NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
627021 |
5oeo   |
34161 | cing | 1-original | 1 | STAR | chemical shift |
# Restraints file 1: CaM12_TRPV5__X9CCvBD.str
data_nef_file
#######################
# Entry information #
#######################
save_nef_nmr_meta_data
_Entry.Sf_category entry_information
_Entry.Sf_framecode nef_nmr_meta_data
_Entry.NMR_STAR_version 3.2.0.4
_Entry.Source_data_format nmr_exchange_format
_Entry.Source_data_format_version 1.1
_Entry.Generated_software_name CcpNmr
_Entry.Generated_software_version 3.0.b1
_Entry.Generated_date 2017-06-06T22:59:13.039972
_Entry.UUID CcpNmr-2017-06-06T22:59:13.039972-692109390
_Entry.Related_coordinate_file_name .
save_
#############################################
# Molecular system (assembly) description #
#############################################
save_nef_molecular_system
_Assembly.Sf_category assembly
_Assembly.Sf_framecode nef_molecular_system
loop_
_Chem_comp_assembly.Entity_assembly_ID
_Chem_comp_assembly.Comp_ID
_Chem_comp_assembly.Seq_ID
_Chem_comp_assembly.Auth_asym_ID
_Chem_comp_assembly.Auth_seq_ID
_Chem_comp_assembly.Auth_comp_ID
_Chem_comp_assembly.Auth_variant_ID
_Chem_comp_assembly.Sequence_linking
_Chem_comp_assembly.Cis_residue
_Chem_comp_assembly.NEF_index
1 SER 1 A -1 SER . middle . 1
1 MET 2 A 0 MET . middle . 2
1 ALA 3 A 1 ALA . middle . 3
1 ASP 4 A 2 ASP . middle . 4
1 GLN 5 A 3 GLN . middle . 5
1 LEU 6 A 4 LEU . middle . 6
1 THR 7 A 5 THR . middle . 7
1 GLU 8 A 6 GLU . middle . 8
1 GLU 9 A 7 GLU . middle . 9
1 GLN 10 A 8 GLN . middle . 10
1 ILE 11 A 9 ILE . middle . 11
1 ALA 12 A 10 ALA . middle . 12
1 GLU 13 A 11 GLU . middle . 13
1 PHE 14 A 12 PHE . middle . 14
1 LYS 15 A 13 LYS . middle . 15
1 GLU 16 A 14 GLU . middle . 16
1 ALA 17 A 15 ALA . middle . 17
1 PHE 18 A 16 PHE . middle . 18
1 SER 19 A 17 SER . middle . 19
1 LEU 20 A 18 LEU . middle . 20
1 PHE 21 A 19 PHE . middle . 21
1 ASP 22 A 20 ASP . middle . 22
1 LYS 23 A 21 LYS . middle . 23
1 ASP 24 A 22 ASP . middle . 24
1 GLY 25 A 23 GLY . middle . 25
1 ASP 26 A 24 ASP . middle . 26
1 GLY 27 A 25 GLY . middle . 27
1 THR 28 A 26 THR . middle . 28
1 ILE 29 A 27 ILE . middle . 29
1 THR 30 A 28 THR . middle . 30
1 THR 31 A 29 THR . middle . 31
1 LYS 32 A 30 LYS . middle . 32
1 GLN 33 A 31 GLN . middle . 33
1 LEU 34 A 32 LEU . middle . 34
1 GLY 35 A 33 GLY . middle . 35
1 THR 36 A 34 THR . middle . 36
1 VAL 37 A 35 VAL . middle . 37
1 MET 38 A 36 MET . middle . 38
1 ARG 39 A 37 ARG . middle . 39
1 SER 40 A 38 SER . middle . 40
1 LEU 41 A 39 LEU . middle . 41
1 GLY 42 A 40 GLY . middle . 42
1 GLN 43 A 41 GLN . middle . 43
1 ASN 44 A 42 ASN . middle . 44
1 PRO 45 A 43 PRO . middle . 45
1 THR 46 A 44 THR . middle . 46
1 GLU 47 A 45 GLU . middle . 47
1 ALA 48 A 46 ALA . middle . 48
1 GLU 49 A 47 GLU . middle . 49
1 LEU 50 A 48 LEU . middle . 50
1 GLN 51 A 49 GLN . middle . 51
1 ASP 52 A 50 ASP . middle . 52
1 MET 53 A 51 MET . middle . 53
1 ILE 54 A 52 ILE . middle . 54
1 ASN 55 A 53 ASN . middle . 55
1 GLU 56 A 54 GLU . middle . 56
1 VAL 57 A 55 VAL . middle . 57
1 ASP 58 A 56 ASP . middle . 58
1 ALA 59 A 57 ALA . middle . 59
1 ASP 60 A 58 ASP . middle . 60
1 GLY 61 A 59 GLY . middle . 61
1 ASN 62 A 60 ASN . middle . 62
1 GLY 63 A 61 GLY . middle . 63
1 THR 64 A 62 THR . middle . 64
1 ILE 65 A 63 ILE . middle . 65
1 ASP 66 A 64 ASP . middle . 66
1 PHE 67 A 65 PHE . middle . 67
1 PRO 68 A 66 PRO . middle . 68
1 GLN 69 A 67 GLN . middle . 69
1 PHE 70 A 68 PHE . middle . 70
1 LEU 71 A 69 LEU . middle . 71
1 THR 72 A 70 THR . middle . 72
1 MET 73 A 71 MET . middle . 73
1 MET 74 A 72 MET . middle . 74
1 ALA 75 A 73 ALA . middle . 75
1 ARG 76 A 74 ARG . middle . 76
1 LYS 77 A 75 LYS . middle . 77
1 MET 78 A 76 MET . middle . 78
1 LYS 79 A 77 LYS . middle . 79
1 ASP 80 A 78 ASP . middle . 80
1 THR 81 A 79 THR . middle . 81
1 ASP 82 A 80 ASP . middle . 82
1 SER 83 A 81 SER . middle . 83
1 GLU 84 A 82 GLU . middle . 84
1 GLU 85 A 83 GLU . middle . 85
1 GLU 86 A 84 GLU . middle . 86
1 ILE 87 A 85 ILE . middle . 87
1 ARG 88 A 86 ARG . middle . 88
1 GLU 89 A 87 GLU . middle . 89
1 ALA 90 A 88 ALA . middle . 90
1 PHE 91 A 89 PHE . middle . 91
1 ARG 92 A 90 ARG . middle . 92
1 VAL 93 A 91 VAL . middle . 93
1 PHE 94 A 92 PHE . middle . 94
1 ASP 95 A 93 ASP . middle . 95
1 LYS 96 A 94 LYS . middle . 96
1 ASP 97 A 95 ASP . middle . 97
1 GLY 98 A 96 GLY . middle . 98
1 ASN 99 A 97 ASN . middle . 99
1 GLY 100 A 98 GLY . middle . 100
1 TYR 101 A 99 TYR . middle . 101
1 ILE 102 A 100 ILE . middle . 102
1 SER 103 A 101 SER . middle . 103
1 ALA 104 A 102 ALA . middle . 104
1 ALA 105 A 103 ALA . middle . 105
1 GLU 106 A 104 GLU . middle . 106
1 LEU 107 A 105 LEU . middle . 107
1 ARG 108 A 106 ARG . middle . 108
1 HIS 109 A 107 HIS . middle . 109
1 VAL 110 A 108 VAL . middle . 110
1 MET 111 A 109 MET . middle . 111
1 THR 112 A 110 THR . middle . 112
1 ASN 113 A 111 ASN . middle . 113
1 LEU 114 A 112 LEU . middle . 114
1 GLY 115 A 113 GLY . middle . 115
1 GLU 116 A 114 GLU . middle . 116
1 LYS 117 A 115 LYS . middle . 117
1 LEU 118 A 116 LEU . middle . 118
1 THR 119 A 117 THR . middle . 119
1 ASP 120 A 118 ASP . middle . 120
1 GLU 121 A 119 GLU . middle . 121
1 GLU 122 A 120 GLU . middle . 122
1 VAL 123 A 121 VAL . middle . 123
1 ASP 124 A 122 ASP . middle . 124
1 GLU 125 A 123 GLU . middle . 125
1 MET 126 A 124 MET . middle . 126
1 ILE 127 A 125 ILE . middle . 127
1 ARG 128 A 126 ARG . middle . 128
1 GLU 129 A 127 GLU . middle . 129
1 ALA 130 A 128 ALA . middle . 130
1 ASP 131 A 129 ASP . middle . 131
1 ILE 132 A 130 ILE . middle . 132
1 ASP 133 A 131 ASP . middle . 133
1 GLY 134 A 132 GLY . middle . 134
1 ASP 135 A 133 ASP . middle . 135
1 GLY 136 A 134 GLY . middle . 136
1 GLN 137 A 135 GLN . middle . 137
1 VAL 138 A 136 VAL . middle . 138
1 ASN 139 A 137 ASN . middle . 139
1 TYR 140 A 138 TYR . middle . 140
1 GLU 141 A 139 GLU . middle . 141
1 GLU 142 A 140 GLU . middle . 142
1 PHE 143 A 141 PHE . middle . 143
1 VAL 144 A 142 VAL . middle . 144
1 GLN 145 A 143 GLN . middle . 145
1 MET 146 A 144 MET . middle . 146
1 MET 147 A 145 MET . middle . 147
1 THR 148 A 146 THR . middle . 148
1 ALA 149 A 147 ALA . middle . 149
1 LYS 150 A 148 LYS . break . 150
1 PL 151 A 150 PL . dummy . 151
1 LL2 152 A 151 LL2 . dummy . 152
1 LL2 153 A 152 LL2 . dummy . 153
1 LL2 154 A 153 LL2 . dummy . 154
1 LL2 155 A 154 LL2 . dummy . 155
1 LL2 156 A 155 LL2 . dummy . 156
1 LL2 157 A 156 LL2 . dummy . 157
1 LL2 158 A 157 LL2 . dummy . 158
1 LL2 159 A 158 LL2 . dummy . 159
1 LL2 160 A 159 LL2 . dummy . 160
1 LL2 161 A 160 LL2 . dummy . 161
1 LL2 162 A 161 LL2 . dummy . 162
1 LL2 163 A 162 LL2 . dummy . 163
1 LL2 164 A 163 LL2 . dummy . 164
1 LL2 165 A 164 LL2 . dummy . 165
1 LL2 166 A 165 LL2 . dummy . 166
1 LL2 167 A 166 LL2 . dummy . 167
1 LL2 168 A 167 LL2 . dummy . 168
1 LL2 169 A 168 LL2 . dummy . 169
1 LL2 170 A 169 LL2 . dummy . 170
1 LL2 171 A 170 LL2 . dummy . 171
1 LL2 172 A 171 LL2 . dummy . 172
1 LL2 173 A 172 LL2 . dummy . 173
1 LL2 174 A 173 LL2 . dummy . 174
1 LL2 175 A 174 LL2 . dummy . 175
1 LL2 176 A 175 LL2 . dummy . 176
1 LL2 177 A 176 LL2 . dummy . 177
1 LL2 178 A 177 LL2 . dummy . 178
1 LL2 179 A 178 LL2 . dummy . 179
1 LL2 180 A 179 LL2 . dummy . 180
1 LL2 181 A 180 LL2 . dummy . 181
1 LL2 182 A 181 LL2 . dummy . 182
1 LL2 183 A 182 LL2 . dummy . 183
1 LL2 184 A 183 LL2 . dummy . 184
1 LL2 185 A 184 LL2 . dummy . 185
1 LL2 186 A 185 LL2 . dummy . 186
1 LL2 187 A 186 LL2 . dummy . 187
1 LL2 188 A 187 LL2 . dummy . 188
1 LL2 189 A 188 LL2 . dummy . 189
1 LL2 190 A 189 LL2 . dummy . 190
1 LL2 191 A 190 LL2 . dummy . 191
1 ION 192 A 200 ION . single . 192
1 LL2 193 A 201 LL2 . dummy . 193
1 LL2 194 A 202 LL2 . dummy . 194
1 LL2 195 A 203 LL2 . dummy . 195
1 LL2 196 A 204 LL2 . dummy . 196
1 LL2 197 A 205 LL2 . dummy . 197
1 LL2 198 A 206 LL2 . dummy . 198
1 LL2 199 A 207 LL2 . dummy . 199
1 LL2 200 A 208 LL2 . dummy . 200
1 LL2 201 A 209 LL2 . dummy . 201
1 LL2 202 A 210 LL2 . dummy . 202
1 LL2 203 A 211 LL2 . dummy . 203
1 LL2 204 A 212 LL2 . dummy . 204
1 LL2 205 A 213 LL2 . dummy . 205
1 LL2 206 A 214 LL2 . dummy . 206
1 LL2 207 A 215 LL2 . dummy . 207
1 LL2 208 A 216 LL2 . dummy . 208
1 LL2 209 A 217 LL2 . dummy . 209
1 LL2 210 A 218 LL2 . dummy . 210
1 LL2 211 A 219 LL2 . dummy . 211
1 LL2 212 A 220 LL2 . dummy . 212
1 LL2 213 A 221 LL2 . dummy . 213
1 LL2 214 A 222 LL2 . dummy . 214
1 LL2 215 A 223 LL2 . dummy . 215
1 LL2 216 A 224 LL2 . dummy . 216
1 LL2 217 A 225 LL2 . dummy . 217
1 LL2 218 A 226 LL2 . dummy . 218
1 LL2 219 A 227 LL2 . dummy . 219
1 LL2 220 A 228 LL2 . dummy . 220
1 LL2 221 A 229 LL2 . dummy . 221
1 LL2 222 A 230 LL2 . dummy . 222
1 ION 223 A 250 ION . single . 223
1 LL2 224 A 251 LL2 . dummy . 224
1 LL2 225 A 252 LL2 . dummy . 225
1 LL2 226 A 253 LL2 . dummy . 226
1 LL2 227 A 254 LL2 . dummy . 227
1 LL2 228 A 255 LL2 . dummy . 228
1 LL2 229 A 256 LL2 . dummy . 229
1 LL2 230 A 257 LL2 . dummy . 230
1 LL2 231 A 258 LL2 . dummy . 231
1 LL2 232 A 259 LL2 . dummy . 232
1 LL2 233 A 260 LL2 . dummy . 233
1 LL2 234 A 261 LL2 . dummy . 234
1 LL2 235 A 262 LL2 . dummy . 235
1 LL2 236 A 263 LL2 . dummy . 236
1 LL2 237 A 264 LL2 . dummy . 237
1 LL2 238 A 265 LL2 . dummy . 238
1 LL2 239 A 266 LL2 . dummy . 239
1 LL2 240 A 267 LL2 . dummy . 240
1 LL2 241 A 268 LL2 . dummy . 241
1 LL2 242 A 269 LL2 . dummy . 242
1 LL2 243 A 270 LL2 . dummy . 243
1 LL2 244 A 271 LL2 . dummy . 244
1 LL2 245 A 272 LL2 . dummy . 245
1 LL2 246 A 273 LL2 . dummy . 246
1 LL2 247 A 274 LL2 . dummy . 247
1 LL2 248 A 275 LL2 . dummy . 248
1 LL2 249 A 276 LL2 . dummy . 249
1 LL2 250 A 277 LL2 . dummy . 250
1 LL2 251 A 278 LL2 . dummy . 251
1 LL2 252 A 279 LL2 . dummy . 252
1 LL2 253 A 280 LL2 . dummy . 253
1 LP 254 A 281 LP . dummy . 254
1 GLY 255 A 653 GLY . middle . 255
1 ALA 256 A 654 ALA . middle . 256
1 ASP 257 A 655 ASP . middle . 257
1 LYS 258 A 656 LYS . middle . 258
1 GLU 259 A 657 GLU . middle . 259
1 ASP 260 A 658 ASP . middle . 260
1 ASP 261 A 659 ASP . middle . 261
1 GLN 262 A 660 GLN . middle . 262
1 GLU 263 A 661 GLU . middle . 263
1 HIS 264 A 662 HIS . middle . 264
1 PRO 265 A 663 PRO . middle . 265
1 SER 266 A 664 SER . middle . 266
1 GLU 267 A 665 GLU . middle . 267
1 LYS 268 A 666 LYS . middle . 268
1 GLN 269 A 667 GLN . middle . 269
1 PRO 270 A 668 PRO . middle . 270
1 SER 271 A 669 SER . middle . 271
1 GLY 272 A 670 GLY . middle . 272
1 ALA 273 A 671 ALA . middle . 273
1 GLU 274 A 672 GLU . middle . 274
1 SER 275 A 673 SER . middle . 275
1 GLY 276 A 674 GLY . middle . 276
1 THR 277 A 675 THR . middle . 277
1 LEU 278 A 676 LEU . middle . 278
1 ALA 279 A 677 ALA . middle . 279
1 ARG 280 A 678 ARG . middle . 280
1 ALA 281 A 679 ALA . middle . 281
1 SER 282 A 680 SER . middle . 282
1 LEU 283 A 681 LEU . middle . 283
1 ALA 284 A 682 ALA . middle . 284
1 LEU 285 A 683 LEU . middle . 285
