20.382 135 HB3 TYR 16 3HB TYR 16 -3.711 10.709 -20.210 136 HD1 TYR 16 HD2 TYR 16 -1.303 13.018 -21.904 137 HD2 TYR 16 HD1 TYR 16 -1.880 9.377 -19.780 138 HE1 TYR 16 HE2 TYR 16 1.125 12.623 -21.931 139 HE2 TYR 16 HE1 TYR 16 0.546 8.973 -19.800 140 HH TYR 16 HH TYR 16 2.728 10.900 -20.074 141 H ARG 17 H ARG 17 -2.290 9.729 -23.173 142 HA ARG 17 HA ARG 17 -0.632 11.645 -24.592 143 HB2 ARG 17 2HB ARG 17 -0.256 9.050 -23.458 144 HB3 ARG 17 3HB ARG 17 0.150 8.974 -25.167 145 HG2 ARG 17 2HG ARG 17 1.258 11.319 -23.856 146 HG3 ARG 17 3HG ARG 17 1.806 9.803 -23.138 147 HD2 ARG 17 2HD ARG 17 3.056 9.281 -24.922 148 HD3 ARG 17 3HD ARG 17 1.800 9.774 -26.056 149 HE ARG 17 HE ARG 17 3.148 11.974 -24.786 150 HH11 ARG 17 1HH1 ARG 17 3.199 9.727 -27.445 151 HH12 ARG 17 2HH1 ARG 17 4.166 10.747 -28.458 152 HH21 ARG 17 1HH2 ARG 17 4.421 13.326 -26.111 153 HH22 ARG 17 2HH2 ARG 17 4.861 12.793 -27.698 154 H ALA 18 H ALA 18 -3.142 9.357 -25.249 155 HA ALA 18 HA ALA 18 -2.745 8.696 -27.892 156 HB1 ALA 18 1HB ALA 18 -5.428 9.412 -26.728 157 HB2 ALA 18 2HB ALA 18 -5.087 8.292 -28.047 158 HB3 ALA 18 3HB ALA 18 -4.592 7.893 -26.402 159 H ILE 19 H ILE 19 -3.946 11.714 -26.543 160 HA ILE 19 HA ILE 19 -4.638 12.829 -29.102 161 HB ILE 19 HB ILE 19 -4.336 14.161 -26.409 162 HG12 ILE 19 2HG1 ILE 19 -6.134 12.524 -26.426 163 HG13 ILE 19 3HG1 ILE 19 -6.816 14.147 -26.429 164 HG21 ILE 19 1HG2 ILE 19 -4.831 15.221 -29.089 165 HG22 ILE 19 2HG2 ILE 19 -6.011 15.732 -27.883 166 HG23 ILE 19 3HG2 ILE 19 -4.295 16.042 -27.623 167 HD11 ILE 19 3HD1 ILE 19 -7.201 13.966 -28.839 168 HD12 ILE 19 1HD1 ILE 19 -6.551 12.327 -28.809 169 HD13 ILE 19 2HD1 ILE 19 -8.035 12.704 -27.933 170 H LYS 20 H LYS 20 -1.793 12.579 -27.197 171 HA LYS 20 HA LYS 20 -0.430 14.865 -28.229 172 HB2 LYS 20 2HB LYS 20 0.025 13.048 -26.191 173 HB3 LYS 20 3HB LYS 20 1.282 12.664 -27.360 174 HG2 LYS 20 2HG LYS 20 0.757 15.372 -26.150 175 HG3 LYS 20 3HG LYS 20 2.070 14.272 -25.721 176 HD2 LYS 20 2HD LYS 20 3.290 15.324 -27.265 177 HD3 LYS 20 3HD LYS 20 2.281 14.523 -28.472 178 HE2 LYS 20 2HE LYS 20 0.806 16.735 -27.593 179 HE3 LYS 20 3HE LYS 20 2.459 17.316 -27.791 180 HZ1 LYS 20 3HZ LYS 20 0.769 15.987 -29.835 181 HZ2 LYS 20 1HZ LYS 20 2.420 16.294 -30.042 182 HZ3 LYS 20 2HZ LYS 20 1.339 17.580 -29.851 183 H LYS 21 H LYS 21 -0.518 11.434 -29.074 184 HA LYS 21 HA LYS 21 1.484 11.590 -31.086 185 HB2 LYS 21 2HB LYS 21 0.573 9.376 -31.804 186 HB3 LYS 21 3HB LYS 21 0.997 9.457 -30.099 187 HG2 LYS 21 2HG LYS 21 -1.339 9.738 -29.506 188 HG3 LYS 21 3HG LYS 21 -1.788 9.729 -31.213 189 HD2 LYS 21 2HD LYS 21 -2.202 7.549 -30.241 190 HD3 LYS 21 3HD LYS 21 -0.884 7.442 -31.411 191 HE2 LYS 21 2HE LYS 21 0.750 7.401 -29.662 192 HE3 LYS 21 3HE LYS 21 -0.474 7.751 -28.441 193 HZ1 LYS 21 3HZ LYS 21 -0.928 5.604 -28.256 194 HZ2 LYS 21 1HZ LYS 21 0.383 5.266 -29.270 195 HZ3 LYS 21 2HZ LYS 21 -1.168 5.435 -29.922 196 H LYS 22 H LYS 22 -2.032 11.852 -31.102 197 HA LYS 22 HA LYS 22 -3.523 12.464 -32.712 198 HB2 LYS 22 2HB LYS 22 -2.002 14.516 -32.460 199 HB3 LYS 22 3HB LYS 22 -1.263 14.006 -33.972 200 HG2 LYS 22 2HG LYS 22 -2.845 15.085 -35.074 201 HG3 LYS 22 3HG LYS 22 -4.046 13.986 -34.391 202 HD2 LYS 22 2HD LYS 22 -4.397 15.439 -32.516 203 HD3 LYS 22 3HD LYS 22 -3.053 16.474 -33.004 204 HE2 LYS 22 2HE LYS 22 -4.760 16.329 -35.223 205 HE3 LYS 22 3HE LYS 22 -5.810 16.546 -33.823 206 HZ1 LYS 22 3HZ LYS 22 -4.499 18.525 -35.123 207 HZ2 LYS 22 1HZ LYS 22 -3.496 18.248 -33.789 208 HZ3 LYS 22 2HZ LYS 22 -5.126 18.636 -33.555 209 H GLY 23 H GLY 23 -2.153 10.013 -33.186 210 HA2 GLY 23 2HA GLY 23 -2.928 9.467 -35.813 211 HA3 GLY 23 3HA GLY 23 -1.199 9.784 -35.834 212 H GLY 24 H GLY 24 0.141 8.144 -35.405 213 HA2 GLY 24 2HA GLY 24 -0.858 5.867 -33.845 214 HA3 GLY 24 3HA GLY 24 -0.249 5.568 -35.466 215 H GLY 25 H GLY 25 1.559 4.409 -35.047 216 HA2 GLY 25 2HA GLY 25 3.949 4.638 -34.817 217 HA3 GLY 25 3HA GLY 25 3.667 5.810 -33.538 218 H GLY 26 H GLY 26 4.560 4.952 -31.763 219 HA2 GLY 26 2HA GLY 26 3.463 2.427 -30.790 220 HA3 GLY 26 3HA GLY 26 5.204 2.496 -31.013 221 H GLY 27 H GLY 27 4.301 1.929 -28.543 222 HA2 GLY 27 2HA GLY 27 4.215 4.416 -27.010 223 HA3 GLY 27 3HA GLY 27 3.942 2.798 -26.380 224 H GLY 28 H GLY 28 5.491 4.364 -24.888 225 HA2 GLY 28 2HA GLY 28 7.508 4.292 -23.782 226 HA3 GLY 28 3HA GLY 28 7.955 2.939 -24.810 227 H GLY 29 H GLY 29 7.923 6.439 -24.519 228 HA2 GLY 29 2HA GLY 29 9.923 7.646 -25.173 229 HA3 GLY 29 3HA GLY 29 10.097 6.522 -26.513 230 H GLY 30 H GLY 30 10.310 8.980 -27.303 231 HA2 GLY 30 2HA GLY 30 8.888 9.620 -29.345 232 HA3 GLY 30 3HA GLY 30 7.639 9.899 -28.140 233 H GLY 31 H GLY 31 7.476 12.092 -28.721 234 HA2 GLY 31 2HA GLY 31 9.391 13.777 -27.351 235 HA3 GLY 31 3HA GLY 31 9.345 13.997 -29.094 236 H GLY 32 H GLY 32 6.867 14.052 -29.865 237 HA2 GLY 32 2HA GLY 32 4.771 15.055 -29.673 238 HA3 GLY 32 3HA GLY 32 5.179 15.534 -28.032 239 H VAL 33 H VAL 33 3.893 17.369 -29.431 240 HA VAL 33 HA VAL 33 5.985 19.335 -30.065 241 HB VAL 33 HB VAL 33 4.418 20.302 -31.790 242 HG11 VAL 33 1HG1 VAL 33 6.435 18.956 -32.327 243 HG12 VAL 33 2HG1 VAL 33 5.413 17.519 -32.389 244 HG13 VAL 33 3HG1 VAL 33 5.162 18.832 -33.540 245 HG21 VAL 33 3HG2 VAL 33 2.789 18.687 -32.779 246 HG22 VAL 33 1HG2 VAL 33 3.049 17.649 -31.377 247 HG23 VAL 33 2HG2 VAL 33 2.356 19.257 -31.167 248 H TRP 34 H TRP 34 2.632 18.754 -29.110 249 HA TRP 34 HA TRP 34 2.717 21.267 -27.585 250 HB2 TRP 34 2HB TRP 34 1.346 21.590 -29.615 251 HB3 TRP 34 3HB TRP 34 0.330 20.234 -29.133 252 HD1 TRP 34 HD1 TRP 34 -1.827 20.957 -27.984 253 HE1 TRP 34 HE1 TRP 34 -2.599 22.981 -26.595 254 HE3 TRP 34 HE3 TRP 34 2.571 23.557 -27.825 255 HZ2 TRP 34 HZ2 TRP 34 -1.491 25.365 -25.568 256 HZ3 TRP 34 HZ3 TRP 34 2.631 25.701 -26.619 257 HH2 TRP 34 HH2 TRP 34 0.641 26.585 -25.515 258 HA PRO 35 HA PRO 35 1.407 17.461 -25.114 259 HB2 PRO 35 2HB PRO 35 3.502 17.469 -23.387 260 HB3 PRO 35 3HB PRO 35 3.523 16.589 -24.920 261 HG2 PRO 35 2HG PRO 35 4.703 19.258 -24.251 262 HG3 PRO 35 3HG PRO 35 5.403 17.931 -25.196 263 HD2 PRO 35 2HD PRO 35 4.281 20.108 -26.350 264 HD3 PRO 35 3HD PRO 35 4.229 18.498 -27.096 265 H LEU 36 H LEU 36 0.080 19.714 -24.850 266 HA LEU 36 HA LEU 36 0.646 20.937 -22.268 267 HB2 LEU 36 2HB LEU 36 0.001 22.588 -23.720 268 HB3 LEU 36 3HB LEU 36 -1.138 21.545 -24.568 269 HG LEU 36 HG LEU 36 -2.673 21.730 -22.623 270 HD11 LEU 36 1HD1 LEU 36 -2.111 22.729 -20.714 271 HD12 LEU 36 2HD1 LEU 36 -1.417 24.118 -21.548 272 HD13 LEU 36 3HD1 LEU 36 -0.447 22.667 -21.295 273 HD21 LEU 36 3HD2 LEU 36 -2.606 23.273 -24.698 274 HD22 LEU 36 1HD2 LEU 36 -2.000 24.488 -23.572 275 HD23 LEU 36 2HD2 LEU 36 -3.581 23.751 -23.308 276 H VAL 37 H VAL 37 -2.209 19.467 -23.830 277 HA VAL 37 HA VAL 37 -3.789 19.225 -21.563 278 HB VAL 37 HB VAL 37 -5.005 17.449 -22.749 279 HG11 VAL 37 1HG1 VAL 37 -4.224 19.967 -24.138 280 HG12 VAL 37 2HG1 VAL 37 -5.250 18.805 -24.982 281 HG13 VAL 37 3HG1 VAL 37 -5.776 19.495 -23.446 282 HG21 VAL 37 3HG2 VAL 37 -4.202 16.828 -25.049 283 HG22 VAL 37 1HG2 VAL 37 -2.657 17.569 -24.630 284 HG23 VAL 37 2HG2 VAL 37 -3.243 16.177 -23.720 285 H ILE 38 H ILE 38 -1.299 17.062 -22.811 286 HA ILE 38 HA ILE 38 -1.704 14.806 -21.298 287 HB ILE 38 HB ILE 38 0.734 14.419 -21.406 288 HG12 ILE 38 2HG1 ILE 38 1.781 16.374 -22.983 289 HG13 ILE 38 3HG1 ILE 38 0.704 17.319 -21.960 290 HG21 ILE 38 1HG2 ILE 38 -0.965 15.085 -23.706 291 HG22 ILE 38 2HG2 ILE 38 0.763 15.016 -24.050 292 HG23 ILE 38 3HG2 ILE 38 -0.054 13.617 -23.352 293 HD11 ILE 38 3HD1 ILE 38 3.165 15.830 -21.267 294 HD12 ILE 38 1HD1 ILE 38 2.585 17.396 -20.701 295 HD13 ILE 38 2HD1 ILE 38 1.883 15.911 -20.058 296 H ARG 39 H ARG 39 -0.234 17.852 -20.316 297 HA ARG 39 HA ARG 39 0.333 16.807 -17.654 298 HB2 ARG 39 2HB ARG 39 1.738 18.593 -17.358 299 HB3 ARG 39 3HB ARG 39 1.785 18.471 -19.112 300 HG2 ARG 39 2HG ARG 39 1.397 20.687 -18.960 301 HG3 ARG 39 3HG ARG 39 -0.279 20.143 -18.867 302 HD2 ARG 39 2HD ARG 39 -0.488 20.744 -16.706 303 HD3 ARG 39 3HD ARG 39 1.147 20.224 -16.300 304 HE ARG 39 HE ARG 39 1.488 22.482 -17.804 305 HH11 ARG 39 1HH1 ARG 39 -0.234 21.686 -14.884 306 HH12 ARG 39 2HH1 ARG 39 -0.077 23.272 -14.204 307 HH21 ARG 39 1HH2 ARG 39 1.702 24.573 -16.919 308 HH22 ARG 39 2HH2 ARG 39 1.024 24.914 -15.363 309 H THR 40 H THR 40 -2.092 18.550 -19.316 310 HA THR 40 HA THR 40 -3.132 19.973 -17.051 311 HB THR 40 HB THR 40 -4.799 19.352 -19.461 312 HG1 THR 40 HG1 THR 40 -2.612 21.179 -19.351 313 HG21 THR 40 3HG2 THR 40 -6.085 20.897 -18.502 314 HG22 THR 40 1HG2 THR 40 -4.805 22.082 -18.758 315 HG23 THR 40 2HG2 THR 40 -4.876 21.173 -17.248 316 H VAL 41 H VAL 41 -4.134 17.080 -18.864 317 HA VAL 41 HA VAL 41 -6.352 16.495 -17.187 318 HB VAL 41 HB VAL 41 -4.875 14.463 -18.846 319 HG11 VAL 41 1HG1 VAL 41 -7.769 14.430 -18.891 320 HG12 VAL 41 2HG1 VAL 41 -6.633 13.146 -18.474 321 HG13 VAL 41 3HG1 VAL 41 -7.138 14.310 -17.249 322 HG21 VAL 41 3HG2 VAL 41 -6.245 16.878 -19.724 323 HG22 VAL 41 1HG2 VAL 41 -5.200 15.778 -20.623 324 HG23 VAL 41 2HG2 VAL 41 -6.915 15.410 -20.436 325 H ILE 42 H ILE 42 -3.196 14.858 -17.518 326 HA ILE 42 HA ILE 42 -3.477 13.124 -15.359 327 HB ILE 42 HB ILE 42 -1.284 14.038 -17.044 328 HG12 ILE 42 2HG1 ILE 42 -2.067 11.478 -15.656 329 HG13 ILE 42 3HG1 ILE 42 -2.168 11.860 -17.371 330 HG21 ILE 42 1HG2 ILE 42 -0.336 14.829 -14.967 331 HG22 ILE 42 2HG2 ILE 42 -0.672 13.282 -14.190 332 HG23 ILE 42 3HG2 ILE 42 0.516 13.377 -15.490 333 HD11 ILE 42 3HD1 ILE 42 0.252 11.206 -15.737 334 HD12 ILE 42 1HD1 ILE 42 -0.354 10.414 -17.191 335 HD13 ILE 42 2HD1 ILE 42 0.377 12.016 -17.298 336 H ALA 43 H ALA 43 -2.739 16.507 -15.433 337 HA ALA 43 HA ALA 43 -1.371 16.999 -13.130 338 HB1 ALA 43 1HB ALA 43 -3.543 18.858 -13.247 339 HB2 ALA 43 2HB ALA 43 -1.847 19.097 -13.671 340 HB3 ALA 43 3HB ALA 43 -2.983 18.498 -14.881 341 H GLY 44 H GLY 44 -4.574 15.722 -13.418 342 HA2 GLY 44 2HA GLY 44 -5.144 16.193 -10.585 343 HA3 GLY 44 3HA GLY 44 -6.273 15.571 -11.778 344 H TYR 45 H TYR 45 -4.553 13.542 -12.834 345 HA TYR 45 HA TYR 45 -5.202 11.405 -11.166 346 HB2 TYR 45 2HB TYR 45 -4.782 10.513 -13.193 347 HB3 TYR 45 3HB TYR 45 -3.655 11.794 -13.625 348 HD1 TYR 45 HD1 TYR 45 -3.889 8.740 -11.492 349 HD2 TYR 45 HD2 TYR 45 -1.394 11.303 -13.797 350 HE1 TYR 45 HE1 TYR 45 -2.011 7.184 -11.179 351 HE2 TYR 45 HE2 TYR 45 0.490 9.753 -13.491 352 HH TYR 45 HH TYR 45 1.134 7.966 -11.716 353 H ASN 46 H ASN 46 -2.065 13.015 -11.642 354 HA ASN 46 HA ASN 46 -0.504 11.483 -9.961 355 HB2 ASN 46 2HB ASN 46 -0.332 14.092 -11.188 356 HB3 ASN 46 3HB ASN 46 0.358 14.130 -9.568 357 HD21 ASN 46 1HD2 ASN 46 2.461 13.882 -9.641 358 HD22 ASN 46 2HD2 ASN 46 3.329 12.805 -10.676 359 H LEU 47 H LEU 47 -3.054 13.632 -9.150 360 HA LEU 47 HA LEU 47 -2.235 14.138 -6.449 361 HB2 LEU 47 2HB LEU 47 -3.996 15.321 -8.115 362 HB3 LEU 47 3HB LEU 47 -5.093 14.338 -7.147 363 HG LEU 47 HG LEU 47 -4.933 16.606 -6.276 364 HD11 LEU 47 1HD1 LEU 47 -5.043 14.435 -4.818 365 HD12 LEU 47 2HD1 LEU 47 -4.843 16.016 -4.062 366 HD13 LEU 47 3HD1 LEU 47 -3.446 14.962 -4.285 367 HD21 LEU 47 3HD2 LEU 47 -2.505 16.840 -7.102 368 HD22 LEU 47 1HD2 LEU 47 -2.067 16.100 -5.562 369 HD23 LEU 47 2HD2 LEU 47 -2.957 17.623 -5.587 370 H TYR 48 H TYR 48 -4.482 11.912 -8.034 371 HA TYR 48 HA TYR 48 -5.732 10.795 -5.851 372 HB2 TYR 48 2HB TYR 48 -5.228 10.023 -8.606 373 HB3 TYR 48 3HB TYR 48 -5.258 8.625 -7.537 374 HD1 TYR 48 HD1 TYR 48 -7.219 11.523 -8.728 375 HD2 TYR 48 HD2 TYR 48 -7.296 7.840 -6.600 376 HE1 TYR 48 HE1 TYR 48 -9.678 11.571 -8.748 377 HE2 TYR 48 HE2 TYR 48 -9.756 7.876 -6.615 378 HH TYR 48 HH TYR 48 -11.560 10.093 -6.854 379 H ARG 49 H ARG 49 -2.566 9.986 -7.209 380 HA ARG 49 HA ARG 49 -2.084 7.895 -5.295 381 HB2 ARG 49 2HB ARG 49 -0.894 8.805 -7.723 382 HB3 ARG 49 3HB ARG 49 0.347 8.784 -6.478 383 HG2 ARG 49 2HG ARG 49 -0.797 6.393 -6.032 384 HG3 ARG 49 3HG ARG 49 -1.086 6.560 -7.764 385 HD2 ARG 49 2HD ARG 49 1.255 6.859 -8.187 386 HD3 ARG 49 3HD ARG 49 1.605 6.930 -6.460 387 HE ARG 49 HE ARG 49 0.372 4.481 -7.005 388 HH11 ARG 49 1HH1 ARG 49 3.341 6.163 -7.696 389 HH12 ARG 49 2HH1 ARG 49 4.282 4.714 -7.833 390 HH21 ARG 49 1HH2 ARG 49 1.600 2.567 -7.183 391 HH22 ARG 49 2HH2 ARG 49 3.290 2.670 -7.542 392 H ALA 50 H ALA 50 -1.651 11.301 -5.413 393 HA ALA 50 HA ALA 50 0.522 11.799 -3.818 394 HB1 ALA 50 1HB ALA 50 -1.203 13.408 -4.920 395 HB2 ALA 50 2HB ALA 50 -1.990 13.342 -3.342 396 HB3 ALA 50 3HB ALA 50 -0.328 13.914 -3.474 397 H ILE 51 H ILE 51 -2.673 10.700 -2.838 398 HA ILE 51 HA ILE 51 -2.096 10.933 -0.023 399 HB ILE 51 HB ILE 51 -4.413 9.945 -1.626 400 HG12 ILE 51 2HG1 ILE 51 -5.633 11.548 -0.276 401 HG13 ILE 51 3HG1 ILE 51 -4.236 11.786 0.769 402 HG21 ILE 51 1HG2 ILE 51 -3.777 9.170 1.197 403 HG22 ILE 51 2HG2 ILE 51 -5.446 9.311 0.646 404 HG23 ILE 51 3HG2 ILE 51 -4.355 8.163 -0.131 405 HD11 ILE 51 3HD1 ILE 51 -4.524 13.635 -0.782 406 HD12 ILE 51 1HD1 ILE 51 -3.012 12.780 -1.082 407 HD13 ILE 51 2HD1 ILE 51 -4.396 12.522 -2.144 408 H LYS 52 H LYS 52 -1.859 8.494 -2.486 409 HA LYS 52 HA LYS 52 -1.749 6.217 -0.813 410 HB2 LYS 52 2HB LYS 52 -0.712 6.762 -3.592 411 HB3 LYS 52 3HB LYS 52 -0.528 5.198 -2.809 412 HG2 LYS 52 2HG LYS 52 -3.253 6.055 -2.617 413 HG3 LYS 52 3HG LYS 52 -2.711 6.135 -4.296 414 HD2 LYS 52 2HD LYS 52 -2.615 3.903 -4.485 415 HD3 LYS 52 3HD LYS 52 -1.853 3.713 -2.905 416 HE2 LYS 52 2HE LYS 52 -4.793 4.174 -3.403 417 HE3 LYS 52 3HE LYS 52 -4.049 2.628 -2.996 418 HZ1 LYS 52 3HZ LYS 52 -4.642 4.905 -1.293 419 HZ2 LYS 52 1HZ LYS 52 -3.167 4.132 -0.995 420 HZ3 LYS 52 2HZ LYS 52 -4.611 3.254 -0.924 421 H LYS 53 H LYS 53 0.632 8.574 -1.807 422 HA LYS 53 HA LYS 53 2.855 7.043 -0.767 423 HB2 LYS 53 2HB LYS 53 2.594 9.794 -1.964 424 HB3 LYS 53 3HB LYS 53 4.099 9.236 -1.245 425 HG2 LYS 53 2HG LYS 53 4.452 7.651 -2.890 426 HG3 LYS 53 3HG LYS 53 2.749 7.604 -3.352 427 HD2 LYS 53 2HD LYS 53 2.999 9.271 -4.825 428 HD3 LYS 53 3HD LYS 53 3.948 10.238 -3.693 429 HE2 LYS 53 2HE LYS 53 5.913 8.805 -4.215 430 HE3 LYS 53 3HE LYS 53 4.943 7.992 -5.442 431 HZ1 LYS 53 3HZ LYS 53 5.688 10.866 -5.399 432 HZ2 LYS 53 1HZ LYS 53 4.647 10.162 -6.533 433 HZ3 LYS 53 2HZ LYS 53 6.270 9.688 -6.465 434 H LYS 54 H LYS 54 0.909 9.820 0.194 435 HA LYS 54 HA LYS 54 0.651 10.891 2.184 436 HB2 LYS 54 2HB LYS 54 0.327 8.542 2.982 437 HB3 LYS 54 3HB LYS 54 2.039 8.487 3.380 438 HG2 LYS 54 2HG LYS 54 1.704 9.520 5.314 439 HG3 LYS 54 3HG LYS 54 0.766 10.802 4.545 440 HD2 LYS 54 2HD LYS 54 -0.496 8.129 4.929 441 HD3 LYS 54 3HD LYS 54 -0.326 9.197 6.324 442 HE2 LYS 54 2HE LYS 54 -1.589 10.918 5.240 443 HE3 LYS 54 3HE LYS 54 -1.601 10.022 3.721 444 HZ1 LYS 54 3HZ LYS 54 -3.637 9.465 4.519 445 HZ2 LYS 54 1HZ LYS 54 -3.182 9.597 6.143 446 HZ3 LYS 54 2HZ LYS 54 -2.742 8.230 5.250 447 H GLY 55 H GLY 55 1.901 12.676 2.095 448 HA2 GLY 55 2HA GLY 55 4.470 12.567 3.461 449 HA3 GLY 55 3HA GLY 55 4.517 13.087 1.783 450 H GLY 56 H GLY 56 1.699 13.891 3.584 451 HA2 GLY 56 2HA GLY 56 1.666 15.930 5.034 452 HA3 GLY 56 3HA GLY 56 2.687 16.668 3.809 453 H GLY 57 H GLY 57 -0.505 16.033 4.817 454 HA2 GLY 57 2HA GLY 57 -1.593 17.784 2.848 455 HA3 GLY 57 3HA GLY 57 -1.990 16.110 2.488 456 H GLY 58 H GLY 58 -4.165 17.354 2.799 457 HA2 GLY 58 2HA GLY 58 -5.198 16.476 5.353 458 HA3 GLY 58 3HA GLY 58 -5.237 18.218 5.124 459 H GLY 59 H GLY 59 -7.560 18.017 5.327 460 HA2 GLY 59 2HA GLY 59 -8.839 17.937 2.787 461 HA3 GLY 59 3HA GLY 59 -9.225 16.498 3.719 462 H GLY 60 H GLY 60 -11.415 17.602 3.299 463 HA2 GLY 60 2HA GLY 60 -12.249 18.762 5.788 464 HA3 GLY 60 3HA GLY 60 -12.288 19.918 4.465 465 H GLY 61 H GLY 61 -14.631 19.832 5.234 466 HA2 GLY 61 2HA GLY 61 -16.155 18.476 3.266 467 HA3 GLY 61 3HA GLY 61 -16.298 17.647 4.809 468 H GLY 62 H GLY 62 -18.617 18.308 4.285 469 HA2 GLY 62 2HA GLY 62 -19.470 20.236 6.100 470 HA3 GLY 62 3HA GLY 62 -19.395 21.022 4.530 