1 PRO 286 A 684 PRO . middle . 286
1 THR 287 A 685 THR . middle . 287
1 SER 288 A 686 SER . middle . 288
1 SER 289 A 687 SER . middle . 289
1 LEU 290 A 688 LEU . middle . 290
1 SER 291 A 689 SER . middle . 291
1 ARG 292 A 690 ARG . middle . 292
1 THR 293 A 691 THR . middle . 293
1 ALA 294 A 692 ALA . middle . 294
1 SER 295 A 693 SER . middle . 295
1 GLN 296 A 694 GLN . middle . 296
1 SER 297 A 695 SER . middle . 297
1 SER 298 A 696 SER . middle . 298
1 SER 299 A 697 SER . middle . 299
1 HIS 300 A 698 HIS . middle . 300
1 ARG 301 A 699 ARG . middle . 301
1 GLY 302 A 700 GLY . middle . 302
1 TRP 303 A 701 TRP . middle . 303
1 GLU 304 A 702 GLU . middle . 304
1 ILE 305 A 703 ILE . middle . 305
1 LEU 306 A 704 LEU . middle . 306
1 ARG 307 A 705 ARG . middle . 307
1 GLN 308 A 706 GLN . middle . 308
1 ASN 309 A 707 ASN . middle . 309
1 THR 310 A 708 THR . middle . 310
1 LEU 311 A 709 LEU . middle . 311
1 GLY 312 A 710 GLY . middle . 312
1 HIS 313 A 711 HIS . middle . 313
1 LEU 314 A 712 LEU . middle . 314
1 ASN 315 A 713 ASN . middle . 315
1 LEU 316 A 714 LEU . middle . 316
1 GLY 317 A 715 GLY . middle . 317
1 LEU 318 A 716 LEU . middle . 318
1 ASN 319 A 717 ASN . middle . 319
1 LEU 320 A 718 LEU . middle . 320
1 SER 321 A 719 SER . middle . 321
1 GLU 322 A 720 GLU . middle . 322
1 GLY 323 A 721 GLY . middle . 323
1 ASP 324 A 722 ASP . middle . 324
1 GLY 325 A 723 GLY . middle . 325
1 GLU 326 A 724 GLU . middle . 326
1 GLU 327 A 725 GLU . middle . 327
stop_
save_
###################################
# Assigned chemical shift lists #
###################################
###################################################################
# 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) #
# (e.g. ILE HD11, HD12, HD13 protons) #
# 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 #
# #
###################################################################
save_nef_chemical_shift_list_ShiftList_1-final.prot
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode nef_chemical_shift_list_ShiftList_1-final.prot
loop_
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 3 ALA CA C 13 54.368 0.03 1 A 1 ALA CA 1
1 3 ALA CB C 13 20.004 0 1 A 1 ALA CB 1
1 3 ALA HA H 1 4.193 0.008 1 A 1 ALA HA 1
1 3 ALA HB1 H 1 1.355 0.005 1 A 1 ALA HB% 1
1 3 ALA HB2 H 1 1.355 0.005 1 A 1 ALA HB% 1
1 3 ALA HB3 H 1 1.355 0.005 1 A 1 ALA HB% 1
1 4 ASP CA C 13 55.967 0 1 A 2 ASP CA 1
1 4 ASP CB C 13 41.909 0 1 A 2 ASP CB 1
1 4 ASP H H 1 7.973 0.002 1 A 2 ASP H 1
1 4 ASP HA H 1 4.541 0.013 1 A 2 ASP HA 1
1 4 ASP HB2 H 1 2.719 0.008 2 A 2 ASP HBx 1
1 4 ASP HB3 H 1 2.719 0.008 2 A 2 ASP HBy 1
1 4 ASP N N 15 117.259 0.018 1 A 2 ASP N 1
1 5 GLN CA C 13 56.738 0.033 1 A 3 GLN CA 1
1 5 GLN CB C 13 30.923 0.037 1 A 3 GLN CB 1
1 5 GLN CG C 13 32.737 0.023 1 A 3 GLN CG 1
1 5 GLN H H 1 7.92 0.003 1 A 3 GLN H 1
1 5 GLN HA H 1 4.379 0.007 1 A 3 GLN HA 1
1 5 GLN HB2 H 1 2.216 0.012 2 A 3 GLN HBx 1
1 5 GLN HB3 H 1 2.033 0.014 2 A 3 GLN HBy 1
1 5 GLN HG2 H 1 2.38 0.019 2 A 3 GLN HGx 1
1 5 GLN HG3 H 1 2.369 0.004 2 A 3 GLN HGy 1
1 5 GLN N N 15 117.622 0.03 1 A 3 GLN N 1
1 6 LEU CB C 13 44.728 0.046 1 A 4 LEU CB 1
1 6 LEU CD1 C 13 28.195 0.017 1 A 4 LEU CD1 1
1 6 LEU CD2 C 13 24.846 0.029 1 A 4 LEU CD2 1
1 6 LEU CG C 13 28.485 0.012 1 A 4 LEU CG 1
1 6 LEU H H 1 7.855 0.001 1 A 4 LEU H 1
1 6 LEU HB2 H 1 1.811 0.008 2 A 4 LEU HBx 1
1 6 LEU HB3 H 1 1.473 0.015 2 A 4 LEU HBy 1
1 6 LEU HD11 H 1 0.956 0.008 2 A 4 LEU HDx% 1
1 6 LEU HD12 H 1 0.956 0.008 2 A 4 LEU HDx% 1
1 6 LEU HD13 H 1 0.956 0.008 2 A 4 LEU HDx% 1
1 6 LEU HD21 H 1 0.956 0.008 2 A 4 LEU HDx% 1
1 6 LEU HD22 H 1 0.956 0.008 2 A 4 LEU HDx% 1
1 6 LEU HD23 H 1 0.956 0.008 2 A 4 LEU HDx% 1
1 6 LEU HD23 H 1 0.926 0.006 2 A 4 LEU HDy% 1
1 6 LEU HD22 H 1 0.926 0.006 2 A 4 LEU HDy% 1
1 6 LEU HD21 H 1 0.926 0.006 2 A 4 LEU HDy% 1
1 6 LEU HD13 H 1 0.926 0.006 2 A 4 LEU HDy% 1
1 6 LEU HD12 H 1 0.926 0.006 2 A 4 LEU HDy% 1
1 6 LEU HD11 H 1 0.926 0.006 2 A 4 LEU HDy% 1
1 6 LEU HG H 1 1.793 0.026 1 A 4 LEU HG 1
1 6 LEU N N 15 120.806 0.002 1 A 4 LEU N 1
1 7 THR CA C 13 61.419 0.032 1 A 5 THR CA 1
1 7 THR CG2 C 13 23.027 0.042 1 A 5 THR CG2 1
1 7 THR H H 1 8.714 0.005 1 A 5 THR H 1
1 7 THR HA H 1 4.5 0 1 A 5 THR HA 1
1 7 THR HG21 H 1 1.385 0.02 1 A 5 THR HG2% 1
1 7 THR HG22 H 1 1.385 0.02 1 A 5 THR HG2% 1
1 7 THR HG23 H 1 1.385 0.02 1 A 5 THR HG2% 1
1 7 THR N N 15 112.577 0.079 1 A 5 THR N 1
1 8 GLU CA C 13 61.083 0.037 1 A 6 GLU CA 1
1 8 GLU CB C 13 30.261 0.02 1 A 6 GLU CB 1
1 8 GLU CG C 13 38.035 0.045 1 A 6 GLU CG 1
1 8 GLU H H 1 9 0.002 1 A 6 GLU H 1
1 8 GLU HA H 1 3.975 0.003 1 A 6 GLU HA 1
1 8 GLU HB2 H 1 2.016 0.048 2 A 6 GLU HBx 1
1 8 GLU HB3 H 1 2.016 0.048 2 A 6 GLU HBy 1
1 8 GLU HG2 H 1 2.317 0.022 2 A 6 GLU HGx 1
1 8 GLU HG3 H 1 2.317 0.022 2 A 6 GLU HGy 1
1 8 GLU N N 15 120.438 0.18 1 A 6 GLU N 1
1 9 GLU CA C 13 61.05 0.018 1 A 7 GLU CA 1
1 9 GLU CB C 13 30.066 0.053 1 A 7 GLU CB 1
1 9 GLU CG C 13 38.059 0.033 1 A 7 GLU CG 1
1 9 GLU H H 1 8.681 0.003 1 A 7 GLU H 1
1 9 GLU HA H 1 4.067 0.009 1 A 7 GLU HA 1
1 9 GLU HB2 H 1 1.961 0.018 2 A 7 GLU HBx 1
1 9 GLU HB3 H 1 1.962 0.017 2 A 7 GLU HBy 1
1 9 GLU HG2 H 1 2.37 0.019 2 A 7 GLU HGx 1
1 9 GLU HG3 H 1 2.37 0.019 2 A 7 GLU HGy 1
1 9 GLU N N 15 119.36 0.042 1 A 7 GLU N 1
1 10 GLN CA C 13 59.688 0.008 1 A 8 GLN CA 1
1 10 GLN CB C 13 30.164 0.068 1 A 8 GLN CB 1
1 10 GLN CG C 13 35.89 0.034 1 A 8 GLN CG 1
1 10 GLN H H 1 7.705 0.002 1 A 8 GLN H 1
1 10 GLN HA H 1 3.805 0.007 1 A 8 GLN HA 1
1 10 GLN HB2 H 1 1.889 0.419 2 A 8 GLN HBx 1
1 10 GLN HB3 H 1 1.627 0.3 2 A 8 GLN HBy 1
1 10 GLN HE21 H 1 7.499 0.005 2 A 8 GLN HE2x 1
1 10 GLN HE22 H 1 6.723 0.001 2 A 8 GLN HE2y 1
1 10 GLN HG2 H 1 2.264 0.005 2 A 8 GLN HGx 1
1 10 GLN HG3 H 1 2.352 0.039 2 A 8 GLN HGy 1
1 10 GLN N N 15 120.398 0.045 1 A 8 GLN N 1
1 10 GLN NE2 N 15 112.175 0.007 1 A 8 GLN NE2 1
1 11 ILE CA C 13 67.713 0.024 1 A 9 ILE CA 1
1 11 ILE CB C 13 39.171 0.013 1 A 9 ILE CB 1
1 11 ILE CD1 C 13 18.373 0.029 1 A 9 ILE CD1 1
1 11 ILE CG1 C 13 32.223 0.064 1 A 9 ILE CG1 1
1 11 ILE CG2 C 13 18.588 0.031 1 A 9 ILE CG2 1
1 11 ILE H H 1 8.254 0.002 1 A 9 ILE H 1
1 11 ILE HA H 1 3.524 0.002 1 A 9 ILE HA 1
1 11 ILE HB H 1 1.886 0.004 1 A 9 ILE HB 1
1 11 ILE HD11 H 1 1.147 0.001 1 A 9 ILE HD1% 1
1 11 ILE HD12 H 1 1.147 0.001 1 A 9 ILE HD1% 1
1 11 ILE HD13 H 1 1.147 0.001 1 A 9 ILE HD1% 1
1 11 ILE HG12 H 1 1.842 0.007 2 A 9 ILE HG1x 1
1 11 ILE HG13 H 1 0.762 0.014 2 A 9 ILE HG1y 1
1 11 ILE HG21 H 1 0.951 0.017 1 A 9 ILE HG2% 1
1 11 ILE HG22 H 1 0.951 0.017 1 A 9 ILE HG2% 1
1 11 ILE HG23 H 1 0.951 0.017 1 A 9 ILE HG2% 1
1 11 ILE N N 15 118.531 0.014 1 A 9 ILE N 1
1 12 ALA CA C 13 56.42 0.034 1 A 10 ALA CA 1
1 12 ALA CB C 13 19.101 0.068 1 A 10 ALA CB 1
1 12 ALA H H 1 7.996 0.002 1 A 10 ALA H 1
1 12 ALA HA H 1 4.168 0.006 1 A 10 ALA HA 1
1 12 ALA HB1 H 1 1.538 0.005 1 A 10 ALA HB% 1
1 12 ALA HB2 H 1 1.538 0.005 1 A 10 ALA HB% 1
1 12 ALA HB3 H 1 1.538 0.005 1 A 10 ALA HB% 1
1 12 ALA N N 15 120.604 0.038 1 A 10 ALA N 1
1 13 GLU CA C 13 60.455 0.075 1 A 11 GLU CA 1
1 13 GLU CB C 13 30.413 0 1 A 11 GLU CB 1
1 13 GLU CG C 13 37.731 0 1 A 11 GLU CG 1
1 13 GLU H H 1 7.787 0 1 A 11 GLU H 1
1 13 GLU HA H 1 4.171 0.009 1 A 11 GLU HA 1
1 13 GLU HB2 H 1 2.081 0.002 2 A 11 GLU HBx 1
1 13 GLU HB3 H 1 2.081 0.002 2 A 11 GLU HBy 1
1 13 GLU HG2 H 1 2.428 0.011 2 A 11 GLU HGx 1
1 13 GLU HG3 H 1 2.428 0.011 2 A 11 GLU HGy 1
1 13 GLU N N 15 120.085 0.017 1 A 11 GLU N 1
1 14 PHE CA C 13 59.605 0.076 1 A 12 PHE CA 1
1 14 PHE CB C 13 38.152 0.045 1 A 12 PHE CB 1
1 14 PHE CD2 C 13 131.01 0 1 A 12 PHE CD2 1
1 14 PHE CE2 C 13 131.291 0 1 A 12 PHE CE2 1
1 14 PHE H H 1 8.607 0.003 1 A 12 PHE H 1
1 14 PHE HA H 1 4.956 0.012 1 A 12 PHE HA 1
1 14 PHE HB2 H 1 3.68 0.005 2 A 12 PHE HBx 1
1 14 PHE HB3 H 1 3.538 0.011 2 A 12 PHE HBy 1
1 14 PHE HD1 H 1 7.196 0 1 A 12 PHE HD% 1
1 14 PHE HD2 H 1 7.196 0 1 A 12 PHE HD% 1
1 14 PHE HE1 H 1 7.361 0 1 A 12 PHE HE% 1
1 14 PHE HE2 H 1 7.361 0 1 A 12 PHE HE% 1
1 14 PHE N N 15 120.085 0.023 1 A 12 PHE N 1
1 15 LYS CA C 13 60.802 0.047 1 A 13 LYS CA 1
1 15 LYS CB C 13 33.113 0.073 1 A 13 LYS CB 1
1 15 LYS CD C 13 29.733 0.069 1 A 13 LYS CD 1
1 15 LYS CE C 13 43.078 0.053 1 A 13 LYS CE 1
1 15 LYS CG C 13 25.889 0.036 1 A 13 LYS CG 1
1 15 LYS H H 1 9.287 0.002 1 A 13 LYS H 1
1 15 LYS HA H 1 3.786 0.012 1 A 13 LYS HA 1
1 15 LYS HB2 H 1 1.819 0.008 1 A 13 LYS HB2 1
1 15 LYS HB3 H 1 1.952 0.011 1 A 13 LYS HB3 1
1 15 LYS HD2 H 1 1.325 0.012 2 A 13 LYS HDx 1
1 15 LYS HD3 H 1 1.233 0.014 2 A 13 LYS HDy 1
1 15 LYS HE2 H 1 2.688 0.009 2 A 13 LYS HEx 1
1 15 LYS HE3 H 1 2.688 0.009 2 A 13 LYS HEy 1
1 15 LYS HG2 H 1 1.143 0.008 2 A 13 LYS HGx 1
1 15 LYS HG3 H 1 0.826 0.01 2 A 13 LYS HGy 1
1 15 LYS N N 15 121.912 0.026 1 A 13 LYS N 1
1 16 GLU CB C 13 30.415 0.036 1 A 14 GLU CB 1
1 16 GLU CG C 13 36.945 0.025 1 A 14 GLU CG 1
1 16 GLU H H 1 8.181 0.001 1 A 14 GLU H 1
1 16 GLU HA H 1 4.077 0 1 A 14 GLU HA 1
1 16 GLU HB2 H 1 2.219 0.006 2 A 14 GLU HBx 1
1 16 GLU HB3 H 1 2.22 0.007 2 A 14 GLU HBy 1
1 16 GLU HG2 H 1 2.379 0.006 2 A 14 GLU HGx 1
1 16 GLU HG3 H 1 2.379 0.006 2 A 14 GLU HGy 1
1 16 GLU N N 15 120.85 0.017 1 A 14 GLU N 1
1 17 ALA CA C 13 56.355 0 1 A 15 ALA CA 1
1 17 ALA CB C 13 20.167 0.019 1 A 15 ALA CB 1
1 17 ALA H H 1 7.753 0.003 1 A 15 ALA H 1
1 17 ALA HA H 1 4.351 0.014 1 A 15 ALA HA 1
1 17 ALA HB1 H 1 1.755 0.007 1 A 15 ALA HB% 1
1 17 ALA HB2 H 1 1.755 0.007 1 A 15 ALA HB% 1
1 17 ALA HB3 H 1 1.755 0.007 1 A 15 ALA HB% 1
1 17 ALA N N 15 121.107 0.021 1 A 15 ALA N 1
1 18 PHE CA C 13 63.338 0.032 1 A 16 PHE CA 1
1 18 PHE CB C 13 41.724 0.021 1 A 16 PHE CB 1
1 18 PHE CE2 C 13 131.409 0.093 1 A 16 PHE CE2 1
1 18 PHE CZ C 13 131.49 0.006 1 A 16 PHE CZ 1
1 18 PHE H H 1 8.52 0 1 A 16 PHE H 1
1 18 PHE HA H 1 3.704 0.006 1 A 16 PHE HA 1
1 18 PHE HB2 H 1 3.255 0.008 2 A 16 PHE HBx 1
1 18 PHE HB3 H 1 2.961 0.008 2 A 16 PHE HBy 1
1 18 PHE HE1 H 1 6.955 0.004 1 A 16 PHE HE% 1
1 18 PHE HE2 H 1 6.955 0.004 1 A 16 PHE HE% 1
1 18 PHE HZ H 1 7.018 0.005 1 A 16 PHE HZ 1
1 18 PHE N N 15 117.635 0 1 A 16 PHE N 1
1 19 SER CA C 13 62.921 0.035 1 A 17 SER CA 1
1 19 SER CB C 13 64.244 0.02 1 A 17 SER CB 1
1 19 SER H H 1 8.503 0.002 1 A 17 SER H 1
1 19 SER HA H 1 4.227 0.001 1 A 17 SER HA 1
1 19 SER HB2 H 1 4.042 0.007 2 A 17 SER HBx 1
1 19 SER HB3 H 1 4.042 0.007 2 A 17 SER HBy 1
1 19 SER N N 15 111.414 0.017 1 A 17 SER N 1
1 20 LEU CA C 13 58.311 0.04 1 A 18 LEU CA 1
1 20 LEU CB C 13 42.81 0.02 1 A 18 LEU CB 1
1 20 LEU CD1 C 13 25.309 0.014 1 A 18 LEU CD1 1
1 20 LEU CG C 13 27.715 0.066 1 A 18 LEU CG 1
1 20 LEU H H 1 7.631 0.002 1 A 18 LEU H 1
1 20 LEU HA H 1 3.941 0.001 1 A 18 LEU HA 1
1 20 LEU HB2 H 1 1.743 0.009 2 A 18 LEU HBx 1
1 20 LEU HB3 H 1 1.384 0 2 A 18 LEU HBy 1
1 20 LEU HD11 H 1 0.837 0.008 2 A 18 LEU HDx% 1
1 20 LEU HD12 H 1 0.837 0.008 2 A 18 LEU HDx% 1
1 20 LEU HD13 H 1 0.837 0.008 2 A 18 LEU HDx% 1
1 20 LEU HD21 H 1 0.837 0.008 2 A 18 LEU HDx% 1
1 20 LEU HD22 H 1 0.837 0.008 2 A 18 LEU HDx% 1
1 20 LEU HD23 H 1 0.837 0.008 2 A 18 LEU HDx% 1
1 20 LEU HD23 H 1 0.736 0 2 A 18 LEU HDy% 1
1 20 LEU HD22 H 1 0.736 0 2 A 18 LEU HDy% 1
1 20 LEU HD21 H 1 0.736 0 2 A 18 LEU HDy% 1
1 20 LEU HD13 H 1 0.736 0 2 A 18 LEU HDy% 1
1 20 LEU HD12 H 1 0.736 0 2 A 18 LEU HDy% 1
1 20 LEU HD11 H 1 0.736 0 2 A 18 LEU HDy% 1
1 20 LEU HG H 1 1.425 0.005 1 A 18 LEU HG 1
1 20 LEU N N 15 121.906 0.015 1 A 18 LEU N 1
1 21 PHE CA C 13 60.49 0.038 1 A 19 PHE CA 1
1 21 PHE CB C 13 40.375 0.019 1 A 19 PHE CB 1
1 21 PHE CD2 C 13 132.38 0.065 1 A 19 PHE CD2 1
1 21 PHE CE2 C 13 131.507 0.092 1 A 19 PHE CE2 1
1 21 PHE CZ C 13 131.443 0.02 1 A 19 PHE CZ 1
1 21 PHE H H 1 7.253 0.004 1 A 19 PHE H 1
1 21 PHE HA H 1 4.316 0.001 1 A 19 PHE HA 1
1 21 PHE HB2 H 1 2.436 0.004 1 A 19 PHE HB2 1
1 21 PHE HB3 H 1 3.059 0.006 1 A 19 PHE HB3 1
1 21 PHE HD1 H 1 7.542 0.001 1 A 19 PHE HD% 1
1 21 PHE HD2 H 1 7.542 0.001 1 A 19 PHE HD% 1
1 21 PHE HE1 H 1 7.442 0.003 1 A 19 PHE HE% 1
1 21 PHE HE2 H 1 7.442 0.003 1 A 19 PHE HE% 1
1 21 PHE HZ H 1 7.076 0.003 1 A 19 PHE HZ 1
1 21 PHE N N 15 114.197 0.026 1 A 19 PHE N 1
1 22 ASP CA C 13 53.381 0.065 1 A 20 ASP CA 1
1 22 ASP CB C 13 40.545 0.03 1 A 20 ASP CB 1
1 22 ASP H H 1 7.664 0.004 1 A 20 ASP H 1
1 22 ASP HA H 1 5.157 0.003 1 A 20 ASP HA 1
1 22 ASP HB2 H 1 2.77 0.006 2 A 20 ASP HBx 1
1 22 ASP HB3 H 1 2.036 0.012 2 A 20 ASP HBy 1
1 22 ASP N N 15 122.161 0.036 1 A 20 ASP N 1
1 23 LYS CA C 13 59.864 0.011 1 A 21 LYS CA 1
1 23 LYS CB C 13 33.208 0.049 1 A 21 LYS CB 1
1 23 LYS CD C 13 29.775 0.024 1 A 21 LYS CD 1
1 23 LYS CG C 13 26.223 0.017 1 A 21 LYS CG 1
1 23 LYS H H 1 7.923 0 1 A 21 LYS H 1
1 23 LYS HA H 1 4.011 0.007 1 A 21 LYS HA 1
1 23 LYS HB2 H 1 1.887 0 2 A 21 LYS HBx 1
1 23 LYS HB3 H 1 1.885 0.006 2 A 21 LYS HBy 1
1 23 LYS HD2 H 1 1.705 0.016 2 A 21 LYS HDx 1
1 23 LYS HD3 H 1 1.671 0.013 2 A 21 LYS HDy 1
1 23 LYS HG2 H 1 1.569 0.005 2 A 21 LYS HGx 1
1 23 LYS HG3 H 1 1.515 0.011 2 A 21 LYS HGy 1
1 23 LYS N N 15 122.612 0 1 A 21 LYS N 1
1 24 ASP CA C 13 54.344 0 1 A 22 ASP CA 1
1 24 ASP CB C 13 40.542 0.049 1 A 22 ASP CB 1
1 24 ASP H H 1 8.603 0.004 1 A 22 ASP H 1
1 24 ASP HA H 1 4.544 0.01 1 A 22 ASP HA 1
1 24 ASP HB2 H 1 2.872 0.005 2 A 22 ASP HBx 1
1 24 ASP HB3 H 1 2.644 0.025 2 A 22 ASP HBy 1
1 24 ASP N N 15 113.661 0.04 1 A 22 ASP N 1
1 25 GLY CA C 13 48.345 0.045 1 A 23 GLY CA 1
1 25 GLY H H 1 7.548 0.006 1 A 23 GLY H 1
1 25 GLY HA2 H 1 3.873 0.01 2 A 23 GLY HAx 1
1 25 GLY HA3 H 1 3.965 0.01 2 A 23 GLY HAy 1
1 25 GLY N N 15 108.968 0.081 1 A 23 GLY N 1
1 26 ASP CB C 13 41.809 0.069 1 A 24 ASP CB 1
1 26 ASP H H 1 8.426 0.002 1 A 24 ASP H 1
1 26 ASP HB2 H 1 3.044 0.008 2 A 24 ASP HBx 1
1 26 ASP HB3 H 1 2.634 0.008 2 A 24 ASP HBy 1
1 26 ASP N N 15 119.86 0.015 1 A 24 ASP N 1
1 27 GLY CA C 13 46.506 0.035 1 A 25 GLY CA 1
1 27 GLY H H 1 10.374 0.001 1 A 25 GLY H 1
1 27 GLY HA2 H 1 4.437 0.01 2 A 25 GLY HAx 1
1 27 GLY HA3 H 1 3.785 0.008 2 A 25 GLY HAy 1
1 27 GLY N N 15 112.759 0.018 1 A 25 GLY N 1
1 28 THR CA C 13 60.946 0.049 1 A 26 THR CA 1
1 28 THR CB C 13 74.124 0.032 1 A 26 THR CB 1
1 28 THR CG2 C 13 22.449 0 1 A 26 THR CG2 1
1 28 THR H H 1 8.103 0.004 1 A 26 THR H 1
1 28 THR HA H 1 5.683 0.015 1 A 26 THR HA 1
1 28 THR HB H 1 4.11 0.002 1 A 26 THR HB 1
1 28 THR HG21 H 1 1.092 0.011 1 A 26 THR HG2% 1
1 28 THR HG22 H 1 1.092 0.011 1 A 26 THR HG2% 1
1 28 THR HG23 H 1 1.092 0.011 1 A 26 THR HG2% 1
1 28 THR N N 15 110.009 0.034 1 A 26 THR N 1
1 29 ILE CA C 13 60.821 0.036 1 A 27 ILE CA 1
1 29 ILE CB C 13 42.093 0.027 1 A 27 ILE CB 1
1 29 ILE CD1 C 13 14.905 0.043 1 A 27 ILE CD1 1
1 29 ILE CG1 C 13 25.574 0.03 1 A 27 ILE CG1 1
1 29 ILE CG2 C 13 16.763 0.019 1 A 27 ILE CG2 1
1 29 ILE H H 1 8.846 0.003 1 A 27 ILE H 1
1 29 ILE HA H 1 4.886 0.016 1 A 27 ILE HA 1
1 29 ILE HB H 1 1.821 0.007 1 A 27 ILE HB 1
1 29 ILE HD11 H 1 0.335 0.009 1 A 27 ILE HD1% 1
1 29 ILE HD12 H 1 0.335 0.009 1 A 27 ILE HD1% 1
1 29 ILE HD13 H 1 0.335 0.009 1 A 27 ILE HD1% 1
1 29 ILE HG12 H 1 1.152 0.012 2 A 27 ILE HG1x 1
1 29 ILE HG13 H 1 0.816 0.01 2 A 27 ILE HG1y 1
1 29 ILE HG21 H 1 -0.008 0.006 1 A 27 ILE HG2% 1
1 29 ILE HG22 H 1 -0.008 0.006 1 A 27 ILE HG2% 1
1 29 ILE HG23 H 1 -0.008 0.006 1 A 27 ILE HG2% 1
1 29 ILE N N 15 117.069 0.035 1 A 27 ILE N 1
1 30 THR CA C 13 61.337 0.04 1 A 28 THR CA 1
1 30 THR CG2 C 13 23.111 0.011 1 A 28 THR CG2 1
1 30 THR H H 1 8.64 0.002 1 A 28 THR H 1
1 30 THR HA H 1 5.17 0.006 1 A 28 THR HA 1
1 30 THR HB H 1 4.709 0 1 A 28 THR HB 1
1 30 THR HG21 H 1 1.311 0.009 1 A 28 THR HG2% 1
1 30 THR HG22 H 1 1.311 0.009 1 A 28 THR HG2% 1
1 30 THR HG23 H 1 1.311 0.009 1 A 28 THR HG2% 1
1 30 THR N N 15 111.19 0.01 1 A 28 THR N 1
1 31 THR CA C 13 66.244 0.097 1 A 29 THR CA 1
1 31 THR CB C 13 68.349 0.008 1 A 29 THR CB 1
1 31 THR CG2 C 13 24.638 0.019 1 A 29 THR CG2 1
1 31 THR H H 1 8.368 0.003 1 A 29 THR H 1
1 31 THR HA H 1 3.796 0.003 1 A 29 THR HA 1
1 31 THR HB H 1 4.302 0 1 A 29 THR HB 1
1 31 THR HG21 H 1 1.166 0.01 1 A 29 THR HG2% 1
1 31 THR HG22 H 1 1.166 0.01 1 A 29 THR HG2% 1
1 31 THR HG23 H 1 1.166 0.01 1 A 29 THR HG2% 1
1 31 THR N N 15 111.683 0.036 1 A 29 THR N 1
1 32 LYS CA C 13 59.181 0 1 A 30 LYS CA 1
1 32 LYS CB C 13 33.381 0.05 1 A 30 LYS CB 1
1 32 LYS CD C 13 30.198 0 1 A 30 LYS CD 1
1 32 LYS CE C 13 43.377 0 1 A 30 LYS CE 1
1 32 LYS CG C 13 25.754 0.013 1 A 30 LYS CG 1
1 32 LYS H H 1 7.512 0 1 A 30 LYS H 1
1 32 LYS HA H 1 4.21 0.002 1 A 30 LYS HA 1
1 32 LYS HB2 H 1 1.835 0.01 2 A 30 LYS HBx 1
1 32 LYS HB3 H 1 1.835 0.01 2 A 30 LYS HBy 1
1 32 LYS HD2 H 1 1.677 0.002 2 A 30 LYS HDx 1
1 32 LYS HD3 H 1 1.677 0.002 2 A 30 LYS HDy 1
1 32 LYS HE2 H 1 3.04 0.004 2 A 30 LYS HEx 1
1 32 LYS HE3 H 1 2.993 0.015 2 A 30 LYS HEy 1
1 32 LYS HG2 H 1 1.53 0.008 2 A 30 LYS HGx 1
1 32 LYS HG3 H 1 1.53 0.008 2 A 30 LYS HGy 1
1 32 LYS N N 15 119.161 0 1 A 30 LYS N 1
1 33 GLN CA C 13 57.56 0.021 1 A 31 GLN CA 1
1 33 GLN CB C 13 31.431 0.059 1 A 31 GLN CB 1
1 33 GLN CG C 13 34.242 0.01 1 A 31 GLN CG 1
1 33 GLN H H 1 7.621 0.005 1 A 31 GLN H 1
1 33 GLN HA H 1 4.335 0.002 1 A 31 GLN HA 1
1 33 GLN HB2 H 1 1.856 0.011 2 A 31 GLN HBx 1
1 33 GLN HB3 H 1 2.283 0.011 2 A 31 GLN HBy 1
1 33 GLN HE21 H 1 7.482 0 2 A 31 GLN HE2x 1
1 33 GLN HE22 H 1 6.659 0 2 A 31 GLN HE2y 1
1 33 GLN HG2 H 1 2.246 0.004 2 A 31 GLN HGx 1
1 33 GLN HG3 H 1 2.129 0.006 2 A 31 GLN HGy 1
1 33 GLN N N 15 117.01 0.011 1 A 31 GLN N 1
1 33 GLN NE2 N 15 111.378 0.01 1 A 31 GLN NE2 1
1 34 LEU CA C 13 59.72 0.008 1 A 32 LEU CA 1
1 34 LEU CB C 13 42.934 0.023 1 A 32 LEU CB 1
1 34 LEU CD1 C 13 24.632 0.017 1 A 32 LEU CD1 1
1 34 LEU CD2 C 13 27.127 0.04 1 A 32 LEU CD2 1
1 34 LEU CG C 13 28.078 0.043 1 A 32 LEU CG 1
1 34 LEU H H 1 7.39 0.003 1 A 32 LEU H 1
1 34 LEU HA H 1 3.767 0.009 1 A 32 LEU HA 1
1 34 LEU HB2 H 1 1.399 0.001 2 A 32 LEU HBx 1
1 34 LEU HB3 H 1 1.399 0 2 A 32 LEU HBy 1
1 34 LEU HD11 H 1 1.031 0.002 2 A 32 LEU HDx% 1
1 34 LEU HD12 H 1 1.031 0.002 2 A 32 LEU HDx% 1
1 34 LEU HD13 H 1 1.031 0.002 2 A 32 LEU HDx% 1
1 34 LEU HD21 H 1 1.031 0.002 2 A 32 LEU HDx% 1
1 34 LEU HD22 H 1 1.031 0.002 2 A 32 LEU HDx% 1
1 34 LEU HD23 H 1 1.031 0.002 2 A 32 LEU HDx% 1
1 34 LEU HD23 H 1 0.911 0.001 2 A 32 LEU HDy% 1
1 34 LEU HD22 H 1 0.911 0.001 2 A 32 LEU HDy% 1
1 34 LEU HD21 H 1 0.911 0.001 2 A 32 LEU HDy% 1
1 34 LEU HD13 H 1 0.911 0.001 2 A 32 LEU HDy% 1
1 34 LEU HD12 H 1 0.911 0.001 2 A 32 LEU HDy% 1
1 34 LEU HD11 H 1 0.911 0.001 2 A 32 LEU HDy% 1
1 34 LEU HG H 1 1.573 0.009 1 A 32 LEU HG 1
1 34 LEU N N 15 120.128 0.016 1 A 32 LEU N 1
1 35 GLY CA C 13 49.256 0.061 1 A 33 GLY CA 1
1 35 GLY H H 1 8.807 0.004 1 A 33 GLY H 1
1 35 GLY HA2 H 1 3.906 0.008 2 A 33 GLY HAx 1
1 35 GLY HA3 H 1 3.514 0.007 2 A 33 GLY HAy 1
1 35 GLY N N 15 105.942 0.031 1 A 33 GLY N 1
1 36 THR CA C 13 67.047 0.065 1 A 34 THR CA 1
1 36 THR CB C 13 69.322 0.013 1 A 34 THR CB 1
1 36 THR CG2 C 13 24.323 0.032 1 A 34 THR CG2 1
1 36 THR H H 1 7.566 0.004 1 A 34 THR H 1
1 36 THR HA H 1 3.825 0.01 1 A 34 THR HA 1
1 36 THR HB H 1 3.96 0.009 1 A 34 THR HB 1
1 36 THR HG21 H 1 1.179 0.018 1 A 34 THR HG2% 1
1 36 THR HG22 H 1 1.179 0.018 1 A 34 THR HG2% 1
1 36 THR HG23 H 1 1.179 0.018 1 A 34 THR HG2% 1
1 36 THR N N 15 117.542 0.023 1 A 34 THR N 1
1 37 VAL CA C 13 67.177 0.041 1 A 35 VAL CA 1
1 37 VAL CB C 13 32.284 0.039 1 A 35 VAL CB 1
1 37 VAL CG1 C 13 23.321 0.034 1 A 35 VAL CG1 1
1 37 VAL CG2 C 13 22.96 0.024 1 A 35 VAL CG2 1
1 37 VAL H H 1 7.828 0.002 1 A 35 VAL H 1
1 37 VAL HA H 1 3.21 0.007 1 A 35 VAL HA 1
1 37 VAL HB H 1 1.835 0.01 1 A 35 VAL HB 1
1 37 VAL HG11 H 1 0.465 0.006 2 A 35 VAL HGx% 1
1 37 VAL HG12 H 1 0.465 0.006 2 A 35 VAL HGx% 1
1 37 VAL HG13 H 1 0.465 0.006 2 A 35 VAL HGx% 1
1 37 VAL HG21 H 1 0.465 0.006 2 A 35 VAL HGx% 1
1 37 VAL HG22 H 1 0.465 0.006 2 A 35 VAL HGx% 1
1 37 VAL HG23 H 1 0.465 0.006 2 A 35 VAL HGx% 1
1 37 VAL HG23 H 1 0.712 0.007 2 A 35 VAL HGy% 1
1 37 VAL HG22 H 1 0.712 0.007 2 A 35 VAL HGy% 1
1 37 VAL HG21 H 1 0.712 0.007 2 A 35 VAL HGy% 1
1 37 VAL HG13 H 1 0.712 0.007 2 A 35 VAL HGy% 1
1 37 VAL HG12 H 1 0.712 0.007 2 A 35 VAL HGy% 1
1 37 VAL HG11 H 1 0.712 0.007 2 A 35 VAL HGy% 1
1 37 VAL N N 15 122.858 0.031 1 A 35 VAL N 1
1 38 MET CA C 13 60.763 0.004 1 A 36 MET CA 1
1 38 MET CB C 13 32.565 0.052 1 A 36 MET CB 1
1 38 MET CE C 13 18.188 0.013 1 A 36 MET CE 1
1 38 MET CG C 13 33.364 0 1 A 36 MET CG 1
1 38 MET H H 1 8.367 0.003 1 A 36 MET H 1
1 38 MET HA H 1 4.08 0.014 1 A 36 MET HA 1
1 38 MET HB2 H 1 1.892 0.014 1 A 36 MET HB2 1
1 38 MET HB3 H 1 2.125 0.01 1 A 36 MET HB3 1
1 38 MET HE1 H 1 2.144 0.007 1 A 36 MET HE% 1
1 38 MET HE2 H 1 2.144 0.007 1 A 36 MET HE% 1
1 38 MET HE3 H 1 2.144 0.007 1 A 36 MET HE% 1
1 38 MET HG2 H 1 2.705 0.008 2 A 36 MET HGx 1
1 38 MET HG3 H 1 2.649 0 2 A 36 MET HGy 1
1 38 MET N N 15 118.217 0.045 1 A 36 MET N 1
1 39 ARG CB C 13 31.14 0 1 A 37 ARG CB 1
1 39 ARG CD C 13 43.11 0 1 A 37 ARG CD 1
1 39 ARG CG C 13 28.934 0 1 A 37 ARG CG 1
1 39 ARG H H 1 8.327 0.002 1 A 37 ARG H 1
1 39 ARG HB2 H 1 1.996 0 2 A 37 ARG HBx 1
1 39 ARG HB3 H 1 1.937 0 2 A 37 ARG HBy 1
1 39 ARG HD2 H 1 3.049 0.003 2 A 37 ARG HDx 1
1 39 ARG HD3 H 1 3.048 0.004 2 A 37 ARG HDy 1
1 39 ARG HG2 H 1 1.681 0.003 2 A 37 ARG HGx 1
1 39 ARG HG3 H 1 1.61 0 2 A 37 ARG HGy 1
1 39 ARG N N 15 119.582 0.022 1 A 37 ARG N 1
1 40 SER CA C 13 62.803 0 1 A 38 SER CA 1
1 40 SER CB C 13 62.795 0 1 A 38 SER CB 1
1 40 SER H H 1 8.069 0.002 1 A 38 SER H 1
1 40 SER HA H 1 4.314 0 1 A 38 SER HA 1
1 40 SER HB2 H 1 4.478 0 2 A 38 SER HBx 1
1 40 SER HB3 H 1 4.478 0 2 A 38 SER HBy 1
1 40 SER N N 15 119.103 0.007 1 A 38 SER N 1
1 41 LEU CB C 13 43.807 0.052 1 A 39 LEU CB 1
1 41 LEU CD1 C 13 24.681 0.007 1 A 39 LEU CD1 1
1 41 LEU CD2 C 13 27.787 0.008 1 A 39 LEU CD2 1
1 41 LEU H H 1 7.369 0.003 1 A 39 LEU H 1
1 41 LEU HA H 1 1.957 0 1 A 39 LEU HA 1
1 41 LEU HB2 H 1 1.972 0 2 A 39 LEU HBx 1
1 41 LEU HB3 H 1 1.972 0.004 2 A 39 LEU HBy 1
1 41 LEU HD11 H 1 1.173 0 2 A 39 LEU HDx% 1