471 H GLY 63 H GLY 63 -21.568 21.322 4.227 472 HA2 GLY 63 2HA GLY 63 -23.527 19.329 4.727 473 HA3 GLY 63 3HA GLY 63 -23.758 20.789 3.776 474 H GLY 64 H GLY 64 -24.233 20.485 1.708 475 HA2 GLY 64 2HA GLY 64 -24.444 17.999 0.492 476 HA3 GLY 64 3HA GLY 64 -24.369 19.526 -0.373 477 H VAL 65 H VAL 65 -21.677 20.113 0.719 478 HA VAL 65 HA VAL 65 -20.123 19.150 -1.381 479 HB VAL 65 HB VAL 65 -19.560 21.122 0.041 480 HG11 VAL 65 1HG1 VAL 65 -18.404 20.804 2.141 481 HG12 VAL 65 2HG1 VAL 65 -19.993 20.041 2.218 482 HG13 VAL 65 3HG1 VAL 65 -18.549 19.053 1.989 483 HG21 VAL 65 3HG2 VAL 65 -17.162 19.377 0.146 484 HG22 VAL 65 1HG2 VAL 65 -17.934 19.615 -1.422 485 HG23 VAL 65 2HG2 VAL 65 -17.351 21.005 -0.506 486 H TRP 66 H TRP 66 -18.445 17.605 -1.470 487 HA TRP 66 HA TRP 66 -17.673 15.863 0.546 488 HB2 TRP 66 2HB TRP 66 -19.701 14.804 0.802 489 HB3 TRP 66 3HB TRP 66 -20.174 15.074 -0.873 490 HD1 TRP 66 HD1 TRP 66 -17.130 13.133 0.571 491 HE1 TRP 66 HE1 TRP 66 -17.141 10.775 -0.462 492 HE3 TRP 66 HE3 TRP 66 -21.417 13.477 -2.194 493 HZ2 TRP 66 HZ2 TRP 66 -18.753 9.262 -2.216 494 HZ3 TRP 66 HZ3 TRP 66 -22.123 11.530 -3.522 495 HH2 TRP 66 HH2 TRP 66 -20.817 9.467 -3.532 496 HA PRO 67 HA PRO 67 -16.528 13.911 -3.724 497 HB2 PRO 67 2HB PRO 67 -17.610 15.047 -5.940 498 HB3 PRO 67 3HB PRO 67 -18.388 13.725 -5.061 499 HG2 PRO 67 2HG PRO 67 -18.935 16.665 -4.932 500 HG3 PRO 67 3HG PRO 67 -20.083 15.315 -4.985 501 HD2 PRO 67 2HD PRO 67 -19.446 16.596 -2.686 502 HD3 PRO 67 3HD PRO 67 -19.856 14.869 -2.735 503 H LEU 68 H LEU 68 -14.999 15.621 -2.524 504 HA LEU 68 HA LEU 68 -14.282 17.827 -4.285 505 HB2 LEU 68 2HB LEU 68 -13.996 17.232 -1.496 506 HB3 LEU 68 3HB LEU 68 -12.416 17.590 -2.190 507 HG LEU 68 HG LEU 68 -14.654 19.467 -2.759 508 HD11 LEU 68 1HD1 LEU 68 -14.157 20.678 -0.658 509 HD12 LEU 68 2HD1 LEU 68 -13.211 19.291 -0.119 510 HD13 LEU 68 3HD1 LEU 68 -14.944 19.121 -0.398 511 HD21 LEU 68 3HD2 LEU 68 -12.874 20.422 -3.716 512 HD22 LEU 68 1HD2 LEU 68 -11.737 19.412 -2.822 513 HD23 LEU 68 2HD2 LEU 68 -12.398 20.868 -2.077 514 H VAL 69 H VAL 69 -13.303 14.610 -3.566 515 HA VAL 69 HA VAL 69 -10.642 14.931 -4.683 516 HB VAL 69 HB VAL 69 -10.398 12.515 -4.283 517 HG11 VAL 69 1HG1 VAL 69 -10.626 14.544 -2.380 518 HG12 VAL 69 2HG1 VAL 69 -11.473 13.158 -1.688 519 HG13 VAL 69 3HG1 VAL 69 -9.792 13.001 -2.200 520 HG21 VAL 69 3HG2 VAL 69 -13.312 12.719 -3.891 521 HG22 VAL 69 1HG2 VAL 69 -12.335 11.375 -4.481 522 HG23 VAL 69 2HG2 VAL 69 -12.454 11.684 -2.749 523 H ILE 70 H ILE 70 -13.754 13.549 -5.585 524 HA ILE 70 HA ILE 70 -12.891 12.265 -7.952 525 HB ILE 70 HB ILE 70 -15.197 12.056 -8.542 526 HG12 ILE 70 2HG1 ILE 70 -16.793 13.328 -6.766 527 HG13 ILE 70 3HG1 ILE 70 -15.470 14.485 -6.872 528 HG21 ILE 70 1HG2 ILE 70 -14.177 11.322 -6.025 529 HG22 ILE 70 2HG2 ILE 70 -15.845 11.827 -5.766 530 HG23 ILE 70 3HG2 ILE 70 -15.481 10.555 -6.932 531 HD11 ILE 70 3HD1 ILE 70 -15.955 13.897 -9.499 532 HD12 ILE 70 1HD1 ILE 70 -17.567 13.857 -8.785 533 HD13 ILE 70 2HD1 ILE 70 -16.567 15.301 -8.625 534 H ARG 71 H ARG 71 -13.766 15.552 -7.208 535 HA ARG 71 HA ARG 71 -14.080 16.364 -9.948 536 HB2 ARG 71 2HB ARG 71 -14.249 18.624 -9.050 537 HB3 ARG 71 3HB ARG 71 -15.260 17.520 -8.127 538 HG2 ARG 71 2HG ARG 71 -14.217 18.041 -6.245 539 HG3 ARG 71 3HG ARG 71 -12.641 17.691 -6.958 540 HD2 ARG 71 2HD ARG 71 -12.468 19.934 -6.389 541 HD3 ARG 71 3HD ARG 71 -12.901 19.992 -8.097 542 HE ARG 71 HE ARG 71 -15.217 20.079 -6.465 543 HH11 ARG 71 1HH1 ARG 71 -12.545 22.020 -7.566 544 HH12 ARG 71 2HH1 ARG 71 -13.401 23.518 -7.413 545 HH21 ARG 71 1HH2 ARG 71 -16.355 22.045 -6.260 546 HH22 ARG 71 2HH2 ARG 71 -15.568 23.532 -6.670 547 H THR 72 H THR 72 -11.463 16.002 -7.741 548 HA THR 72 HA THR 72 -9.610 17.854 -8.597 549 HB THR 72 HB THR 72 -8.711 15.042 -8.088 550 HG1 THR 72 HG1 THR 72 -9.900 16.816 -6.205 551 HG21 THR 72 3HG2 THR 72 -6.836 16.332 -8.210 552 HG22 THR 72 1HG2 THR 72 -7.216 16.591 -6.508 553 HG23 THR 72 2HG2 THR 72 -7.678 17.798 -7.709 554 H VAL 73 H VAL 73 -9.901 14.514 -9.829 555 HA VAL 73 HA VAL 73 -8.106 14.894 -11.976 556 HB VAL 73 HB VAL 73 -10.298 12.838 -11.667 557 HG11 VAL 73 1HG1 VAL 73 -9.779 12.761 -13.928 558 HG12 VAL 73 2HG1 VAL 73 -8.080 13.153 -13.654 559 HG13 VAL 73 3HG1 VAL 73 -8.697 11.553 -13.237 560 HG21 VAL 73 3HG2 VAL 73 -8.505 12.936 -9.888 561 HG22 VAL 73 1HG2 VAL 73 -8.665 11.398 -10.737 562 HG23 VAL 73 2HG2 VAL 73 -7.352 12.500 -11.150 563 H ILE 74 H ILE 74 -11.632 15.074 -11.749 564 HA ILE 74 HA ILE 74 -12.287 15.313 -14.424 565 HB ILE 74 HB ILE 74 -13.577 16.805 -12.136 566 HG12 ILE 74 2HG1 ILE 74 -13.297 14.152 -12.191 567 HG13 ILE 74 3HG1 ILE 74 -14.763 14.923 -11.596 568 HG21 ILE 74 1HG2 ILE 74 -14.388 16.269 -14.964 569 HG22 ILE 74 2HG2 ILE 74 -15.609 16.473 -13.709 570 HG23 ILE 74 3HG2 ILE 74 -14.464 17.771 -14.044 571 HD11 ILE 74 3HD1 ILE 74 -14.952 12.954 -13.243 572 HD12 ILE 74 1HD1 ILE 74 -15.971 14.373 -13.486 573 HD13 ILE 74 2HD1 ILE 74 -14.523 14.147 -14.469 574 H ALA 75 H ALA 75 -10.699 17.584 -12.351 575 HA ALA 75 HA ALA 75 -11.209 20.027 -13.466 576 HB1 ALA 75 1HB ALA 75 -8.857 20.626 -12.862 577 HB2 ALA 75 2HB ALA 75 -9.775 19.857 -11.567 578 HB3 ALA 75 3HB ALA 75 -8.585 18.927 -12.477 579 H GLY 76 H GLY 76 -9.495 17.365 -14.889 580 HA2 GLY 76 2HA GLY 76 -8.458 19.039 -17.053 581 HA3 GLY 76 3HA GLY 76 -8.093 17.340 -16.790 582 H TYR 77 H TYR 77 -10.914 16.615 -16.457 583 HA TYR 77 HA TYR 77 -11.517 15.847 -19.054 584 HB2 TYR 77 2HB TYR 77 -12.598 14.637 -17.366 585 HB3 TYR 77 3HB TYR 77 -13.177 16.091 -16.562 586 HD1 TYR 77 HD2 TYR 77 -13.449 15.204 -20.162 587 HD2 TYR 77 HD1 TYR 77 -15.493 15.754 -16.471 588 HE1 TYR 77 HE2 TYR 77 -15.604 14.986 -21.329 589 HE2 TYR 77 HE1 TYR 77 -17.653 15.537 -17.627 590 HH TYR 77 HH TYR 77 -18.214 15.974 -20.573 591 H ASN 78 H ASN 78 -12.896 18.538 -17.175 592 HA ASN 78 HA ASN 78 -14.709 19.528 -18.976 593 HB2 ASN 78 2HB ASN 78 -12.889 21.025 -17.084 594 HB3 ASN 78 3HB ASN 78 -14.211 21.788 -17.962 595 HD21 ASN 78 1HD2 ASN 78 -14.090 21.807 -15.216 596 HD22 ASN 78 2HD2 ASN 78 -15.367 20.832 -14.580 597 H LEU 79 H LEU 79 -11.287 19.478 -19.251 598 HA LEU 79 HA LEU 79 -11.260 21.501 -21.354 599 HB2 LEU 79 2HB LEU 79 -9.419 20.694 -19.429 600 HB3 LEU 79 3HB LEU 79 -8.768 20.089 -20.951 601 HG LEU 79 HG LEU 79 -7.851 22.282 -20.360 602 HD11 LEU 79 1HD1 LEU 79 -8.822 23.463 -22.532 603 HD12 LEU 79 2HD1 LEU 79 -9.451 21.840 -22.814 604 HD13 LEU 79 3HD1 LEU 79 -7.717 22.091 -22.618 605 HD21 LEU 79 3HD2 LEU 79 -9.149 23.818 -19.425 606 HD22 LEU 79 1HD2 LEU 79 -10.587 22.849 -19.749 607 HD23 LEU 79 2HD2 LEU 79 -10.005 23.995 -20.957 608 H TYR 80 H TYR 80 -10.843 18.040 -20.896 609 HA TYR 80 HA TYR 80 -9.809 17.256 -23.314 610 HB2 TYR 80 2HB TYR 80 -11.164 16.006 -21.155 611 HB3 TYR 80 3HB TYR 80 -11.919 15.443 -22.642 612 HD1 TYR 80 HD2 TYR 80 -9.952 15.017 -24.556 613 HD2 TYR 80 HD1 TYR 80 -9.561 14.575 -20.343 614 HE1 TYR 80 HE2 TYR 80 -8.101 13.434 -24.900 615 HE2 TYR 80 HE1 TYR 80 -7.708 12.992 -20.675 616 HH TYR 80 HH TYR 80 -6.720 11.620 -22.259 617 H ARG 81 H ARG 81 -13.220 17.878 -22.542 618 HA ARG 81 HA ARG 81 -14.095 17.367 -25.227 619 HB2 ARG 81 2HB ARG 81 -15.320 17.938 -22.654 620 HB3 ARG 81 3HB ARG 81 -16.093 18.834 -23.955 621 HG2 ARG 81 2HG ARG 81 -15.877 16.343 -25.043 622 HG3 ARG 81 3HG ARG 81 -16.157 15.981 -23.339 623 HD2 ARG 81 2HD ARG 81 -17.850 17.928 -24.884 624 HD3 ARG 81 3HD ARG 81 -18.212 16.204 -24.814 625 HE ARG 81 HE ARG 81 -17.912 17.069 -22.199 626 HH11 ARG 81 1HH1 ARG 81 -20.015 17.697 -24.901 627 HH12 ARG 81 2HH1 ARG 81 -21.381 18.096 -23.912 628 HH21 ARG 81 1HH2 ARG 81 -19.703 17.592 -20.887 629 HH22 ARG 81 2HH2 ARG 81 -21.202 18.036 -21.629 630 H ALA 82 H ALA 82 -12.888 20.087 -23.494 631 HA ALA 82 HA ALA 82 -14.031 22.246 -24.770 632 HB1 ALA 82 1HB ALA 82 -11.098 22.152 -24.135 633 HB2 ALA 82 2HB ALA 82 -12.202 23.525 -24.051 634 HB3 ALA 82 3HB ALA 82 -12.327 22.220 -22.872 635 H ILE 83 H ILE 83 -11.424 20.152 -25.895 636 HA ILE 83 HA ILE 83 -10.956 21.709 -28.274 637 HB ILE 83 HB ILE 83 -9.986 18.948 -27.524 638 HG12 ILE 83 2HG1 ILE 83 -9.136 20.659 -26.019 639 HG13 ILE 83 3HG1 ILE 83 -7.844 20.114 -27.083 640 HG21 ILE 83 1HG2 ILE 83 -9.736 20.539 -29.971 641 HG22 ILE 83 2HG2 ILE 83 -8.210 19.920 -29.342 642 HG23 ILE 83 3HG2 ILE 83 -9.526 18.807 -29.715 643 HD11 ILE 83 3HD1 ILE 83 -9.409 22.673 -27.281 644 HD12 ILE 83 1HD1 ILE 83 -7.705 22.483 -26.867 645 HD13 ILE 83 2HD1 ILE 83 -8.264 22.113 -28.499 646 H LYS 84 H LYS 84 -13.078 19.185 -27.330 647 HA LYS 84 HA LYS 84 -13.539 18.115 -29.950 648 HB2 LYS 84 2HB LYS 84 -15.257 17.887 -27.473 649 HB3 LYS 84 3HB LYS 84 -15.364 16.881 -28.912 650 HG2 LYS 84 2HG LYS 84 -13.035 17.011 -27.007 651 HG3 LYS 84 3HG LYS 84 -14.224 15.711 -27.122 652 HD2 LYS 84 2HD LYS 84 -12.328 16.557 -29.313 653 HD3 LYS 84 3HD LYS 84 -12.132 15.144 -28.274 654 HE2 LYS 84 2HE LYS 84 -14.254 14.245 -29.130 655 HE3 LYS 84 3HE LYS 84 -14.407 15.645 -30.191 656 HZ1 LYS 84 3HZ LYS 84 -12.460 14.985 -31.374 657 HZ2 LYS 84 1HZ LYS 84 -13.488 13.644 -31.288 658 HZ3 LYS 84 2HZ LYS 84 -12.134 13.738 -30.278 659 H LYS 85 H LYS 85 -14.904 20.663 -27.994 660 HA LYS 85 HA LYS 85 -17.253 21.018 -29.599 661 HB2 LYS 85 2HB LYS 85 -15.971 22.456 -27.325 662 HB3 LYS 85 3HB LYS 85 -17.124 23.343 -28.314 663 HG2 LYS 85 2HG LYS 85 -18.867 22.293 -27.411 664 HG3 LYS 85 3HG LYS 85 -18.091 20.712 -27.533 665 HD2 LYS 85 2HD LYS 85 -16.800 21.188 -25.511 666 HD3 LYS 85 3HD LYS 85 -17.562 22.776 -25.394 667 HE2 LYS 85 2HE LYS 85 -19.437 20.530 -25.607 668 HE3 LYS 85 3HE LYS 85 -18.447 20.520 -24.149 669 HZ1 LYS 85 3HZ LYS 85 -19.241 23.097 -24.323 670 HZ2 LYS 85 1HZ LYS 85 -19.973 21.917 -23.356 671 HZ3 LYS 85 2HZ LYS 85 -20.606 22.270 -24.884 672 H LYS 86 H LYS 86 -14.071 22.536 -29.407 673 HA LYS 86 HA LYS 86 -12.995 24.026 -30.753 674 HB2 LYS 86 2HB LYS 86 -13.145 22.162 -32.321 675 HB3 LYS 86 3HB LYS 86 -14.741 22.695 -32.833 676 HG2 LYS 86 2HG LYS 86 -13.805 23.937 -34.402 677 HG3 LYS 86 3HG LYS 86 -12.988 24.885 -33.157 678 HD2 LYS 86 2HD LYS 86 -11.131 23.299 -33.159 679 HD3 LYS 86 3HD LYS 86 -11.954 22.327 -34.382 680 HE2 LYS 86 2HE LYS 86 -10.714 23.532 -35.822 681 HE3 LYS 86 3HE LYS 86 -11.962 24.754 -35.578 682 HZ1 LYS 86 3HZ LYS 86 -9.639 24.667 -33.775 683 HZ2 LYS 86 1HZ LYS 86 -10.616 25.981 -34.200 684 HZ3 LYS 86 2HZ LYS 86 -9.482 25.380 -35.301 685 H GLY 87 H GLY 87 -13.984 25.847 -29.717 686 HA2 GLY 87 2HA GLY 87 -14.771 27.934 -31.111 687 HA3 GLY 87 3HA GLY 87 -16.282 27.037 -31.084 688 H GLY 88 H GLY 88 -15.515 26.018 -28.327 689 HA2 GLY 88 2HA GLY 88 -15.493 28.360 -26.656 690 HA3 GLY 88 3HA GLY 88 -17.077 27.606 -26.756 691 H GLY 89 H GLY 89 -16.481 27.537 -24.342 692 HA2 GLY 89 2HA GLY 89 -15.341 24.870 -23.830 693 HA3 GLY 89 3HA GLY 89 -14.801 26.247 -22.881 694 H GLY 90 H GLY 90 -15.978 23.917 -21.794 695 HA2 GLY 90 2HA GLY 90 -17.943 25.097 -20.122 696 HA3 GLY 90 3HA GLY 90 -18.709 24.041 -21.300 697 H GLY 91 H GLY 91 -19.366 22.967 -19.224 698 HA2 GLY 91 2HA GLY 91 -17.694 20.662 -18.826 699 HA3 GLY 91 3HA GLY 91 -17.745 21.716 -17.420 700 H GLY 92 H GLY 92 -18.635 19.113 -17.262 701 HA2 GLY 92 2HA GLY 92 -20.423 18.089 -16.190 702 HA3 GLY 92 3HA GLY 92 -21.365 19.554 -16.426 703 H GLY 93 H GLY 93 -21.468 16.435 -17.078 704 HA2 GLY 93 2HA GLY 93 -23.492 16.123 -18.681 705 HA3 GLY 93 3HA GLY 93 -22.336 16.700 -19.872 706 H GLY 94 H GLY 94 -23.158 14.451 -20.661 707 HA2 GLY 94 2HA GLY 94 -21.084 12.706 -20.871 708 HA3 GLY 94 3HA GLY 94 -21.906 12.176 -19.410 709 H GLY 95 H GLY 95 -21.563 11.226 -22.375 710 HA2 GLY 95 2HA GLY 95 -23.704 9.544 -22.558 711 HA3 GLY 95 3HA GLY 95 -24.275 11.027 -23.310 712 H GLY 96 H GLY 96 -24.485 9.956 -25.318 713 HA2 GLY 96 2HA GLY 96 -21.895 9.574 -26.680 714 HA3 GLY 96 3HA GLY 96 -23.205 8.423 -26.895 715 H VAL 97 H VAL 97 -22.035 11.621 -27.638 716 HA VAL 97 HA VAL 97 -24.220 11.934 -29.592 717 HB VAL 97 HB VAL 97 -22.512 14.088 -28.338 718 HG11 VAL 97 1HG1 VAL 97 -23.023 15.008 -30.374 719 HG12 VAL 97 2HG1 VAL 97 -24.526 14.096 -30.532 720 HG13 VAL 97 3HG1 VAL 97 -24.445 15.484 -29.446 721 HG21 VAL 97 3HG2 VAL 97 -25.188 12.974 -27.706 722 HG22 VAL 97 1HG2 VAL 97 -23.952 13.633 -26.635 723 HG23 VAL 97 2HG2 VAL 97 -24.977 14.719 -27.572 724 H TRP 98 H TRP 98 -20.776 11.875 -29.098 725 HA TRP 98 HA TRP 98 -20.137 11.196 -31.707 726 HB2 TRP 98 2HB TRP 98 -20.623 13.228 -32.671 727 HB3 TRP 98 3HB TRP 98 -20.262 14.132 -31.202 728 HD1 TRP 98 HD1 TRP 98 -17.968 11.834 -33.340 729 HE1 TRP 98 HE1 TRP 98 -15.852 13.173 -33.936 730 HE3 TRP 98 HE3 TRP 98 -19.200 16.301 -31.182 731 HZ2 TRP 98 HZ2 TRP 98 -14.838 15.778 -33.542 732 HZ3 TRP 98 HZ3 TRP 98 -17.602 18.166 -31.336 733 HH2 TRP 98 HH2 TRP 98 -15.467 17.907 -32.492 734 HA PRO 99 HA PRO 99 -16.107 12.584 -29.426 735 HB2 PRO 99 2HB PRO 99 -16.403 13.836 -27.036 736 HB3 PRO 99 3HB PRO 99 -16.341 14.705 -28.574 737 HG2 PRO 99 2HG PRO 99 -18.721 13.925 -26.934 738 HG3 PRO 99 3HG PRO 99 -18.389 15.454 -27.768 739 HD2 PRO 99 2HD PRO 99 -20.036 13.564 -28.791 740 HD3 PRO 99 3HD PRO 99 -19.048 14.626 -29.815 741 H LEU 100 H LEU 100 -16.111 10.294 -29.174 742 HA LEU 100 HA LEU 100 -17.117 9.159 -26.704 743 HB2 LEU 100 2HB LEU 100 -16.308 7.031 -27.616 744 HB3 LEU 100 3HB LEU 100 -17.376 7.880 -28.730 745 HG LEU 100 HG LEU 100 -14.516 8.390 -29.156 746 HD11 LEU 100 1HD1 LEU 100 -14.596 5.972 -28.449 747 HD12 LEU 100 2HD1 LEU 100 -13.956 6.279 -30.063 748 HD13 LEU 100 3HD1 LEU 100 -15.602 5.677 -29.867 749 HD21 LEU 100 3HD2 LEU 100 -15.983 7.312 -31.375 750 HD22 LEU 100 1HD2 LEU 100 -15.313 8.928 -31.156 751 HD23 LEU 100 2HD2 LEU 100 -16.934 8.559 -30.567 752 H VAL 101 H VAL 101 -14.099 10.219 -28.061 753 HA VAL 101 HA VAL 101 -12.231 8.862 -26.556 754 HB VAL 101 HB VAL 101 -10.826 10.950 -26.717 755 HG11 VAL 101 1HG1 VAL 101 -11.651 10.758 -29.458 756 HG12 VAL 101 2HG1 VAL 101 -10.203 10.116 -28.680 757 HG13 VAL 101 3HG1 VAL 101 -11.687 9.164 -28.705 758 HG21 VAL 101 3HG2 VAL 101 -11.782 12.715 -28.257 759 HG22 VAL 101 1HG2 VAL 101 -13.362 11.991 -27.958 760 HG23 VAL 101 2HG2 VAL 101 -12.440 12.679 -26.621 761 H ILE 102 H ILE 102 -14.031 11.790 -25.671 762 HA ILE 102 HA ILE 102 -12.830 12.351 -23.241 763 HB ILE 102 HB ILE 102 -14.927 13.444 -22.584 764 HG12 ILE 102 2HG1 ILE 102 -16.645 13.302 -24.683 765 HG13 ILE 102 3HG1 ILE 102 -16.001 11.664 -24.685 766 HG21 ILE 102 1HG2 ILE 102 -14.212 15.107 -23.865 767 HG22 ILE 102 2HG2 ILE 102 -13.397 13.958 -24.925 768 HG23 ILE 102 3HG2 ILE 102 -15.071 14.413 -25.239 769 HD11 ILE 102 3HD1 ILE 102 -17.746 11.357 -23.283 770 HD12 ILE 102 1HD1 ILE 102 -16.544 11.866 -22.097 771 HD13 ILE 102 2HD1 ILE 102 -17.724 13.025 -22.709 772 H ARG 103 H ARG 103 -15.262 9.943 -24.028 773 HA ARG 103 HA ARG 103 -15.987 9.265 -21.385 774 HB2 ARG 103 2HB ARG 103 -17.327 7.714 -22.347 775 HB3 ARG 103 3HB ARG 103 -16.926 8.582 -23.823 776 HG2 ARG 103 2HG ARG 103 -14.961 6.927 -24.003 777 HG3 ARG 103 3HG ARG 103 -15.866 5.970 -22.829 778 HD2 ARG 103 2HD ARG 103 -16.942 6.940 -25.474 779 HD3 ARG 103 3HD ARG 103 -16.322 5.318 -25.169 780 HE ARG 103 HE ARG 103 -18.366 5.980 -23.320 781 HH11 ARG 103 1HH1 ARG 103 -17.842 5.048 -26.633 782 HH12 ARG 103 2HH1 ARG 103 -19.396 4.301 -26.805 783 HH21 ARG 103 1HH2 ARG 103 -20.414 5.001 -23.534 784 HH22 ARG 103 2HH2 ARG 103 -20.859 4.276 -25.042 785 H THR 104 H THR 104 -13.292 8.390 -23.399 786 HA THR 104 HA THR 104 -12.421 6.028 -22.286 787 HB THR 104 HB THR 104 -10.522 8.264 -22.984 788 HG1 THR 104 HG1 THR 104 -11.643 6.426 -24.839 789 HG21 THR 104 3HG2 THR 104 -9.100 6.596 -22.454 790 HG22 THR 104 1HG2 THR 104 -9.531 5.964 -24.042 791 HG23 THR 104 2HG2 THR 104 -10.344 5.354 -22.600 792 H VAL 105 H VAL 105 -11.414 9.295 -21.256 793 HA