1 41 LEU HD12 H 1 1.173 0 2 A 39 LEU HDx% 1
1 41 LEU HD13 H 1 1.173 0 2 A 39 LEU HDx% 1
1 41 LEU HD21 H 1 1.173 0 2 A 39 LEU HDx% 1
1 41 LEU HD22 H 1 1.173 0 2 A 39 LEU HDx% 1
1 41 LEU HD23 H 1 1.173 0 2 A 39 LEU HDx% 1
1 41 LEU HD23 H 1 1.111 0.005 2 A 39 LEU HDy% 1
1 41 LEU HD22 H 1 1.111 0.005 2 A 39 LEU HDy% 1
1 41 LEU HD21 H 1 1.111 0.005 2 A 39 LEU HDy% 1
1 41 LEU HD13 H 1 1.111 0.005 2 A 39 LEU HDy% 1
1 41 LEU HD12 H 1 1.111 0.005 2 A 39 LEU HDy% 1
1 41 LEU HD11 H 1 1.111 0.005 2 A 39 LEU HDy% 1
1 41 LEU N N 15 120.997 0.013 1 A 39 LEU N 1
1 42 GLY CA C 13 46.783 0.048 1 A 40 GLY CA 1
1 42 GLY H H 1 7.937 0.001 1 A 40 GLY H 1
1 42 GLY HA2 H 1 4.306 0.013 2 A 40 GLY HAx 1
1 42 GLY HA3 H 1 3.862 0.009 2 A 40 GLY HAy 1
1 42 GLY N N 15 107.319 0.02 1 A 40 GLY N 1
1 43 GLN CG C 13 34.988 0.025 1 A 41 GLN CG 1
1 43 GLN H H 1 7.805 0.002 1 A 41 GLN H 1
1 43 GLN HB2 H 1 2.229 0.007 2 A 41 GLN HBx 1
1 43 GLN HB3 H 1 2.238 0 2 A 41 GLN HBy 1
1 43 GLN HG2 H 1 2.463 0.001 2 A 41 GLN HGx 1
1 43 GLN HG3 H 1 2.403 0.002 2 A 41 GLN HGy 1
1 43 GLN N N 15 118.189 0.015 1 A 41 GLN N 1
1 45 PRO CB C 13 32.871 0.019 1 A 43 PRO CB 1
1 45 PRO CD C 13 51.003 0.013 1 A 43 PRO CD 1
1 45 PRO HB2 H 1 2.113 0.011 2 A 43 PRO HBx 1
1 45 PRO HB3 H 1 2.115 0.01 2 A 43 PRO HBy 1
1 45 PRO HD2 H 1 3.687 0.012 2 A 43 PRO HDx 1
1 45 PRO HD3 H 1 3.348 0.009 2 A 43 PRO HDy 1
1 46 THR CA C 13 61.869 0 1 A 44 THR CA 1
1 46 THR CG2 C 13 22.949 0.014 1 A 44 THR CG2 1
1 46 THR H H 1 8.71 0.006 1 A 44 THR H 1
1 46 THR HA H 1 4.457 0.004 1 A 44 THR HA 1
1 46 THR HG21 H 1 1.355 0.005 1 A 44 THR HG2% 1
1 46 THR HG22 H 1 1.355 0.005 1 A 44 THR HG2% 1
1 46 THR HG23 H 1 1.355 0.005 1 A 44 THR HG2% 1
1 46 THR N N 15 113.166 0.011 1 A 44 THR N 1
1 47 GLU CA C 13 61.138 0.02 1 A 45 GLU CA 1
1 47 GLU CB C 13 30.172 0.022 1 A 45 GLU CB 1
1 47 GLU CG C 13 37.782 0.003 1 A 45 GLU CG 1
1 47 GLU H H 1 8.859 0.004 1 A 45 GLU H 1
1 47 GLU HA H 1 4.021 0.012 1 A 45 GLU HA 1
1 47 GLU HB2 H 1 2.076 0.008 2 A 45 GLU HBx 1
1 47 GLU HB3 H 1 2.076 0.008 2 A 45 GLU HBy 1
1 47 GLU HG2 H 1 2.374 0.009 2 A 45 GLU HGx 1
1 47 GLU HG3 H 1 2.378 0.007 2 A 45 GLU HGy 1
1 47 GLU N N 15 120.793 0.02 1 A 45 GLU N 1
1 48 ALA CA C 13 56.064 0.037 1 A 46 ALA CA 1
1 48 ALA CB C 13 19.402 0.006 1 A 46 ALA CB 1
1 48 ALA H H 1 8.316 0.002 1 A 46 ALA H 1
1 48 ALA HA H 1 4.132 0.011 1 A 46 ALA HA 1
1 48 ALA HB1 H 1 1.42 0.007 1 A 46 ALA HB% 1
1 48 ALA HB2 H 1 1.42 0.007 1 A 46 ALA HB% 1
1 48 ALA HB3 H 1 1.42 0.007 1 A 46 ALA HB% 1
1 48 ALA N N 15 121.101 0.01 1 A 46 ALA N 1
1 49 GLU CA C 13 59.895 0.024 1 A 47 GLU CA 1
1 49 GLU CB C 13 31.204 0.046 1 A 47 GLU CB 1
1 49 GLU CG C 13 37.377 0.033 1 A 47 GLU CG 1
1 49 GLU H H 1 7.72 0.002 1 A 47 GLU H 1
1 49 GLU HA H 1 4.066 0.008 1 A 47 GLU HA 1
1 49 GLU HB2 H 1 2.292 0.007 2 A 47 GLU HBx 1
1 49 GLU HB3 H 1 1.931 0.012 2 A 47 GLU HBy 1
1 49 GLU HG2 H 1 2.532 0.006 2 A 47 GLU HGx 1
1 49 GLU HG3 H 1 2.532 0.006 2 A 47 GLU HGy 1
1 49 GLU N N 15 119.211 0.028 1 A 47 GLU N 1
1 50 LEU CA C 13 59.039 0.025 1 A 48 LEU CA 1
1 50 LEU CB C 13 42.905 0.024 1 A 48 LEU CB 1
1 50 LEU CD1 C 13 25.693 0.017 1 A 48 LEU CD1 1
1 50 LEU CD2 C 13 25.668 0.012 1 A 48 LEU CD2 1
1 50 LEU CG C 13 28.228 0.013 1 A 48 LEU CG 1
1 50 LEU H H 1 8.489 0.002 1 A 48 LEU H 1
1 50 LEU HA H 1 4.075 0.012 1 A 48 LEU HA 1
1 50 LEU HB2 H 1 1.704 0.005 2 A 48 LEU HBx 1
1 50 LEU HB3 H 1 1.67 0.003 2 A 48 LEU HBy 1
1 50 LEU HD11 H 1 0.865 0.003 2 A 48 LEU HDx% 1
1 50 LEU HD12 H 1 0.865 0.003 2 A 48 LEU HDx% 1
1 50 LEU HD13 H 1 0.865 0.003 2 A 48 LEU HDx% 1
1 50 LEU HD21 H 1 0.865 0.003 2 A 48 LEU HDx% 1
1 50 LEU HD22 H 1 0.865 0.003 2 A 48 LEU HDx% 1
1 50 LEU HD23 H 1 0.865 0.003 2 A 48 LEU HDx% 1
1 50 LEU HD23 H 1 0.854 0.002 2 A 48 LEU HDy% 1
1 50 LEU HD22 H 1 0.854 0.002 2 A 48 LEU HDy% 1
1 50 LEU HD21 H 1 0.854 0.002 2 A 48 LEU HDy% 1
1 50 LEU HD13 H 1 0.854 0.002 2 A 48 LEU HDy% 1
1 50 LEU HD12 H 1 0.854 0.002 2 A 48 LEU HDy% 1
1 50 LEU HD11 H 1 0.854 0.002 2 A 48 LEU HDy% 1
1 50 LEU HG H 1 1.638 0.009 1 A 48 LEU HG 1
1 50 LEU N N 15 120.521 0.019 1 A 48 LEU N 1
1 51 GLN CA C 13 59.801 0.038 1 A 49 GLN CA 1
1 51 GLN CB C 13 29.185 0.013 1 A 49 GLN CB 1
1 51 GLN CG C 13 35.129 0 1 A 49 GLN CG 1
1 51 GLN H H 1 8.085 0.001 1 A 49 GLN H 1
1 51 GLN HA H 1 3.928 0.006 1 A 49 GLN HA 1
1 51 GLN HB2 H 1 2.187 0.003 2 A 49 GLN HBx 1
1 51 GLN HB3 H 1 2.186 0.004 2 A 49 GLN HBy 1
1 51 GLN HE21 H 1 7.464 0 2 A 49 GLN HE2x 1
1 51 GLN HE22 H 1 6.837 0 2 A 49 GLN HE2y 1
1 51 GLN HG2 H 1 2.459 0.011 2 A 49 GLN HGx 1
1 51 GLN HG3 H 1 2.465 0.006 2 A 49 GLN HGy 1
1 51 GLN N N 15 117.865 0.01 1 A 49 GLN N 1
1 51 GLN NE2 N 15 113.214 0.002 1 A 49 GLN NE2 1
1 52 ASP CA C 13 58.514 0.06 1 A 50 ASP CA 1
1 52 ASP CB C 13 41.551 0.021 1 A 50 ASP CB 1
1 52 ASP H H 1 7.78 0.003 1 A 50 ASP H 1
1 52 ASP HA H 1 4.465 0.003 1 A 50 ASP HA 1
1 52 ASP HB2 H 1 2.846 0.005 2 A 50 ASP HBx 1
1 52 ASP HB3 H 1 2.7 0.008 2 A 50 ASP HBy 1
1 52 ASP N N 15 119.243 0.008 1 A 50 ASP N 1
1 53 MET CA C 13 60.828 0 1 A 51 MET CA 1
1 53 MET CB C 13 35.121 0.026 1 A 51 MET CB 1
1 53 MET CE C 13 19.336 0.013 1 A 51 MET CE 1
1 53 MET CG C 13 34.034 0.034 1 A 51 MET CG 1
1 53 MET H H 1 8.104 0.002 1 A 51 MET H 1
1 53 MET HA H 1 4.095 0.015 1 A 51 MET HA 1
1 53 MET HB2 H 1 2.059 0.017 2 A 51 MET HBx 1
1 53 MET HB3 H 1 2.34 0.01 2 A 51 MET HBy 1
1 53 MET HE1 H 1 1.954 0.001 1 A 51 MET HE% 1
1 53 MET HE2 H 1 1.954 0.001 1 A 51 MET HE% 1
1 53 MET HE3 H 1 1.954 0.001 1 A 51 MET HE% 1
1 53 MET HG2 H 1 2.845 0.008 2 A 51 MET HGx 1
1 53 MET HG3 H 1 2.573 0.009 2 A 51 MET HGy 1
1 53 MET N N 15 119.364 0.031 1 A 51 MET N 1
1 54 ILE CA C 13 67.044 0.017 1 A 52 ILE CA 1
1 54 ILE CB C 13 39.062 0.007 1 A 52 ILE CB 1
1 54 ILE CD1 C 13 14.793 0.052 1 A 52 ILE CD1 1
1 54 ILE CG1 C 13 31.779 0.007 1 A 52 ILE CG1 1
1 54 ILE CG2 C 13 14.871 0.038 1 A 52 ILE CG2 1
1 54 ILE H H 1 8.552 0.002 1 A 52 ILE H 1
1 54 ILE HA H 1 3.44 0.005 1 A 52 ILE HA 1
1 54 ILE HB H 1 1.903 0.013 1 A 52 ILE HB 1
1 54 ILE HD11 H 1 0.808 0.014 1 A 52 ILE HD1% 1
1 54 ILE HD12 H 1 0.808 0.014 1 A 52 ILE HD1% 1
1 54 ILE HD13 H 1 0.808 0.014 1 A 52 ILE HD1% 1
1 54 ILE HG12 H 1 1.624 0 2 A 52 ILE HG1x 1
1 54 ILE HG13 H 1 1.906 0.013 2 A 52 ILE HG1y 1
1 54 ILE HG21 H 1 0.857 0.004 1 A 52 ILE HG2% 1
1 54 ILE HG22 H 1 0.857 0.004 1 A 52 ILE HG2% 1
1 54 ILE HG23 H 1 0.857 0.004 1 A 52 ILE HG2% 1
1 54 ILE N N 15 120.372 0.021 1 A 52 ILE N 1
1 55 ASN CA C 13 56.364 0.019 1 A 53 ASN CA 1
1 55 ASN CB C 13 39.131 0.036 1 A 53 ASN CB 1
1 55 ASN H H 1 8.174 0.004 1 A 53 ASN H 1
1 55 ASN HA H 1 4.386 0.005 1 A 53 ASN HA 1
1 55 ASN HB2 H 1 2.846 0.008 2 A 53 ASN HBx 1
1 55 ASN HB3 H 1 2.968 0.011 2 A 53 ASN HBy 1
1 55 ASN HD21 H 1 7.744 0.003 2 A 53 ASN HD2x 1
1 55 ASN HD22 H 1 6.887 0 2 A 53 ASN HD2y 1
1 55 ASN N N 15 117.239 0.016 1 A 53 ASN N 1
1 55 ASN ND2 N 15 111.74 0.007 1 A 53 ASN ND2 1
1 56 GLU CA C 13 59.437 0.065 1 A 54 GLU CA 1
1 56 GLU CB C 13 31.54 0.018 1 A 54 GLU CB 1
1 56 GLU CG C 13 37.407 0 1 A 54 GLU CG 1
1 56 GLU H H 1 7.508 0.004 1 A 54 GLU H 1
1 56 GLU HA H 1 4.225 0.006 1 A 54 GLU HA 1
1 56 GLU HB2 H 1 2.135 0.005 2 A 54 GLU HBx 1
1 56 GLU HB3 H 1 2.137 0.009 2 A 54 GLU HBy 1
1 56 GLU HG2 H 1 2.359 0.004 2 A 54 GLU HGx 1
1 56 GLU HG3 H 1 2.359 0.004 2 A 54 GLU HGy 1
1 56 GLU N N 15 117.208 0.045 1 A 54 GLU N 1
1 57 VAL CA C 13 64.141 0.01 1 A 55 VAL CA 1
1 57 VAL CB C 13 33.754 0.071 1 A 55 VAL CB 1
1 57 VAL CG1 C 13 22.516 0.004 1 A 55 VAL CG1 1
1 57 VAL CG2 C 13 23.365 0.031 1 A 55 VAL CG2 1
1 57 VAL H H 1 8.289 0.008 1 A 55 VAL H 1
1 57 VAL HA H 1 4.293 0.011 1 A 55 VAL HA 1
1 57 VAL HB H 1 2.243 0.006 1 A 55 VAL HB 1
1 57 VAL HG11 H 1 1.051 0.003 2 A 55 VAL HGx% 1
1 57 VAL HG12 H 1 1.051 0.003 2 A 55 VAL HGx% 1
1 57 VAL HG13 H 1 1.051 0.003 2 A 55 VAL HGx% 1
1 57 VAL HG21 H 1 1.051 0.003 2 A 55 VAL HGx% 1
1 57 VAL HG22 H 1 1.051 0.003 2 A 55 VAL HGx% 1
1 57 VAL HG23 H 1 1.051 0.003 2 A 55 VAL HGx% 1
1 57 VAL HG23 H 1 1.089 0.007 2 A 55 VAL HGy% 1
1 57 VAL HG22 H 1 1.089 0.007 2 A 55 VAL HGy% 1
1 57 VAL HG21 H 1 1.089 0.007 2 A 55 VAL HGy% 1
1 57 VAL HG13 H 1 1.089 0.007 2 A 55 VAL HGy% 1
1 57 VAL HG12 H 1 1.089 0.007 2 A 55 VAL HGy% 1
1 57 VAL HG11 H 1 1.089 0.007 2 A 55 VAL HGy% 1
1 57 VAL N N 15 115.416 0.036 1 A 55 VAL N 1
1 58 ASP CA C 13 54.251 0.052 1 A 56 ASP CA 1
1 58 ASP CB C 13 42.581 0.036 1 A 56 ASP CB 1
1 58 ASP H H 1 8.557 0.002 1 A 56 ASP H 1
1 58 ASP HA H 1 5.296 0.014 1 A 56 ASP HA 1
1 58 ASP HB2 H 1 2.874 0.01 2 A 56 ASP HBx 1
1 58 ASP HB3 H 1 2.042 0.008 2 A 56 ASP HBy 1
1 58 ASP N N 15 122.959 0.022 1 A 56 ASP N 1
1 59 ALA CA C 13 55.973 0 1 A 57 ALA CA 1
1 59 ALA CB C 13 19.518 0.048 1 A 57 ALA CB 1
1 59 ALA H H 1 7.533 0.008 1 A 57 ALA H 1
1 59 ALA HA H 1 4.177 0.007 1 A 57 ALA HA 1
1 59 ALA HB1 H 1 1.528 0.002 1 A 57 ALA HB% 1
1 59 ALA HB2 H 1 1.528 0.002 1 A 57 ALA HB% 1
1 59 ALA HB3 H 1 1.528 0.002 1 A 57 ALA HB% 1
1 59 ALA N N 15 124.854 0.016 1 A 57 ALA N 1
1 60 ASP CB C 13 41.203 0 1 A 58 ASP CB 1
1 60 ASP H H 1 8.335 0.003 1 A 58 ASP H 1
1 60 ASP HA H 1 4.444 0.001 1 A 58 ASP HA 1
1 60 ASP HB2 H 1 2.819 0.002 2 A 58 ASP HBx 1
1 60 ASP HB3 H 1 2.69 0.005 2 A 58 ASP HBy 1
1 60 ASP N N 15 112.874 0.032 1 A 58 ASP N 1
1 61 GLY CA C 13 47.683 0.024 1 A 59 GLY CA 1
1 61 GLY H H 1 7.736 0.008 1 A 59 GLY H 1
1 61 GLY HA2 H 1 3.99 0.011 2 A 59 GLY HAx 1
1 61 GLY HA3 H 1 3.888 0.006 2 A 59 GLY HAy 1
1 61 GLY N N 15 107.587 0.023 1 A 59 GLY N 1
1 62 ASN CB C 13 39.254 0.003 1 A 60 ASN CB 1
1 62 ASN H H 1 8.26 0.003 1 A 60 ASN H 1
1 62 ASN HB2 H 1 3.309 0.009 2 A 60 ASN HBx 1
1 62 ASN HB3 H 1 2.919 0 2 A 60 ASN HBy 1
1 62 ASN N N 15 118.224 0.019 1 A 60 ASN N 1
1 63 GLY CA C 13 47.144 0.048 1 A 61 GLY CA 1
1 63 GLY H H 1 9.978 0.006 1 A 61 GLY H 1
1 63 GLY HA2 H 1 4.223 0.011 2 A 61 GLY HAx 1
1 63 GLY HA3 H 1 3.823 0.009 2 A 61 GLY HAy 1
1 63 GLY N N 15 112.003 0.06 1 A 61 GLY N 1
1 64 THR CA C 13 60.791 0.045 1 A 62 THR CA 1
1 64 THR CB C 13 73.315 0.019 1 A 62 THR CB 1
1 64 THR CG2 C 13 22.784 0.064 1 A 62 THR CG2 1
1 64 THR H H 1 7.877 0.002 1 A 62 THR H 1
1 64 THR HA H 1 5.25 0.021 1 A 62 THR HA 1
1 64 THR HB H 1 4.111 0.008 1 A 62 THR HB 1
1 64 THR HG21 H 1 1.086 0.005 1 A 62 THR HG2% 1
1 64 THR HG22 H 1 1.086 0.005 1 A 62 THR HG2% 1
1 64 THR HG23 H 1 1.086 0.005 1 A 62 THR HG2% 1
1 64 THR N N 15 111.425 0.029 1 A 62 THR N 1
1 65 ILE CB C 13 43.149 0.043 1 A 63 ILE CB 1
1 65 ILE CD1 C 13 16.904 0.033 1 A 63 ILE CD1 1
1 65 ILE CG1 C 13 27.835 0.03 1 A 63 ILE CG1 1
1 65 ILE CG2 C 13 19.07 0.009 1 A 63 ILE CG2 1
1 65 ILE H H 1 9.184 0.003 1 A 63 ILE H 1
1 65 ILE HB H 1 1.874 0.008 1 A 63 ILE HB 1
1 65 ILE HD11 H 1 0.872 0.013 1 A 63 ILE HD1% 1
1 65 ILE HD12 H 1 0.872 0.013 1 A 63 ILE HD1% 1
1 65 ILE HD13 H 1 0.872 0.013 1 A 63 ILE HD1% 1
1 65 ILE HG12 H 1 0.997 0.007 2 A 63 ILE HG1x 1
1 65 ILE HG13 H 1 1.514 0.009 2 A 63 ILE HG1y 1