VAL 105 HA VAL 105 -10.051 8.380 -18.943 794 HB VAL 105 HB VAL 105 -11.163 11.157 -19.301 795 HG11 VAL 105 1HG1 VAL 105 -8.762 11.498 -18.200 796 HG12 VAL 105 2HG1 VAL 105 -10.209 11.189 -17.238 797 HG13 VAL 105 3HG1 VAL 105 -9.098 9.871 -17.609 798 HG21 VAL 105 3HG2 VAL 105 -8.558 11.233 -20.203 799 HG22 VAL 105 1HG2 VAL 105 -9.197 9.755 -20.921 800 HG23 VAL 105 2HG2 VAL 105 -10.006 11.296 -21.207 801 H ILE 106 H ILE 106 -13.316 9.573 -19.527 802 HA ILE 106 HA ILE 106 -14.122 9.851 -16.851 803 HB ILE 106 HB ILE 106 -15.884 9.076 -19.177 804 HG12 ILE 106 2HG1 ILE 106 -14.278 11.295 -19.077 805 HG13 ILE 106 3HG1 ILE 106 -15.778 11.178 -19.990 806 HG21 ILE 106 1HG2 ILE 106 -16.441 10.376 -16.519 807 HG22 ILE 106 2HG2 ILE 106 -17.596 10.337 -17.850 808 HG23 ILE 106 3HG2 ILE 106 -17.049 8.831 -17.114 809 HD11 ILE 106 3HD1 ILE 106 -15.663 12.152 -17.153 810 HD12 ILE 106 1HD1 ILE 106 -15.517 13.217 -18.551 811 HD13 ILE 106 2HD1 ILE 106 -16.996 12.289 -18.300 812 H ALA 107 H ALA 107 -13.641 7.061 -18.819 813 HA ALA 107 HA ALA 107 -15.338 5.174 -17.787 814 HB1 ALA 107 1HB ALA 107 -13.850 4.624 -19.580 815 HB2 ALA 107 2HB ALA 107 -12.439 4.866 -18.549 816 HB3 ALA 107 3HB ALA 107 -13.534 3.517 -18.243 817 H GLY 108 H GLY 108 -12.686 6.748 -16.200 818 HA2 GLY 108 2HA GLY 108 -12.735 4.830 -13.986 819 HA3 GLY 108 3HA GLY 108 -11.568 6.126 -14.208 820 H TYR 109 H TYR 109 -13.779 8.051 -14.784 821 HA TYR 109 HA TYR 109 -14.028 9.231 -12.307 822 HB2 TYR 109 2HB TYR 109 -14.517 10.508 -14.267 823 HB3 TYR 109 3HB TYR 109 -15.815 9.414 -14.733 824 HD1 TYR 109 HD2 TYR 109 -15.276 10.660 -11.300 825 HD2 TYR 109 HD1 TYR 109 -17.559 11.033 -14.872 826 HE1 TYR 109 HE2 TYR 109 -16.895 12.080 -10.111 827 HE2 TYR 109 HE1 TYR 109 -19.183 12.454 -13.693 828 HH TYR 109 HH TYR 109 -19.935 12.849 -11.363 829 H ASN 110 H ASN 110 -16.419 7.169 -13.953 830 HA ASN 110 HA ASN 110 -18.426 7.193 -12.068 831 HB2 ASN 110 2HB ASN 110 -17.618 5.449 -14.260 832 HB3 ASN 110 3HB ASN 110 -18.414 4.564 -12.962 833 HD21 ASN 110 1HD2 ASN 110 -18.863 6.378 -15.713 834 HD22 ASN 110 2HD2 ASN 110 -20.544 6.730 -15.532 835 H LEU 111 H LEU 111 -15.310 5.736 -11.869 836 HA LEU 111 HA LEU 111 -16.055 4.047 -9.615 837 HB2 LEU 111 2HB LEU 111 -13.857 4.180 -11.515 838 HB3 LEU 111 3HB LEU 111 -13.304 3.954 -9.857 839 HG LEU 111 HG LEU 111 -13.577 1.841 -11.128 840 HD11 LEU 111 1HD1 LEU 111 -15.628 1.509 -9.084 841 HD12 LEU 111 2HD1 LEU 111 -14.211 2.393 -8.519 842 HD13 LEU 111 3HD1 LEU 111 -14.026 0.783 -9.215 843 HD21 LEU 111 3HD2 LEU 111 -15.573 1.113 -11.978 844 HD22 LEU 111 1HD2 LEU 111 -15.737 2.848 -12.246 845 HD23 LEU 111 2HD2 LEU 111 -16.532 2.091 -10.866 846 H TYR 112 H TYR 112 -14.294 6.998 -10.313 847 HA TYR 112 HA TYR 112 -12.834 7.469 -8.079 848 HB2 TYR 112 2HB TYR 112 -14.610 9.414 -9.561 849 HB3 TYR 112 3HB TYR 112 -13.418 9.899 -8.360 850 HD1 TYR 112 HD2 TYR 112 -12.025 7.148 -9.901 851 HD2 TYR 112 HD1 TYR 112 -12.939 11.227 -10.692 852 HE1 TYR 112 HE2 TYR 112 -10.290 7.192 -11.643 853 HE2 TYR 112 HE1 TYR 112 -11.207 11.283 -12.437 854 HH TYR 112 HH TYR 112 -10.038 9.653 -13.923 855 H ARG 113 H ARG 113 -16.325 8.071 -8.396 856 HA ARG 113 HA ARG 113 -16.568 8.766 -5.605 857 HB2 ARG 113 2HB ARG 113 -18.352 8.719 -7.971 858 HB3 ARG 113 3HB ARG 113 -19.124 8.491 -6.407 859 HG2 ARG 113 2HG ARG 113 -17.521 10.625 -5.902 860 HG3 ARG 113 3HG ARG 113 -17.941 10.890 -7.595 861 HD2 ARG 113 2HD ARG 113 -20.326 10.128 -6.376 862 HD3 ARG 113 3HD ARG 113 -19.554 11.211 -5.218 863 HE ARG 113 HE ARG 113 -19.890 12.960 -6.668 864 HH11 ARG 113 1HH1 ARG 113 -20.484 9.950 -8.312 865 HH12 ARG 113 2HH1 ARG 113 -21.159 10.701 -9.720 866 HH21 ARG 113 1HH2 ARG 113 -20.777 13.962 -8.516 867 HH22 ARG 113 2HH2 ARG 113 -21.324 12.983 -9.835 868 H ALA 114 H ALA 114 -16.905 5.940 -7.575 869 HA ALA 114 HA ALA 114 -18.640 4.352 -6.150 870 HB1 ALA 114 1HB ALA 114 -17.542 2.454 -7.104 871 HB2 ALA 114 2HB ALA 114 -17.515 3.756 -8.294 872 HB3 ALA 114 3HB ALA 114 -16.063 3.377 -7.368 873 H ILE 115 H ILE 115 -15.241 5.034 -5.468 874 HA ILE 115 HA ILE 115 -15.207 3.270 -3.175 875 HB ILE 115 HB ILE 115 -13.138 5.252 -4.132 876 HG12 ILE 115 2HG1 ILE 115 -13.492 3.475 -5.754 877 HG13 ILE 115 3HG1 ILE 115 -11.952 3.228 -4.938 878 HG21 ILE 115 1HG2 ILE 115 -13.337 3.595 -1.740 879 HG22 ILE 115 2HG2 ILE 115 -11.843 3.349 -2.643 880 HG23 ILE 115 3HG2 ILE 115 -12.281 4.964 -2.087 881 HD11 ILE 115 3HD1 ILE 115 -14.188 1.470 -5.150 882 HD12 ILE 115 1HD1 ILE 115 -12.587 1.166 -4.474 883 HD13 ILE 115 2HD1 ILE 115 -13.868 1.819 -3.451 884 H LYS 116 H LYS 116 -15.961 6.546 -3.831 885 HA LYS 116 HA LYS 116 -15.443 7.519 -1.168 886 HB2 LYS 116 2HB LYS 116 -16.808 8.705 -3.580 887 HB3 LYS 116 3HB LYS 116 -16.743 9.539 -2.033 888 HG2 LYS 116 2HG LYS 116 -14.338 8.637 -3.605 889 HG3 LYS 116 3HG LYS 116 -14.997 10.275 -3.603 890 HD2 LYS 116 2HD LYS 116 -13.972 10.768 -1.685 891 HD3 LYS 116 3HD LYS 116 -14.575 9.300 -0.912 892 HE2 LYS 116 2HE LYS 116 -12.752 8.018 -1.761 893 HE3 LYS 116 3HE LYS 116 -12.228 9.342 -2.800 894 HZ1 LYS 116 3HZ LYS 116 -11.054 8.895 -0.536 895 HZ2 LYS 116 1HZ LYS 116 -12.351 9.777 0.100 896 HZ3 LYS 116 2HZ LYS 116 -11.332 10.483 -1.050 897 H LYS 117 H LYS 117 -18.008 5.924 -2.788 898 HA LYS 117 HA LYS 117 -20.066 6.816 -0.957 899 HB2 LYS 117 2HB LYS 117 -19.983 4.926 -3.288 900 HB3 LYS 117 3HB LYS 117 -21.362 4.928 -2.196 901 HG2 LYS 117 2HG LYS 117 -21.610 7.375 -2.651 902 HG3 LYS 117 3HG LYS 117 -20.369 7.203 -3.895 903 HD2 LYS 117 2HD LYS 117 -22.951 5.643 -3.819 904 HD3 LYS 117 3HD LYS 117 -22.686 7.097 -4.783 905 HE2 LYS 117 2HE LYS 117 -21.878 5.811 -6.404 906 HE3 LYS 117 3HE LYS 117 -20.532 5.391 -5.346 907 HZ1 LYS 117 3HZ LYS 117 -21.930 3.578 -4.450 908 HZ2 LYS 117 1HZ LYS 117 -21.576 3.396 -6.094 909 HZ3 LYS 117 2HZ LYS 117 -23.105 3.936 -5.613 910 H LYS 118 H LYS 118 -18.125 3.922 -1.521 911 HA LYS 118 HA LYS 118 -19.298 2.677 0.864 912 HB2 LYS 118 2HB LYS 118 -17.662 1.562 -1.411 913 HB3 LYS 118 3HB LYS 118 -18.017 0.641 0.044 914 HG2 LYS 118 2HG LYS 118 -20.424 0.904 -0.410 915 HG3 LYS 118 3HG LYS 118 -20.025 1.748 -1.908 916 HD2 LYS 118 2HD LYS 118 -18.544 -0.505 -2.182 917 HD3 LYS 118 3HD LYS 118 -19.917 -1.122 -1.260 918 HE2 LYS 118 2HE LYS 118 -20.748 0.641 -3.407 919 HE3 LYS 118 3HE LYS 118 -19.803 -0.723 -4.003 920 HZ1 LYS 118 3HZ LYS 118 -21.550 -1.785 -2.163 921 HZ2 LYS 118 1HZ LYS 118 -21.648 -1.916 -3.847 922 HZ3 LYS 118 2HZ LYS 118 -22.476 -0.678 -3.046 Start of MODEL 19 1 H1 VAL 1 H VAL 1 6.511 -1.076 -5.370 2 HA VAL 1 HA VAL 1 4.358 -0.895 -7.366 3 HB VAL 1 HB VAL 1 5.080 -3.448 -5.927 4 HG11 VAL 1 1HG1 VAL 1 2.687 -2.807 -6.886 5 HG12 VAL 1 2HG1 VAL 1 3.427 -3.362 -8.389 6 HG13 VAL 1 3HG1 VAL 1 3.336 -4.443 -6.998 7 HG21 VAL 1 3HG2 VAL 1 6.843 -3.364 -7.371 8 HG22 VAL 1 1HG2 VAL 1 5.631 -4.057 -8.448 9 HG23 VAL 1 2HG2 VAL 1 5.996 -2.333 -8.523 10 H TRP 2 H TRP 2 2.559 -0.154 -6.475 11 HA TRP 2 HA TRP 2 1.323 -1.170 -4.203 12 HB2 TRP 2 2HB TRP 2 2.763 -0.293 -2.649 13 HB3 TRP 2 3HB TRP 2 3.238 1.048 -3.688 14 HD1 TRP 2 HD1 TRP 2 2.588 3.233 -2.542 15 HE1 TRP 2 HE1 TRP 2 0.550 4.103 -1.233 16 HE3 TRP 2 HE3 TRP 2 -0.221 -1.038 -2.484 17 HZ2 TRP 2 HZ2 TRP 2 -1.922 3.109 -0.299 18 HZ3 TRP 2 HZ3 TRP 2 -2.411 -0.994 -1.362 19 HH2 TRP 2 HH2 TRP 2 -3.241 1.037 -0.292 20 HA PRO 3 HA PRO 3 -0.814 2.993 -5.402 21 HB2 PRO 3 2HB PRO 3 0.457 4.572 -7.207 22 HB3 PRO 3 3HB PRO 3 0.715 4.706 -5.464 23 HG2 PRO 3 2HG PRO 3 2.384 3.317 -7.525 24 HG3 PRO 3 3HG PRO 3 2.900 4.339 -6.170 25 HD2 PRO 3 2HD PRO 3 2.994 1.635 -6.073 26 HD3 PRO 3 3HD PRO 3 2.686 2.631 -4.637 27 H LEU 4 H LEU 4 -1.830 1.053 -6.450 28 HA LEU 4 HA LEU 4 -1.508 0.877 -9.334 29 HB2 LEU 4 2HB LEU 4 -2.804 -1.071 -9.243 30 HB3 LEU 4 3HB LEU 4 -1.795 -1.116 -7.799 31 HG LEU 4 HG LEU 4 -4.029 0.043 -6.805 32 HD11 LEU 4 1HD1 LEU 4 -5.481 -0.059 -8.590 33 HD12 LEU 4 2HD1 LEU 4 -5.853 -1.558 -7.741 34 HD13 LEU 4 3HD1 LEU 4 -4.827 -1.589 -9.175 35 HD21 LEU 4 3HD2 LEU 4 -4.482 -2.061 -5.779 36 HD22 LEU 4 1HD2 LEU 4 -2.734 -1.934 -5.978 37 HD23 LEU 4 2HD2 LEU 4 -3.677 -2.937 -7.082 38 H VAL 5 H VAL 5 -3.556 2.393 -7.035 39 HA VAL 5 HA VAL 5 -5.882 2.652 -8.655 40 HB VAL 5 HB VAL 5 -6.607 4.346 -7.049 41 HG11 VAL 5 1HG1 VAL 5 -5.429 2.428 -5.175 42 HG12 VAL 5 2HG1 VAL 5 -7.122 2.797 -5.510 43 HG13 VAL 5 3HG1 VAL 5 -6.234 1.691 -6.560 44 HG21 VAL 5 3HG2 VAL 5 -4.566 5.539 -6.661 45 HG22 VAL 5 1HG2 VAL 5 -5.123 4.889 -5.119 46 HG23 VAL 5 2HG2 VAL 5 -3.798 4.105 -5.980 47 H ILE 6 H ILE 6 -2.960 4.542 -8.229 48 HA ILE 6 HA ILE 6 -3.761 6.931 -9.432 49 HB ILE 6 HB ILE 6 -1.424 7.398 -9.815 50 HG12 ILE 6 2HG1 ILE 6 0.117 5.342 -9.008 51 HG13 ILE 6 3HG1 ILE 6 -1.215 4.440 -9.722 52 HG21 ILE 6 1HG2 ILE 6 -2.497 6.524 -7.318 53 HG22 ILE 6 2HG2 ILE 6 -0.778 6.136 -7.379 54 HG23 ILE 6 3HG2 ILE 6 -1.317 7.795 -7.635 55 HD11 ILE 6 3HD1 ILE 6 -0.763 6.229 -11.673 56 HD12 ILE 6 1HD1 ILE 6 0.859 6.084 -10.997 57 HD13 ILE 6 2HD1 ILE 6 0.016 4.650 -11.585 58 H ARG 7 H ARG 7 -2.819 3.868 -10.826 59 HA ARG 7 HA ARG 7 -2.544 4.894 -13.498 60 HB2 ARG 7 2HB ARG 7 -1.947 2.745 -14.121 61 HB3 ARG 7 3HB ARG 7 -1.458 2.777 -12.432 62 HG2 ARG 7 2HG ARG 7 -2.594 0.868 -12.263 63 HG3 ARG 7 3HG ARG 7 -4.032 1.890 -12.258 64 HD2 ARG 7 2HD ARG 7 -4.046 1.693 -14.766 65 HD3 ARG 7 3HD ARG 7 -2.784 0.473 -14.603 66 HE ARG 7 HE ARG 7 -4.946 -0.228 -12.959 67 HH11 ARG 7 1HH1 ARG 7 -4.119 0.023 -16.331 68 HH12 ARG 7 2HH1 ARG 7 -5.220 -1.218 -16.828 69 HH21 ARG 7 1HH2 ARG 7 -6.400 -1.864 -13.601 70 HH22 ARG 7 2HH2 ARG 7 -6.518 -2.290 -15.274 71 H THR 8 H THR 8 -5.129 3.855 -11.512 72 HA THR 8 HA THR 8 -6.959 2.769 -13.258 73 HB THR 8 HB THR 8 -7.720 4.788 -11.148 74 HG1 THR 8 HG1 THR 8 -6.700 2.178 -10.921 75 HG21 THR 8 3HG2 THR 8 -9.810 3.899 -11.220 76 HG22 THR 8 1HG2 THR 8 -9.228 2.283 -11.616 77 HG23 THR 8 2HG2 THR 8 -9.330 3.515 -12.873 78 H VAL 9 H VAL 9 -6.806 6.231 -12.392 79 HA VAL 9 HA VAL 9 -8.570 7.050 -14.444 80 HB VAL 9 HB VAL 9 -7.610 9.352 -13.987 81 HG11 VAL 9 1HG1 VAL 9 -8.818 7.621 -11.857 82 HG12 VAL 9 2HG1 VAL 9 -8.499 9.333 -11.576 83 HG13 VAL 9 3HG1 VAL 9 -9.593 8.839 -12.869 84 HG21 VAL 9 3HG2 VAL 9 -6.111 7.864 -11.832 85 HG22 VAL 9 1HG2 VAL 9 -5.385 8.593 -13.265 86 HG23 VAL 9 2HG2 VAL 9 -6.163 9.613 -12.055 87 H ILE 10 H ILE 10 -5.060 6.817 -14.243 88 HA ILE 10 HA ILE 10 -4.362 8.217 -16.544 89 HB ILE 10 HB ILE 10 -3.012 5.754 -15.432 90 HG12 ILE 10 2HG1 ILE 10 -3.422 8.006 -14.043 91 HG13 ILE 10 3HG1 ILE 10 -1.942 7.065 -13.896 92 HG21 ILE 10 1HG2 ILE 10 -2.066 7.883 -17.338 93 HG22 ILE 10 2HG2 ILE 10 -0.987 6.755 -16.518 94 HG23 ILE 10 3HG2 ILE 10 -2.208 6.151 -17.638 95 HD11 ILE 10 3HD1 ILE 10 -0.706 8.580 -15.120 96 HD12 ILE 10 1HD1 ILE 10 -2.130 9.268 -15.900 97 HD13 ILE 10 2HD1 ILE 10 -1.797 9.620 -14.204 98 H ALA 11 H ALA 11 -5.969 5.206 -16.212 99 HA ALA 11 HA ALA 11 -5.290 3.759 -18.431 100 HB1 ALA 11 1HB ALA 11 -8.020 4.187 -17.232 101 HB2 ALA 11 2HB ALA 11 -7.661 2.967 -18.454 102 HB3 ALA 11 3HB ALA 11 -6.878 2.891 -16.876 103 H GLY 12 H GLY 12 -6.954 6.800 -18.311 104 HA2 GLY 12 2HA GLY 12 -7.751 6.600 -21.121 105 HA3 GLY 12 3HA GLY 12 -8.211 7.875 -20.003 106 H TYR 13 H TYR 13 -5.457 8.267 -19.068 107 HA TYR 13 HA TYR 13 -4.674 10.356 -20.692 108 HB2 TYR 13 2HB TYR 13 -3.746 10.269 -18.523 109 HB3 TYR 13 3HB TYR 13 -3.122 8.641 -18.763 110 HD1 TYR 13 HD2 TYR 13 -2.781 11.470 -21.129 111 HD2 TYR 13 HD1 TYR 13 -0.840 8.998 -18.261 112 HE1 TYR 13 HE2 TYR 13 -0.608 12.405 -21.802 113 HE2 TYR 13 HE1 TYR 13 1.338 9.928 -18.924 114 HH TYR 13 HH TYR 13 2.100 12.217 -20.035 115 H ASN 14 H ASN 14 -3.418 7.027 -20.683 116 HA ASN 14 HA ASN 14 -1.459 7.204 -22.584 117 HB2 ASN 14 2HB ASN 14 -2.981 5.117 -21.387 118 HB3 ASN 14 3HB ASN 14 -2.927 4.812 -23.120 119 HD21 ASN 14 1HD2 ASN 14 -1.424 3.351 -23.481 120 HD22 ASN 14 2HD2 ASN 14 0.175 3.357 -22.826 121 H LEU 15 H LEU 15 -4.856 7.554 -23.031 122 HA LEU 15 HA LEU 15 -4.659 7.240 -25.927 123 HB2 LEU 15 2HB LEU 15 -6.701 6.854 -24.015 124 HB3 LEU 15 3HB LEU 15 -7.222 8.169 -25.066 125 HG LEU 15 HG LEU 15 -8.102 6.082 -25.883 126 HD11 LEU 15 1HD1 LEU 15 -6.649 7.890 -27.383 127 HD12 LEU 15 2HD1 LEU 15 -7.781 6.687 -28.000 128 HD13 LEU 15 3HD1 LEU 15 -6.058 6.319 -27.925 129 HD21 LEU 15 3HD2 LEU 15 -6.150 4.764 -24.822 130 HD22 LEU 15 1HD2 LEU 15 -5.332 5.050 -26.358 131 HD23 LEU 15 2HD2 LEU 15 -6.861 4.171 -26.324 132 H TYR 16 H TYR 16 -5.196 9.703 -23.477 133 HA TYR 16 HA TYR 16 -6.076 11.840 -24.932 134 HB2 TYR 16 2HB TYR 16 -4.922 11.464 -22.406 135 HB3 TYR 16 3HB TYR 16 -3.933 12.694 -23.184 136 HD1 TYR 16 HD2 TYR 16 -5.484 14.493 -24.533 137 HD2 TYR 16 HD1 TYR 16 -6.639 12.259 -21.102 138 HE1 TYR 16 HE2 TYR 16 -7.176 16.196 -24.002 139 HE2 TYR 16 HE1 TYR 16 -8.336 13.955 -20.561 140 HH TYR 16 HH TYR 16 -8.488 16.995 -22.216 141 H ARG 17 H ARG 17 -2.681 10.849 -24.529 142 HA ARG 17 HA ARG 17 -1.713 12.836 -26.353 143 HB2 ARG 17 2HB ARG 17 -0.547 10.656 -24.724 144 HB3 ARG 17 3HB ARG 17 0.344 11.094 -26.176 145 HG2 ARG 17 2HG ARG 17 0.072 13.522 -25.282 146 HG3 ARG 17 3HG ARG 17 -0.222 12.717 -23.740 147 HD2 ARG 17 2HD ARG 17 2.220 12.453 -25.487 148 HD3 ARG 17 3HD ARG 17 2.119 13.267 -23.927 149 HE ARG 17 HE ARG 17 1.391 10.479 -23.864 150 HH11 ARG 17 1HH1 ARG 17 3.980 12.792 -23.610 151 HH12 ARG 17 2HH1 ARG 17 5.004 11.740 -22.690 152 HH21 ARG 17 1HH2 ARG 17 2.729 9.085 -22.653 153 HH22 ARG 17 2HH2 ARG 17 4.292 9.631 -22.147 154 H ALA 18 H ALA 18 -2.900 9.606 -26.623 155 HA ALA 18 HA ALA 18 -1.674 8.649 -28.897 156 HB1 ALA 18 1HB ALA 18 -3.393 7.499 -27.425 157 HB2 ALA 18 2HB ALA 18 -4.618 8.317 -28.396 158 HB3 ALA 18 3HB ALA 18 -3.499 7.186 -29.158 159 H ILE 19 H ILE 19 -4.214 11.057 -28.613 160 HA ILE 19 HA ILE 19 -4.598 11.205 -31.482 161 HB ILE 19 HB ILE 19 -5.725 12.954 -29.291 162 HG12 ILE 19 2HG1 ILE 19 -6.485 10.653 -29.065 163 HG13 ILE 19 3HG1 ILE 19 -7.802 11.656 -29.663 164 HG21 ILE 19 1HG2 ILE 19 -5.808 13.118 -32.187 165 HG22 ILE 19 2HG2 ILE 19 -7.417 13.047 -31.471 166 HG23 ILE 19 3HG2 ILE 19 -6.286 14.305 -30.973 167 HD11 ILE 19 3HD1 ILE 19 -6.656 9.307 -30.806 168 HD12 ILE 19 1HD1 ILE 19 -8.075 10.220 -31.317 169 HD13 ILE 19 2HD1 ILE 19 -6.479 10.658 -31.926 170 H LYS 20 H LYS 20 -2.647 12.696 -29.084 171 HA LYS 20 HA LYS 20 -2.161 15.129 -30.545 172 HB2 LYS 20 2HB LYS 20 -1.043 15.828 -28.698 173 HB3 LYS 20 3HB LYS 20 -1.907 14.496 -27.942 174 HG2 LYS 20 2HG LYS 20 0.188 14.039 -27.206 175 HG3 LYS 20 3HG LYS 20 0.227 13.145 -28.728 176 HD2 LYS 20 2HD LYS 20 1.017 15.605 -29.553 177 HD3 LYS 20 3HD LYS 20 1.678 15.573 -27.917 178 HE2 LYS 20 2HE LYS 20 2.096 13.363 -29.919 179 HE3 LYS 20 3HE LYS 20 3.205 14.720 -29.731 180 HZ1 LYS 20 3HZ LYS 20 4.138 13.718 -28.008 181 HZ2 LYS 20 1HZ LYS 20 3.161 12.363 -28.276 182 HZ3 LYS 20 2HZ LYS 20 2.653 13.574 -27.211 183 H LYS 21 H LYS 21 -0.871 11.938 -30.499 184 HA LYS 21 HA LYS 21 1.636 12.686 -31.749 185 HB2 LYS 21 2HB LYS 21 2.011 10.218 -31.843 186 HB3 LYS 21 3HB LYS 21 1.714 10.834 -30.223 187 HG2 LYS 21 2HG LYS 21 -0.570 10.041 -30.304 188 HG3 LYS 21 3HG LYS 21 -0.345 9.498 -31.968 189 HD2 LYS 21 2HD LYS 21 1.562 8.060 -31.041 190 HD3 LYS 21 3HD LYS 21 0.873 8.398 -29.452 191 HE2 LYS 21 2HE LYS 21 -1.316 7.651 -30.954 192 HE3 LYS 21 3HE LYS 21 -0.039 6.587 -31.542 193 HZ1 LYS 21 3HZ LYS 21 -1.474 6.450 -29.118 194 HZ2 LYS 21 1HZ LYS 21 0.172 6.643 -28.778 195 HZ3 LYS 21 2HZ LYS 21 -0.346 5.356 -29.745 196 H LYS 22 H LYS 22 -1.427 11.190 -32.654 197 HA LYS 22 HA LYS 22 -2.352 10.677 -34.671 198 HB2 LYS 22 2HB LYS 22 -2.116 13.146 -34.888 199 HB3 LYS 22 3HB LYS 22 -0.560 12.898 -35.671 200 HG2 LYS 22 2HG LYS 22 -1.491 12.226 -37.622 201 HG3 LYS 22 3HG LYS 22 -2.882 11.479 -36.831 202 HD2 LYS 22 2HD LYS 22 -3.955 13.569 -36.541 203 HD3 LYS 22 3HD LYS 22 -2.488 14.461 -36.952 204 HE2 LYS 22 2HE LYS 22 -2.669 13.939 -39.222 205 HE3 LYS 22 3HE LYS 22 -3.779 12.603 -38.920 206 HZ1 LYS 22 3HZ LYS 22 -4.466 15.146 -39.648 207 HZ2 LYS 22 1HZ LYS 22 -4.825 15.091 -37.995 208 HZ3 LYS 22 2HZ LYS 22 -5.514 13.961 -39.048 209 H GLY 23 H GLY 23 -1.227 8.612 -34.631 210 HA2 GLY 23 2HA GLY 23 0.160 8.126 -37.071 211 HA3 GLY 23 3HA GLY 23 1.262 8.065 -35.704 212 H GLY 24 H GLY 24 0.085 6.777 -33.763 213 HA2 GLY 24 2HA GLY 24 -0.692 4.747 -33.005 214 HA3 GLY 24 3HA GLY 24 -1.519 4.556 -34.544 215 H GLY 25 H GLY 25 -0.130 2.526 -33.027 216 HA2 GLY 25 2HA GLY 25 0.996 0.939 -34.853 217 HA3 GLY 25 3HA GLY 25 2.331 2.025 -34.496 218 H GLY 26 H GLY 26 0.028 -0.205 -32.970 219 HA2 GLY 26 2HA GLY 26 0.432 -1.817 -31.361 220 HA3 GLY 26 3HA GLY 26 2.132 -1.371 -31.396 221 H GLY 27 H GLY 27 0.046 -1.832 -29.203 222 HA2 GLY 27 2HA GLY 27 0.379 0.752 -27.817 223 HA3 GLY 27 3HA GLY 27 -0.895 -0.408 -27.472 224 H GLY 28 H GLY 28 0.998 0.788 -25.622 225 HA2 GLY 28 2HA GLY 28 1.500 -0.905 -23.724 226 HA3 GLY 28 3HA GLY 28 2.670 -1.516 -24.885 227 H GLY 29 H GLY 29 3.406 1.069 -25.936 228 HA2 GLY 29 2HA GLY 29 4.202 2.900 -23.980 229 HA3 GLY 29 3HA GLY 29 5.486 1.710 -24.137 230 H GLY 30 H GLY 30 4.315 4.619 -25.268 231 HA2 GLY 30 2HA GLY 30 6.366 5.271 -26.922 232 HA3 GLY 30 3HA GLY 30 5.263 4.409 -27.984 233 H GLY 31 H GLY 31 6.178 7.390 -27.202 234 HA2 GLY 31 2HA GLY 31 4.698 9.039 -28.472 235 HA3 GLY 31 3HA GLY 31 3.459 8.524 -27.338 236 H GLY 32 H GLY 32 4.617 11.190 -27.796 237 HA2 GLY 32 2HA GLY 32 4.498 12.534 -25.588 238 HA3 GLY 32 3HA GLY 32 5.982 11.661 -25.234 239 H VAL 33 H VAL 33 4.766 14.502 -26.386 240 HA VAL 33 HA VAL 33 7.368 15.275 -27.437 241 HB VAL 33 HB VAL 33 4.841 15.679 -29.043 242 HG11 VAL 33 1HG1 VAL 33 6.413 16.626 -30.735 243 HG12 VAL 33 2HG1 VAL 33 6.247 17.601 -29.273 244 HG13 VAL 33 3HG1 VAL 33 7.675 16.592 -29.504 245 HG21 VAL 33 3HG2 VAL 33 7.217 13.875 -29.412 246 HG22 VAL 33 1HG2 VAL 33 5.507 13.443 -29.364 247 HG23 VAL 33 2HG2 VAL 33 6.156 14.324 -30.747 248 H TRP 34 H TRP 34 4.028 16.515 -27.199 249 HA TRP 34 HA TRP 34 5.056 18.748 -25.592 250 HB2 TRP 34 2HB TRP 34 3.493 20.274 -26.825 251 HB3 TRP 34 3HB TRP 34 4.830 19.669 -27.800 252 HD1 TRP 34 HD1 TRP 34 4.147 17.506 -29.460 253 HE1 TRP 34 HE1 TRP 34 1.975 17.159 -30.798 254 HE3 TRP 34 HE3 TRP 34 1.096 20.713 -26.901 255 HZ2 TRP 34 HZ2 TRP 34 -0.679 18.119 -30.772 256 HZ3 TRP 34 HZ3 TRP 34 -1.246 20.940 -27.622 257 HH2 TRP 34 HH2 TRP 34 -2.113 19.670 -29.518 258 HA PRO 35 HA PRO 35 1.328 16.669 -23.712 259 HB2 PRO 35 2HB PRO 35 2.441 16.334 -21.259 260 HB3 PRO 35 3HB PRO 35 2.617 15.154 -22.563 261 HG2 PRO 35 2HG PRO 35 4.528 17.271 -21.654 262 HG3 PRO 35 3HG PRO 35 4.855 15.588 -22.104 263 HD2 PRO 35 2HD PRO 35 5.304 17.660 -23.788 264 HD3 PRO 35 3HD PRO 35 4.816 16.052 -24.361 265 H LEU 36 H LEU 36 0.987 19.171 -24.193 266 HA LEU 36 HA LEU 36 1.176 20.775 -21.769 267 HB2 LEU 36 2HB LEU 36 0.242 21.407 -24.561 268 HB3 LEU 36 3HB LEU 36 0.195 22.561 -23.231 269 HG LEU 36 HG LEU 36 2.751 21.268 -24.149 270 HD11 LEU 36 1HD1 LEU 36 3.011 23.660 -25.208 271 HD12 LEU 36 2HD1 LEU 36 1.252 23.566 -25.298 272 HD13 LEU 36 3HD1 LEU 36 2.242 22.346 -26.099 273 HD21 LEU 36 3HD2 LEU 36 3.477 22.289 -22.304 274 HD22 LEU 36 1HD2 LEU 36 1.972 23.187 -22.111 275 HD23 LEU 36 2HD2 LEU 36 3.236 23.804 -23.175 276 H VAL 37 H VAL 37 -1.273 19.350 -23.877 277 HA VAL 37 HA VAL 37 -3.433 20.342 -22.207 278 HB VAL 37 HB VAL 37 -4.924 19.194 -23.792 279 HG11 VAL 37 1HG1 VAL 37 -4.233 20.505 -25.843 280 HG12 VAL 37 2HG1 VAL 37 -4.402 21.431 -24.351 281 HG13 VAL 37 3HG1 VAL 37 -2.799 20.988 -24.939 282 HG21 VAL 37 3HG2 VAL 37 -2.339 18.280 -25.043 283 HG22 VAL 37 1HG2 VAL 37 -3.631 17.276 -24.384 284 HG23 VAL 37 2HG2 VAL 37 -3.903 18.209 -25.855 285 H ILE 38 H ILE 38 -1.839 17.288 -22.965 286 HA ILE 38 HA ILE 38 -3.591 15.570 -21.607 287 HB ILE 38 HB ILE 38 -1.831 13.934 -21.630 288 HG12 ILE 38 2HG1 ILE 38 0.437 14.955 -22.677 289 HG13 ILE 38 3HG1 ILE 38 -0.106 16.342 -21.739 290 HG21 ILE 38 1HG2 ILE 38 -2.026 13.675 -23.830 291 HG22 ILE 38 2HG2 ILE 38 -2.754 15.280 -23.880 292 HG23 ILE 38 3HG2 ILE 38 -1.022 15.090 -24.149 293 HD11 ILE 38 3HD1 ILE 38 1.219 13.986 -20.857 294 HD12 ILE 38 1HD1 ILE 38 0.770 15.421 -19.935 295 HD13 ILE 38 2HD1 ILE 38 -0.364 14.077 -20.085 296 H ARG 39 H ARG 39 -1.020 17.635 -20.469 297 HA ARG 39 HA ARG 39 -0.824 16.436 -17.874 298 HB2 ARG 39 2HB ARG 39 0.519 18.448 -17.316 299 HB3 ARG 39 3HB ARG 39 1.080 17.625 -18.766 300 HG2 ARG 39 2HG ARG 39 0.012 19.285 -20.163 301 HG3 ARG 39 3HG ARG 39 -0.656 20.085 -18.738 302 HD2 ARG 39 2HD ARG 39 2.108 19.851 -18.292 303 HD3 ARG 39 3HD ARG 39 1.923 20.393 -19.959 304 HE ARG 39 HE ARG 39 0.235 21.970 -18.455 305 HH11 ARG 39 1HH1 ARG 39 3.649 21.297 -18.573 306 HH12 ARG 39 2HH1 ARG 39 4.111 22.865 -17.999 307 HH21 ARG 39 1HH2 ARG 39 0.831 24.038 -17.699 308 HH22 ARG 39 2HH2 ARG 39 2.507 24.423 -17.501 309 H THR 40 H THR 40 -2.682 19.024 -19.316 310 HA THR 40 HA THR 40 -3.533 20.451 -17.125 311 HB THR 40 HB THR 40 -5.650 19.789 -19.091 312 HG1 THR 40 HG1 THR 40 -3.320 21.238 -19.863 313 HG21 THR 40 3HG2 THR 40 -4.518 22.239 -17.785 314 HG22 THR 40 1HG2 THR 40 -6.163 21.608 -17.727 315 HG23 THR 40 2HG2 THR 40 -5.563 22.374 -19.198 316 H VAL 41 H VAL 41 -5.029 17.507 -18.461 317 HA VAL 41 HA VAL 41 -6.971 17.318 -16.373 318 HB VAL 41 HB VAL 41 -7.504 15.122 -17.304 319 HG11 VAL 41 1HG1 VAL 41 -7.555 16.081 -19.849 320 HG12 VAL 41 2HG1 VAL 41 -8.718 16.505 -18.591 321 HG13 VAL 41 3HG1 VAL 41 -7.345 17.564 -18.919 322 HG21 VAL 41 3HG2 VAL 41 -6.254 14.315 -19.300 323 HG22 VAL 41 1HG2 VAL 41 -5.051 15.568 -18.998 324 HG23 VAL 41 2HG2 VAL 41 -5.309 14.289 -17.811 325 H ILE 42 H ILE 42 -3.804 15.910 -16.971 326 HA ILE 42 HA ILE 42 -3.828 13.922 -15.003 327 HB ILE 42 HB ILE 42 -1.524 15.528 -16.106 328 HG12 ILE 42 2HG1 ILE 42 -3.109 13.578 -17.280 329 HG13 ILE 42 3HG1 ILE 42 -1.513 14.082 -17.824 330 HG21 ILE 42 1HG2 ILE 42 -1.502 13.108 -14.312 331 HG22 ILE 42 2HG2 ILE 42 -0.098 13.698 -15.200 332 HG23 ILE 42 3HG2 ILE 42 -0.846 14.706 -13.961 333 HD11 ILE 42 3HD1 ILE 42 -0.472 12.301 -16.629 334 HD12 ILE 42 1HD1 ILE 42 -1.992 11.870 -15.846 335 HD13 ILE 42 2HD1 ILE 42 -1.795 11.629 -17.583 336 H ALA 43 H ALA 43 -3.774 17.315 -14.703 337 HA ALA 43 HA ALA 43 -2.302 17.845 -12.452 338 HB1 ALA 43 1HB ALA 43 -4.086 19.595 -11.957 339 HB2 ALA 43 2HB ALA 43 -3.303 19.670 -13.536 340 HB3 ALA 43 3HB ALA 43 -4.920 18.983 -13.385 341 H GLY 44 H GLY 44 -5.139 15.914 -12.702 342 HA2 GLY 44 2HA GLY 44 -5.690 16.048 -9.837 343 HA3 GLY 44 3HA GLY 44 -6.638 15.186 -11.040 344 H TYR 45 H TYR 45 -4.392 13.805 -12.216 345 HA TYR 45 HA TYR 45 -4.407 11.449 -10.778 346 HB2 TYR 45 2HB TYR 45 -3.581 10.967 -12.825 347 HB3 TYR 45 3HB TYR 45 -2.836 12.552 -13.003 348 HD1 TYR 45 HD2 TYR 45 -2.376 9.186 -11.535 349 HD2 TYR 45 HD1 TYR 45 -0.526 12.869 -12.591 350 HE1 TYR 45 HE2 TYR 45 -0.166 8.186 -11.128 351 HE2 TYR 45 HE1 TYR 45 1.689 11.878 -12.189 352 HH TYR 45 HH TYR 45 2.282 9.338 -10.463 353 H ASN 46 H ASN 46 -1.975 14.034 -10.723 354 HA ASN 46 HA ASN 46 -0.101 12.888 -9.052 355 HB2 ASN 46 2HB ASN 46 -0.901 15.656 -9.727 356 HB3 ASN 46 3HB ASN 46 0.016 15.468 -8.235 357 HD21 ASN 46 1HD2 ASN 46 1.947 16.255 -8.796 358 HD22 ASN 46 2HD2 ASN 46 2.925 15.646 -10.083 359 H LEU 47 H LEU 47 -3.278 13.998 -8.303 360 HA LEU 47 HA LEU 47 -2.842 14.245 -5.469 361 HB2 LEU 47 2HB LEU 47 -4.582 15.490 -6.801 362 HB3 LEU 47 3HB LEU 47 -5.472 13.973 -6.908 363 HG LEU 47 HG LEU 47 -5.109 14.200 -4.217 364 HD11 LEU 47 1HD1 LEU 47 -6.004 16.680 -3.969 365 HD12 LEU 47 2HD1 LEU 47 -5.021 16.912 -5.414 366 HD13 LEU 47 3HD1 LEU 47 -4.282 16.299 -3.935 367 HD21 LEU 47 3HD2 LEU 47 -7.269 13.777 -4.546 368 HD22 LEU 47 1HD2 LEU 47 -7.247 14.531 -6.140 369 HD23 LEU 47 2HD2 LEU 47 -7.501 15.519 -4.701 370 H TYR 48 H TYR 48 -4.063 11.797 -7.675 371 HA TYR 48 HA TYR 48 -5.333 10.015 -6.083 372 HB2 TYR 48 2HB TYR 48 -4.144 9.918 -8.595 373 HB3 TYR 48 3HB TYR 48 -3.357 8.622 -7.703 374 HD1 TYR 48 HD2 TYR 48 -5.643 7.808 -5.937 375 HD2 TYR 48 HD1 TYR 48 -5.498 8.713 -10.092 376 HE1 TYR 48 HE2 TYR 48 -7.594 6.358 -6.315 377 HE2 TYR 48 HE1 TYR 48 -7.450 7.267 -10.481 378 HH TYR 48 HH TYR 48 -8.955 5.458 -7.821 379 H ARG 49 H ARG 49 -1.799 10.233 -6.445 380 HA ARG 49 HA ARG 49 -1.336 8.279 -4.387 381 HB2 ARG 49 2HB ARG 49 0.262 9.756 -6.337 382 HB3 ARG 49 3HB ARG 49 1.064 9.588 -4.782 383 HG2 ARG 49 2HG ARG 49 -0.099 7.085 -5.540 384 HG3 ARG 49 3HG ARG 49 0.905 7.706 -6.852 385 HD2 ARG 49 2HD ARG 49 1.798 7.480 -3.982 386 HD3 ARG 49 3HD ARG 49 2.127 6.272 -5.223 387 HE ARG 49 HE ARG 49 3.073 8.599 -6.280 388 HH11 ARG 49 1HH1 ARG 49 3.626 6.842 -3.326 389 HH12 ARG 49 2HH1 ARG 49 5.263 7.384 -3.157 390 HH21 ARG 49 1HH2 ARG 49 5.227 9.319 -6.069 391 HH22 ARG 49 2HH2 ARG 49 6.173 8.793 -4.717 392 H ALA 50 H ALA 50 -1.623 11.727 -4.576 393 HA ALA 50 HA ALA 50 -0.212 12.624 -2.396 394 HB1 ALA 50 1HB ALA 50 -1.670 14.503 -2.332 395 HB2 ALA 50 2HB ALA 50 -1.526 14.011 -4.020 396 HB3 ALA 50 3HB ALA 50 -2.973 13.596 -3.101 397 H ILE 51 H ILE 51 -3.376 11.055 -2.445 398 HA ILE 51 HA ILE 51 -3.709 11.319 0.415 399 HB ILE 51 HB ILE 51 -5.336 9.737 -1.579 400 HG12 ILE 51 2HG1 ILE 51 -5.381 12.138 -2.051 401 HG13 ILE 51 3HG1 ILE 51 -6.935 11.606 -1.417 402 HG21 ILE 51 1HG2 ILE 51 -5.413 9.946 1.320 403 HG22 ILE 51 2HG2 ILE 51 -6.948 10.368 0.564 404 HG23 ILE 51 3HG2 ILE 51 -6.212 8.798 0.246 405 HD11 ILE 51 3HD1 ILE 51 -5.155 13.621 -0.429 406 HD12 ILE 51 1HD1 ILE 51 -6.806 13.241 0.062 407 HD13 ILE 51 2HD1 ILE 51 -5.447 12.399 0.809 408 H LYS 52 H LYS 52 -2.299 9.081 -1.763 409 HA LYS 52 HA LYS 52 -2.549 6.749 -0.125 410 HB2 LYS 52 2HB LYS 52 -0.684 7.378 -2.420 411 HB3 LYS 52 3HB LYS 52 -0.835 5.798 -1.663 412 HG2 LYS 52 2HG LYS 52 -3.141 7.234 -2.949 413 HG3 LYS 52 3HG LYS 52 -2.096 6.100 -3.808 414 HD2 LYS 52 2HD LYS 52 -3.073 4.316 -2.863 415 HD3 LYS 52 3HD LYS 52 -3.110 5.069 -1.267 416 HE2 LYS 52 2HE LYS 52 -4.956 6.338 -3.104 417 HE3 LYS 52 3HE LYS 52 -5.275 4.611 -2.946 418 HZ1 LYS 52 3HZ LYS 52 -5.933 6.652 -1.159 419 HZ2 LYS 52 1HZ LYS 52 -4.786 5.670 -0.397 420 HZ3 LYS 52 2HZ LYS 52 -6.215 4.992 -0.995 421 H LYS 53 H LYS 53 -0.258 9.367 -0.403 422 HA LYS 53 HA LYS 53 1.720 8.055 1.257 423 HB2 LYS 53 2HB LYS 53 2.971 10.168 1.036 424 HB3 LYS 53 3HB LYS 53 2.487 9.518 -0.526 425 HG2 LYS 53 2HG LYS 53 0.607 11.102 -0.579 426 HG3 LYS 53 3HG LYS 53 1.157 11.778 0.956 427 HD2 LYS 53 2HD LYS 53 3.430 12.019 -0.371 428 HD3 LYS 53 3HD LYS 53 2.346 12.007 -1.764 429 HE2 LYS 53 2HE LYS 53 1.168 13.912 -0.965 430 HE3 LYS 53 3HE LYS 53 1.970 13.829 0.603 431 HZ1 LYS 53 3HZ LYS 53 3.912 14.021 -1.422 432 HZ2 LYS 53 1HZ LYS 53 3.582 15.109 -0.170 433 HZ3 LYS 53 2HZ LYS 53 2.773 15.251 -1.649 434 H LYS 54 H LYS 54 -0.665 10.641 1.549 435 HA LYS 54 HA LYS 54 0.071 11.353 4.217 436 HB2 LYS 54 2HB LYS 54 -1.560 12.435 2.228 437 HB3 LYS 54 3HB LYS 54 -2.673 11.998 3.518 438 HG2 LYS 54 2HG LYS 54 -1.722 13.471 5.019 439 HG3 LYS 54 3HG LYS 54 -0.186 13.524 4.152 440 HD2 LYS 54 2HD LYS 54 -2.110 14.463 2.345 441 HD3 LYS 54 3HD LYS 54 -2.494 15.226 3.890 442 HE2 LYS 54 2HE LYS 54 -0.613 16.471 3.888 443 HE3 LYS 54 3HE LYS 54 0.362 15.183 3.180 444 HZ1 LYS 54 3HZ LYS 54 -0.264 17.364 1.854 445 HZ2 LYS 54 1HZ LYS 54 -1.632 16.447 1.463 446 HZ3 LYS 54 2HZ LYS 54 -0.088 15.868 1.083 447 H GLY 55 H GLY 55 -2.244 11.473 5.646 448 HA2 GLY 55 2HA GLY 55 -3.250 8.712 5.779 449 HA3 GLY 55 3HA GLY 55 -2.533 9.435 7.212 450 H GLY 56 H GLY 56 -4.452 11.281 4.943 451 HA2 GLY 56 2HA GLY 56 -6.986 10.988 6.054 452 HA3 GLY 56 3HA GLY 56 -6.172 12.238 6.983 453 H GLY 57 H GLY 57 -8.521 12.465 5.266 454 HA2 GLY 57 2HA GLY 57 -7.520 14.647 3.582 455 HA3 GLY 57 3HA GLY 57 -8.493 13.397 2.820 456 H GLY 58 H GLY 58 -10.705 13.270 3.262 457 HA2 GLY 58 2HA GLY 58 -12.257 14.424 5.126 458 HA3 GLY 58 3HA GLY 58 -11.866 15.794 4.098 459 H GLY 59 H GLY 59 -11.796 14.133 1.666 460 HA2 GLY 59 2HA GLY 59 -14.590 14.329 1.029 461 HA3 GLY 59 3HA GLY 59 -13.306 13.810 -0.053 462 H GLY 60 H GLY 60 -16.067 12.826 1.416 463 HA2 GLY 60 2HA GLY 60 -16.439 10.389 0.579 464 HA3 GLY 60 3HA GLY 60 -15.192 10.045 1.769 465 H GLY 61 H GLY 61 -18.205 9.459 1.461 466 HA2 GLY 61 2HA GLY 61 -18.890 9.094 4.074 467 HA3 GLY 61 3HA GLY 61 -19.394 10.745 3.744 468 H GLY 62 H GLY 62 -21.326 11.078 2.815 469 HA2 GLY 62 2HA GLY 62 -22.655 9.783 0.874 470 HA3 GLY 62 3HA GLY 62 -22.970 8.752 2.262 471 H GLY 63 H GLY 63 -23.831 11.610 0.605 472 HA2 GLY 63 2HA GLY 63 -26.227 11.929 2.059 473 HA3 GLY 63 3HA GLY 63 -25.055 13.111 2.621 474 H GLY 64 H GLY 64 -24.133 14.582 1.017 475 HA2 GLY 64 2HA GLY 64 -26.012 15.039 -1.219 476 HA3 GLY 64 3HA GLY 64 -25.318 16.345 -0.269 477 H VAL 65 H VAL 65 -23.752 13.453 -1.600 478 HA VAL 65 HA VAL 65 -22.108 13.196 -3.163 479 HB VAL 65 HB VAL 65 -22.441 16.081 -3.954 480 HG11 VAL 65 1HG1 VAL 65 -21.704 15.291 -6.128 481 HG12 VAL 65 2HG1 VAL 65 -20.535 14.837 -4.886 482 HG13 VAL 65 3HG1 VAL 65 -21.652 13.633 -5.530 483 HG21 VAL 65 3HG2 VAL 65 -24.325 13.847 -4.262 484 HG22 VAL 65 1HG2 VAL 65 -24.604 15.587 -4.328 485 HG23 VAL 65 2HG2 VAL 65 -23.977 14.741 -5.742 486 H TRP 66 H TRP 66 -21.747 16.624 -2.253 487 HA TRP 66 HA TRP 66 -19.964 17.785 -1.437 488 HB2 TRP 66 2HB TRP 66 -20.526 16.773 0.645 489 HB3 TRP 66 3HB TRP 66 -19.809 15.236 0.170 490 HD1 TRP 66 HD1 TRP 66 -17.642 14.827 1.446 491 HE1 TRP 66 HE1 TRP 66 -15.687 16.271 2.293 492 HE3 TRP 66 HE3 TRP 66 -19.277 19.410 -0.124 493 HZ2 TRP 66 HZ2 TRP 66 -14.937 18.992 2.297 494 HZ3 TRP 66 HZ3 TRP 66 -17.882 21.383 0.342 495 HH2 TRP 66 HH2 TRP 66 -15.758 21.176 1.528 496 HA PRO 67 HA PRO 67 -17.026 15.400 -4.216 497 HB2 PRO 67 2HB PRO 67 -16.907 17.276 -6.175 498 HB3 PRO 67 3HB PRO 67 -18.117 15.987 -6.151 499 HG2 PRO 67 2HG PRO 67 -18.375 18.844 -5.293 500 HG3 PRO 67 3HG PRO 67 -19.508 17.849 -6.225 501 HD2 PRO 67 2HD PRO 67 -19.824 18.326 -3.579 502 HD3 PRO 67 3HD PRO 67 -20.338 16.808 -4.344 503 H LEU 68 H LEU 68 -15.695 16.009 -2.299 504 HA LEU 68 HA LEU 68 -14.301 18.559 -2.507 505 HB2 LEU 68 2HB LEU 68 -14.692 18.188 -0.294 506 HB3 LEU 68 3HB LEU 68 -14.572 16.437 -0.454 507 HG LEU 68 HG LEU 68 -12.138 16.601 -0.525 508 HD11 LEU 68 1HD1 LEU 68 -12.733 19.413 -0.914 509 HD12 LEU 68 2HD1 LEU 68 -11.257 18.511 -1.252 510 HD13 LEU 68 3HD1 LEU 68 -11.550 19.147 0.366 511 HD21 LEU 68 3HD2 LEU 68 -12.610 18.234 1.848 512 HD22 LEU 68 1HD2 LEU 68 -12.016 16.580 1.707 513 HD23 LEU 68 2HD2 LEU 68 -13.750 16.899 1.670 514 H VAL 69 H VAL 69 -13.553 15.087 -2.560 515 HA VAL 69 HA VAL 69 -10.819 15.630 -3.390 516 HB VAL 69 HB VAL 69 -10.556 13.162 -3.354 517 HG11 VAL 69 1HG1 VAL 69 -11.049 12.943 -0.836 518 HG12 VAL 69 2HG1 VAL 69 -9.919 14.191 -1.364 519 HG13 VAL 69 3HG1 VAL 69 -11.577 14.621 -0.943 520 HG21 VAL 69 3HG2 VAL 69 -12.659 12.297 -3.892 521 HG22 VAL 69 1HG2 VAL 69 -12.478 11.929 -2.177 522 HG23 VAL 69 2HG2 VAL 69 -13.479 13.289 -2.686 523 H ILE 70 H ILE 70 -13.686 13.959 -4.668 524 HA ILE 70 HA ILE 70 -12.708 13.099 -7.092 525 HB ILE 70 HB ILE 70 -15.172 13.772 -7.878 526 HG12 ILE 70 2HG1 ILE 70 -15.200 14.928 -5.426 527 HG13 ILE 70 3HG1 ILE 70 -16.641 14.332 -6.242 528 HG21 ILE 70 1HG2 ILE 70 -14.479 11.556 -5.955 529 HG22 ILE 70 2HG2 ILE 70 -15.933 11.614 -6.951 530 HG23 ILE 70 3HG2 ILE 70 -14.346 11.508 -7.713 531 HD11 ILE 70 3HD1 ILE 70 -16.319 13.675 -3.817 532 HD12 ILE 70 1HD1 ILE 70 -16.693 12.380 -4.954 533 HD13 ILE 70 2HD1 ILE 70 -15.037 12.608 -4.390 534 H ARG 71 H ARG 71 -14.071 16.287 -6.318 535 HA ARG 71 HA ARG 71 -14.065 17.459 -8.800 536 HB2 ARG 71 2HB ARG 71 -13.688 19.619 -7.610 537 HB3 ARG 71 3HB ARG 71 -14.954 18.628 -6.897 538 HG2 ARG 