1 65 ILE HG21 H 1 1.107 0.004 1 A 63 ILE HG2% 1
1 65 ILE HG22 H 1 1.107 0.004 1 A 63 ILE HG2% 1
1 65 ILE HG23 H 1 1.107 0.004 1 A 63 ILE HG2% 1
1 65 ILE N N 15 121.129 0.038 1 A 63 ILE N 1
1 66 ASP CA C 13 53.063 0.033 1 A 64 ASP CA 1
1 66 ASP CB C 13 43.38 0.013 1 A 64 ASP CB 1
1 66 ASP H H 1 8.314 0.007 1 A 64 ASP H 1
1 66 ASP HA H 1 5.577 0.011 1 A 64 ASP HA 1
1 66 ASP HB2 H 1 3.213 0.008 2 A 64 ASP HBx 1
1 66 ASP HB3 H 1 2.71 0.009 2 A 64 ASP HBy 1
1 66 ASP N N 15 124.355 0.02 1 A 64 ASP N 1
1 67 PHE CB C 13 37.356 0.013 1 A 65 PHE CB 1
1 67 PHE H H 1 8.674 0.002 1 A 65 PHE H 1
1 67 PHE HB2 H 1 2.93 0.001 2 A 65 PHE HBx 1
1 67 PHE HB3 H 1 2.93 0.001 2 A 65 PHE HBy 1
1 67 PHE N N 15 118.208 0.013 1 A 65 PHE N 1
1 68 PRO CD C 13 50.305 0.015 1 A 66 PRO CD 1
1 68 PRO CG C 13 29.616 0.027 1 A 66 PRO CG 1
1 68 PRO HD2 H 1 3.855 0.002 2 A 66 PRO HDx 1
1 68 PRO HD3 H 1 3.855 0.002 2 A 66 PRO HDy 1
1 68 PRO HG2 H 1 2.238 0.003 1 A 66 PRO HG2 1
1 68 PRO HG3 H 1 1.935 0.012 1 A 66 PRO HG3 1
1 69 GLN CB C 13 29.659 0.059 1 A 67 GLN CB 1
1 69 GLN CG C 13 35.69 0.119 1 A 67 GLN CG 1
1 69 GLN H H 1 8.206 0.008 1 A 67 GLN H 1
1 69 GLN HA H 1 4.029 0 1 A 67 GLN HA 1
1 69 GLN HB2 H 1 2.632 0.007 2 A 67 GLN HBx 1
1 69 GLN HB3 H 1 1.85 0.007 2 A 67 GLN HBy 1
1 69 GLN HE21 H 1 6.722 0 2 A 67 GLN HE2x 1
1 69 GLN HE22 H 1 7.494 0 2 A 67 GLN HE2y 1
1 69 GLN HG2 H 1 2.967 0.008 2 A 67 GLN HGx 1
1 69 GLN HG3 H 1 2.53 0.009 2 A 67 GLN HGy 1
1 69 GLN N N 15 117.041 0.029 1 A 67 GLN N 1
1 69 GLN NE2 N 15 111.11 0.004 1 A 67 GLN NE2 1
1 70 PHE CA C 13 62.456 0.044 1 A 68 PHE CA 1
1 70 PHE CB C 13 40.644 0.052 1 A 68 PHE CB 1
1 70 PHE CE1 C 13 129.839 0.038 1 A 68 PHE CE1 1
1 70 PHE H H 1 8.427 0.004 1 A 68 PHE H 1
1 70 PHE HA H 1 4.035 0.01 1 A 68 PHE HA 1
1 70 PHE HB2 H 1 3.314 0.007 2 A 68 PHE HBx 1
1 70 PHE HB3 H 1 3.15 0.009 2 A 68 PHE HBy 1
1 70 PHE HD1 H 1 7.05 0 1 A 68 PHE HD% 1
1 70 PHE HD2 H 1 7.05 0 1 A 68 PHE HD% 1
1 70 PHE HE1 H 1 7.44 0.009 1 A 68 PHE HE% 1
1 70 PHE HE2 H 1 7.44 0.009 1 A 68 PHE HE% 1
1 70 PHE N N 15 122.337 0.036 1 A 68 PHE N 1
1 71 LEU CA C 13 58.79 0.024 1 A 69 LEU CA 1
1 71 LEU CB C 13 42.384 0.024 1 A 69 LEU CB 1
1 71 LEU CD1 C 13 25.593 0 1 A 69 LEU CD1 1
1 71 LEU CD2 C 13 26.629 0.034 1 A 69 LEU CD2 1
1 71 LEU CG C 13 26.765 0.047 1 A 69 LEU CG 1
1 71 LEU H H 1 8.576 0.001 1 A 69 LEU H 1
1 71 LEU HA H 1 3.323 0.009 1 A 69 LEU HA 1
1 71 LEU HB2 H 1 1.332 0.011 2 A 69 LEU HBx 1
1 71 LEU HB3 H 1 1.249 0.006 2 A 69 LEU HBy 1
1 71 LEU HD11 H 1 0.8 0.001 2 A 69 LEU HDx% 1
1 71 LEU HD12 H 1 0.8 0.001 2 A 69 LEU HDx% 1
1 71 LEU HD13 H 1 0.8 0.001 2 A 69 LEU HDx% 1
1 71 LEU HD21 H 1 0.8 0.001 2 A 69 LEU HDx% 1
1 71 LEU HD22 H 1 0.8 0.001 2 A 69 LEU HDx% 1
1 71 LEU HD23 H 1 0.8 0.001 2 A 69 LEU HDx% 1
1 71 LEU HD23 H 1 0.753 0.01 2 A 69 LEU HDy% 1
1 71 LEU HD22 H 1 0.753 0.01 2 A 69 LEU HDy% 1
1 71 LEU HD21 H 1 0.753 0.01 2 A 69 LEU HDy% 1
1 71 LEU HD13 H 1 0.753 0.01 2 A 69 LEU HDy% 1
1 71 LEU HD12 H 1 0.753 0.01 2 A 69 LEU HDy% 1
1 71 LEU HD11 H 1 0.753 0.01 2 A 69 LEU HDy% 1
1 71 LEU HG H 1 1.034 0.013 1 A 69 LEU HG 1
1 71 LEU N N 15 119.007 0.019 1 A 69 LEU N 1
1 72 THR CA C 13 67.8 0.068 1 A 70 THR CA 1
1 72 THR CB C 13 69.612 0.051 1 A 70 THR CB 1
1 72 THR H H 1 7.757 0.002 1 A 70 THR H 1
1 72 THR HA H 1 3.751 0.011 1 A 70 THR HA 1
1 72 THR HB H 1 4.284 0 1 A 70 THR HB 1
1 72 THR HG21 H 1 1.235 0.008 1 A 70 THR HG2% 1
1 72 THR HG22 H 1 1.235 0.008 1 A 70 THR HG2% 1
1 72 THR HG23 H 1 1.235 0.008 1 A 70 THR HG2% 1
1 72 THR N N 15 114.827 0.023 1 A 70 THR N 1
1 73 MET CA C 13 59.745 0.002 1 A 71 MET CA 1
1 73 MET CB C 13 33.774 0.011 1 A 71 MET CB 1
1 73 MET CG C 13 33.122 0.006 1 A 71 MET CG 1
1 73 MET H H 1 7.6 0.002 1 A 71 MET H 1
1 73 MET HA H 1 4.002 0.002 1 A 71 MET HA 1
1 73 MET HB2 H 1 2.025 0.005 2 A 71 MET HBx 1
1 73 MET HB3 H 1 2.021 0.01 2 A 71 MET HBy 1
1 73 MET HG2 H 1 2.648 0 2 A 71 MET HGx 1
1 73 MET HG3 H 1 2.586 0.001 2 A 71 MET HGy 1
1 73 MET N N 15 120.977 0.022 1 A 71 MET N 1
1 74 MET CA C 13 56.904 0.06 1 A 72 MET CA 1
1 74 MET CB C 13 31.763 0.085 1 A 72 MET CB 1
1 74 MET CG C 13 33.575 0.039 1 A 72 MET CG 1
1 74 MET H H 1 7.991 0.002 1 A 72 MET H 1
1 74 MET HA H 1 4.061 0.006 1 A 72 MET HA 1
1 74 MET HB2 H 1 1.4 0.009 2 A 72 MET HBx 1
1 74 MET HB3 H 1 1.272 0.01 2 A 72 MET HBy 1
1 74 MET HG2 H 1 2.72 0.001 2 A 72 MET HGx 1
1 74 MET HG3 H 1 2.72 0.001 2 A 72 MET HGy 1
1 74 MET N N 15 117.593 0.014 1 A 72 MET N 1
1 75 ALA CA C 13 55.947 0.023 1 A 73 ALA CA 1
1 75 ALA CB C 13 19.205 0.021 1 A 73 ALA CB 1
1 75 ALA H H 1 8.376 0.002 1 A 73 ALA H 1
1 75 ALA HA H 1 4.021 0.006 1 A 73 ALA HA 1
1 75 ALA HB1 H 1 1.414 0.002 1 A 73 ALA HB% 1
1 75 ALA HB2 H 1 1.414 0.002 1 A 73 ALA HB% 1
1 75 ALA HB3 H 1 1.414 0.002 1 A 73 ALA HB% 1
1 75 ALA N N 15 121.266 0.036 1 A 73 ALA N 1
1 76 ARG CA C 13 59.715 0.003 1 A 74 ARG CA 1
1 76 ARG CB C 13 31.256 0.022 1 A 74 ARG CB 1
1 76 ARG CG C 13 28.778 0.013 1 A 74 ARG CG 1
1 76 ARG H H 1 7.53 0.001 1 A 74 ARG H 1
1 76 ARG HA H 1 4.078 0.013 1 A 74 ARG HA 1
1 76 ARG HB2 H 1 1.967 0.007 2 A 74 ARG HBx 1
1 76 ARG HB3 H 1 1.949 0.015 2 A 74 ARG HBy 1
1 76 ARG HD2 H 1 3.154 0.002 2 A 74 ARG HDx 1
1 76 ARG HD3 H 1 3.154 0.002 2 A 74 ARG HDy 1
1 76 ARG HG2 H 1 1.616 0.003 2 A 74 ARG HGx 1
1 76 ARG HG3 H 1 1.615 0.001 2 A 74 ARG HGy 1
1 76 ARG N N 15 116.668 0.006 1 A 74 ARG N 1
1 77 LYS CA C 13 57.918 0.067 1 A 75 LYS CA 1
1 77 LYS CB C 13 32.865 0.013 1 A 75 LYS CB 1
1 77 LYS CD C 13 29.21 0.052 1 A 75 LYS CD 1
1 77 LYS CE C 13 42.864 0.023 1 A 75 LYS CE 1
1 77 LYS CG C 13 25.764 0.002 1 A 75 LYS CG 1
1 77 LYS H H 1 7.797 0.004 1 A 75 LYS H 1
1 77 LYS HA H 1 4.251 0.006 1 A 75 LYS HA 1
1 77 LYS HB2 H 1 1.818 0.003 2 A 75 LYS HBx 1
1 77 LYS HB3 H 1 1.819 0.002 2 A 75 LYS HBy 1
1 77 LYS HD2 H 1 1.717 0.008 2 A 75 LYS HDx 1
1 77 LYS HD3 H 1 1.628 0.006 2 A 75 LYS HDy 1
1 77 LYS HE2 H 1 2.978 0.009 2 A 75 LYS HEx 1
1 77 LYS HE3 H 1 2.886 0.009 2 A 75 LYS HEy 1
1 77 LYS HG2 H 1 1.417 0.014 2 A 75 LYS HGx 1
1 77 LYS HG3 H 1 1.417 0.014 2 A 75 LYS HGy 1
1 77 LYS N N 15 118.414 0.024 1 A 75 LYS N 1
1 78 MET CA C 13 57.801 0.016 1 A 76 MET CA 1
1 78 MET CB C 13 33.977 0.029 1 A 76 MET CB 1
1 78 MET CG C 13 32.797 0 1 A 76 MET CG 1
1 78 MET H H 1 8.002 0.003 1 A 76 MET H 1
1 78 MET HA H 1 4.338 0.008 1 A 76 MET HA 1
1 78 MET HB2 H 1 2.124 0.015 2 A 76 MET HBx 1
1 78 MET HB3 H 1 2.124 0.015 2 A 76 MET HBy 1
1 78 MET HE1 H 1 2.131 0 1 A 76 MET HE% 1
1 78 MET HE2 H 1 2.131 0 1 A 76 MET HE% 1
1 78 MET HE3 H 1 2.131 0 1 A 76 MET HE% 1
1 78 MET HG2 H 1 2.587 0.012 2 A 76 MET HGx 1
1 78 MET HG3 H 1 2.587 0.012 2 A 76 MET HGy 1
1 78 MET N N 15 117.921 0.016 1 A 76 MET N 1
1 79 LYS CA C 13 57.865 0.01 1 A 77 LYS CA 1
1 79 LYS CB C 13 33.898 0.025 1 A 77 LYS CB 1
1 79 LYS CD C 13 30.033 0 1 A 77 LYS CD 1
1 79 LYS CE C 13 43.463 0 1 A 77 LYS CE 1
1 79 LYS CG C 13 25.983 0.018 1 A 77 LYS CG 1
1 79 LYS H H 1 7.73 0.004 1 A 77 LYS H 1
1 79 LYS HA H 1 4.35 0.008 1 A 77 LYS HA 1
1 79 LYS HB2 H 1 1.949 0.002 2 A 77 LYS HBx 1
1 79 LYS HB3 H 1 1.894 0.009 2 A 77 LYS HBy 1
1 79 LYS HD2 H 1 1.724 0.015 2 A 77 LYS HDx 1
1 79 LYS HD3 H 1 1.677 0.005 2 A 77 LYS HDy 1
1 79 LYS HE2 H 1 3.018 0.002 2 A 77 LYS HEx 1
1 79 LYS HE3 H 1 3.018 0.002 2 A 77 LYS HEy 1
1 79 LYS HG2 H 1 1.523 0.022 2 A 77 LYS HGx 1
1 79 LYS HG3 H 1 1.494 0.019 2 A 77 LYS HGy 1
1 79 LYS N N 15 119.966 0.041 1 A 77 LYS N 1
1 80 ASP CB C 13 42.155 0 1 A 78 ASP CB 1
1 80 ASP H H 1 8.216 0.006 1 A 78 ASP H 1
1 80 ASP HB2 H 1 2.744 0 2 A 78 ASP HBx 1
1 80 ASP HB3 H 1 2.847 0 2 A 78 ASP HBy 1
1 80 ASP N N 15 121.616 0.006 1 A 78 ASP N 1
1 81 THR CA C 13 63.508 0.009 1 A 79 THR CA 1
1 81 THR CB C 13 70.747 0 1 A 79 THR CB 1
1 81 THR CG2 C 13 22.824 0.038 1 A 79 THR CG2 1
1 81 THR H H 1 8.121 0.001 1 A 79 THR H 1
1 81 THR HA H 1 4.376 0.001 1 A 79 THR HA 1
1 81 THR HB H 1 4.347 0.004 1 A 79 THR HB 1
1 81 THR HG21 H 1 1.255 0.011 1 A 79 THR HG2% 1
1 81 THR HG22 H 1 1.255 0.011 1 A 79 THR HG2% 1
1 81 THR HG23 H 1 1.255 0.011 1 A 79 THR HG2% 1
1 81 THR N N 15 114.91 0.027 1 A 79 THR N 1
1 82 ASP H H 1 8.424 0.002 1 A 80 ASP H 1
1 82 ASP N N 15 123.359 0.018 1 A 80 ASP N 1
1 84 GLU CB C 13 30.552 0.025 1 A 82 GLU CB 1
1 84 GLU CG C 13 37.199 0.011 1 A 82 GLU CG 1
1 84 GLU H H 1 8.322 0.007 1 A 82 GLU H 1
1 84 GLU HA H 1 4.158 0.01 1 A 82 GLU HA 1
1 84 GLU HB2 H 1 2.16 0.005 2 A 82 GLU HBx 1
1 84 GLU HB3 H 1 2.161 0.006 2 A 82 GLU HBy 1
1 84 GLU HG2 H 1 2.325 0.005 2 A 82 GLU HGx 1
1 84 GLU HG3 H 1 2.325 0.004 2 A 82 GLU HGy 1
1 84 GLU N N 15 121.999 0.012 1 A 82 GLU N 1
1 85 GLU CA C 13 60.686 0 1 A 83 GLU CA 1
1 85 GLU CB C 13 30.356 0.038 1 A 83 GLU CB 1
1 85 GLU CG C 13 37.488 0.005 1 A 83 GLU CG 1
1 85 GLU H H 1 8.261 0 1 A 83 GLU H 1
1 85 GLU HA H 1 4.088 0.004 1 A 83 GLU HA 1
1 85 GLU HB2 H 1 2.145 0.007 2 A 83 GLU HBx 1
1 85 GLU HB3 H 1 2.145 0.007 2 A 83 GLU HBy 1
1 85 GLU HG2 H 1 2.526 0.005 2 A 83 GLU HGx 1
1 85 GLU HG3 H 1 2.526 0.005 2 A 83 GLU HGy 1
1 85 GLU N N 15 119.668 0.01 1 A 83 GLU N 1
1 86 GLU CA C 13 60.561 0.037 1 A 84 GLU CA 1
1 86 GLU CB C 13 30.469 0 1 A 84 GLU CB 1
1 86 GLU CG C 13 37.213 0.006 1 A 84 GLU CG 1
1 86 GLU H H 1 8.392 0.001 1 A 84 GLU H 1
1 86 GLU HA H 1 4.174 0.007 1 A 84 GLU HA 1
1 86 GLU HB2 H 1 2.166 0.003 2 A 84 GLU HBx 1
1 86 GLU HB3 H 1 2.166 0.002 2 A 84 GLU HBy 1
1 86 GLU HG2 H 1 2.452 0.002 2 A 84 GLU HGx 1
1 86 GLU HG3 H 1 2.452 0.002 2 A 84 GLU HGy 1
1 86 GLU N N 15 118.761 0.02 1 A 84 GLU N 1
1 87 ILE CA C 13 66.724 0.05 1 A 85 ILE CA 1
1 87 ILE CB C 13 38.801 0.007 1 A 85 ILE CB 1
1 87 ILE CD1 C 13 14.476 0.059 1 A 85 ILE CD1 1
1 87 ILE CG1 C 13 31.499 0.009 1 A 85 ILE CG1 1
1 87 ILE CG2 C 13 20.278 0.012 1 A 85 ILE CG2 1
1 87 ILE H H 1 8.013 0.004 1 A 85 ILE H 1
1 87 ILE HA H 1 3.806 0.005 1 A 85 ILE HA 1
1 87 ILE HB H 1 2.179 0.006 1 A 85 ILE HB 1
1 87 ILE HD11 H 1 0.832 0.029 1 A 85 ILE HD1% 1
1 87 ILE HD12 H 1 0.832 0.029 1 A 85 ILE HD1% 1
1 87 ILE HD13 H 1 0.832 0.029 1 A 85 ILE HD1% 1
1 87 ILE HG12 H 1 2.134 0.008 2 A 85 ILE HG1x 1
1 87 ILE HG13 H 1 0.991 0.007 2 A 85 ILE HG1y 1
1 87 ILE HG21 H 1 1.13 0.006 1 A 85 ILE HG2% 1
1 87 ILE HG22 H 1 1.13 0.006 1 A 85 ILE HG2% 1
1 87 ILE HG23 H 1 1.13 0.006 1 A 85 ILE HG2% 1
1 87 ILE N N 15 121.068 0.008 1 A 85 ILE N 1
1 88 ARG CA C 13 61.17 0.052 1 A 86 ARG CA 1
1 88 ARG CB C 13 31.146 0.017 1 A 86 ARG CB 1
1 88 ARG CD C 13 44.265 0.02 1 A 86 ARG CD 1
1 88 ARG CG C 13 28.702 0.008 1 A 86 ARG CG 1
1 88 ARG H H 1 8.439 0.002 1 A 86 ARG H 1
1 88 ARG HA H 1 4.206 0.006 1 A 86 ARG HA 1
1 88 ARG HB2 H 1 2.097 0.009 2 A 86 ARG HBx 1
1 88 ARG HB3 H 1 2.095 0.012 2 A 86 ARG HBy 1
1 88 ARG HD2 H 1 3.05 0.002 2 A 86 ARG HDx 1
1 88 ARG HD3 H 1 3.05 0.002 2 A 86 ARG HDy 1
1 88 ARG HG2 H 1 1.883 0.016 2 A 86 ARG HGx 1
1 88 ARG HG3 H 1 1.883 0.016 2 A 86 ARG HGy 1
1 88 ARG N N 15 121.766 0.024 1 A 86 ARG N 1
1 89 GLU CA C 13 59.814 0.048 1 A 87 GLU CA 1
1 89 GLU CB C 13 30.234 0 1 A 87 GLU CB 1
1 89 GLU H H 1 8.191 0.002 1 A 87 GLU H 1
1 89 GLU HA H 1 4.148 0.008 1 A 87 GLU HA 1
1 89 GLU HB2 H 1 2.105 0 2 A 87 GLU HBx 1
1 89 GLU HB3 H 1 2.105 0 2 A 87 GLU HBy 1
1 89 GLU N N 15 118.691 0.029 1 A 87 GLU N 1
1 90 ALA CA C 13 55.815 0.031 1 A 88 ALA CA 1
1 90 ALA CB C 13 19.265 0.015 1 A 88 ALA CB 1
1 90 ALA H H 1 7.842 0.004 1 A 88 ALA H 1
1 90 ALA HA H 1 3.794 0.005 1 A 88 ALA HA 1
1 90 ALA HB1 H 1 1.493 0.008 1 A 88 ALA HB% 1
1 90 ALA HB2 H 1 1.493 0.008 1 A 88 ALA HB% 1
1 90 ALA HB3 H 1 1.493 0.008 1 A 88 ALA HB% 1
1 90 ALA N N 15 121.264 0.032 1 A 88 ALA N 1
1 91 PHE CA C 13 63.633 0.042 1 A 89 PHE CA 1
1 91 PHE CB C 13 40.148 0.043 1 A 89 PHE CB 1
1 91 PHE CE2 C 13 129.676 0.008 1 A 89 PHE CE2 1
1 91 PHE H H 1 8.28 0.002 1 A 89 PHE H 1
1 91 PHE HA H 1 3.092 0.011 1 A 89 PHE HA 1
1 91 PHE HB2 H 1 3.229 0.01 2 A 89 PHE HBx 1
1 91 PHE HB3 H 1 3.083 0.007 2 A 89 PHE HBy 1
1 91 PHE HD1 H 1 7.414 0 1 A 89 PHE HD% 1
1 91 PHE HD2 H 1 7.414 0 1 A 89 PHE HD% 1
1 91 PHE HE1 H 1 7.494 0 1 A 89 PHE HE% 1
1 91 PHE HE2 H 1 7.494 0 1 A 89 PHE HE% 1
1 91 PHE N N 15 116.822 0.023 1 A 89 PHE N 1
1 92 ARG CA C 13 60.031 0.037 1 A 90 ARG CA 1
1 92 ARG CB C 13 31.207 0 1 A 90 ARG CB 1
1 92 ARG CD C 13 44.686 0.009 1 A 90 ARG CD 1
1 92 ARG CG C 13 28.789 0.013 1 A 90 ARG CG 1
1 92 ARG H H 1 7.651 0.003 1 A 90 ARG H 1
1 92 ARG HA H 1 3.952 0.006 1 A 90 ARG HA 1
1 92 ARG HB2 H 1 1.99 0.001 2 A 90 ARG HBx 1
1 92 ARG HB3 H 1 1.99 0.001 2 A 90 ARG HBy 1
1 92 ARG HD2 H 1 3.271 0.005 2 A 90 ARG HDx 1
1 92 ARG HD3 H 1 3.212 0.028 2 A 90 ARG HDy 1
1 92 ARG HG2 H 1 1.686 0.01 2 A 90 ARG HGx 1
1 92 ARG HG3 H 1 1.686 0.01 2 A 90 ARG HGy 1
1 92 ARG N N 15 114.764 0.035 1 A 90 ARG N 1
1 93 VAL CA C 13 66.291 0.012 1 A 91 VAL CA 1
1 93 VAL CB C 13 32.633 0.056 1 A 91 VAL CB 1
1 93 VAL CG1 C 13 23.681 0.038 1 A 91 VAL CG1 1
1 93 VAL CG2 C 13 22.448 0.031 1 A 91 VAL CG2 1
1 93 VAL H H 1 7.538 0.004 1 A 91 VAL H 1
1 93 VAL HA H 1 3.625 0.007 1 A 91 VAL HA 1
1 93 VAL HB H 1 2.045 0.009 1 A 91 VAL HB 1
1 93 VAL HG11 H 1 1.033 0.005 2 A 91 VAL HGx% 1
1 93 VAL HG12 H 1 1.033 0.005 2 A 91 VAL HGx% 1
1 93 VAL HG13 H 1 1.033 0.005 2 A 91 VAL HGx% 1
1 93 VAL HG21 H 1 1.033 0.005 2 A 91 VAL HGx% 1
1 93 VAL HG22 H 1 1.033 0.005 2 A 91 VAL HGx% 1
1 93 VAL HG23 H 1 1.033 0.005 2 A 91 VAL HGx% 1
1 93 VAL HG23 H 1 0.955 0.005 2 A 91 VAL HGy% 1
1 93 VAL HG22 H 1 0.955 0.005 2 A 91 VAL HGy% 1
1 93 VAL HG21 H 1 0.955 0.005 2 A 91 VAL HGy% 1
1 93 VAL HG13 H 1 0.955 0.005 2 A 91 VAL HGy% 1
1 93 VAL HG12 H 1 0.955 0.005 2 A 91 VAL HGy% 1
1 93 VAL HG11 H 1 0.955 0.005 2 A 91 VAL HGy% 1
1 93 VAL N N 15 117.861 0.031 1 A 91 VAL N 1
1 94 PHE CA C 13 57.836 0.035 1 A 92 PHE CA 1
1 94 PHE CB C 13 39.147 0.007 1 A 92 PHE CB 1
1 94 PHE CD2 C 13 130.338 0.055 1 A 92 PHE CD2 1
1 94 PHE CE2 C 13 131.234 0.132 1 A 92 PHE CE2 1
1 94 PHE H H 1 7.997 0.003 1 A 92 PHE H 1
1 94 PHE HA H 1 4.45 0.001 1 A 92 PHE HA 1
1 94 PHE HB2 H 1 2.798 0.016 2 A 92 PHE HBx 1
1 94 PHE HB3 H 1 2.801 0.016 2 A 92 PHE HBy 1
1 94 PHE HD1 H 1 7.062 0.003 1 A 92 PHE HD% 1
1 94 PHE HD2 H 1 7.062 0.003 1 A 92 PHE HD% 1
1 94 PHE HE1 H 1 7.458 0.007 1 A 92 PHE HE% 1
1 94 PHE HE2 H 1 7.458 0.007 1 A 92 PHE HE% 1
1 94 PHE N N 15 119.21 0.019 1 A 92 PHE N 1
1 95 ASP CA C 13 53.35 0.029 1 A 93 ASP CA 1
1 95 ASP CB C 13 39.245 0.021 1 A 93 ASP CB 1
1 95 ASP H H 1 7.942 0.002 1 A 93 ASP H 1
1 95 ASP HA H 1 4.52 0.003 1 A 93 ASP HA 1
1 95 ASP HB2 H 1 2.47 0.008 2 A 93 ASP HBx 1
1 95 ASP HB3 H 1 1.956 0.504 2 A 93 ASP HBy 1
1 95 ASP N N 15 117.933 0.022 1 A 93 ASP N 1
1 96 LYS CA C 13 60.175 0.031 1 A 94 LYS CA 1
1 96 LYS CB C 13 34.103 0.016 1 A 94 LYS CB 1
1 96 LYS CD C 13 29.885 0 1 A 94 LYS CD 1
1 96 LYS CE C 13 43.3 0 1 A 94 LYS CE 1
1 96 LYS CG C 13 25.644 0.048 1 A 94 LYS CG 1
1 96 LYS H H 1 7.428 0.004 1 A 94 LYS H 1
1 96 LYS HA H 1 3.953 0.008 1 A 94 LYS HA 1
1 96 LYS HB2 H 1 1.893 0.008 2 A 94 LYS HBx 1
1 96 LYS HB3 H 1 1.894 0.007 2 A 94 LYS HBy 1
1 96 LYS HD2 H 1 1.696 0.006 2 A 94 LYS HDx 1
1 96 LYS HD3 H 1 1.699 0.004 2 A 94 LYS HDy 1
1 96 LYS HE2 H 1 2.898 0.011 2 A 94 LYS HEx 1
1 96 LYS HE3 H 1 2.865 0.018 2 A 94 LYS HEy 1
1 96 LYS HG2 H 1 1.475 0.015 2 A 94 LYS HGx 1
1 96 LYS HG3 H 1 1.475 0.015 2 A 94 LYS HGy 1
1 96 LYS N N 15 126.15 0.039 1 A 94 LYS N 1
1 97 ASP CA C 13 54.081 0 1 A 95 ASP CA 1
1 97 ASP CB C 13 40.724 0.046 1 A 95 ASP CB 1
1 97 ASP H H 1 8.213 0.004 1 A 95 ASP H 1
1 97 ASP HA H 1 4.601 0 1 A 95 ASP HA 1
1 97 ASP HB2 H 1 3.129 0.016 2 A 95 ASP HBx 1
1 97 ASP HB3 H 1 2.892 0.224 2 A 95 ASP HBy 1
1 97 ASP N N 15 114.038 0.032 1 A 95 ASP N 1
1 98 GLY CA C 13 48.187 0.022 1 A 96 GLY CA 1
1 98 GLY H H 1 7.873 0.002 1 A 96 GLY H 1
1 98 GLY HA2 H 1 3.875 0.018 2 A 96 GLY HAx 1
1 98 GLY HA3 H 1 3.867 0.013 2 A 96 GLY HAy 1
1 98 GLY N N 15 109.532 0.009 1 A 96 GLY N 1
1 99 ASN CA C 13 53.78 0 1 A 97 ASN CA 1
1 99 ASN CB C 13 39.255 0.054 1 A 97 ASN CB 1
1 99 ASN H H 1 8.351 0.003 1 A 97 ASN H 1
1 99 ASN HA H 1 4.686 0 1 A 97 ASN HA 1
1 99 ASN HB2 H 1 3.462 0.011 2 A 97 ASN HBx 1
1 99 ASN HB3 H 1 2.715 0.008 2 A 97 ASN HBy 1
1 99 ASN HD21 H 1 8.062 0.004 2 A 97 ASN HD2x 1
1 99 ASN HD22 H 1 7.41 0.001 2 A 97 ASN HD2y 1
1 99 ASN N N 15 119.619 0.039 1 A 97 ASN N 1
1 99 ASN ND2 N 15 116.649 0.117 1 A 97 ASN ND2 1
1 100 GLY CA C 13 46.034 0.037 1 A 98 GLY CA 1
1 100 GLY H H 1 10.704 0.002 1 A 98 GLY H 1
1 100 GLY HA2 H 1 3.897 0.299 2 A 98 GLY HAx 1
1 100 GLY HA3 H 1 3.633 0.266 2 A 98 GLY HAy 1
1 100 GLY N N 15 113.015 0.039 1 A 98 GLY N 1
1 101 TYR CA C 13 57.053 0.109 1 A 99 TYR CA 1
1 101 TYR CB C 13 44.193 0.021 1 A 99 TYR CB 1
1 101 TYR CD1 C 13 133.544 0.054 1 A 99 TYR CD1 1
1 101 TYR CE1 C 13 118.423 0.061 1 A 99 TYR CE1 1
1 101 TYR H H 1 7.63 0.004 1 A 99 TYR H 1
1 101 TYR HA H 1 5.146 0.013 1 A 99 TYR HA 1
1 101 TYR HB2 H 1 2.539 0.01 2 A 99 TYR HBx 1
1 101 TYR HB3 H 1 2.539 0.01 2 A 99 TYR HBy 1
1 101 TYR HD1 H 1 6.84 0.005 1 A 99 TYR HD% 1
1 101 TYR HD2 H 1 6.84 0.005 1 A 99 TYR HD% 1
1 101 TYR HE1 H 1 7.025 0.002 1 A 99 TYR HE% 1
1 101 TYR HE2 H 1 7.025 0.002 1 A 99 TYR HE% 1
1 101 TYR N N 15 115.644 0.025 1 A 99 TYR N 1
1 102 ILE CA C 13 61.872 0 1 A 100 ILE CA 1
1 102 ILE CB C 13 39.855 0.027 1 A 100 ILE CB 1
1 102 ILE CD1 C 13 16.445 0.059 1 A 100 ILE CD1 1
1 102 ILE CG1 C 13 28.424 0.089 1 A 100 ILE CG1 1
1 102 ILE CG2 C 13 18.993 0.022 1 A 100 ILE CG2 1
1 102 ILE H H 1 10.223 0.003 1 A 100 ILE H 1
1 102 ILE HA H 1 4.877 0 1 A 100 ILE HA 1
1 102 ILE HB H 1 1.948 0.009 1 A 100 ILE HB 1
1 102 ILE HD11 H 1 0.526 0.008 1 A 100 ILE HD1% 1
1 102 ILE HD12 H 1 0.526 0.008 1 A 100 ILE HD1% 1
1 102 ILE HD13 H 1 0.526 0.008 1 A 100 ILE HD1% 1
1 102 ILE HG12 H 1 1.309 0.005 1 A 100 ILE HG12 1
1 102 ILE HG13 H 1 1.55 0.092 1 A 100 ILE HG13 1
1 102 ILE HG21 H 1 0.978 0.008 1 A 100 ILE HG2% 1
1 102 ILE HG22 H 1 0.978 0.008 1 A 100 ILE HG2% 1
1 102 ILE HG23 H 1 0.978 0.008 1 A 100 ILE HG2% 1
1 102 ILE N N 15 127.152 0.025 1 A 100 ILE N 1
1 103 SER CB C 13 67.844 0.073 1 A 101 SER CB 1
1 103 SER H H 1 8.993 0.004 1 A 101 SER H 1
1 103 SER HA H 1 4.502 0 1 A 101 SER HA 1
1 103 SER HB2 H 1 4.058 0.006 2 A 101 SER HBx 1
1 103 SER HB3 H 1 4.058 0.006 2 A 101 SER HBy 1
1 103 SER N N 15 124.178 0.023 1 A 101 SER N 1
1 104 ALA CA C 13 57.09 0.064 1 A 102 ALA CA 1
1 104 ALA CB C 13 19.01 0.011 1 A 102 ALA CB 1
1 104 ALA H H 1 9.279 0.007 1 A 102 ALA H 1
1 104 ALA HA H 1 3.929 0.007 1 A 102 ALA HA 1
1 104 ALA HB1 H 1 1.502 0.009 1 A 102 ALA HB% 1
1 104 ALA HB2 H 1 1.502 0.009 1 A 102 ALA HB% 1
1 104 ALA HB3 H 1 1.502 0.009 1 A 102 ALA HB% 1
1 104 ALA N N 15 122.908 0.018 1 A 102 ALA N 1
1 105 ALA CA C 13 56.484 0 1 A 103 ALA CA 1
1 105 ALA CB C 13 19.447 0.03 1 A 103 ALA CB 1
1 105 ALA H H 1 8.295 0.002 1 A 103 ALA H 1
1 105 ALA HA H 1 4.03 0.009 1 A 103 ALA HA 1
1 105 ALA HB1 H 1 1.445 0.009 1 A 103 ALA HB% 1
1 105 ALA HB2 H 1 1.445 0.009 1 A 103 ALA HB% 1
1 105 ALA HB3 H 1 1.445 0.009 1 A 103 ALA HB% 1
1 105 ALA N N 15 118.708 0.046 1 A 103 ALA N 1
1 106 GLU CA C 13 60.186 0.052 1 A 104 GLU CA 1
1 106 GLU CB C 13 30.258 0.049 1 A 104 GLU CB 1
1 106 GLU CG C 13 37.586 0 1 A 104 GLU CG 1
1 106 GLU H H 1 7.827 0.003 1 A 104 GLU H 1
1 106 GLU HA H 1 4.068 0.009 1 A 104 GLU HA 1
1 106 GLU HB2 H 1 2.361 0.011 2 A 104 GLU HBx 1
1 106 GLU HB3 H 1 2.36 0.012 2 A 104 GLU HBy 1
1 106 GLU HG2 H 1 2.552 0.004 2 A 104 GLU HGx 1
1 106 GLU HG3 H 1 2.551 0.005 2 A 104 GLU HGy 1
1 106 GLU N N 15 119.312 0.026 1 A 104 GLU N 1
1 107 LEU CA C 13 58.52 0.015 1 A 105 LEU CA 1
1 107 LEU CB C 13 42.94 0.022 1 A 105 LEU CB 1
1 107 LEU CD1 C 13 24.177 0.027 1 A 105 LEU CD1 1
1 107 LEU CD2 C 13 26.574 0.024 1 A 105 LEU CD2 1
1 107 LEU CG C 13 27.428 0.006 1 A 105 LEU CG 1
1 107 LEU H H 1 8.701 0.009 1 A 105 LEU H 1
1 107 LEU HA H 1 3.926 0.008 1 A 105 LEU HA 1
1 107 LEU HB2 H 1 1.691 0.007 1 A 105 LEU HB2 1
1 107 LEU HB3 H 1 1.493 0.006 1 A 105 LEU HB3 1
1 107 LEU HD11 H 1 0.576 0.007 2 A 105 LEU HDx% 1
1 107 LEU HD12 H 1 0.576 0.007 2 A 105 LEU HDx% 1
1 107 LEU HD13 H 1 0.576 0.007 2 A 105 LEU HDx% 1
1 107 LEU HD21 H 1 0.576 0.007 2 A 105 LEU HDx% 1
1 107 LEU HD22 H 1 0.576 0.007 2 A 105 LEU HDx% 1
1 107 LEU HD23 H 1 0.576 0.007 2 A 105 LEU HDx% 1
1 107 LEU HD23 H 1 0.662 0.008 2 A 105 LEU HDy% 1
1 107 LEU HD22 H 1 0.662 0.008 2 A 105 LEU HDy% 1
1 107 LEU HD21 H 1 0.662 0.008 2 A 105 LEU HDy% 1
1 107 LEU HD13 H 1 0.662 0.008 2 A 105 LEU HDy% 1
1 107 LEU HD12 H 1 0.662 0.008 2 A 105 LEU HDy% 1
1 107 LEU HD11 H 1 0.662 0.008 2 A 105 LEU HDy% 1
1 107 LEU HG H 1 1.425 0.021 1 A 105 LEU HG 1
1 107 LEU N N 15 122.046 0.029 1 A 105 LEU N 1
1 108 ARG CA C 13 61.184 0.057 1 A 106 ARG CA 1
1 108 ARG CB C 13 31.315 0.026 1 A 106 ARG CB 1
1 108 ARG CD C 13 44.989 0 1 A 106 ARG CD 1
1 108 ARG CG C 13 28.684 0.036 1 A 106 ARG CG 1
1 108 ARG H H 1 8.739 0.011 1 A 106 ARG H 1
1 108 ARG HA H 1 3.756 0.011 1 A 106 ARG HA 1
1 108 ARG HB2 H 1 1.97 0.004 2 A 106 ARG HBx 1
1 108 ARG HB3 H 1 1.963 0.005 2 A 106 ARG HBy 1
1 108 ARG HD2 H 1 3.265 0.003 2 A 106 ARG HDx 1
1 108 ARG HD3 H 1 3.167 0.002 2 A 106 ARG HDy 1
1 108 ARG HG2 H 1 1.687 0.002 2 A 106 ARG HGx 1
1 108 ARG HG3 H 1 1.679 0.015 2 A 106 ARG HGy 1
1 108 ARG N N 15 119.192 0.018 1 A 106 ARG N 1
1 109 HIS CA C 13 60.913 0.04 1 A 107 HIS CA 1
1 109 HIS CB C 13 31.656 0.077 1 A 107 HIS CB 1
1 109 HIS CD2 C 13 120.438 0.007 1 A 107 HIS CD2 1
1 109 HIS CE1 C 13 139.361 0.03 1 A 107 HIS CE1 1
1 109 HIS H H 1 7.677 0.007 1 A 107 HIS H 1
1 109 HIS HA H 1 4.295 0.014 1 A 107 HIS HA 1
1 109 HIS HB2 H 1 3.232 0.008 2 A 107 HIS HBx 1
1 109 HIS HB3 H 1 3.341 0.007 2 A 107 HIS HBy 1
1 109 HIS HD2 H 1 7.007 0.003 1 A 107 HIS HD2 1
1 109 HIS HE1 H 1 7.837 0.001 1 A 107 HIS HE1 1
1 109 HIS N N 15 119.368 0.011 1 A 107 HIS N 1
1 110 VAL CA C 13 67.247 0.045 1 A 108 VAL CA 1
1 110 VAL CB C 13 32.824 0.042 1 A 108 VAL CB 1
1 110 VAL CG1 C 13 21.826 0.021 1 A 108 VAL CG1 1