71 2HG ARG 71 -13.471 17.925 -5.131 539 HG3 ARG 71 3HG ARG 71 -12.126 18.791 -5.878 540 HD2 ARG 71 2HD ARG 71 -14.630 20.257 -5.162 541 HD3 ARG 71 3HD ARG 71 -13.452 19.873 -3.908 542 HE ARG 71 HE ARG 71 -12.085 21.053 -6.032 543 HH11 ARG 71 1HH1 ARG 71 -14.488 21.898 -3.659 544 HH12 ARG 71 2HH1 ARG 71 -14.037 23.570 -3.606 545 HH21 ARG 71 1HH2 ARG 71 -11.481 23.252 -5.971 546 HH22 ARG 71 2HH2 ARG 71 -12.327 24.339 -4.923 547 H THR 72 H THR 72 -11.344 17.163 -6.547 548 HA THR 72 HA THR 72 -9.439 18.653 -7.875 549 HB THR 72 HB THR 72 -8.596 16.042 -6.692 550 HG1 THR 72 HG1 THR 72 -9.756 18.215 -5.259 551 HG21 THR 72 3HG2 THR 72 -6.748 17.327 -7.192 552 HG22 THR 72 1HG2 THR 72 -7.045 17.804 -5.521 553 HG23 THR 72 2HG2 THR 72 -7.575 18.845 -6.843 554 H VAL 73 H VAL 73 -10.543 15.378 -8.543 555 HA VAL 73 HA VAL 73 -8.549 14.939 -10.588 556 HB VAL 73 HB VAL 73 -10.982 13.225 -10.350 557 HG11 VAL 73 1HG1 VAL 73 -8.153 12.288 -10.528 558 HG12 VAL 73 2HG1 VAL 73 -9.625 11.548 -11.161 559 HG13 VAL 73 3HG1 VAL 73 -8.939 12.968 -11.952 560 HG21 VAL 73 3HG2 VAL 73 -8.693 13.182 -8.384 561 HG22 VAL 73 1HG2 VAL 73 -10.346 13.684 -8.031 562 HG23 VAL 73 2HG2 VAL 73 -10.008 12.010 -8.471 563 H ILE 74 H ILE 74 -11.970 15.765 -10.420 564 HA ILE 74 HA ILE 74 -12.544 15.504 -13.170 565 HB ILE 74 HB ILE 74 -13.915 17.509 -11.404 566 HG12 ILE 74 2HG1 ILE 74 -13.753 14.586 -11.064 567 HG13 ILE 74 3HG1 ILE 74 -14.188 15.834 -9.901 568 HG21 ILE 74 1HG2 ILE 74 -14.838 15.706 -13.636 569 HG22 ILE 74 2HG2 ILE 74 -15.892 16.757 -12.692 570 HG23 ILE 74 3HG2 ILE 74 -14.628 17.456 -13.703 571 HD11 ILE 74 3HD1 ILE 74 -16.420 15.968 -10.986 572 HD12 ILE 74 1HD1 ILE 74 -15.963 14.584 -11.978 573 HD13 ILE 74 2HD1 ILE 74 -16.071 14.416 -10.225 574 H ALA 75 H ALA 75 -10.635 17.743 -11.512 575 HA ALA 75 HA ALA 75 -11.016 20.168 -12.716 576 HB1 ALA 75 1HB ALA 75 -8.551 18.758 -11.787 577 HB2 ALA 75 2HB ALA 75 -8.423 20.326 -12.585 578 HB3 ALA 75 3HB ALA 75 -9.365 20.166 -11.103 579 H GLY 76 H GLY 76 -9.908 17.242 -14.183 580 HA2 GLY 76 2HA GLY 76 -8.876 18.620 -16.539 581 HA3 GLY 76 3HA GLY 76 -8.843 16.887 -16.248 582 H TYR 77 H TYR 77 -11.762 17.021 -15.487 583 HA TYR 77 HA TYR 77 -12.898 16.105 -17.804 584 HB2 TYR 77 2HB TYR 77 -13.835 16.147 -15.393 585 HB3 TYR 77 3HB TYR 77 -14.524 17.703 -15.842 586 HD1 TYR 77 HD2 TYR 77 -14.597 16.159 -18.834 587 HD2 TYR 77 HD1 TYR 77 -16.398 15.766 -14.999 588 HE1 TYR 77 HE2 TYR 77 -16.517 15.013 -19.859 589 HE2 TYR 77 HE1 TYR 77 -18.322 14.618 -16.014 590 HH TYR 77 HH TYR 77 -19.381 14.674 -18.529 591 H ASN 78 H ASN 78 -13.120 19.430 -16.543 592 HA ASN 78 HA ASN 78 -14.637 20.577 -18.531 593 HB2 ASN 78 2HB ASN 78 -13.701 21.627 -16.375 594 HB3 ASN 78 3HB ASN 78 -12.272 22.006 -17.331 595 HD21 ASN 78 1HD2 ASN 78 -12.265 23.978 -18.096 596 HD22 ASN 78 2HD2 ASN 78 -13.649 24.901 -18.565 597 H LEU 79 H LEU 79 -11.423 19.381 -18.727 598 HA LEU 79 HA LEU 79 -10.843 20.840 -21.184 599 HB2 LEU 79 2HB LEU 79 -9.297 19.636 -19.118 600 HB3 LEU 79 3HB LEU 79 -8.880 18.865 -20.647 601 HG LEU 79 HG LEU 79 -7.393 20.748 -20.056 602 HD11 LEU 79 1HD1 LEU 79 -7.079 20.960 -22.238 603 HD12 LEU 79 2HD1 LEU 79 -8.522 21.961 -22.383 604 HD13 LEU 79 3HD1 LEU 79 -8.650 20.208 -22.516 605 HD21 LEU 79 3HD2 LEU 79 -9.586 22.014 -19.157 606 HD22 LEU 79 1HD2 LEU 79 -9.451 22.742 -20.758 607 HD23 LEU 79 2HD2 LEU 79 -8.103 22.848 -19.626 608 H TYR 80 H TYR 80 -11.733 17.647 -20.082 609 HA TYR 80 HA TYR 80 -11.088 15.982 -22.115 610 HB2 TYR 80 2HB TYR 80 -13.676 16.171 -20.579 611 HB3 TYR 80 3HB TYR 80 -13.340 14.860 -21.704 612 HD1 TYR 80 HD2 TYR 80 -10.285 15.766 -20.319 613 HD2 TYR 80 HD1 TYR 80 -13.888 13.736 -19.322 614 HE1 TYR 80 HE2 TYR 80 -9.099 14.547 -18.542 615 HE2 TYR 80 HE1 TYR 80 -12.713 12.512 -17.541 616 HH TYR 80 HH TYR 80 -10.269 13.246 -16.109 617 H ARG 81 H ARG 81 -13.917 18.140 -22.088 618 HA ARG 81 HA ARG 81 -14.539 17.503 -24.840 619 HB2 ARG 81 2HB ARG 81 -15.789 19.160 -22.695 620 HB3 ARG 81 3HB ARG 81 -16.205 19.507 -24.368 621 HG2 ARG 81 2HG ARG 81 -16.915 17.174 -24.660 622 HG3 ARG 81 3HG ARG 81 -16.539 16.865 -22.963 623 HD2 ARG 81 2HD ARG 81 -18.596 18.791 -24.035 624 HD3 ARG 81 3HD ARG 81 -18.911 17.258 -23.223 625 HE ARG 81 HE ARG 81 -17.393 18.795 -21.485 626 HH11 ARG 81 1HH1 ARG 81 -20.517 18.948 -23.015 627 HH12 ARG 81 2HH1 ARG 81 -21.246 19.855 -21.732 628 HH21 ARG 81 1HH2 ARG 81 -18.342 19.989 -19.789 629 HH22 ARG 81 2HH2 ARG 81 -20.008 20.448 -19.898 630 H ALA 82 H ALA 82 -12.787 19.915 -23.091 631 HA ALA 82 HA ALA 82 -12.842 22.126 -24.701 632 HB1 ALA 82 1HB ALA 82 -10.618 22.656 -23.897 633 HB2 ALA 82 2HB ALA 82 -11.589 21.972 -22.592 634 HB3 ALA 82 3HB ALA 82 -10.374 20.981 -23.401 635 H ILE 83 H ILE 83 -11.121 19.107 -25.254 636 HA ILE 83 HA ILE 83 -9.817 20.118 -27.635 637 HB ILE 83 HB ILE 83 -9.750 17.555 -26.119 638 HG12 ILE 83 2HG1 ILE 83 -7.370 17.914 -26.200 639 HG13 ILE 83 3HG1 ILE 83 -7.551 19.170 -27.421 640 HG21 ILE 83 1HG2 ILE 83 -9.120 17.837 -29.042 641 HG22 ILE 83 2HG2 ILE 83 -8.382 16.593 -28.035 642 HG23 ILE 83 3HG2 ILE 83 -10.132 16.631 -28.246 643 HD11 ILE 83 3HD1 ILE 83 -8.554 19.342 -24.590 644 HD12 ILE 83 1HD1 ILE 83 -7.075 20.081 -25.202 645 HD13 ILE 83 2HD1 ILE 83 -8.643 20.609 -25.813 646 H LYS 84 H LYS 84 -12.671 18.331 -26.796 647 HA LYS 84 HA LYS 84 -13.157 17.163 -29.339 648 HB2 LYS 84 2HB LYS 84 -15.060 16.323 -28.408 649 HB3 LYS 84 3HB LYS 84 -14.222 16.755 -26.923 650 HG2 LYS 84 2HG LYS 84 -16.191 17.742 -26.456 651 HG3 LYS 84 3HG LYS 84 -15.487 19.065 -27.389 652 HD2 LYS 84 2HD LYS 84 -16.990 18.838 -29.032 653 HD3 LYS 84 3HD LYS 84 -16.819 17.081 -29.057 654 HE2 LYS 84 2HE LYS 84 -18.926 17.104 -28.271 655 HE3 LYS 84 3HE LYS 84 -18.148 17.433 -26.724 656 HZ1 LYS 84 3HZ LYS 84 -18.690 19.756 -28.374 657 HZ2 LYS 84 1HZ LYS 84 -18.878 19.543 -26.706 658 HZ3 LYS 84 2HZ LYS 84 -20.057 18.962 -27.772 659 H LYS 85 H LYS 85 -13.530 20.334 -28.094 660 HA LYS 85 HA LYS 85 -15.510 21.135 -30.057 661 HB2 LYS 85 2HB LYS 85 -15.862 22.375 -28.161 662 HB3 LYS 85 3HB LYS 85 -14.155 22.412 -27.737 663 HG2 LYS 85 2HG LYS 85 -13.726 24.240 -29.048 664 HG3 LYS 85 3HG LYS 85 -15.070 23.907 -30.143 665 HD2 LYS 85 2HD LYS 85 -16.359 24.340 -27.772 666 HD3 LYS 85 3HD LYS 85 -15.000 25.461 -27.661 667 HE2 LYS 85 2HE LYS 85 -15.685 26.679 -29.495 668 HE3 LYS 85 3HE LYS 85 -16.594 25.333 -30.181 669 HZ1 LYS 85 3HZ LYS 85 -17.917 25.758 -27.897 670 HZ2 LYS 85 1HZ LYS 85 -18.342 26.457 -29.378 671 HZ3 LYS 85 2HZ LYS 85 -17.423 27.334 -28.262 672 H LYS 86 H LYS 86 -12.058 21.567 -29.453 673 HA LYS 86 HA LYS 86 -10.367 22.406 -30.731 674 HB2 LYS 86 2HB LYS 86 -11.020 20.420 -32.066 675 HB3 LYS 86 3HB LYS 86 -12.114 21.432 -33.000 676 HG2 LYS 86 2HG LYS 86 -10.414 21.687 -34.411 677 HG3 LYS 86 3HG LYS 86 -9.732 22.777 -33.201 678 HD2 LYS 86 2HD LYS 86 -9.236 19.854 -32.922 679 HD3 LYS 86 3HD LYS 86 -8.347 20.744 -34.160 680 HE2 LYS 86 2HE LYS 86 -7.478 22.265 -32.499 681 HE3 LYS 86 3HE LYS 86 -8.459 21.508 -31.245 682 HZ1 LYS 86 3HZ LYS 86 -5.946 20.868 -31.621 683 HZ2 LYS 86 1HZ LYS 86 -6.625 19.795 -32.739 684 HZ3 LYS 86 2HZ LYS 86 -7.086 19.726 -31.114 685 H GLY 87 H GLY 87 -10.815 24.593 -30.123 686 HA2 GLY 87 2HA GLY 87 -10.804 26.458 -32.105 687 HA3 GLY 87 3HA GLY 87 -12.515 26.228 -31.776 688 H GLY 88 H GLY 88 -12.448 25.853 -29.016 689 HA2 GLY 88 2HA GLY 88 -11.209 27.192 -27.194 690 HA3 GLY 88 3HA GLY 88 -11.706 28.571 -28.163 691 H GLY 89 H GLY 89 -12.518 26.603 -25.589 692 HA2 GLY 89 2HA GLY 89 -14.779 27.994 -24.835 693 HA3 GLY 89 3HA GLY 89 -15.362 26.646 -25.800 694 H GLY 90 H GLY 90 -16.088 26.916 -23.151 695 HA2 GLY 90 2HA GLY 90 -15.572 24.393 -22.106 696 HA3 GLY 90 3HA GLY 90 -14.413 25.486 -21.364 697 H GLY 91 H GLY 91 -16.702 23.962 -20.226 698 HA2 GLY 91 2HA GLY 91 -17.867 26.215 -18.768 699 HA3 GLY 91 3HA GLY 91 -18.977 25.112 -19.567 700 H GLY 92 H GLY 92 -19.216 22.995 -18.784 701 HA2 GLY 92 2HA GLY 92 -18.030 21.400 -17.119 702 HA3 GLY 92 3HA GLY 92 -18.353 22.706 -15.989 703 H GLY 93 H GLY 93 -19.333 19.813 -16.372 704 HA2 GLY 93 2HA GLY 93 -21.259 18.683 -15.835 705 HA3 GLY 93 3HA GLY 93 -21.923 20.224 -15.310 706 H GLY 94 H GLY 94 -21.776 17.879 -17.844 707 HA2 GLY 94 2HA GLY 94 -24.218 18.645 -18.978 708 HA3 GLY 94 3HA GLY 94 -22.936 19.374 -19.934 709 H GLY 95 H GLY 95 -24.844 17.388 -20.792 710 HA2 GLY 95 2HA GLY 95 -23.051 15.086 -21.250 711 HA3 GLY 95 3HA GLY 95 -24.805 14.991 -21.261 712 H GLY 96 H GLY 96 -24.590 13.971 -23.348 713 HA2 GLY 96 2HA GLY 96 -25.259 15.490 -25.501 714 HA3 GLY 96 3HA GLY 96 -23.502 15.484 -25.547 715 H VAL 97 H VAL 97 -24.669 14.468 -27.689 716 HA VAL 97 HA VAL 97 -24.270 11.569 -27.382 717 HB VAL 97 HB VAL 97 -26.354 12.834 -29.166 718 HG11 VAL 97 1HG1 VAL 97 -25.379 10.043 -28.765 719 HG12 VAL 97 2HG1 VAL 97 -27.071 10.319 -29.183 720 HG13 VAL 97 3HG1 VAL 97 -25.792 10.887 -30.257 721 HG21 VAL 97 3HG2 VAL 97 -27.135 13.049 -26.938 722 HG22 VAL 97 1HG2 VAL 97 -27.948 11.639 -27.617 723 HG23 VAL 97 2HG2 VAL 97 -26.587 11.427 -26.515 724 H TRP 98 H TRP 98 -22.097 12.063 -28.098 725 HA TRP 98 HA TRP 98 -21.646 11.525 -30.782 726 HB2 TRP 98 2HB TRP 98 -22.265 13.588 -31.594 727 HB3 TRP 98 3HB TRP 98 -21.808 14.427 -30.114 728 HD1 TRP 98 HD1 TRP 98 -19.619 12.295 -32.516 729 HE1 TRP 98 HE1 TRP 98 -17.601 13.729 -33.221 730 HE3 TRP 98 HE3 TRP 98 -20.829 16.640 -30.108 731 HZ2 TRP 98 HZ2 TRP 98 -16.647 16.353 -32.809 732 HZ3 TRP 98 HZ3 TRP 98 -19.310 18.565 -30.314 733 HH2 TRP 98 HH2 TRP 98 -17.263 18.422 -31.637 734 HA PRO 99 HA PRO 99 -17.488 12.921 -28.751 735 HB2 PRO 99 2HB PRO 99 -17.627 14.056 -26.289 736 HB3 PRO 99 3HB PRO 99 -17.708 14.994 -27.785 737 HG2 PRO 99 2HG PRO 99 -19.931 14.073 -26.004 738 HG3 PRO 99 3HG PRO 99 -19.705 15.647 -26.789 739 HD2 PRO 99 2HD PRO 99 -21.378 13.758 -27.770 740 HD3 PRO 99 3HD PRO 99 -20.501 14.893 -28.816 741 H LEU 100 H LEU 100 -17.424 10.620 -28.610 742 HA LEU 100 HA LEU 100 -18.165 9.376 -26.089 743 HB2 LEU 100 2HB LEU 100 -17.398 8.442 -28.790 744 HB3 LEU 100 3HB LEU 100 -16.987 7.387 -27.440 745 HG LEU 100 HG LEU 100 -19.782 8.395 -27.648 746 HD11 LEU 100 1HD1 LEU 100 -20.019 6.099 -29.002 747 HD12 LEU 100 2HD1 LEU 100 -18.448 6.627 -29.602 748 HD13 LEU 100 3HD1 LEU 100 -19.858 7.670 -29.787 749 HD21 LEU 100 3HD2 LEU 100 -19.426 5.603 -27.092 750 HD22 LEU 100 1HD2 LEU 100 -20.104 6.870 -26.069 751 HD23 LEU 100 2HD2 LEU 100 -18.367 6.565 -26.060 752 H VAL 101 H VAL 101 -15.382 10.665 -27.637 753 HA VAL 101 HA VAL 101 -13.349 9.173 -26.401 754 HB VAL 101 HB VAL 101 -11.897 11.146 -26.829 755 HG11 VAL 101 1HG1 VAL 101 -13.188 11.080 -29.394 756 HG12 VAL 101 2HG1 VAL 101 -11.667 10.342 -28.888 757 HG13 VAL 101 3HG1 VAL 101 -13.186 9.473 -28.669 758 HG21 VAL 101 3HG2 VAL 101 -12.920 13.036 -28.115 759 HG22 VAL 101 1HG2 VAL 101 -14.504 12.396 -27.675 760 HG23 VAL 101 2HG2 VAL 101 -13.399 12.957 -26.420 761 H ILE 102 H ILE 102 -15.154 12.009 -25.340 762 HA ILE 102 HA ILE 102 -13.638 12.738 -23.127 763 HB ILE 102 HB ILE 102 -15.690 13.726 -22.205 764 HG12 ILE 102 2HG1 ILE 102 -17.659 13.429 -24.055 765 HG13 ILE 102 3HG1 ILE 102 -16.927 11.829 -24.101 766 HG21 ILE 102 1HG2 ILE 102 -14.756 15.199 -23.686 767 HG22 ILE 102 2HG2 ILE 102 -14.928 14.102 -25.055 768 HG23 ILE 102 3HG2 ILE 102 -16.335 14.967 -24.437 769 HD11 ILE 102 3HD1 ILE 102 -17.311 12.704 -21.387 770 HD12 ILE 102 1HD1 ILE 102 -18.820 12.764 -22.298 771 HD13 ILE 102 2HD1 ILE 102 -17.906 11.258 -22.202 772 H ARG 103 H ARG 103 -16.028 10.187 -23.495 773 HA ARG 103 HA ARG 103 -16.200 9.553 -20.721 774 HB2 ARG 103 2HB ARG 103 -17.702 7.943 -21.338 775 HB3 ARG 103 3HB ARG 103 -17.766 8.949 -22.778 776 HG2 ARG 103 2HG ARG 103 -17.496 6.953 -23.794 777 HG3 ARG 103 3HG ARG 103 -15.793 7.314 -23.509 778 HD2 ARG 103 2HD ARG 103 -16.446 6.126 -21.172 779 HD3 ARG 103 3HD ARG 103 -17.538 5.288 -22.274 780 HE ARG 103 HE ARG 103 -14.935 5.346 -23.359 781 HH11 ARG 103 1HH1 ARG 103 -16.797 3.832 -20.837 782 HH12 ARG 103 2HH1 ARG 103 -15.833 2.393 -20.810 783 HH21 ARG 103 1HH2 ARG 103 -13.658 3.456 -23.333 784 HH22 ARG 103 2HH2 ARG 103 -14.047 2.181 -22.230 785 H THR 104 H THR 104 -13.977 8.791 -23.235 786 HA THR 104 HA THR 104 -12.947 6.346 -22.410 787 HB THR 104 HB THR 104 -11.173 8.537 -23.461 788 HG1 THR 104 HG1 THR 104 -13.138 7.024 -24.861 789 HG21 THR 104 3HG2 THR 104 -9.960 6.777 -24.480 790 HG22 THR 104 1HG2 THR 104 -11.252 5.614 -24.184 791 HG23 THR 104 2HG2 THR 104 -10.299 6.236 -22.837 792 H VAL 105 H VAL 105 -11.727 9.594 -21.572 793 HA VAL 105 HA VAL 105 -9.876 8.624 -19.644 794 HB VAL 105 HB VAL 105 -10.978 11.420 -19.641 795 HG11 VAL 105 1HG1 VAL 105 -8.731 12.001 -18.925 796 HG12 VAL 105 2HG1 VAL 105 -9.410 10.763 -17.866 797 HG13 VAL 105 3HG1 VAL 105 -8.223 10.321 -19.094 798 HG21 VAL 105 3HG2 VAL 105 -10.545 11.255 -21.905 799 HG22 VAL 105 1HG2 VAL 105 -8.993 11.814 -21.280 800 HG23 VAL 105 2HG2 VAL 105 -9.223 10.111 -21.676 801 H ILE 106 H ILE 106 -13.185 9.803 -19.485 802 HA ILE 106 HA ILE 106 -13.369 10.083 -16.690 803 HB ILE 106 HB ILE 106 -15.563 9.398 -18.650 804 HG12 ILE 106 2HG1 ILE 106 -14.055 11.612 -18.763 805 HG13 ILE 106 3HG1 ILE 106 -15.774 11.617 -19.144 806 HG21 ILE 106 1HG2 ILE 106 -15.593 10.273 -15.782 807 HG22 ILE 106 2HG2 ILE 106 -16.963 10.568 -16.851 808 HG23 ILE 106 3HG2 ILE 106 -16.431 8.917 -16.535 809 HD11 ILE 106 3HD1 ILE 106 -14.837 13.430 -17.587 810 HD12 ILE 106 1HD1 ILE 106 -16.341 12.626 -17.139 811 HD13 ILE 106 2HD1 ILE 106 -14.827 12.161 -16.363 812 H ALA 107 H ALA 107 -13.340 7.307 -18.729 813 HA ALA 107 HA ALA 107 -14.782 5.418 -17.363 814 HB1 ALA 107 1HB ALA 107 -13.118 3.760 -18.209 815 HB2 ALA 107 2HB ALA 107 -13.736 4.864 -19.438 816 HB3 ALA 107 3HB ALA 107 -12.129 5.115 -18.757 817 H GLY 108 H GLY 108 -11.899 7.022 -16.347 818 HA2 GLY 108 2HA GLY 108 -11.398 5.061 -14.232 819 HA3 GLY 108 3HA GLY 108 -10.364 6.419 -14.652 820 H TYR 109 H TYR 109 -12.573 8.335 -14.667 821 HA TYR 109 HA TYR 109 -12.404 9.292 -12.072 822 HB2 TYR 109 2HB TYR 109 -13.075 10.873 -13.648 823 HB3 TYR 109 3HB TYR 109 -14.304 9.816 -14.333 824 HD1 TYR 109 HD2 TYR 109 -13.614 11.079 -10.879 825 HD2 TYR 109 HD1 TYR 109 -16.405 10.722 -14.071 826 HE1 TYR 109 HE2 TYR 109 -15.324 12.183 -9.499 827 HE2 TYR 109 HE1 TYR 109 -18.123 11.827 -12.700 828 HH TYR 109 HH TYR 109 -18.562 12.865 -10.784 829 H ASN 110 H ASN 110 -15.014 7.407 -13.575 830 HA ASN 110 HA ASN 110 -16.843 7.359 -11.525 831 HB2 ASN 110 2HB ASN 110 -16.086 5.180 -13.477 832 HB3 ASN 110 3HB ASN 110 -17.478 5.072 -12.403 833 HD21 ASN 110 1HD2 ASN 110 -16.098 6.669 -15.161 834 HD22 ASN 110 2HD2 ASN 110 -17.558 7.409 -15.716 835 H LEU 111 H LEU 111 -13.738 5.859 -11.656 836 HA LEU 111 HA LEU 111 -14.236 3.960 -9.554 837 HB2 LEU 111 2HB LEU 111 -12.265 4.343 -11.485 838 HB3 LEU 111 3HB LEU 111 -11.450 4.623 -9.948 839 HG LEU 111 HG LEU 111 -11.128 2.340 -10.528 840 HD11 LEU 111 1HD1 LEU 111 -11.850 2.991 -8.149 841 HD12 LEU 111 2HD1 LEU 111 -11.872 1.285 -8.594 842 HD13 LEU 111 3HD1 LEU 111 -13.376 2.204 -8.553 843 HD21 LEU 111 3HD2 LEU 111 -12.814 1.966 -12.153 844 HD22 LEU 111 1HD2 LEU 111 -14.102 2.289 -10.992 845 HD23 LEU 111 2HD2 LEU 111 -13.121 0.831 -10.838 846 H TYR 112 H TYR 112 -12.668 7.120 -9.824 847 HA TYR 112 HA TYR 112 -11.526 7.379 -7.346 848 HB2 TYR 112 2HB TYR 112 -12.347 9.144 -9.444 849 HB3 TYR 112 3HB TYR 112 -12.790 9.860 -7.898 850 HD1 TYR 112 HD2 TYR 112 -10.929 9.948 -6.093 851 HD2 TYR 112 HD1 TYR 112 -10.172 9.360 -10.238 852 HE1 TYR 112 HE2 TYR 112 -8.608 10.694 -5.769 853 HE2 TYR 112 HE1 TYR 112 -7.848 10.103 -9.925 854 HH TYR 112 HH TYR 112 -6.694 11.760 -7.966 855 H ARG 113 H ARG 113 -14.908 8.021 -8.219 856 HA ARG 113 HA ARG 113 -15.701 8.790 -5.601 857 HB2 ARG 113 2HB ARG 113 -16.907 8.578 -8.187 858 HB3 ARG 113 3HB ARG 113 -17.935 7.761 -7.018 859 HG2 ARG 113 2HG ARG 113 -17.031 10.281 -5.971 860 HG3 ARG 113 3HG ARG 113 -17.800 10.495 -7.546 861 HD2 ARG 113 2HD ARG 113 -19.025 8.918 -5.291 862 HD3 ARG 113 3HD ARG 113 -19.342 10.631 -5.566 863 HE ARG 113 HE ARG 113 -19.820 8.984 -7.872 864 HH11 ARG 113 1HH1 ARG 113 -21.177 10.247 -4.925 865 HH12 ARG 113 2HH1 ARG 113 -22.817 10.103 -5.465 866 HH21 ARG 113 1HH2 ARG 113 -21.975 8.789 -8.594 867 HH22 ARG 113 2HH2 ARG 113 -23.270 9.272 -7.551 868 H ALA 114 H ALA 114 -15.369 5.741 -7.229 869 HA ALA 114 HA ALA 114 -17.056 4.082 -5.825 870 HB1 ALA 114 1HB ALA 114 -14.361 2.987 -6.269 871 HB2 ALA 114 2HB ALA 114 -15.934 2.389 -6.797 872 HB3 ALA 114 3HB ALA 114 -15.141 3.688 -7.687 873 H ILE 115 H ILE 115 -14.004 5.477 -4.800 874 HA ILE 115 HA ILE 115 -13.925 3.916 -2.362 875 HB ILE 115 HB ILE 115 -12.199 6.244 -3.218 876 HG12 ILE 115 2HG1 ILE 115 -11.924 4.389 -4.746 877 HG13 ILE 115 3HG1 ILE 115 -10.515 4.466 -3.693 878 HG21 ILE 115 1HG2 ILE 115 -12.408 4.750 -0.743 879 HG22 ILE 115 2HG2 ILE 115 -10.788 4.670 -1.433 880 HG23 ILE 115 3HG2 ILE 115 -11.525 6.236 -1.094 881 HD11 ILE 115 3HD1 ILE 115 -11.262 2.176 -4.051 882 HD12 ILE 115 1HD1 ILE 115 -11.397 2.643 -2.356 883 HD13 ILE 115 2HD1 ILE 115 -12.838 2.582 -3.372 884 H LYS 116 H LYS 116 -15.203 6.921 -3.427 885 HA LYS 116 HA LYS 116 -15.309 8.137 -0.814 886 HB2 LYS 116 2HB LYS 116 -15.962 10.023 -1.890 887 HB3 LYS 116 3HB LYS 116 -15.343 9.175 -3.302 888 HG2 LYS 116 2HG LYS 116 -17.373 9.818 -4.095 889 HG3 LYS 116 3HG LYS 116 -17.812 8.254 -3.404 890 HD2 LYS 116 2HD LYS 116 -18.060 9.997 -1.275 891 HD3 LYS 116 3HD LYS 116 -18.658 10.933 -2.647 892 HE2 LYS 116 2HE LYS 116 -19.822 8.492 -3.057 893 HE3 LYS 116 3HE LYS 116 -19.818 8.609 -1.298 894 HZ1 LYS 116 3HZ LYS 116 -21.470 10.064 -1.373 895 HZ2 LYS 116 1HZ LYS 116 -21.604 9.784 -3.036 896 HZ3 LYS 116 2HZ LYS 116 -20.647 11.056 -2.467 897 H LYS 117 H LYS 117 -17.271 6.018 -2.693 898 HA LYS 117 HA LYS 117 -19.719 6.568 -1.271 899 HB2 LYS 117 2HB LYS 117 -18.866 4.822 -3.491 900 HB3 LYS 117 3HB LYS 117 -20.157 4.175 -2.488 901 HG2 LYS 117 2HG LYS 117 -21.323 6.414 -2.842 902 HG3 LYS 117 3HG LYS 117 -20.142 6.686 -4.126 903 HD2 LYS 117 2HD LYS 117 -20.938 4.890 -5.396 904 HD3 LYS 117 3HD LYS 117 -21.778 4.172 -4.019 905 HE2 LYS 117 2HE LYS 117 -23.139 6.403 -4.065 906 HE3 LYS 117 3HE LYS 117 -22.564 6.492 -5.729 907 HZ1 LYS 117 3HZ LYS 117 -24.049 4.985 -6.345 908 HZ2 LYS 117 1HZ LYS 117 -24.734 5.075 -4.801 909 HZ3 LYS 117 2HZ LYS 117 -23.564 3.902 -5.139 910 H LYS 118 H LYS 118 -17.181 4.120 -1.196 911 HA LYS 118 HA LYS 118 -18.325 3.125 1.330 912 HB2 LYS 118 2HB LYS 118 -17.158 1.607 -0.983 913 HB3 LYS 118 3HB LYS 118 -17.114 0.929 0.640 914 HG2 LYS 118 2HG LYS 118 -19.460 0.834 0.777 915 HG3 LYS 118 3HG LYS 118 -19.663 1.878 -0.632 916 HD2 LYS 118 2HD LYS 118 -18.300 -0.794 -0.817 917 HD3 LYS 118 3HD LYS 118 -20.052 -0.630 -0.951 918 HE2 LYS 118 2HE LYS 118 -19.535 1.140 -2.745 919 HE3 LYS 118 3HE LYS 118 -17.913 0.449 -2.756 920 HZ1 LYS 118 3HZ LYS 118 -19.115 -0.649 -4.434 921 HZ2 LYS 118 1HZ LYS 118 -20.462 -0.894 -3.440 922 HZ3 LYS 118 2HZ LYS 118 -19.033 -1.750 -3.153 Start of MODEL 20 1 H1 VAL 1 H VAL 1 2.379 0.353 -6.650 2 HA VAL 1 HA VAL 1 2.473 -2.471 -6.623 3 HB VAL 1 HB VAL 1 4.160 -2.782 -4.835 4 HG11 VAL 1 1HG1 VAL 1 5.102 -1.641 -7.459 5 HG12 VAL 1 2HG1 VAL 1 6.164 -2.462 -6.313 6 HG13 VAL 1 3HG1 VAL 1 4.822 -3.335 -7.055 7 HG21 VAL 1 3HG2 VAL 1 5.889 -0.896 -4.673 8 HG22 VAL 1 1HG2 VAL 1 4.627 0.139 -5.343 9 HG23 VAL 1 2HG2 VAL 1 4.367 -0.689 -3.808 10 H TRP 2 H TRP 2 0.664 -0.315 -5.998 11 HA TRP 2 HA TRP 2 -0.589 -1.328 -3.734 12 HB2 TRP 2 2HB TRP 2 0.878 -0.504 -2.177 13 HB3 TRP 2 3HB TRP 2 1.378 0.839 -3.201 14 HD1 TRP 2 HD1 TRP 2 0.786 3.021 -2.020 15 HE1 TRP 2 HE1 TRP 2 -1.228 3.921 -0.694 16 HE3 TRP 2 HE3 TRP 2 -2.125 -1.181 -2.015 17 HZ2 TRP 2 HZ2 TRP 2 -3.721 2.974 0.233 18 HZ3 TRP 2 HZ3 TRP 2 -4.310 -1.101 -0.886 19 HH2 TRP 2 HH2 TRP 2 -5.089 0.934 0.214 20 HA PRO 3 HA PRO 3 -2.630 2.899 -4.877 21 HB2 PRO 3 2HB PRO 3 -1.326 4.469 -6.667 22 HB3 PRO 3 3HB PRO 3 -1.060 4.576 -4.922 23 HG2 PRO 3 2HG PRO 3 0.570 3.173 -7.005 24 HG3 PRO 3 3HG PRO 3 1.113 4.165 -5.639 25 HD2 PRO 3 2HD PRO 3 1.143 1.458 -5.576 26 HD3 PRO 3 3HD PRO 3 0.863 2.445 -4.126 27 H LEU 4 H LEU 4 -3.865 1.204 -5.937 28 HA LEU 4 HA LEU 4 -3.478 0.897 -8.808 29 HB2 LEU 4 2HB LEU 4 -5.172 -0.455 -6.751 30 HB3 LEU 4 3HB LEU 4 -5.570 -0.610 -8.461 31 HG LEU 4 HG LEU 4 -2.954 -1.295 -8.500 32 HD11 LEU 4 1HD1 LEU 4 -2.944 -3.018 -6.510 33 HD12 LEU 4 2HD1 LEU 4 -3.979 -1.806 -5.756 34 HD13 LEU 4 3HD1 LEU 4 -2.359 -1.368 -6.296 35 HD21 LEU 4 3HD2 LEU 4 -5.233 -2.465 -9.190 36 HD22 LEU 4 1HD2 LEU 4 -4.868 -3.441 -7.767 37 HD23 LEU 4 2HD2 LEU 4 -3.713 -3.357 -9.097 38 H VAL 5 H VAL 5 -5.401 2.680 -6.595 39 HA VAL 5 HA VAL 5 -7.686 3.131 -8.194 40 HB VAL 5 HB VAL 5 -8.066 5.114 -6.750 41 HG11 VAL 5 1HG1 VAL 5 -8.075 2.407 -6.049 42 HG12 VAL 5 2HG1 VAL 5 -7.405 3.256 -4.655 43 HG13 VAL 5 3HG1 VAL 5 -8.986 3.713 -5.290 44 HG21 VAL 5 3HG2 VAL 5 -5.363 4.363 -5.651 45 HG22 VAL 5 1HG2 VAL 5 -5.837 5.891 -6.394 46 HG23 VAL 5 2HG2 VAL 5 -6.497 5.431 -4.825 47 H ILE 6 H ILE 6 -4.591 4.800 -7.914 48 HA ILE 6 HA ILE 6 -5.159 7.092 -9.382 49 HB ILE 6 HB ILE 6 -2.819 7.363 -9.716 50 HG12 ILE 6 2HG1 ILE 6 -2.585 4.400 -9.150 51 HG13 ILE 6 3HG1 ILE 6 -2.290 5.200 -10.690 52 HG21 ILE 6 1HG2 ILE 6 -3.891 7.104 -7.288 53 HG22 ILE 6 2HG2 ILE 6 -2.679 5.827 -7.190 54 HG23 ILE 6 3HG2 ILE 6 -2.187 7.484 -7.540 55 HD11 ILE 6 3HD1 ILE 6 -0.688 5.593 -8.174 56 HD12 ILE 6 1HD1 ILE 6 -0.215 4.613 -9.562 57 HD13 ILE 6 2HD1 ILE 6 -0.382 6.361 -9.731 58 H ARG 7 H ARG 7 -4.571 3.825 -10.444 59 HA ARG 7 HA ARG 7 -4.175 4.536 -13.206 60 HB2 ARG 7 2HB ARG 7 -3.696 2.330 -13.561 61 HB3 ARG 7 3HB ARG 7 -3.403 2.400 -11.828 62 HG2 ARG 7 2HG ARG 7 -6.005 1.785 -11.797 63 HG3 ARG 7 3HG ARG 7 -5.550 1.053 -13.338 64 HD2 ARG 7 2HD ARG 7 -3.655 0.510 -11.186 65 HD3 ARG 7 3HD ARG 7 -5.275 -0.105 -10.862 66 HE ARG 7 HE ARG 7 -4.818 -0.955 -13.375 67 HH11 ARG 7 1HH1 ARG 7 -2.949 -1.155 -10.445 68 HH12 ARG 7 2HH1 ARG 7 -2.181 -2.646 -10.882 69 HH21 ARG 7 1HH2 ARG 7 -3.815 -2.917 -13.961 70 HH22 ARG 7 2HH2 ARG 7 -2.674 -3.647 -12.882 71 H THR 8 H THR 8 -6.854 3.972 -11.149 72 HA THR 8 HA THR 8 -8.788 2.918 -12.800 73 HB THR 8 HB THR 8 -9.328 5.194 -10.892 74 HG1 THR 8 HG1 THR 8 -8.563 2.538 -10.424 75 HG21 THR 8 3HG2 THR 8 -11.444 4.767 -11.452 76 HG22 THR 8 1HG2 THR 8 -11.264 3.187 -10.692 77 HG23 THR 8 2HG2 THR 8 -10.965 3.374 -12.420 78 H VAL 9 H VAL 9 -8.197 6.405 -12.296 79 HA VAL 9 HA VAL 9 -9.906 7.231 -14.394 80 HB VAL 9 HB VAL 9 -8.743 9.432 -14.184 81 HG11 VAL 9 1HG1 VAL 9 -9.530 9.889 -11.912 82 HG12 VAL 9 2HG1 VAL 9 -10.679 8.889 -12.803 83 HG13 VAL 9 3HG1 VAL 9 -9.622 8.157 -11.595 84 HG21 VAL 9 3HG2 VAL 9 -7.090 7.929 -12.158 85 HG22 VAL 9 1HG2 VAL 9 -6.518 8.697 -13.639 86 HG23 VAL 9 2HG2 VAL 9 -7.129 9.685 -12.313 87 H ILE 10 H ILE 10 -6.437 6.609 -14.220 88 HA ILE 10 HA ILE 10 -5.683 7.637 -16.703 89 HB ILE 10 HB ILE 10 -4.481 5.187 -15.418 90 HG12 ILE 10 2HG1 ILE 10 -4.821 7.560 -14.121 91 HG13 ILE 10 3HG1 ILE 10 -3.503 6.437 -13.806 92 HG21 ILE 10 1HG2 ILE 10 -3.484 7.236 -17.374 93 HG22 ILE 10 2HG2 ILE 10 -2.391 6.204 -16.454 94 HG23 ILE 10 3HG2 ILE 10 -3.562 5.484 -17.560 95 HD11 ILE 10 3HD1 ILE 10 -3.299 8.662 -15.809 96 HD12 ILE 10 1HD1 ILE 10 -2.869 8.852 -14.110 97 HD13 ILE 10 2HD1 ILE 10 -2.000 7.692 -15.116 98 H ALA 11 H ALA 11 -7.563 4.886 -15.938 99 HA ALA 11 HA ALA 11 -7.077 3.057 -17.905 100 HB1 ALA 11 1HB ALA 11 -8.742 2.580 -16.292 101 HB2 ALA 11 2HB ALA 11 -9.707 3.977 -16.770 102 HB3 ALA 11 3HB ALA 11 -9.556 2.596 -17.857 103 H GLY 12 H GLY 12 -8.465 6.233 -18.259 104 HA2 GLY 12 2HA GLY 12 -9.151 5.685 -21.061 105 HA3 GLY 12 3HA GLY 12 -9.646 7.097 -20.139 106 H TYR 13 H TYR 13 -6.838 7.382 -19.108 107 HA TYR 13 HA TYR 13 -5.924 9.350 -20.801 108 HB2 TYR 13 2HB TYR 13 -4.956 7.996 -18.476 109 HB3 TYR 13 3HB TYR 13 -3.632 8.144 -19.627 110 HD1 TYR 13 HD2 TYR 13 -4.021 10.689 -20.893 111 HD2 TYR 13 HD1 TYR 13 -4.716 9.605 -16.838 112 HE1 TYR 13 HE2 TYR 13 -3.690 13.030 -20.216 113 HE2 TYR 13 HE1 TYR 13 -4.388 11.943 -16.150 114 HH TYR 13 HH TYR 13 -3.850 14.501 -18.538 115 H ASN 14 H ASN 14 -5.156 5.901 -20.831 116 HA ASN 14 HA ASN 14 -3.085 5.759 -22.596 117 HB2 ASN 14 2HB ASN 14 -5.184 3.987 -21.717 118 HB3 ASN 14 3HB ASN 14 -4.846 3.724 -23.426 119 HD21 ASN 14 1HD2 ASN 14 -3.613 3.547 -20.196 120 HD22 ASN 14 2HD2 ASN 14 -2.191 2.637 -20.567 121 H LEU 15 H LEU 15 -6.346 6.720 -23.262 122 HA LEU 15 HA LEU 15 -5.939 6.580 -26.148 123 HB2 LEU 15 2HB LEU 15 -8.211 6.609 -24.367 124 HB3 LEU 15 3HB LEU 15 -8.380 7.827 -25.630 125 HG LEU 15 HG LEU 15 -9.454 5.644 -26.155 126 HD11 LEU 15 1HD1 LEU 15 -8.023 5.432 -28.399 127 HD12 LEU 15 2HD1 LEU 15 -7.424 6.990 -27.830 128 HD13 LEU 15 3HD1 LEU 15 -9.150 6.756 -28.102 129 HD21 LEU 15 3HD2 LEU 15 -7.061 4.589 -25.206 130 HD22 LEU 15 1HD2 LEU 15 -7.018 4.309 -26.947 131 HD23 LEU 15 2HD2 LEU 15 -8.373 3.708 -25.991 132 H TYR 16 H TYR 16 -6.272 8.925 -23.555 133 HA TYR 16 HA TYR 16 -6.676 11.272 -24.897 134 HB2 TYR 16 2HB TYR 16 -5.810 10.538 -22.331 135 HB3 TYR 16 3HB TYR 16 -4.589 11.653 -22.934 136 HD1 TYR 16 HD2 TYR 16 -6.219 13.485 -24.569 137 HD2 TYR 16 HD1 TYR 16 -7.012 11.767 -20.758 138 HE1 TYR 16 HE2 TYR 16 -7.681 15.387 -24.022 139 HE2 TYR 16 HE1 TYR 16 -8.477 13.663 -20.201 140 HH TYR 16 HH TYR 16 -9.298 15.613 -20.867 141 H ARG 17 H ARG 17 -3.539 9.688 -24.338 142 HA ARG 17 HA ARG 17 -2.098 11.610 -25.898 143 HB2 ARG 17 2HB ARG 17 -1.470 9.427 -24.154 144 HB3 ARG 17 3HB ARG 17 -0.599 9.215 -25.666 145 HG2 ARG 17 2HG ARG 17 0.917 10.644 -24.922 146 HG3 ARG 17 3HG ARG 17 -0.304 11.915 -25.002 147 HD2 ARG 17 2HD ARG 17 0.725 11.807 -22.789 148 HD3 ARG 17 3HD ARG 17 -0.993 11.414 -22.720 149 HE ARG 17 HE ARG 17 0.211 8.993 -22.951 150 HH11 ARG 17 1HH1 ARG 17 0.597 11.690 -20.784 151 HH12 ARG 17 2HH1 ARG 17 1.093 10.710 -19.444 152 HH21 ARG 17 1HH2 ARG 17 0.864 7.692 -21.194 153 HH22 ARG 17 2HH2 ARG 17 1.246 8.436 -19.679 154 H ALA 18 H ALA 18 -3.777 8.661 -26.546 155 HA ALA 18 HA ALA 18 -2.549 7.679 -28.802 156 HB1 ALA 18 1HB ALA 18 -5.539 7.866 -28.572 157 HB2 ALA 18 2HB ALA 18 -4.570 6.602 -29.330 158 HB3 ALA 18 3HB ALA 18 -4.582 6.770 -27.575 159 H ILE 19 H ILE 19 -4.720 10.443 -28.522 160 HA ILE 19 HA ILE 19 -4.749 10.893 -31.380 161 HB ILE 19 HB ILE 19 -5.819 12.608 -29.135 162 HG12 ILE 19 2HG1 ILE 19 -6.965 10.467 -29.240 163 HG13 ILE 19 3HG1 ILE 19 -8.022 11.729 -29.863 164 HG21 ILE 19 1HG2 ILE 19 -5.586 13.024 -32.014 165 HG22 ILE 19 2HG2 ILE 19 -7.224 13.239 -31.399 166 HG23 ILE 19 3HG2 ILE 19 -5.898 14.183 -30.721 167 HD11 ILE 19 3HD1 ILE 19 -8.348 10.410 -31.611 168 HD12 ILE 19 1HD1 ILE 19 -6.702 10.805 -32.105 169 HD13 ILE 19 2HD1 ILE 19 -7.013 9.352 -31.155 170 H LYS 20 H LYS 20 -2.838 11.822 -28.691 171 HA LYS 20 HA LYS 20 -1.840 14.271 -29.810 172 HB2 LYS 20 2HB LYS 20 -1.257 12.612 -27.408 173 HB3 LYS 20 3HB LYS 20 0.000 13.710 -27.961 174 HG2 LYS 20 2HG LYS 20 -2.824 14.568 -27.382 175 HG3 LYS 20 3HG LYS 20 -1.513 14.631 -26.202 176 HD2 LYS 20 2HD LYS 20 -1.210 15.928 -28.885 177 HD3 LYS 20 3HD LYS 20 -2.074 16.751 -27.584 178 HE2 LYS 20 2HE LYS 20 -0.129 17.421 -26.749 179 HE3 LYS 20 3HE LYS 20 0.315 15.737 -26.477 180 HZ1 LYS 20 3HZ LYS 20 1.114 17.545 -28.618 181 HZ2 LYS 20 1HZ LYS 20 0.868 15.927 -29.046 182 HZ3 LYS 20 2HZ LYS 20 1.995 16.323 -27.848 183 H LYS 21 H LYS 21 -1.002 10.908 -29.978 184 HA LYS 21 HA LYS 21 1.648 11.374 -31.023 185 HB2 LYS 21 2HB LYS 21 -0.041 8.891 -30.725 186 HB3 LYS 21 3HB LYS 21 1.557 8.875 -31.459 187 HG2 LYS 21 2HG LYS 21 2.623 9.149 -29.482 188 HG3 LYS 21 3HG LYS 21 1.328 10.130 -28.792 189 HD2 LYS 21 2HD LYS 21 0.232 8.334 -27.966 190 HD3 LYS 21 3HD LYS 21 0.640 7.318 -29.351 191 HE2 LYS 21 2HE LYS 21 2.844 6.927 -28.487 192 HE3 LYS 21 3HE LYS 21 2.596 8.100 -27.194 193 HZ1 LYS 21 3HZ LYS 21 2.095 5.391 -27.099 194 HZ2 LYS 21 1HZ LYS 21 0.568 6.119 -27.152 195 HZ3 LYS 21 2HZ LYS 21 1.667 6.547 -25.940 196 H LYS 22 H LYS 22 -1.522 10.479 -32.294 197 HA LYS 22 HA LYS 22 -2.338 10.318 -34.416 198 HB2 LYS 22 2HB LYS 22 -1.822 12.750 -34.274 199 HB3 LYS 22 3HB LYS 22 -0.249 12.427 -34.990 200 HG2 LYS 22 2HG LYS 22 -1.109 12.533 -37.024 201 HG3 LYS 22 3HG LYS 22 -2.285 11.277 -36.632 202 HD2 LYS 22 2HD LYS 22 -3.862 12.865 -35.862 203 HD3 LYS 22 3HD LYS 22 -2.660 14.157 -35.841 204 HE2 LYS 22 2HE LYS 22 -2.923 12.930 -38.461 205 HE3 LYS 22 3HE LYS 22 -4.448 13.598 -37.880 206 HZ1 LYS 22 3HZ LYS 22 -1.896 14.995 -38.377 207 HZ2 LYS 22 1HZ LYS 22 -3.060 15.659 -37.343 208 HZ3 LYS 22 2HZ LYS 22 -3.439 15.364 -38.965 209 H GLY 23 H GLY 23 -1.414 8.144 -34.557 210 HA2 GLY 23 2HA GLY 23 -0.530 7.203 -36.799 211 HA3 GLY 23 3HA GLY 23 0.965 7.967 -36.278 212 H GLY 24 H GLY 24 -1.441 6.162 -34.386 213 HA2 GLY 24 2HA GLY 24 -1.104 3.835 -33.784 214 HA3 GLY 24 3HA GLY 24 0.628 4.119 -33.881 215 H GLY 25 H GLY 25 -0.947 3.014 -31.676 216 HA2 GLY 25 2HA GLY 25 0.323 4.331 -29.535 217 HA3 GLY 25 3HA GLY 25 -1.350 4.863 -29.611 218 H GLY 26 H GLY 26 -0.972 3.767 -27.356 219 HA2 GLY 26 2HA GLY 26 -2.237 2.123 -26.188 220 HA3 GLY 26 3HA GLY 26 -2.136 1.084 -27.602 221 H GLY 27 H GLY 27 -1.257 1.120 -24.554 222 HA2 GLY 27 2HA GLY 27 0.275 -0.846 -24.087 223 HA3 GLY 27 3HA GLY 27 1.447 0.044 -25.048 224 H GLY 28 H GLY 28 1.784 -0.814 -22.338 225 HA2 GLY 28 2HA GLY 28 1.333 1.324 -20.522 226 HA3 GLY 28 3HA GLY 28 2.438 -0.022 -20.281 227 H GLY 29 H GLY 29 2.487 3.094 -20.043 228 HA2 GLY 29 2HA GLY 29 4.348 4.489 -19.899 229 HA3 GLY 29 3HA GLY 29 5.280 3.297 -20.793 230 H GLY 30 H GLY 30 5.302 6.129 -21.218 231 HA2 GLY 30 2HA GLY 30 5.115 6.196 -24.027 232 HA3 GLY 30 3HA GLY 30 3.687 6.965 -23.349 233 H GLY 31 H GLY 31 4.800 8.735 -24.702 234 HA2 GLY 31 2HA GLY 31 6.156 10.475 -22.809 235 HA3 GLY 31 3HA GLY 31 7.082 10.053 -24.242 236 H GLY 32 H GLY 32 6.468 10.869 -26.257 237 HA2 GLY 32 2HA GLY 32 4.829 12.036 -27.630 238 HA3 GLY 32 3HA GLY 32 4.332 12.906 -26.186 239 H VAL 33 H VAL 33 4.715 14.617 -27.993 240 HA VAL 33 HA VAL 33 7.509 15.540 -27.812 241 HB VAL 33 HB VAL 33 7.072 16.847 -29.867 242 HG11 VAL 33 1HG1 VAL 33 7.898 14.365 -29.734 243 HG12 VAL 33 2HG1 VAL 33 6.363 14.030 -30.539 244 HG13 VAL 33 3HG1 VAL 33 7.539 15.107 -31.293 245 HG21 VAL 33 3HG2 VAL 33 4.732 17.181 -29.823 246 HG22 VAL 33 1HG2 VAL 33 5.048 16.147 -31.216 247 HG23 VAL 33 2HG2 VAL 33 4.411 15.449 -29.727 248 H TRP 34 H TRP 34 4.124 16.461 -27.585 249 HA TRP 34 HA TRP 34 4.935 18.832 -26.062 250 HB2 TRP 34 2HB TRP 34 4.414 19.550 -28.379 251 HB3 TRP 34 3HB TRP 34 2.801 18.862 -28.208 252 HD1 TRP 34 HD1 TRP 34 4.069 20.643 -25.148 253 HE1 TRP 34 HE1 TRP 34 2.848 22.894 -24.894 254 HE3 TRP 34 HE3 TRP 34 1.742 20.823 -29.697 255 HZ2 TRP 34 HZ2 TRP 34 1.126 24.530 -26.419 256 HZ3 TRP 34 HZ3 TRP 34 0.325 22.765 -30.220 257 HH2 TRP 34 HH2 TRP 34 0.024 24.579 -28.614 258 HA PRO 35 HA PRO 35 1.619 16.256 -24.014 259 HB2 PRO 35 2HB PRO 35 2.924 15.994 -21.648 260 HB3 PRO 35 3HB PRO 35 3.149 14.876 -22.997 261 HG2 PRO 35 2HG PRO 35 4.857 17.181 -22.143 262 HG3 PRO 35 3HG PRO 35 5.347 15.559 -22.667 263 HD2 PRO 35 2HD PRO 35 5.439 17.710 -24.309 264 HD3 PRO 35 3HD PRO 35 5.104 16.070 -24.901 265 H LEU 36 H LEU 36 0.981 18.726 -24.397 266 HA LEU 36 HA LEU 36 1.123 20.261 -21.924 267 HB2 LEU 36 2HB LEU 36 1.425 21.723 -23.649 268 HB3 LEU 36 3HB LEU 36 0.375 20.821 -24.740 269 HG LEU 36 HG LEU 36 -1.591 21.733 -23.625 270 HD11 LEU 36 1HD1 LEU 36 -1.488 22.535 -21.564 271 HD12 LEU 36 2HD1 LEU 36 -0.435 23.838 -22.113 272 HD13 LEU 36 3HD1 LEU 36 0.262 22.315 -21.560 