1 110 VAL CG2 C 13 24.114 0.069 1 A 108 VAL CG2 1
1 110 VAL H H 1 7.792 0.001 1 A 108 VAL H 1
1 110 VAL HA H 1 3.464 0.009 1 A 108 VAL HA 1
1 110 VAL HB H 1 1.938 0.015 1 A 108 VAL HB 1
1 110 VAL HG11 H 1 0.283 0.01 1 A 108 VAL HG1% 1
1 110 VAL HG12 H 1 0.283 0.01 1 A 108 VAL HG1% 1
1 110 VAL HG13 H 1 0.283 0.01 1 A 108 VAL HG1% 1
1 110 VAL HG21 H 1 0.814 0.013 1 A 108 VAL HG2% 1
1 110 VAL HG22 H 1 0.814 0.013 1 A 108 VAL HG2% 1
1 110 VAL HG23 H 1 0.814 0.013 1 A 108 VAL HG2% 1
1 110 VAL N N 15 119.33 0.023 1 A 108 VAL N 1
1 111 MET CA C 13 57.837 0.025 1 A 109 MET CA 1
1 111 MET CG C 13 32.948 0 1 A 109 MET CG 1
1 111 MET H H 1 8.08 0.003 1 A 109 MET H 1
1 111 MET HA H 1 4.253 0.009 1 A 109 MET HA 1
1 111 MET HB2 H 1 2.022 0 2 A 109 MET HBx 1
1 111 MET HB3 H 1 2.022 0 2 A 109 MET HBy 1
1 111 MET HG2 H 1 2.581 0.002 2 A 109 MET HGx 1
1 111 MET HG3 H 1 2.581 0.002 2 A 109 MET HGy 1
1 111 MET N N 15 115.469 0.03 1 A 109 MET N 1
1 112 THR CA C 13 67.529 0.072 1 A 110 THR CA 1
1 112 THR CG2 C 13 22.689 0.01 1 A 110 THR CG2 1
1 112 THR H H 1 8.237 0.003 1 A 110 THR H 1
1 112 THR HA H 1 4.055 0.008 1 A 110 THR HA 1
1 112 THR HB H 1 4.265 0.005 1 A 110 THR HB 1
1 112 THR HG21 H 1 1.249 0.007 1 A 110 THR HG2% 1
1 112 THR HG22 H 1 1.249 0.007 1 A 110 THR HG2% 1
1 112 THR HG23 H 1 1.249 0.007 1 A 110 THR HG2% 1
1 112 THR N N 15 116.515 0.049 1 A 110 THR N 1
1 113 ASN CA C 13 56.781 0.026 1 A 111 ASN CA 1
1 113 ASN CB C 13 39.208 0.02 1 A 111 ASN CB 1
1 113 ASN H H 1 7.945 0.007 1 A 111 ASN H 1
1 113 ASN HA H 1 4.492 0 1 A 111 ASN HA 1
1 113 ASN HB2 H 1 2.814 0.006 2 A 111 ASN HBx 1
1 113 ASN HB3 H 1 2.814 0.005 2 A 111 ASN HBy 1
1 113 ASN HD21 H 1 7.933 0.003 2 A 111 ASN HD2x 1
1 113 ASN HD22 H 1 6.907 0.003 2 A 111 ASN HD2y 1
1 113 ASN N N 15 122.526 0.021 1 A 111 ASN N 1
1 113 ASN ND2 N 15 115.188 0.017 1 A 111 ASN ND2 1
1 114 LEU CA C 13 56.198 0 1 A 112 LEU CA 1
1 114 LEU CB C 13 43.186 0.034 1 A 112 LEU CB 1
1 114 LEU CD1 C 13 25.187 0 1 A 112 LEU CD1 1
1 114 LEU CD2 C 13 25.018 0.014 1 A 112 LEU CD2 1
1 114 LEU CG C 13 27.499 0.007 1 A 112 LEU CG 1
1 114 LEU H H 1 7.601 0.003 1 A 112 LEU H 1
1 114 LEU HA H 1 4.387 0.001 1 A 112 LEU HA 1
1 114 LEU HB2 H 1 1.734 0.004 2 A 112 LEU HBx 1
1 114 LEU HB3 H 1 1.685 0.018 2 A 112 LEU HBy 1
1 114 LEU HD11 H 1 0.84 0.004 2 A 112 LEU HDx% 1
1 114 LEU HD12 H 1 0.84 0.004 2 A 112 LEU HDx% 1
1 114 LEU HD13 H 1 0.84 0.004 2 A 112 LEU HDx% 1
1 114 LEU HD21 H 1 0.84 0.004 2 A 112 LEU HDx% 1
1 114 LEU HD22 H 1 0.84 0.004 2 A 112 LEU HDx% 1
1 114 LEU HD23 H 1 0.84 0.004 2 A 112 LEU HDx% 1
1 114 LEU HD23 H 1 0.754 0.007 2 A 112 LEU HDy% 1
1 114 LEU HD22 H 1 0.754 0.007 2 A 112 LEU HDy% 1
1 114 LEU HD21 H 1 0.754 0.007 2 A 112 LEU HDy% 1
1 114 LEU HD13 H 1 0.754 0.007 2 A 112 LEU HDy% 1
1 114 LEU HD12 H 1 0.754 0.007 2 A 112 LEU HDy% 1
1 114 LEU HD11 H 1 0.754 0.007 2 A 112 LEU HDy% 1
1 114 LEU HG H 1 1.379 0.005 1 A 112 LEU HG 1
1 114 LEU N N 15 118.418 0.023 1 A 112 LEU N 1
1 115 GLY CA C 13 46.413 0.054 1 A 113 GLY CA 1
1 115 GLY H H 1 7.864 0.003 1 A 113 GLY H 1
1 115 GLY HA2 H 1 4.264 0.012 2 A 113 GLY HAx 1
1 115 GLY HA3 H 1 3.753 0.009 2 A 113 GLY HAy 1
1 115 GLY N N 15 107.02 0.012 1 A 113 GLY N 1
1 116 GLU CA C 13 55.628 0 1 A 114 GLU CA 1
1 116 GLU CB C 13 31.681 0.067 1 A 114 GLU CB 1
1 116 GLU H H 1 7.735 0.002 1 A 114 GLU H 1
1 116 GLU HA H 1 4.447 0 1 A 114 GLU HA 1
1 116 GLU HB2 H 1 1.92 0.01 2 A 114 GLU HBx 1
1 116 GLU HB3 H 1 1.621 0.008 2 A 114 GLU HBy 1
1 116 GLU N N 15 119.934 0.033 1 A 114 GLU N 1
1 117 LYS CA C 13 56.471 0 1 A 115 LYS CA 1
1 117 LYS CB C 13 32.878 0.026 1 A 115 LYS CB 1
1 117 LYS CD C 13 30.491 0 1 A 115 LYS CD 1
1 117 LYS CE C 13 43.21 0.058 1 A 115 LYS CE 1
1 117 LYS CG C 13 25.587 0.016 1 A 115 LYS CG 1
1 117 LYS H H 1 8.605 0.002 1 A 115 LYS H 1
1 117 LYS HA H 1 4.373 0.01 1 A 115 LYS HA 1
1 117 LYS HB2 H 1 1.675 0.011 2 A 115 LYS HBx 1
1 117 LYS HB3 H 1 1.777 0.006 2 A 115 LYS HBy 1
1 117 LYS HD2 H 1 1.666 0.005 2 A 115 LYS HDx 1
1 117 LYS HD3 H 1 1.726 0 2 A 115 LYS HDy 1
1 117 LYS HE2 H 1 2.988 0.009 2 A 115 LYS HEx 1
1 117 LYS HE3 H 1 3.04 0.001 2 A 115 LYS HEy 1
1 117 LYS HG2 H 1 1.318 0.013 2 A 115 LYS HGx 1
1 117 LYS HG3 H 1 1.389 0.003 2 A 115 LYS HGy 1
1 117 LYS N N 15 124.392 0.028 1 A 115 LYS N 1
1 118 LEU CB C 13 45.207 0.034 1 A 116 LEU CB 1
1 118 LEU CD1 C 13 25.936 0.046 1 A 116 LEU CD1 1
1 118 LEU CD2 C 13 27.752 0.032 1 A 116 LEU CD2 1
1 118 LEU CG C 13 29.658 0 1 A 116 LEU CG 1
1 118 LEU H H 1 8.091 0.002 1 A 116 LEU H 1
1 118 LEU HA H 1 4.749 0 1 A 116 LEU HA 1
1 118 LEU HB2 H 1 1.664 0.011 2 A 116 LEU HBx 1
1 118 LEU HB3 H 1 1.367 0.008 2 A 116 LEU HBy 1
1 118 LEU HD11 H 1 0.731 0.009 2 A 116 LEU HDx% 1
1 118 LEU HD12 H 1 0.731 0.009 2 A 116 LEU HDx% 1
1 118 LEU HD13 H 1 0.731 0.009 2 A 116 LEU HDx% 1
1 118 LEU HD21 H 1 0.731 0.009 2 A 116 LEU HDx% 1
1 118 LEU HD22 H 1 0.731 0.009 2 A 116 LEU HDx% 1
1 118 LEU HD23 H 1 0.731 0.009 2 A 116 LEU HDx% 1
1 118 LEU HD23 H 1 0.723 0.002 2 A 116 LEU HDy% 1
1 118 LEU HD22 H 1 0.723 0.002 2 A 116 LEU HDy% 1
1 118 LEU HD21 H 1 0.723 0.002 2 A 116 LEU HDy% 1
1 118 LEU HD13 H 1 0.723 0.002 2 A 116 LEU HDy% 1
1 118 LEU HD12 H 1 0.723 0.002 2 A 116 LEU HDy% 1
1 118 LEU HD11 H 1 0.723 0.002 2 A 116 LEU HDy% 1
1 118 LEU HG H 1 1.666 0 1 A 116 LEU HG 1
1 118 LEU N N 15 125.825 0.027 1 A 116 LEU N 1
1 119 THR CA C 13 61.79 0.019 1 A 117 THR CA 1
1 119 THR CB C 13 72.165 0 1 A 117 THR CB 1
1 119 THR CG2 C 13 22.934 0.015 1 A 117 THR CG2 1
1 119 THR H H 1 9.241 0.003 1 A 117 THR H 1
1 119 THR HA H 1 4.445 0.004 1 A 117 THR HA 1
1 119 THR HB H 1 4.771 0 1 A 117 THR HB 1
1 119 THR HG21 H 1 1.363 0.007 1 A 117 THR HG2% 1
1 119 THR HG22 H 1 1.363 0.007 1 A 117 THR HG2% 1
1 119 THR HG23 H 1 1.363 0.007 1 A 117 THR HG2% 1
1 119 THR N N 15 114.373 0.027 1 A 117 THR N 1
1 120 ASP CA C 13 59.027 0.029 1 A 118 ASP CA 1
1 120 ASP CB C 13 40.468 0 1 A 118 ASP CB 1
1 120 ASP H H 1 8.887 0.002 1 A 118 ASP H 1
1 120 ASP HA H 1 4.224 0.002 1 A 118 ASP HA 1
1 120 ASP HB2 H 1 2.694 0.004 2 A 118 ASP HBx 1
1 120 ASP HB3 H 1 2.698 0 2 A 118 ASP HBy 1
1 120 ASP N N 15 121.057 0.015 1 A 118 ASP N 1
1 121 GLU CA C 13 61.078 0.02 1 A 119 GLU CA 1
1 121 GLU CG C 13 37.608 0 1 A 119 GLU CG 1
1 121 GLU H H 1 8.668 0.004 1 A 119 GLU H 1
1 121 GLU HA H 1 4.145 0.005 1 A 119 GLU HA 1
1 121 GLU HB2 H 1 2.046 0.003 2 A 119 GLU HBx 1
1 121 GLU HB3 H 1 2.046 0.003 2 A 119 GLU HBy 1
1 121 GLU HG2 H 1 2.366 0.002 2 A 119 GLU HGx 1
1 121 GLU HG3 H 1 2.366 0.002 2 A 119 GLU HGy 1
1 121 GLU N N 15 119.544 0.004 1 A 119 GLU N 1
1 122 GLU CA C 13 60.356 0 1 A 120 GLU CA 1
1 122 GLU CB C 13 31.854 0.074 1 A 120 GLU CB 1
1 122 GLU CG C 13 39.326 0.023 1 A 120 GLU CG 1
1 122 GLU H H 1 7.754 0.002 1 A 120 GLU H 1
1 122 GLU HA H 1 4.104 0.002 1 A 120 GLU HA 1
1 122 GLU HB2 H 1 2.453 0.012 2 A 120 GLU HBx 1
1 122 GLU HB3 H 1 1.861 0.004 2 A 120 GLU HBy 1
1 122 GLU HG2 H 1 2.303 0.009 2 A 120 GLU HGx 1
1 122 GLU HG3 H 1 2.506 0.011 2 A 120 GLU HGy 1
1 122 GLU N N 15 120.532 0.015 1 A 120 GLU N 1
1 123 VAL CA C 13 67.849 0.046 1 A 121 VAL CA 1
1 123 VAL CB C 13 32.17 0.068 1 A 121 VAL CB 1
1 123 VAL CG1 C 13 24.641 0.04 1 A 121 VAL CG1 1
1 123 VAL CG2 C 13 23.4 0.012 1 A 121 VAL CG2 1
1 123 VAL H H 1 8.052 0.011 1 A 121 VAL H 1
1 123 VAL HA H 1 3.459 0.009 1 A 121 VAL HA 1
1 123 VAL HB H 1 2.185 0.01 1 A 121 VAL HB 1
1 123 VAL HG11 H 1 0.884 0.006 2 A 121 VAL HGx% 1
1 123 VAL HG12 H 1 0.884 0.006 2 A 121 VAL HGx% 1
1 123 VAL HG13 H 1 0.884 0.006 2 A 121 VAL HGx% 1
1 123 VAL HG21 H 1 0.884 0.006 2 A 121 VAL HGx% 1
1 123 VAL HG22 H 1 0.884 0.006 2 A 121 VAL HGx% 1
1 123 VAL HG23 H 1 0.884 0.006 2 A 121 VAL HGx% 1
1 123 VAL HG23 H 1 0.98 0.007 2 A 121 VAL HGy% 1
1 123 VAL HG22 H 1 0.98 0.007 2 A 121 VAL HGy% 1
1 123 VAL HG21 H 1 0.98 0.007 2 A 121 VAL HGy% 1
1 123 VAL HG13 H 1 0.98 0.007 2 A 121 VAL HGy% 1
1 123 VAL HG12 H 1 0.98 0.007 2 A 121 VAL HGy% 1
1 123 VAL HG11 H 1 0.98 0.007 2 A 121 VAL HGy% 1
1 123 VAL N N 15 120.998 0.019 1 A 121 VAL N 1
1 124 ASP CA C 13 58.874 0.048 1 A 122 ASP CA 1
1 124 ASP CB C 13 41.508 0.024 1 A 122 ASP CB 1
1 124 ASP H H 1 7.985 0.004 1 A 122 ASP H 1
1 124 ASP HA H 1 4.405 0.005 1 A 122 ASP HA 1
1 124 ASP HB2 H 1 2.726 0.047 2 A 122 ASP HBx 1
1 124 ASP HB3 H 1 2.827 0.009 2 A 122 ASP HBy 1
1 124 ASP N N 15 120.423 0.01 1 A 122 ASP N 1
1 125 GLU CA C 13 60.471 0.062 1 A 123 GLU CA 1
1 125 GLU CB C 13 30.648 0 1 A 123 GLU CB 1
1 125 GLU CG C 13 37.288 0.009 1 A 123 GLU CG 1
1 125 GLU H H 1 8.096 0.004 1 A 123 GLU H 1
1 125 GLU HA H 1 4.065 0.005 1 A 123 GLU HA 1
1 125 GLU HB2 H 1 2.192 0.008 2 A 123 GLU HBx 1
1 125 GLU HB3 H 1 2.192 0.008 2 A 123 GLU HBy 1
1 125 GLU HG2 H 1 2.389 0.009 2 A 123 GLU HGx 1
1 125 GLU HG3 H 1 2.389 0.009 2 A 123 GLU HGy 1
1 125 GLU N N 15 120.036 0.021 1 A 123 GLU N 1
1 126 MET CA C 13 61.546 0.026 1 A 124 MET CA 1
1 126 MET CB C 13 33.91 0.054 1 A 124 MET CB 1
1 126 MET H H 1 7.872 0.002 1 A 124 MET H 1
1 126 MET HA H 1 4.048 0.01 1 A 124 MET HA 1
1 126 MET HB2 H 1 2.245 0.003 2 A 124 MET HBx 1
1 126 MET HB3 H 1 1.909 0.003 2 A 124 MET HBy 1
1 126 MET HG2 H 1 2.217 0 2 A 124 MET HGx 1
1 126 MET HG3 H 1 1.884 0 2 A 124 MET HGy 1
1 126 MET N N 15 119.542 0.029 1 A 124 MET N 1
1 127 ILE CA C 13 65.733 0.041 1 A 125 ILE CA 1
1 127 ILE CB C 13 37.297 0.072 1 A 125 ILE CB 1
1 127 ILE CD1 C 13 12.242 0.055 1 A 125 ILE CD1 1
1 127 ILE CG1 C 13 29.563 0.023 1 A 125 ILE CG1 1
1 127 ILE CG2 C 13 17.313 0.016 1 A 125 ILE CG2 1
1 127 ILE H H 1 8.104 0.002 1 A 125 ILE H 1
1 127 ILE HA H 1 3.686 0.011 1 A 125 ILE HA 1
1 127 ILE HB H 1 2.269 0.023 1 A 125 ILE HB 1
1 127 ILE HD11 H 1 0.824 0.007 1 A 125 ILE HD1% 1
1 127 ILE HD12 H 1 0.824 0.007 1 A 125 ILE HD1% 1
1 127 ILE HD13 H 1 0.824 0.007 1 A 125 ILE HD1% 1
1 127 ILE HG12 H 1 1.298 0.007 1 A 125 ILE HG12 1
1 127 ILE HG13 H 1 1.686 0.008 1 A 125 ILE HG13 1
1 127 ILE HG21 H 1 0.781 0.006 1 A 125 ILE HG2% 1
1 127 ILE HG22 H 1 0.781 0.006 1 A 125 ILE HG2% 1
1 127 ILE HG23 H 1 0.781 0.006 1 A 125 ILE HG2% 1
1 127 ILE N N 15 120.197 0.033 1 A 125 ILE N 1
1 128 ARG CA C 13 60.914 0 1 A 126 ARG CA 1
1 128 ARG CB C 13 31.292 0.002 1 A 126 ARG CB 1
1 128 ARG CD C 13 44.609 0.034 1 A 126 ARG CD 1
1 128 ARG CG C 13 28.498 0.014 1 A 126 ARG CG 1
1 128 ARG H H 1 8.417 0.002 1 A 126 ARG H 1
1 128 ARG HA H 1 4.121 0 1 A 126 ARG HA 1
1 128 ARG HB2 H 1 1.968 0.011 2 A 126 ARG HBx 1
1 128 ARG HB3 H 1 1.968 0.011 2 A 126 ARG HBy 1
1 128 ARG HD2 H 1 3.262 0.006 2 A 126 ARG HDx 1
1 128 ARG HD3 H 1 3.197 0.001 2 A 126 ARG HDy 1
1 128 ARG HG2 H 1 1.679 0.006 2 A 126 ARG HGx 1
1 128 ARG HG3 H 1 1.679 0.006 2 A 126 ARG HGy 1
1 128 ARG N N 15 118.704 0.024 1 A 126 ARG N 1
1 129 GLU CA C 13 59.986 0.005 1 A 127 GLU CA 1
1 129 GLU CB C 13 31.407 0.04 1 A 127 GLU CB 1
1 129 GLU CG C 13 37.641 0 1 A 127 GLU CG 1
1 129 GLU H H 1 7.962 0.005 1 A 127 GLU H 1
1 129 GLU HA H 1 4.041 0.007 1 A 127 GLU HA 1