273 HD21 LEU 36 3HD2 LEU 36 -0.791 22.978 -25.494 274 HD22 LEU 36 1HD2 LEU 36 0.455 23.755 -24.518 275 HD23 LEU 36 2HD2 LEU 36 -1.245 24.134 -24.241 276 H VAL 37 H VAL 37 -1.257 18.651 -23.975 277 HA VAL 37 HA VAL 37 -3.438 19.364 -22.198 278 HB VAL 37 HB VAL 37 -4.856 18.077 -23.741 279 HG11 VAL 37 1HG1 VAL 37 -4.342 19.470 -25.818 280 HG12 VAL 37 2HG1 VAL 37 -4.651 20.342 -24.316 281 HG13 VAL 37 3HG1 VAL 37 -2.997 20.135 -24.892 282 HG21 VAL 37 3HG2 VAL 37 -3.479 17.489 -25.957 283 HG22 VAL 37 1HG2 VAL 37 -2.219 17.203 -24.757 284 HG23 VAL 37 2HG2 VAL 37 -3.746 16.325 -24.660 285 H ILE 38 H ILE 38 -1.556 16.510 -23.074 286 HA ILE 38 HA ILE 38 -3.032 14.570 -21.720 287 HB ILE 38 HB ILE 38 -1.046 13.198 -21.731 288 HG12 ILE 38 2HG1 ILE 38 1.024 14.556 -22.829 289 HG13 ILE 38 3HG1 ILE 38 0.301 15.830 -21.854 290 HG21 ILE 38 1HG2 ILE 38 -1.920 13.133 -23.847 291 HG22 ILE 38 2HG2 ILE 38 -1.655 14.854 -24.127 292 HG23 ILE 38 3HG2 ILE 38 -0.297 13.730 -24.195 293 HD11 ILE 38 3HD1 ILE 38 1.956 13.642 -21.049 294 HD12 ILE 38 1HD1 ILE 38 1.399 15.029 -20.114 295 HD13 ILE 38 2HD1 ILE 38 0.408 13.573 -20.206 296 H ARG 39 H ARG 39 -1.063 17.103 -20.501 297 HA ARG 39 HA ARG 39 -0.776 15.841 -17.884 298 HB2 ARG 39 2HB ARG 39 0.514 17.923 -17.334 299 HB3 ARG 39 3HB ARG 39 1.191 16.966 -18.645 300 HG2 ARG 39 2HG ARG 39 0.230 18.497 -20.277 301 HG3 ARG 39 3HG ARG 39 -0.481 19.448 -18.971 302 HD2 ARG 39 2HD ARG 39 2.474 18.945 -19.291 303 HD3 ARG 39 3HD ARG 39 1.644 20.381 -19.888 304 HE ARG 39 HE ARG 39 1.029 20.146 -17.192 305 HH11 ARG 39 1HH1 ARG 39 3.846 20.648 -19.176 306 HH12 ARG 39 2HH1 ARG 39 4.691 21.564 -17.972 307 HH21 ARG 39 1HH2 ARG 39 2.131 21.351 -15.599 308 HH22 ARG 39 2HH2 ARG 39 3.715 21.963 -15.938 309 H THR 40 H THR 40 -2.821 18.010 -19.546 310 HA THR 40 HA THR 40 -3.698 19.780 -17.635 311 HB THR 40 HB THR 40 -5.473 18.342 -19.617 312 HG1 THR 40 HG1 THR 40 -4.970 20.302 -20.876 313 HG21 THR 40 3HG2 THR 40 -7.124 19.704 -18.986 314 HG22 THR 40 1HG2 THR 40 -6.079 21.119 -19.098 315 HG23 THR 40 2HG2 THR 40 -6.125 20.173 -17.611 316 H VAL 41 H VAL 41 -5.237 16.632 -18.325 317 HA VAL 41 HA VAL 41 -6.916 16.670 -16.063 318 HB VAL 41 HB VAL 41 -5.931 14.163 -17.413 319 HG11 VAL 41 1HG1 VAL 41 -7.244 13.712 -15.478 320 HG12 VAL 41 2HG1 VAL 41 -8.457 14.904 -15.949 321 HG13 VAL 41 3HG1 VAL 41 -8.266 13.421 -16.885 322 HG21 VAL 41 3HG2 VAL 41 -7.440 16.369 -18.545 323 HG22 VAL 41 1HG2 VAL 41 -6.723 14.966 -19.337 324 HG23 VAL 41 2HG2 VAL 41 -8.328 14.847 -18.615 325 H ILE 42 H ILE 42 -3.638 15.543 -16.554 326 HA ILE 42 HA ILE 42 -3.330 13.939 -14.293 327 HB ILE 42 HB ILE 42 -1.345 15.644 -15.785 328 HG12 ILE 42 2HG1 ILE 42 -2.390 12.909 -15.997 329 HG13 ILE 42 3HG1 ILE 42 -1.612 13.915 -17.214 330 HG21 ILE 42 1HG2 ILE 42 -0.772 13.671 -13.578 331 HG22 ILE 42 2HG2 ILE 42 0.429 14.501 -14.565 332 HG23 ILE 42 3HG2 ILE 42 -0.598 15.423 -13.468 333 HD11 ILE 42 3HD1 ILE 42 -0.277 12.223 -15.121 334 HD12 ILE 42 1HD1 ILE 42 -0.270 11.983 -16.868 335 HD13 ILE 42 2HD1 ILE 42 0.575 13.361 -16.163 336 H ALA 43 H ALA 43 -3.636 17.354 -14.577 337 HA ALA 43 HA ALA 43 -2.284 18.405 -12.457 338 HB1 ALA 43 1HB ALA 43 -3.679 19.705 -14.016 339 HB2 ALA 43 2HB ALA 43 -5.122 19.103 -13.199 340 HB3 ALA 43 3HB ALA 43 -3.979 20.127 -12.329 341 H GLY 44 H GLY 44 -5.000 16.245 -12.353 342 HA2 GLY 44 2HA GLY 44 -5.331 16.678 -9.468 343 HA3 GLY 44 3HA GLY 44 -6.430 15.782 -10.506 344 H TYR 45 H TYR 45 -4.197 14.310 -11.770 345 HA TYR 45 HA TYR 45 -4.239 11.994 -10.272 346 HB2 TYR 45 2HB TYR 45 -3.566 11.837 -12.540 347 HB3 TYR 45 3HB TYR 45 -2.259 12.994 -12.313 348 HD1 TYR 45 HD2 TYR 45 -0.191 12.317 -11.156 349 HD2 TYR 45 HD1 TYR 45 -3.285 9.518 -11.990 350 HE1 TYR 45 HE2 TYR 45 1.379 10.469 -10.749 351 HE2 TYR 45 HE1 TYR 45 -1.724 7.662 -11.584 352 HH TYR 45 HH TYR 45 1.012 7.490 -11.746 353 H ASN 46 H ASN 46 -1.784 14.553 -10.287 354 HA ASN 46 HA ASN 46 0.127 13.446 -8.654 355 HB2 ASN 46 2HB ASN 46 -0.212 15.887 -9.772 356 HB3 ASN 46 3HB ASN 46 -0.515 16.279 -8.082 357 HD21 ASN 46 1HD2 ASN 46 1.816 15.783 -10.438 358 HD22 ASN 46 2HD2 ASN 46 3.208 15.736 -9.417 359 H LEU 47 H LEU 47 -3.052 14.517 -7.814 360 HA LEU 47 HA LEU 47 -2.493 14.517 -4.961 361 HB2 LEU 47 2HB LEU 47 -4.526 15.588 -6.688 362 HB3 LEU 47 3HB LEU 47 -5.262 14.650 -5.390 363 HG LEU 47 HG LEU 47 -5.130 17.014 -4.815 364 HD11 LEU 47 1HD1 LEU 47 -4.547 14.952 -3.204 365 HD12 LEU 47 2HD1 LEU 47 -4.618 16.625 -2.652 366 HD13 LEU 47 3HD1 LEU 47 -3.063 15.889 -3.037 367 HD21 LEU 47 3HD2 LEU 47 -3.267 18.295 -4.951 368 HD22 LEU 47 1HD2 LEU 47 -2.843 17.120 -6.196 369 HD23 LEU 47 2HD2 LEU 47 -2.183 16.957 -4.568 370 H TYR 48 H TYR 48 -4.034 12.512 -7.384 371 HA TYR 48 HA TYR 48 -5.572 10.781 -5.979 372 HB2 TYR 48 2HB TYR 48 -4.490 10.783 -8.496 373 HB3 TYR 48 3HB TYR 48 -3.724 9.371 -7.777 374 HD1 TYR 48 HD2 TYR 48 -5.911 8.416 -6.005 375 HD2 TYR 48 HD1 TYR 48 -6.019 9.861 -10.006 376 HE1 TYR 48 HE2 TYR 48 -7.945 7.098 -6.420 377 HE2 TYR 48 HE1 TYR 48 -8.055 8.547 -10.431 378 HH TYR 48 HH TYR 48 -9.403 6.930 -9.632 379 H ARG 49 H ARG 49 -2.041 10.496 -6.344 380 HA ARG 49 HA ARG 49 -1.905 8.324 -4.458 381 HB2 ARG 49 2HB ARG 49 -0.034 9.742 -6.245 382 HB3 ARG 49 3HB ARG 49 0.675 9.125 -4.758 383 HG2 ARG 49 2HG ARG 49 -0.832 7.007 -5.660 384 HG3 ARG 49 3HG ARG 49 -0.182 7.711 -7.142 385 HD2 ARG 49 2HD ARG 49 1.321 6.673 -4.754 386 HD3 ARG 49 3HD ARG 49 1.399 6.108 -6.422 387 HE ARG 49 HE ARG 49 2.821 8.326 -5.274 388 HH11 ARG 49 1HH1 ARG 49 1.574 6.936 -8.212 389 HH12 ARG 49 2HH1 ARG 49 2.697 7.767 -9.236 390 HH21 ARG 49 1HH2 ARG 49 4.306 9.426 -6.612 391 HH22 ARG 49 2HH2 ARG 49 4.251 9.182 -8.325 392 H ALA 50 H ALA 50 -1.648 11.772 -4.370 393 HA ALA 50 HA ALA 50 -0.086 12.254 -2.155 394 HB1 ALA 50 1HB ALA 50 -2.653 13.710 -2.765 395 HB2 ALA 50 2HB ALA 50 -1.241 14.331 -1.909 396 HB3 ALA 50 3HB ALA 50 -1.139 13.971 -3.632 397 H ILE 51 H ILE 51 -3.466 11.233 -2.271 398 HA ILE 51 HA ILE 51 -3.761 11.341 0.598 399 HB ILE 51 HB ILE 51 -5.583 10.150 -1.496 400 HG12 ILE 51 2HG1 ILE 51 -5.292 12.567 -1.764 401 HG13 ILE 51 3HG1 ILE 51 -6.910 12.199 -1.177 402 HG21 ILE 51 1HG2 ILE 51 -5.657 10.162 1.420 403 HG22 ILE 51 2HG2 ILE 51 -7.125 10.794 0.676 404 HG23 ILE 51 3HG2 ILE 51 -6.555 9.176 0.266 405 HD11 ILE 51 3HD1 ILE 51 -4.822 13.802 0.017 406 HD12 ILE 51 1HD1 ILE 51 -6.547 13.738 0.375 407 HD13 ILE 51 2HD1 ILE 51 -5.447 12.585 1.130 408 H LYS 52 H LYS 52 -2.682 9.061 -1.724 409 HA LYS 52 HA LYS 52 -3.271 6.688 -0.251 410 HB2 LYS 52 2HB LYS 52 -1.320 7.235 -2.492 411 HB3 LYS 52 3HB LYS 52 -1.618 5.636 -1.823 412 HG2 LYS 52 2HG LYS 52 -3.704 7.382 -3.114 413 HG3 LYS 52 3HG LYS 52 -2.856 6.053 -3.906 414 HD2 LYS 52 2HD LYS 52 -4.290 4.582 -3.055 415 HD3 LYS 52 3HD LYS 52 -3.942 5.144 -1.418 416 HE2 LYS 52 2HE LYS 52 -5.738 6.782 -3.137 417 HE3 LYS 52 3HE LYS 52 -6.370 5.290 -2.443 418 HZ1 LYS 52 3HZ LYS 52 -6.874 6.848 -0.843 419 HZ2 LYS 52 1HZ LYS 52 -5.443 7.723 -1.069 420 HZ3 LYS 52 2HZ LYS 52 -5.407 6.237 -0.262 421 H LYS 53 H LYS 53 -0.607 8.952 -0.343 422 HA LYS 53 HA LYS 53 1.102 7.269 1.282 423 HB2 LYS 53 2HB LYS 53 2.673 9.167 1.186 424 HB3 LYS 53 3HB LYS 53 2.131 8.676 -0.414 425 HG2 LYS 53 2HG LYS 53 0.519 10.536 -0.413 426 HG3 LYS 53 3HG LYS 53 1.142 11.047 1.158 427 HD2 LYS 53 2HD LYS 53 2.330 12.401 -0.289 428 HD3 LYS 53 3HD LYS 53 3.444 11.051 -0.059 429 HE2 LYS 53 2HE LYS 53 1.992 10.162 -2.165 430 HE3 LYS 53 3HE LYS 53 1.955 11.901 -2.453 431 HZ1 LYS 53 3HZ LYS 53 4.056 10.097 -2.922 432 HZ2 LYS 53 1HZ LYS 53 4.566 11.217 -1.761 433 HZ3 LYS 53 2HZ LYS 53 3.996 11.753 -3.260 434 H LYS 54 H LYS 54 -0.856 10.183 1.660 435 HA LYS 54 HA LYS 54 -1.652 11.263 3.496 436 HB2 LYS 54 2HB LYS 54 -2.309 8.850 4.031 437 HB3 LYS 54 3HB LYS 54 -0.914 8.821 5.102 438 HG2 LYS 54 2HG LYS 54 -2.736 9.325 6.479 439 HG3 LYS 54 3HG LYS 54 -1.919 10.868 6.220 440 HD2 LYS 54 2HD LYS 54 -3.616 11.015 4.195 441 HD3 LYS 54 3HD LYS 54 -4.548 9.909 5.207 442 HE2 LYS 54 2HE LYS 54 -5.100 11.530 6.644 443 HE3 LYS 54 3HE LYS 54 -3.452 12.155 6.699 444 HZ1 LYS 54 3HZ LYS 54 -5.533 13.437 5.590 445 HZ2 LYS 54 1HZ LYS 54 -4.855 12.689 4.232 446 HZ3 LYS 54 2HZ LYS 54 -3.914 13.720 5.188 447 H GLY 55 H GLY 55 -0.176 12.895 3.715 448 HA2 GLY 55 2HA GLY 55 1.361 13.031 6.046 449 HA3 GLY 55 3HA GLY 55 2.440 12.591 4.731 450 H GLY 56 H GLY 56 0.937 14.119 2.736 451 HA2 GLY 56 2HA GLY 56 1.430 16.868 3.678 452 HA3 GLY 56 3HA GLY 56 2.166 16.300 2.187 453 H GLY 57 H GLY 57 0.916 18.317 1.500 454 HA2 GLY 57 2HA GLY 57 -1.317 17.485 -0.034 455 HA3 GLY 57 3HA GLY 57 -1.862 18.409 1.358 456 H GLY 58 H GLY 58 -2.513 19.446 -0.990 457 HA2 GLY 58 2HA GLY 58 -0.921 21.879 -1.061 458 HA3 GLY 58 3HA GLY 58 -0.967 20.958 -2.556 459 H GLY 59 H GLY 59 -2.754 21.046 -3.850 460 HA2 GLY 59 2HA GLY 59 -4.776 23.025 -3.049 461 HA3 GLY 59 3HA GLY 59 -4.394 22.567 -4.702 462 H GLY 60 H GLY 60 -6.934 22.601 -3.019 463 HA2 GLY 60 2HA GLY 60 -8.832 21.328 -2.797 464 HA3 GLY 60 3HA GLY 60 -8.269 20.501 -4.242 465 H GLY 61 H GLY 61 -9.509 18.762 -2.991 466 HA2 GLY 61 2HA GLY 61 -8.869 16.546 -2.335 467 HA3 GLY 61 3HA GLY 61 -7.522 17.240 -1.444 468 H GLY 62 H GLY 62 -8.487 15.685 0.184 469 HA2 GLY 62 2HA GLY 62 -9.772 17.163 2.213 470 HA3 GLY 62 3HA GLY 62 -10.956 16.137 1.418 471 H GLY 63 H GLY 63 -11.312 14.841 3.215 472 HA2 GLY 63 2HA GLY 63 -9.395 12.713 3.556 473 HA3 GLY 63 3HA GLY 63 -9.577 13.727 4.979 474 H GLY 64 H GLY 64 -11.896 12.447 2.590 475 HA2 GLY 64 2HA GLY 64 -13.074 10.643 4.477 476 HA3 GLY 64 3HA GLY 64 -14.037 12.098 4.271 477 H VAL 65 H VAL 65 -15.501 10.181 3.598 478 HA VAL 65 HA VAL 65 -15.075 9.098 0.978 479 HB VAL 65 HB VAL 65 -17.281 8.126 1.188 480 HG11 VAL 65 1HG1 VAL 65 -16.555 6.570 2.615 481 HG12 VAL 65 2HG1 VAL 65 -15.146 7.607 2.848 482 HG13 VAL 65 3HG1 VAL 65 -16.510 7.707 3.962 483 HG21 VAL 65 3HG2 VAL 65 -18.520 9.960 2.111 484 HG22 VAL 65 1HG2 VAL 65 -18.658 8.590 3.214 485 HG23 VAL 65 2HG2 VAL 65 -17.565 9.922 3.593 486 H TRP 66 H TRP 66 -16.697 11.880 2.304 487 HA TRP 66 HA TRP 66 -18.574 12.639 0.558 488 HB2 TRP 66 2HB TRP 66 -17.516 15.020 0.731 489 HB3 TRP 66 3HB TRP 66 -18.113 14.229 2.187 490 HD1 TRP 66 HD1 TRP 66 -14.680 14.229 0.344 491 HE1 TRP 66 HE1 TRP 66 -12.842 14.549 2.117 492 HE3 TRP 66 HE3 TRP 66 -17.621 14.540 4.514 493 HZ2 TRP 66 HZ2 TRP 66 -12.663 14.888 4.914 494 HZ3 TRP 66 HZ3 TRP 66 -16.538 14.862 6.700 495 HH2 TRP 66 HH2 TRP 66 -14.110 15.032 6.894 496 HA PRO 67 HA PRO 67 -16.938 12.755 -3.523 497 HB2 PRO 67 2HB PRO 67 -18.621 14.570 -4.639 498 HB3 PRO 67 3HB PRO 67 -19.116 12.922 -4.237 499 HG2 PRO 67 2HG PRO 67 -19.560 15.459 -2.711 500 HG3 PRO 67 3HG PRO 67 -20.689 14.126 -3.019 501 HD2 PRO 67 2HD PRO 67 -19.373 14.407 -0.669 502 HD3 PRO 67 3HD PRO 67 -19.802 12.820 -1.340 503 H LEU 68 H LEU 68 -15.546 14.408 -1.605 504 HA LEU 68 HA LEU 68 -15.140 16.957 -2.950 505 HB2 LEU 68 2HB LEU 68 -13.841 15.814 -0.481 506 HB3 LEU 68 3HB LEU 68 -13.630 17.455 -1.087 507 HG LEU 68 HG LEU 68 -16.190 16.270 -0.014 508 HD11 LEU 68 1HD1 LEU 68 -14.121 17.003 1.483 509 HD12 LEU 68 2HD1 LEU 68 -15.790 17.310 1.962 510 HD13 LEU 68 3HD1 LEU 68 -14.834 18.595 1.223 511 HD21 LEU 68 3HD2 LEU 68 -16.802 17.830 -1.678 512 HD22 LEU 68 1HD2 LEU 68 -15.541 18.962 -1.189 513 HD23 LEU 68 2HD2 LEU 68 -16.933 18.686 -0.141 514 H VAL 69 H VAL 69 -13.722 13.827 -2.767 515 HA VAL 69 HA VAL 69 -11.142 14.695 -3.778 516 HB VAL 69 HB VAL 69 -10.548 12.315 -3.767 517 HG11 VAL 69 1HG1 VAL 69 -10.675 11.951 -1.354 518 HG12 VAL 69 2HG1 VAL 69 -10.268 13.627 -1.726 519 HG13 VAL 69 3HG1 VAL 69 -11.906 13.207 -1.225 520 HG21 VAL 69 3HG2 VAL 69 -12.263 10.922 -4.186 521 HG22 VAL 69 1HG2 VAL 69 -12.500 10.973 -2.439 522 HG23 VAL 69 2HG2 VAL 69 -13.456 12.018 -3.490 523 H ILE 70 H ILE 70 -14.079 13.177 -4.950 524 HA ILE 70 HA ILE 70 -13.169 12.253 -7.425 525 HB ILE 70 HB ILE 70 -15.500 12.368 -8.172 526 HG12 ILE 70 2HG1 ILE 70 -17.033 13.149 -6.075 527 HG13 ILE 70 3HG1 ILE 70 -15.678 14.259 -5.905 528 HG21 ILE 70 1HG2 ILE 70 -16.244 10.677 -6.815 529 HG22 ILE 70 2HG2 ILE 70 -14.528 10.682 -6.412 530 HG23 ILE 70 3HG2 ILE 70 -15.688 11.467 -5.340 531 HD11 ILE 70 3HD1 ILE 70 -17.874 14.344 -7.729 532 HD12 ILE 70 1HD1 ILE 70 -16.617 15.545 -7.435 533 HD13 ILE 70 2HD1 ILE 70 -16.356 14.267 -8.623 534 H ARG 71 H ARG 71 -14.228 15.449 -6.401 535 HA ARG 71 HA ARG 71 -14.301 16.587 -9.009 536 HB2 ARG 71 2HB ARG 71 -14.268 18.768 -7.754 537 HB3 ARG 71 3HB ARG 71 -15.559 17.665 -7.295 538 HG2 ARG 71 2HG ARG 71 -14.725 17.329 -5.215 539 HG3 ARG 71 3HG ARG 71 -13.049 17.520 -5.736 540 HD2 ARG 71 2HD ARG 71 -13.092 19.581 -4.907 541 HD3 ARG 71 3HD ARG 71 -14.258 20.007 -6.159 542 HE ARG 71 HE ARG 71 -14.793 19.559 -3.364 543 HH11 ARG 71 1HH1 ARG 71 -16.132 19.646 -6.576 544 HH12 ARG 71 2HH1 ARG 71 -17.751 19.943 -6.034 545 HH21 ARG 71 1HH2 ARG 71 -16.919 19.950 -2.638 546 HH22 ARG 71 2HH2 ARG 71 -18.197 20.117 -3.794 547 H THR 72 H THR 72 -11.794 15.988 -6.696 548 HA THR 72 HA THR 72 -9.871 17.851 -7.316 549 HB THR 72 HB THR 72 -9.122 14.960 -6.967 550 HG1 THR 72 HG1 THR 72 -9.294 15.639 -4.612 551 HG21 THR 72 3HG2 THR 72 -7.912 17.620 -6.303 552 HG22 THR 72 1HG2 THR 72 -7.198 16.254 -7.159 553 HG23 THR 72 2HG2 THR 72 -7.435 16.174 -5.413 554 H VAL 73 H VAL 73 -10.181 14.641 -8.850 555 HA VAL 73 HA VAL 73 -8.270 15.162 -10.869 556 HB VAL 73 HB VAL 73 -9.369 13.187 -12.034 557 HG11 VAL 73 1HG1 VAL 73 -8.683 12.468 -9.218 558 HG12 VAL 73 2HG1 VAL 73 -8.208 11.683 -10.725 559 HG13 VAL 73 3HG1 VAL 73 -7.466 13.212 -10.254 560 HG21 VAL 73 3HG2 VAL 73 -10.904 12.952 -9.453 561 HG22 VAL 73 1HG2 VAL 73 -11.599 13.585 -10.946 562 HG23 VAL 73 2HG2 VAL 73 -11.020 11.920 -10.879 563 H ILE 74 H ILE 74 -11.767 15.540 -10.713 564 HA ILE 74 HA ILE 74 -12.318 15.969 -13.407 565 HB ILE 74 HB ILE 74 -13.662 17.376 -11.099 566 HG12 ILE 74 2HG1 ILE 74 -13.392 14.681 -11.295 567 HG13 ILE 74 3HG1 ILE 74 -14.773 15.478 -10.550 568 HG21 ILE 74 1HG2 ILE 74 -14.523 16.744 -13.913 569 HG22 ILE 74 2HG2 ILE 74 -15.640 17.247 -12.645 570 HG23 ILE 74 3HG2 ILE 74 -14.349 18.331 -13.163 571 HD11 ILE 74 3HD1 ILE 74 -15.266 13.634 -12.205 572 HD12 ILE 74 1HD1 ILE 74 -16.109 15.164 -12.452 573 HD13 ILE 74 2HD1 ILE 74 -14.720 14.749 -13.457 574 H ALA 75 H ALA 75 -10.600 17.929 -11.182 575 HA ALA 75 HA ALA 75 -11.004 20.508 -11.980 576 HB1 ALA 75 1HB ALA 75 -8.449 19.115 -11.224 577 HB2 ALA 75 2HB ALA 75 -8.545 20.856 -11.494 578 HB3 ALA 75 3HB ALA 75 -9.495 20.108 -10.210 579 H GLY 76 H GLY 76 -9.471 17.949 -13.776 580 HA2 GLY 76 2HA GLY 76 -8.576 19.844 -15.833 581 HA3 GLY 76 3HA GLY 76 -8.109 18.153 -15.719 582 H TYR 77 H TYR 77 -10.976 17.407 -15.237 583 HA TYR 77 HA TYR 77 -11.677 16.596 -17.771 584 HB2 TYR 77 2HB TYR 77 -13.241 17.023 -15.255 585 HB3 TYR 77 3HB TYR 77 -14.099 16.625 -16.739 586 HD1 TYR 77 HD2 TYR 77 -10.736 15.328 -16.068 587 HD2 TYR 77 HD1 TYR 77 -14.907 14.509 -15.879 588 HE1 TYR 77 HE2 TYR 77 -10.246 12.945 -15.707 589 HE2 TYR 77 HE1 TYR 77 -14.429 12.124 -15.517 590 HH TYR 77 HH TYR 77 -11.770 10.920 -14.475 591 H ASN 78 H ASN 78 -12.682 19.541 -16.071 592 HA ASN 78 HA ASN 78 -14.547 20.566 -17.785 593 HB2 ASN 78 2HB ASN 78 -13.892 21.660 -15.686 594 HB3 ASN 78 3HB ASN 78 -12.346 22.113 -16.397 595 HD21 ASN 78 1HD2 ASN 78 -15.831 22.428 -16.937 596 HD22 ASN 78 2HD2 ASN 78 -15.763 24.037 -17.563 597 H LEU 79 H LEU 79 -11.209 20.059 -18.404 598 HA LEU 79 HA LEU 79 -11.175 21.852 -20.701 599 HB2 LEU 79 2HB LEU 79 -9.229 20.816 -18.936 600 HB3 LEU 79 3HB LEU 79 -8.856 20.189 -20.540 601 HG LEU 79 HG LEU 79 -7.633 22.259 -20.011 602 HD11 LEU 79 1HD1 LEU 79 -9.084 23.472 -22.083 603 HD12 LEU 79 2HD1 LEU 79 -9.232 21.733 -22.330 604 HD13 LEU 79 3HD1 LEU 79 -7.636 22.474 -22.217 605 HD21 LEU 79 3HD2 LEU 79 -10.030 23.941 -20.329 606 HD22 LEU 79 1HD2 LEU 79 -8.598 24.176 -19.326 607 HD23 LEU 79 2HD2 LEU 79 -9.885 23.097 -18.786 608 H TYR 80 H TYR 80 -11.196 18.418 -19.948 609 HA TYR 80 HA TYR 80 -10.568 17.235 -22.316 610 HB2 TYR 80 2HB TYR 80 -11.582 15.351 -21.509 611 HB3 TYR 80 3HB TYR 80 -11.559 16.295 -20.024 612 HD1 TYR 80 HD2 TYR 80 -13.756 15.862 -23.024 613 HD2 TYR 80 HD1 TYR 80 -13.510 16.336 -18.803 614 HE1 TYR 80 HE2 TYR 80 -16.201 15.657 -22.864 615 HE2 TYR 80 HE1 TYR 80 -15.955 16.132 -18.631 616 HH TYR 80 HH TYR 80 -17.819 15.228 -19.883 617 H ARG 81 H ARG 81 -13.592 18.854 -21.501 618 HA ARG 81 HA ARG 81 -14.725 18.246 -24.111 619 HB2 ARG 81 2HB ARG 81 -15.816 18.709 -21.590 620 HB3 ARG 81 3HB ARG 81 -16.217 20.155 -22.507 621 HG2 ARG 81 2HG ARG 81 -17.469 18.965 -24.069 622 HG3 ARG 81 3HG ARG 81 -16.736 17.424 -23.618 623 HD2 ARG 81 2HD ARG 81 -17.820 17.952 -21.288 624 HD3 ARG 81 3HD ARG 81 -18.873 18.991 -22.248 625 HE ARG 81 HE ARG 81 -18.969 16.158 -22.088 626 HH11 ARG 81 1HH1 ARG 81 -19.425 18.825 -24.279 627 HH12 ARG 81 2HH1 ARG 81 -20.553 17.976 -25.283 628 HH21 ARG 81 1HH2 ARG 81 -20.453 15.030 -23.402 629 HH22 ARG 81 2HH2 ARG 81 -21.138 15.818 -24.783 630 H ALA 82 H ALA 82 -13.154 20.851 -22.440 631 HA ALA 82 HA ALA 82 -13.951 23.091 -23.808 632 HB1 ALA 82 1HB ALA 82 -11.886 24.097 -23.206 633 HB2 ALA 82 2HB ALA 82 -12.302 22.968 -21.915 634 HB3 ALA 82 3HB ALA 82 -11.077 22.532 -23.107 635 H ILE 83 H ILE 83 -11.502 20.724 -24.810 636 HA ILE 83 HA ILE 83 -10.949 22.081 -27.278 637 HB ILE 83 HB ILE 83 -10.217 19.289 -26.390 638 HG12 ILE 83 2HG1 ILE 83 -9.204 20.948 -24.953 639 HG13 ILE 83 3HG1 ILE 83 -7.968 20.311 -26.032 640 HG21 ILE 83 1HG2 ILE 83 -9.868 20.710 -28.915 641 HG22 ILE 83 2HG2 ILE 83 -8.367 20.065 -28.253 642 HG23 ILE 83 3HG2 ILE 83 -9.733 18.990 -28.553 643 HD11 ILE 83 3HD1 ILE 83 -9.015 22.516 -27.363 644 HD12 ILE 83 1HD1 ILE 83 -8.880 23.013 -25.677 645 HD13 ILE 83 2HD1 ILE 83 -7.463 22.404 -26.534 646 H LYS 84 H LYS 84 -13.297 19.838 -26.199 647 HA LYS 84 HA LYS 84 -13.863 18.720 -28.798 648 HB2 LYS 84 2HB LYS 84 -15.563 18.592 -26.305 649 HB3 LYS 84 3HB LYS 84 -15.654 17.534 -27.708 650 HG2 LYS 84 2HG LYS 84 -13.093 17.687 -26.202 651 HG3 LYS 84 3HG LYS 84 -14.440 16.780 -25.509 652 HD2 LYS 84 2HD LYS 84 -13.862 15.060 -26.796 653 HD3 LYS 84 3HD LYS 84 -14.317 16.022 -28.205 654 HE2 LYS 84 2HE LYS 84 -12.055 16.911 -28.346 655 HE3 LYS 84 3HE LYS 84 -11.594 16.006 -26.905 656 HZ1 LYS 84 3HZ LYS 84 -12.482 14.819 -29.478 657 HZ2 LYS 84 1HZ LYS 84 -12.037 13.952 -28.095 658 HZ3 LYS 84 2HZ LYS 84 -10.887 14.879 -28.918 659 H LYS 85 H LYS 85 -14.938 21.400 -26.874 660 HA LYS 85 HA LYS 85 -17.369 21.852 -28.331 661 HB2 LYS 85 2HB LYS 85 -15.801 23.574 -26.408 662 HB3 LYS 85 3HB LYS 85 -17.331 24.064 -27.125 663 HG2 LYS 85 2HG LYS 85 -17.421 21.436 -25.858 664 HG3 LYS 85 3HG LYS 85 -17.036 22.754 -24.749 665 HD2 LYS 85 2HD LYS 85 -19.196 23.422 -26.581 666 HD3 LYS 85 3HD LYS 85 -19.560 22.010 -25.586 667 HE2 LYS 85 2HE LYS 85 -18.979 23.308 -23.576 668 HE3 LYS 85 3HE LYS 85 -18.677 24.718 -24.589 669 HZ1 LYS 85 3HZ LYS 85 -20.844 24.966 -23.765 670 HZ2 LYS 85 1HZ LYS 85 -21.257 23.357 -24.087 671 HZ3 LYS 85 2HZ LYS 85 -21.046 24.447 -25.362 672 H LYS 86 H LYS 86 -14.076 23.102 -28.439 673 HA LYS 86 HA LYS 86 -13.084 24.653 -29.820 674 HB2 LYS 86 2HB LYS 86 -13.173 23.988 -32.162 675 HB3 LYS 86 3HB LYS 86 -13.065 22.570 -31.128 676 HG2 LYS 86 2HG LYS 86 -15.286 21.969 -31.518 677 HG3 LYS 86 3HG LYS 86 -15.705 23.571 -32.130 678 HD2 LYS 86 2HD LYS 86 -15.217 22.944 -34.207 679 HD3 LYS 86 3HD LYS 86 -13.589 22.470 -33.714 680 HE2 LYS 86 2HE LYS 86 -14.994 20.390 -32.748 681 HE3 LYS 86 3HE LYS 86 -16.011 20.828 -34.120 682 HZ1 LYS 86 3HZ LYS 86 -13.645 20.873 -35.285 683 HZ2 LYS 86 1HZ LYS 86 -14.576 19.464 -35.177 684 HZ3 LYS 86 2HZ LYS 86 -13.313 19.729 -34.083 685 H GLY 87 H GLY 87 -15.387 25.759 -28.701 686 HA2 GLY 87 2HA GLY 87 -16.016 27.732 -30.735 687 HA3 GLY 87 3HA GLY 87 -17.386 26.796 -30.157 688 H GLY 88 H GLY 88 -16.660 26.553 -27.453 689 HA2 GLY 88 2HA GLY 88 -16.541 29.354 -26.546 690 HA3 GLY 88 3HA GLY 88 -17.835 28.302 -25.993 691 H GLY 89 H GLY 89 -17.484 26.949 -24.305 692 HA2 GLY 89 2HA GLY 89 -15.284 25.691 -23.406 693 HA3 GLY 89 3HA GLY 89 -15.014 27.331 -22.835 694 H GLY 90 H GLY 90 -15.732 24.581 -21.591 695 HA2 GLY 90 2HA GLY 90 -16.626 25.003 -19.214 696 HA3 GLY 90 3HA GLY 90 -18.095 25.456 -20.066 697 H GLY 91 H GLY 91 -19.218 23.790 -18.942 698 HA2 GLY 91 2HA GLY 91 -18.447 21.060 -19.085 699 HA3 GLY 91 3HA GLY 91 -20.037 21.663 -18.641 700 H GLY 92 H GLY 92 -21.406 20.463 -19.823 701 HA2 GLY 92 2HA GLY 92 -22.405 20.765 -22.159 702 HA3 GLY 92 3HA GLY 92 -20.844 20.170 -22.702 703 H GLY 93 H GLY 93 -22.899 18.784 -23.600 704 HA2 GLY 93 2HA GLY 93 -22.498 16.195 -22.447 705 HA3 GLY 93 3HA GLY 93 -24.105 16.821 -22.106 706 H GLY 94 H GLY 94 -23.139 14.531 -23.778 707 HA2 GLY 94 2HA GLY 94 -24.865 13.982 -25.581 708 HA3 GLY 94 3HA GLY 94 -24.197 15.390 -26.393 709 H GLY 95 H GLY 95 -23.066 14.696 -28.087 710 HA2 GLY 95 2HA GLY 95 -20.621 13.609 -28.108 711 HA3 GLY 95 3HA GLY 95 -21.626 12.174 -27.966 712 H GLY 96 H GLY 96 -20.048 12.271 -30.108 713 HA2 GLY 96 2HA GLY 96 -21.882 12.137 -32.269 714 HA3 GLY 96 3HA GLY 96 -20.913 13.598 -32.390 715 H VAL 97 H VAL 97 -19.619 13.155 -34.086 716 HA VAL 97 HA VAL 97 -18.058 10.658 -33.997 717 HB VAL 97 HB VAL 97 -17.609 11.160 -36.445 718 HG11 VAL 97 1HG1 VAL 97 -20.349 10.708 -36.744 719 HG12 VAL 97 2HG1 VAL 97 -19.076 9.495 -36.597 720 HG13 VAL 97 3HG1 VAL 97 -19.937 10.051 -35.161 721 HG21 VAL 97 3HG2 VAL 97 -18.813 12.759 -37.599 722 HG22 VAL 97 1HG2 VAL 97 -20.067 12.857 -36.363 723 HG23 VAL 97 2HG2 VAL 97 -18.487 13.585 -36.075 724 H TRP 98 H TRP 98 -16.765 11.943 -32.369 725 HA TRP 98 HA TRP 98 -14.306 12.669 -33.437 726 HB2 TRP 98 2HB TRP 98 -14.929 14.703 -34.294 727 HB3 TRP 98 3HB TRP 98 -16.235 14.914 -33.130 728 HD1 TRP 98 HD1 TRP 98 -15.757 17.001 -31.742 729 HE1 TRP 98 HE1 TRP 98 -13.691 18.039 -30.611 730 HE3 TRP 98 HE3 TRP 98 -12.218 13.648 -33.283 731 HZ2 TRP 98 HZ2 TRP 98 -10.927 17.507 -30.400 732 HZ3 TRP 98 HZ3 TRP 98 -9.886 13.985 -32.573 733 HH2 TRP 98 HH2 TRP 98 -9.256 15.875 -31.162 734 HA PRO 99 HA PRO 99 -14.417 13.960 -28.783 735 HB2 PRO 99 2HB PRO 99 -16.833 13.947 -27.543 736 HB3 PRO 99 3HB PRO 99 -16.185 15.369 -28.370 737 HG2 PRO 99 2HG PRO 99 -18.182 13.360 -29.338 738 HG3 PRO 99 3HG PRO 99 -18.202 15.125 -29.501 739 HD2 PRO 99 2HD PRO 99 -17.436 13.486 -31.515 740 HD3 PRO 99 3HD PRO 99 -16.743 15.104 -31.284 741 H LEU 100 H LEU 100 -13.620 11.672 -29.247 742 HA LEU 100 HA LEU 100 -15.300 9.568 -28.141 743 HB2 LEU 100 2HB LEU 100 -12.641 9.621 -29.525 744 HB3 LEU 100 3HB LEU 100 -13.199 8.179 -28.680 745 HG LEU 100 HG LEU 100 -14.681 9.501 -30.950 746 HD11 LEU 100 1HD1 LEU 100 -13.693 8.083 -32.447 747 HD12 LEU 100 2HD1 LEU 100 -13.287 6.886 -31.217 748 HD13 LEU 100 3HD1 LEU 100 -12.342 8.369 -31.350 749 HD21 LEU 100 3HD2 LEU 100 -15.356 7.448 -29.045 750 HD22 LEU 100 1HD2 LEU 100 -15.373 6.810 -30.689 751 HD23 LEU 100 2HD2 LEU 100 -16.361 8.212 -30.278 752 H VAL 101 H VAL 101 -12.781 11.677 -27.161 753 HA VAL 101 HA VAL 101 -11.805 10.038 -25.007 754 HB VAL 101 HB VAL 101 -10.577 12.060 -24.300 755 HG11 VAL 101 1HG1 VAL 101 -10.284 10.615 -26.726 756 HG12 VAL 101 2HG1 VAL 101 -9.804 12.287 -27.021 757 HG13 VAL 101 3HG1 VAL 101 -9.033 11.361 -25.733 758 HG21 VAL 101 3HG2 VAL 101 -11.641 13.990 -24.758 759 HG22 VAL 101 1HG2 VAL 101 -10.790 13.879 -26.299 760 HG23 VAL 101 2HG2 VAL 101 -12.459 13.324 -26.171 761 H ILE 102 H ILE 102 -14.122 12.657 -25.388 762 HA ILE 102 HA ILE 102 -14.581 13.517 -22.857 763 HB ILE 102 HB ILE 102 -16.891 13.927 -23.440 764 HG12 ILE 102 2HG1 ILE 102 -17.417 13.001 -25.922 765 HG13 ILE 102 3HG1 ILE 102 -16.402 11.693 -25.325 766 HG21 ILE 102 1HG2 ILE 102 -14.835 15.051 -24.645 767 HG22 ILE 102 2HG2 ILE 102 -15.538 14.278 -26.065 768 HG23 ILE 102 3HG2 ILE 102 -16.491 15.424 -25.122 769 HD11 ILE 102 3HD1 ILE 102 -18.019 11.873 -23.247 770 HD12 ILE 102 1HD1 ILE 102 -19.103 12.550 -24.463 771 HD13 ILE 102 2HD1 ILE 102 -18.437 10.930 -24.677 772 H ARG 103 H ARG 103 -15.566 10.426 -24.224 773 HA ARG 103 HA ARG 103 -16.895 9.669 -21.741 774 HB2 ARG 103 2HB ARG 103 -17.740 7.785 -22.912 775 HB3 ARG 103 3HB ARG 103 -17.854 9.143 -24.023 776 HG2 ARG 103 2HG ARG 103 -15.473 8.242 -24.768 777 HG3 ARG 103 3HG ARG 103 -16.138 6.734 -24.137 778 HD2 ARG 103 2HD ARG 103 -17.335 8.490 -26.276 779 HD3 ARG 103 3HD ARG 103 -16.608 6.899 -26.498 780 HE ARG 103 HE ARG 103 -18.824 6.919 -24.666 781 HH11 ARG 103 1HH1 ARG 103 -17.863 6.666 -28.002 782 HH12 ARG 103 2HH1 ARG 103 -19.288 5.807 -28.483 783 HH21 ARG 103 1HH2 ARG 103 -20.705 5.788 -25.287 784 HH22 ARG 103 2HH2 ARG 103 -20.905 5.309 -26.938 785 H THR 104 H THR 104 -14.040 8.894 -23.638 786 HA THR 104 HA THR 104 -13.202 6.593 -22.302 787 HB THR 104 HB THR 104 -11.401 8.729 -23.460 788 HG1 THR 104 HG1 THR 104 -12.966 6.705 -24.640 789 HG21 THR 104 3HG2 THR 104 -10.995 5.972 -22.470 790 HG22 THR 104 1HG2 THR 104 -9.875 7.333 -22.526 791 HG23 THR 104 2HG2 THR 104 -10.187 6.386 -23.981 792 H VAL 105 H VAL 105 -12.339 9.992 -21.674 793 HA VAL 105 HA VAL 105 -10.703 9.485 -19.440 794 HB VAL 105 HB VAL 105 -12.301 11.998 -19.929 795 HG11 VAL 105 1HG1 VAL 105 -10.992 11.507 -17.728 796 HG12 VAL 105 2HG1 VAL 105 -9.575 11.875 -18.714 797 HG13 VAL 105 3HG1 VAL 105 -10.845 13.082 -18.507 798 HG21 VAL 105 3HG2 VAL 105 -11.056 11.331 -21.948 799 HG22 VAL 105 1HG2 VAL 105 -10.425 12.813 -21.230 800 HG23 VAL 105 2HG2 VAL 105 -9.570 11.288 -20.999 801 H ILE 106 H ILE 106 -14.055 10.706 -19.550 802 HA ILE 106 HA ILE 106 -14.547 10.667 -16.815 803 HB ILE 106 HB ILE 106 -16.552 10.128 -19.008 804 HG12 ILE 106 2HG1 ILE 106 -15.003 12.330 -18.853 805 HG13 ILE 106 3HG1 ILE 106 -16.660 12.358 -19.446 806 HG21 ILE 106 1HG2 ILE 106 -16.830 10.914 -16.124 807 HG22 ILE 106 2HG2 ILE 106 -18.104 11.215 -17.305 808 HG23 ILE 106 3HG2 ILE 106 -17.579 9.564 -16.975 809 HD11 ILE 106 3HD1 ILE 106 -17.478 13.251 -17.457 810 HD12 ILE 106 1HD1 ILE 106 -16.029 12.809 -16.555 811 HD13 ILE 106 2HD1 ILE 106 -15.968 14.117 -17.737 812 H ALA 107 H ALA 107 -14.347 8.058 -19.065 813 HA ALA 107 HA ALA 107 -15.910 6.085 -17.976 814 HB1 ALA 107 1HB ALA 107 -14.499 4.499 -19.019 815 HB2 ALA 107 2HB ALA 107 -14.449 5.944 -20.029 816 HB3 ALA 107 3HB ALA 107 -13.107 5.580 -18.944 817 H GLY 108 H GLY 108 -13.098 7.559 -16.614 818 HA2 GLY 108 2HA GLY 108 -12.792 5.432 -14.625 819 HA3 GLY 108 3HA GLY 108 -11.708 6.795 -14.858 820 H TYR 109 H TYR 109 -13.901 8.742 -14.903 821 HA TYR 109 HA TYR 109 -13.915 9.503 -12.235 822 HB2 TYR 109 2HB TYR 109 -14.426 11.189 -13.783 823 HB3 TYR 109 3HB TYR 109 -15.673 10.223 -14.565 824 HD1 TYR 109 HD2 TYR 109 -15.180 10.975 -10.948 825 HD2 TYR 109 HD1 TYR 109 -17.614 11.499 -14.398 826 HE1 TYR 109 HE2 TYR 109 -16.891 12.075 -9.567 827 HE2 TYR 109 HE1 TYR 109 -19.332 12.602 -13.026 828 HH TYR 109 HH TYR 109 -19.768 13.519 -11.010 829 H ASN 110 H ASN 110 -16.393 7.749 -14.072 830 HA ASN 110 HA ASN 110 -18.398 7.595 -12.197 831 HB2 ASN 110 2HB ASN 110 -17.516 5.875 -14.448 832 HB3 ASN 110 3HB ASN 110 -18.621 5.145 -13.287 833 HD21 ASN 110 1HD2 ASN 110 -18.373 8.451 -14.528 834 HD22 ASN 110 2HD2 ASN 110 -19.981 8.519 -15.158 835 H LEU 111 H LEU 111 -15.299 6.086 -12.143 836 HA LEU 111 HA LEU 111 -16.027 4.114 -10.155 837 HB2 LEU 111 2HB LEU 111 -13.913 4.470 -11.981 838 HB3 LEU 111 3HB LEU 111 -13.198 4.519 -10.371 839 HG LEU 111 HG LEU 111 -13.162 2.271 -11.404 840 HD11 LEU 111 1HD1 LEU 111 -14.549 2.847 -8.836 841 HD12 LEU 111 2HD1 LEU 111 -12.987 2.085 -9.132 842 HD13 LEU 111 3HD1 LEU 111 -14.475 1.180 -9.405 843 HD21 LEU 111 3HD2 LEU 111 -16.100 2.047 -10.946 844 HD22 LEU 111 1HD2 LEU 111 -15.046 1.099 -11.996 845 HD23 LEU 111 2HD2 LEU 111 -15.512 2.736 -12.460 846 H TYR 112 H TYR 112 -14.358 7.213 -10.290 847 HA TYR 112 HA TYR 112 -13.216 7.353 -7.798 848 HB2 TYR 112 2HB TYR 112 -13.907 9.190 -9.847 849 HB3 TYR 112 3HB TYR 112 -14.476 9.870 -8.327 850 HD1 TYR 112 HD2 TYR 112 -12.731 9.816 -6.359 851 HD2 TYR 112 HD1 TYR 112 -11.710 9.548 -10.481 852 HE1 TYR 112 HE2 TYR 112 -10.448 10.567 -5.836 853 HE2 TYR 112 HE1 TYR 112 -9.423 10.297 -9.969 854 HH TYR 112 HH TYR 112 -8.466 11.143 -6.655 855 H ARG 113 H ARG 113 -16.581 8.078 -8.665 856 HA ARG 113 HA ARG 113 -17.330 8.688 -5.964 857 HB2 ARG 113 2HB ARG 113 -18.632 8.637 -8.600 858 HB3 ARG 113 3HB ARG 113 -19.688 8.202 -7.263 859 HG2 ARG 113 2HG ARG 113 -18.906 10.325 -6.131 860 HG3 ARG 113 3HG ARG 113 -18.184 10.765 -7.680 861 HD2 ARG 113 2HD ARG 113 -20.455 10.415 -8.710 862 HD3 ARG 113 3HD ARG 113 -21.091 10.273 -7.072 863 HE ARG 113 HE ARG 113 -19.604 12.658 -7.326 864 HH11 ARG 113 1HH1 ARG 113 -22.622 11.216 -8.289 865 HH12 ARG 113 2HH1 ARG 113 -23.459 12.729 -8.403 866 HH21 ARG 113 1HH2 ARG 113 -20.694 14.656 -7.473 867 HH22 ARG 113 2HH2 ARG 113 -22.360 14.685 -7.940 868 H ALA 114 H ALA 114 -17.095 5.835 -7.876 869 HA ALA 114 HA ALA 114 -18.987 4.152 -6.783 870 HB1 ALA 114 1HB ALA 114 -17.751 2.370 -7.622 871 HB2 ALA 114 2HB ALA 114 -17.260 3.720 -8.645 872 HB3 ALA 114 3HB ALA 114 -16.209 3.177 -7.337 873 H ILE 115 H ILE 115 -15.874 5.133 -5.457 874 HA ILE 115 HA ILE 115 -16.063 3.341 -3.206 875 HB ILE 115 HB ILE 115 -14.172 5.640 -3.714 876 HG12 ILE 115 2HG1 ILE 115 -13.899 3.869 -5.354 877 HG13 ILE 115 3HG1 ILE 115 -12.547 3.835 -4.228 878 HG21 ILE 115 1HG2 ILE 115 -14.601 3.912 -1.401 879 HG22 ILE 115 2HG2 ILE 115 -12.932 3.936 -1.967 880 HG23 ILE 115 3HG2 ILE 115 -13.736 5.443 -1.528 881 HD11 ILE 115 3HD1 ILE 115 -12.947 1.689 -3.906 882 HD12 ILE 115 1HD1 ILE 115 -14.485 2.122 -3.158 883 HD13 ILE 115 2HD1 ILE 115 -14.411 1.772 -4.886 884 H LYS 116 H LYS 116 -17.132 6.511 -3.976 885 HA LYS 116 HA LYS 116 -17.283 7.521 -1.307 886 HB2 LYS 116 2HB LYS 116 -17.308 9.281 -2.760 887 HB3 LYS 116 3HB LYS 116 -18.189 8.390 -3.994 888 HG2 LYS 116 2HG LYS 116 -19.543 10.199 -3.162 889 HG3 LYS 116 3HG LYS 116 -20.253 8.655 -2.685 890 HD2 LYS 116 2HD LYS 116 -18.694 9.129 -0.544 891 HD3 LYS 116 3HD LYS 116 -19.051 10.788 -1.032 892 HE2 LYS 116 2HE LYS 116 -21.496 9.521 -1.212 893 HE3 LYS 116 3HE LYS 116 -20.765 8.794 0.218 894 HZ1 LYS 116 3HZ LYS 116 -22.072 11.163 0.158 895 HZ2 LYS 116 1HZ LYS 116 -20.452 11.648 0.102 896 HZ3 LYS 116 2HZ LYS 116 -21.000 10.672 1.370 897 H LYS 117 H LYS 117 -19.503 5.852 -3.476 898 HA LYS 117 HA LYS 117 -21.779 6.118 -1.770 899 HB2 LYS 117 2HB LYS 117 -22.788 4.406 -3.267 900 HB3 LYS 117 3HB LYS 117 -22.119 5.783 -4.132 901 HG2 LYS 117 2HG LYS 117 -20.139 4.485 -4.695 902 HG3 LYS 117 3HG LYS 117 -20.780 3.105 -3.800 903 HD2 LYS 117 2HD LYS 117 -21.178 2.833 -6.184 904 HD3 LYS 117 3HD LYS 117 -22.707 3.029 -5.322 905 HE2 LYS 117 2HE LYS 117 -21.542 5.547 -6.240 906 HE3 LYS 117 3HE LYS 117 -21.932 4.432 -7.548 907 HZ1 LYS 117 3HZ LYS 117 -23.843 5.733 -7.173 908 HZ2 LYS 117 1HZ LYS 117 -23.765 5.528 -5.495 909 HZ3 LYS 117 2HZ LYS 117 -24.180 4.223 -6.488 910 H LYS 118 H LYS 118 -19.326 3.638 -2.289 911 HA LYS 118 HA LYS 118 -20.497 2.062 -0.099 912 HB2 LYS 118 2HB LYS 118 -18.643 1.313 -2.355 913 HB3 LYS 118 3HB LYS 118 -18.917 0.260 -0.973 914 HG2 LYS 118 2HG LYS 118 -21.079 -0.209 -1.584 915 HG3 LYS 118 3HG LYS 118 -21.260 1.289 -2.499 916 HD2 LYS 118 2HD LYS 118 -19.368 0.187 -3.984 917 HD3 LYS 118 3HD LYS 118 -20.030 -1.300 -3.302 918 HE2 LYS 118 2HE LYS 118 -22.263 -0.647 -4.091 919 HE3 LYS 118 3HE LYS 118 -21.579 0.817 -4.795 920 HZ1 LYS 118 3HZ LYS 118 -20.842 -0.301 -6.560 921 HZ2 LYS 118 1HZ LYS 118 -21.874 -1.551 -6.074 922 HZ3 LYS 118 2HZ LYS 118 -20.241 -1.583 -5.633