1 129 GLU HB2 H 1 2.324 0.017 2 A 127 GLU HBx 1
1 129 GLU HB3 H 1 2.134 0.004 2 A 127 GLU HBy 1
1 129 GLU HG2 H 1 2.331 0.005 2 A 127 GLU HGx 1
1 129 GLU HG3 H 1 2.331 0.005 2 A 127 GLU HGy 1
1 129 GLU N N 15 116.601 0.022 1 A 127 GLU N 1
1 130 ALA CA C 13 53.099 0.044 1 A 128 ALA CA 1
1 130 ALA CB C 13 23.942 0.03 1 A 128 ALA CB 1
1 130 ALA H H 1 7.222 0.004 1 A 128 ALA H 1
1 130 ALA HA H 1 4.479 0.033 1 A 128 ALA HA 1
1 130 ALA HB1 H 1 1.327 0.003 1 A 128 ALA HB% 1
1 130 ALA HB2 H 1 1.327 0.003 1 A 128 ALA HB% 1
1 130 ALA HB3 H 1 1.327 0.003 1 A 128 ALA HB% 1
1 130 ALA N N 15 117.502 0.019 1 A 128 ALA N 1
1 131 ASP CA C 13 55.562 0 1 A 129 ASP CA 1
1 131 ASP CB C 13 41.682 0.017 1 A 129 ASP CB 1
1 131 ASP H H 1 7.931 0.002 1 A 129 ASP H 1
1 131 ASP HA H 1 4.571 0 1 A 129 ASP HA 1
1 131 ASP HB2 H 1 2.899 0.005 2 A 129 ASP HBx 1
1 131 ASP HB3 H 1 2.668 0.009 2 A 129 ASP HBy 1
1 131 ASP N N 15 117.503 0.048 1 A 129 ASP N 1
1 132 ILE CA C 13 64.374 0.035 1 A 130 ILE CA 1
1 132 ILE CB C 13 39.831 0.023 1 A 130 ILE CB 1
1 132 ILE CD1 C 13 13.659 0.034 1 A 130 ILE CD1 1
1 132 ILE CG1 C 13 28.901 0.059 1 A 130 ILE CG1 1
1 132 ILE CG2 C 13 18.459 0.006 1 A 130 ILE CG2 1
1 132 ILE H H 1 8.578 0.004 1 A 130 ILE H 1
1 132 ILE HA H 1 3.966 0.01 1 A 130 ILE HA 1
1 132 ILE HB H 1 2.018 0.009 1 A 130 ILE HB 1
1 132 ILE HD11 H 1 0.903 0.006 1 A 130 ILE HD1% 1
1 132 ILE HD12 H 1 0.903 0.006 1 A 130 ILE HD1% 1
1 132 ILE HD13 H 1 0.903 0.006 1 A 130 ILE HD1% 1
1 132 ILE HG12 H 1 1.309 0.008 2 A 130 ILE HG1x 1
1 132 ILE HG13 H 1 1.691 0.009 2 A 130 ILE HG1y 1
1 132 ILE HG21 H 1 0.968 0.002 1 A 130 ILE HG2% 1
1 132 ILE HG22 H 1 0.968 0.002 1 A 130 ILE HG2% 1
1 132 ILE HG23 H 1 0.968 0.002 1 A 130 ILE HG2% 1
1 132 ILE N N 15 128.277 0.021 1 A 130 ILE N 1
1 133 ASP CA C 13 54.86 0 1 A 131 ASP CA 1
1 133 ASP CB C 13 40.875 0.002 1 A 131 ASP CB 1
1 133 ASP H H 1 8.224 0 1 A 131 ASP H 1
1 133 ASP HA H 1 4.598 0 1 A 131 ASP HA 1
1 133 ASP HB2 H 1 2.676 0.009 2 A 131 ASP HBx 1
1 133 ASP HB3 H 1 3.123 0.01 2 A 131 ASP HBy 1
1 133 ASP N N 15 116.61 0 1 A 131 ASP N 1
1 134 GLY CA C 13 48.515 0.072 1 A 132 GLY CA 1
1 134 GLY H H 1 7.542 0 1 A 132 GLY H 1
1 134 GLY HA2 H 1 3.861 0.008 2 A 132 GLY HAx 1
1 134 GLY HA3 H 1 4.011 0.007 2 A 132 GLY HAy 1
1 134 GLY N N 15 108.394 0 1 A 132 GLY N 1
1 135 ASP CA C 13 54.639 0 1 A 133 ASP CA 1
1 135 ASP CB C 13 41.373 0.074 1 A 133 ASP CB 1
1 135 ASP H H 1 8.358 0.004 1 A 133 ASP H 1
1 135 ASP HA H 1 4.533 0 1 A 133 ASP HA 1
1 135 ASP HB2 H 1 2.981 0.012 2 A 133 ASP HBx 1
1 135 ASP HB3 H 1 2.514 0.007 2 A 133 ASP HBy 1
1 135 ASP N N 15 120.787 0.04 1 A 133 ASP N 1
1 136 GLY CA C 13 47.01 0.019 1 A 134 GLY CA 1
1 136 GLY H H 1 10.433 0.005 1 A 134 GLY H 1
1 136 GLY HA2 H 1 4.062 0.01 2 A 134 GLY HAx 1
1 136 GLY HA3 H 1 3.469 0.008 2 A 134 GLY HAy 1
1 136 GLY N N 15 112.887 0.005 1 A 134 GLY N 1
1 137 GLN CA C 13 54.314 0.085 1 A 135 GLN CA 1
1 137 GLN CB C 13 33.137 0.028 1 A 135 GLN CB 1
1 137 GLN CG C 13 34.14 0.046 1 A 135 GLN CG 1
1 137 GLN H H 1 8.037 0.003 1 A 135 GLN H 1
1 137 GLN HA H 1 4.902 0.014 1 A 135 GLN HA 1
1 137 GLN HB2 H 1 2.099 0.003 2 A 135 GLN HBx 1
1 137 GLN HB3 H 1 1.762 0.008 2 A 135 GLN HBy 1
1 137 GLN HG2 H 1 2.716 0.005 2 A 135 GLN HGx 1
1 137 GLN HG3 H 1 2.558 0.016 2 A 135 GLN HGy 1
1 137 GLN N N 15 115.117 0.033 1 A 135 GLN N 1
1 138 VAL CA C 13 62.849 0.049 1 A 136 VAL CA 1
1 138 VAL CB C 13 34.714 0.036 1 A 136 VAL CB 1
1 138 VAL CG1 C 13 23.228 0.028 1 A 136 VAL CG1 1
1 138 VAL CG2 C 13 23.775 0.021 1 A 136 VAL CG2 1
1 138 VAL H H 1 9.185 0.002 1 A 136 VAL H 1
1 138 VAL HA H 1 5.258 0.011 1 A 136 VAL HA 1
1 138 VAL HB H 1 2.539 0.006 1 A 136 VAL HB 1
1 138 VAL HG11 H 1 1.454 0.008 2 A 136 VAL HGx% 1
1 138 VAL HG12 H 1 1.454 0.008 2 A 136 VAL HGx% 1
1 138 VAL HG13 H 1 1.454 0.008 2 A 136 VAL HGx% 1
1 138 VAL HG21 H 1 1.454 0.008 2 A 136 VAL HGx% 1
1 138 VAL HG22 H 1 1.454 0.008 2 A 136 VAL HGx% 1
1 138 VAL HG23 H 1 1.454 0.008 2 A 136 VAL HGx% 1
1 138 VAL HG23 H 1 1.172 0.007 2 A 136 VAL HGy% 1
1 138 VAL HG22 H 1 1.172 0.007 2 A 136 VAL HGy% 1
1 138 VAL HG21 H 1 1.172 0.007 2 A 136 VAL HGy% 1
1 138 VAL HG13 H 1 1.172 0.007 2 A 136 VAL HGy% 1
1 138 VAL HG12 H 1 1.172 0.007 2 A 136 VAL HGy% 1
1 138 VAL HG11 H 1 1.172 0.007 2 A 136 VAL HGy% 1
1 138 VAL N N 15 125.385 0.03 1 A 136 VAL N 1
1 139 ASN CA C 13 52.234 0.043 1 A 137 ASN CA 1
1 139 ASN CB C 13 39.348 0.011 1 A 137 ASN CB 1
1 139 ASN H H 1 9.687 0.005 1 A 137 ASN H 1
1 139 ASN HA H 1 5.322 0.009 1 A 137 ASN HA 1
1 139 ASN HB2 H 1 3.37 0.015 2 A 137 ASN HBx 1
1 139 ASN HB3 H 1 3.392 0.027 2 A 137 ASN HBy 1
1 139 ASN HD21 H 1 7.197 0.008 1 A 137 ASN HD21 1
1 139 ASN HD22 H 1 6.781 0.021 1 A 137 ASN HD22 1
1 139 ASN N N 15 129.324 0.019 1 A 137 ASN N 1
1 139 ASN ND2 N 15 108.131 0.002 1 A 137 ASN ND2 1
1 140 TYR CA C 13 63.588 0.037 1 A 138 TYR CA 1
1 140 TYR CB C 13 38.756 0.041 1 A 138 TYR CB 1
1 140 TYR CD1 C 13 132.554 0.035 1 A 138 TYR CD1 1
1 140 TYR CE1 C 13 118.058 0.027 1 A 138 TYR CE1 1
1 140 TYR H H 1 8.483 0.004 1 A 138 TYR H 1
1 140 TYR HA H 1 3.363 0.011 1 A 138 TYR HA 1
1 140 TYR HB2 H 1 2.409 0.012 2 A 138 TYR HBx 1
1 140 TYR HB3 H 1 2.128 0.092 2 A 138 TYR HBy 1
1 140 TYR HD1 H 1 6.41 0.035 1 A 138 TYR HD% 1
1 140 TYR HD2 H 1 6.41 0.035 1 A 138 TYR HD% 1
1 140 TYR HE1 H 1 6.625 0.014 1 A 138 TYR HE% 1
1 140 TYR HE2 H 1 6.625 0.014 1 A 138 TYR HE% 1
1 140 TYR N N 15 118.686 0.01 1 A 138 TYR N 1
1 141 GLU CA C 13 61.321 0.041 1 A 139 GLU CA 1
1 141 GLU CB C 13 30.007 0.028 1 A 139 GLU CB 1
1 141 GLU CG C 13 38.18 0.026 1 A 139 GLU CG 1
1 141 GLU H H 1 8.116 0.004 1 A 139 GLU H 1
1 141 GLU HA H 1 3.645 0.006 1 A 139 GLU HA 1
1 141 GLU HB2 H 1 2.088 0.009 2 A 139 GLU HBx 1
1 141 GLU HB3 H 1 2.091 0.009 2 A 139 GLU HBy 1
1 141 GLU HG2 H 1 2.313 0.004 2 A 139 GLU HGx 1
1 141 GLU HG3 H 1 2.375 0.005 2 A 139 GLU HGy 1
1 141 GLU N N 15 118.698 0.027 1 A 139 GLU N 1
1 142 GLU CA C 13 59.558 0.025 1 A 140 GLU CA 1
1 142 GLU CB C 13 30.911 0.068 1 A 140 GLU CB 1
1 142 GLU CG C 13 37.467 0.013 1 A 140 GLU CG 1
1 142 GLU H H 1 8.789 0.003 1 A 140 GLU H 1
1 142 GLU HA H 1 3.989 0.006 1 A 140 GLU HA 1
1 142 GLU HB2 H 1 2.6 0.009 2 A 140 GLU HBx 1
1 142 GLU HB3 H 1 2.145 0.007 2 A 140 GLU HBy 1
1 142 GLU HG2 H 1 2.313 0.005 2 A 140 GLU HGx 1
1 142 GLU HG3 H 1 2.313 0.005 2 A 140 GLU HGy 1
1 142 GLU N N 15 119.799 0.037 1 A 140 GLU N 1
1 143 PHE CA C 13 62.951 0.072 1 A 141 PHE CA 1
1 143 PHE CB C 13 41.2 0.04 1 A 141 PHE CB 1
1 143 PHE CD2 C 13 129.668 0.037 1 A 141 PHE CD2 1
1 143 PHE CE2 C 13 131.952 0.091 1 A 141 PHE CE2 1
1 143 PHE CZ C 13 132.012 0.038 1 A 141 PHE CZ 1
1 143 PHE H H 1 8.656 0.008 1 A 141 PHE H 1
1 143 PHE HA H 1 3.881 0.006 1 A 141 PHE HA 1
1 143 PHE HB2 H 1 3.333 0.008 2 A 141 PHE HBx 1
1 143 PHE HB3 H 1 3.476 0.015 2 A 141 PHE HBy 1
1 143 PHE HD1 H 1 7.31 0.014 1 A 141 PHE HD% 1
1 143 PHE HD2 H 1 7.31 0.014 1 A 141 PHE HD% 1
1 143 PHE HE1 H 1 6.659 0.011 1 A 141 PHE HE% 1
1 143 PHE HE2 H 1 6.659 0.011 1 A 141 PHE HE% 1
1 143 PHE HZ H 1 7.294 0.005 1 A 141 PHE HZ 1
1 143 PHE N N 15 122.639 0.054 1 A 141 PHE N 1
1 144 VAL CA C 13 68.183 0.032 1 A 142 VAL CA 1
1 144 VAL CB C 13 32.499 0.06 1 A 142 VAL CB 1
1 144 VAL CG1 C 13 22.478 0.032 1 A 142 VAL CG1 1
1 144 VAL CG2 C 13 24.261 0.024 1 A 142 VAL CG2 1
1 144 VAL H H 1 8.854 0.007 1 A 142 VAL H 1
1 144 VAL HA H 1 3.074 0.008 1 A 142 VAL HA 1
1 144 VAL HB H 1 1.809 0.012 1 A 142 VAL HB 1
1 144 VAL HG11 H 1 0.714 0.09 2 A 142 VAL HGx% 1
1 144 VAL HG12 H 1 0.714 0.09 2 A 142 VAL HGx% 1
1 144 VAL HG13 H 1 0.714 0.09 2 A 142 VAL HGx% 1
1 144 VAL HG21 H 1 0.714 0.09 2 A 142 VAL HGx% 1
1 144 VAL HG22 H 1 0.714 0.09 2 A 142 VAL HGx% 1
1 144 VAL HG23 H 1 0.714 0.09 2 A 142 VAL HGx% 1
1 144 VAL HG23 H 1 0.489 0.007 2 A 142 VAL HGy% 1
1 144 VAL HG22 H 1 0.489 0.007 2 A 142 VAL HGy% 1
1 144 VAL HG21 H 1 0.489 0.007 2 A 142 VAL HGy% 1
1 144 VAL HG13 H 1 0.489 0.007 2 A 142 VAL HGy% 1
1 144 VAL HG12 H 1 0.489 0.007 2 A 142 VAL HGy% 1
1 144 VAL HG11 H 1 0.489 0.007 2 A 142 VAL HGy% 1
1 144 VAL N N 15 119.897 0.112 1 A 142 VAL N 1
1 145 GLN CA C 13 59.874 0.041 1 A 143 GLN CA 1
1 145 GLN CB C 13 29.012 0.013 1 A 143 GLN CB 1
1 145 GLN CG C 13 35.212 0 1 A 143 GLN CG 1
1 145 GLN H H 1 7.548 0.002 1 A 143 GLN H 1
1 145 GLN HA H 1 3.83 0.006 1 A 143 GLN HA 1
1 145 GLN HB2 H 1 2.047 0.006 2 A 143 GLN HBx 1
1 145 GLN HB3 H 1 2.047 0.006 2 A 143 GLN HBy 1
1 145 GLN HG2 H 1 2.389 0.01 2 A 143 GLN HGx 1
1 145 GLN HG3 H 1 2.389 0.01 2 A 143 GLN HGy 1
1 145 GLN N N 15 118.252 0.029 1 A 143 GLN N 1
1 146 MET CA C 13 56.573 0.065 1 A 144 MET CA 1
1 146 MET CB C 13 32.785 0.048 1 A 144 MET CB 1
1 146 MET CE C 13 18.379 0.029 1 A 144 MET CE 1
1 146 MET CG C 13 34.711 0.061 1 A 144 MET CG 1
1 146 MET H H 1 7.111 0.004 1 A 144 MET H 1
1 146 MET HA H 1 4.218 0.013 1 A 144 MET HA 1
1 146 MET HB2 H 1 0.974 0.006 2 A 144 MET HBx 1
1 146 MET HB3 H 1 1.387 0.01 2 A 144 MET HBy 1
1 146 MET HE1 H 1 1.904 0.004 1 A 144 MET HE% 1
1 146 MET HE2 H 1 1.904 0.004 1 A 144 MET HE% 1
1 146 MET HE3 H 1 1.904 0.004 1 A 144 MET HE% 1
1 146 MET HG2 H 1 2.401 0.003 2 A 144 MET HGx 1
1 146 MET HG3 H 1 2.401 0.003 2 A 144 MET HGy 1
1 146 MET N N 15 114.924 0.042 1 A 144 MET N 1
1 147 MET CA C 13 56.53 0.001 1 A 145 MET CA 1
1 147 MET CB C 13 34.186 0.082 1 A 145 MET CB 1
1 147 MET CE C 13 18.433 0.037 1 A 145 MET CE 1
1 147 MET CG C 13 33.166 0.049 1 A 145 MET CG 1
1 147 MET H H 1 7.904 0.004 1 A 145 MET H 1
1 147 MET HA H 1 4.392 0.002 1 A 145 MET HA 1
1 147 MET HB2 H 1 1.775 0.009 1 A 145 MET HB2 1
1 147 MET HB3 H 1 1.743 0.031 1 A 145 MET HB3 1
1 147 MET HE1 H 1 2.016 0.005 1 A 145 MET HE% 1
1 147 MET HE2 H 1 2.016 0.005 1 A 145 MET HE% 1
1 147 MET HE3 H 1 2.016 0.005 1 A 145 MET HE% 1
1 147 MET HG2 H 1 2.3 0.001 2 A 145 MET HGx 1
1 147 MET HG3 H 1 2.3 0.001 2 A 145 MET HGy 1
1 147 MET N N 15 116.508 0.041 1 A 145 MET N 1
1 148 THR CA C 13 62.616 0 1 A 146 THR CA 1
1 148 THR CB C 13 71.175 0 1 A 146 THR CB 1
1 148 THR CG2 C 13 22.491 0.02 1 A 146 THR CG2 1
1 148 THR H H 1 7.495 0.009 1 A 146 THR H 1
1 148 THR HA H 1 4.038 0.001 1 A 146 THR HA 1
1 148 THR HB H 1 4.295 0 1 A 146 THR HB 1
1 148 THR HG21 H 1 1.11 0.015 1 A 146 THR HG2% 1
1 148 THR HG22 H 1 1.11 0.015 1 A 146 THR HG2% 1
1 148 THR HG23 H 1 1.11 0.015 1 A 146 THR HG2% 1
1 148 THR N N 15 108.366 0.011 1 A 146 THR N 1
1 149 ALA CA C 13 53.914 0.006 1 A 147 ALA CA 1
1 149 ALA CB C 13 20.179 0.005 1 A 147 ALA CB 1
1 149 ALA H H 1 7.421 0.007 1 A 147 ALA H 1
1 149 ALA HA H 1 4.274 0.011 1 A 147 ALA HA 1
1 149 ALA HB1 H 1 1.398 0.008 1 A 147 ALA HB% 1
1 149 ALA HB2 H 1 1.398 0.008 1 A 147 ALA HB% 1
1 149 ALA HB3 H 1 1.398 0.008 1 A 147 ALA HB% 1
1 149 ALA N N 15 126.572 0.009 1 A 147 ALA N 1
1 150 LYS CA C 13 58.372 0.028 1 A 148 LYS CA 1
1 150 LYS CB C 13 34.986 0.032 1 A 148 LYS CB 1
1 150 LYS CD C 13 30.116 0.01 1 A 148 LYS CD 1
1 150 LYS CE C 13 43.489 0 1 A 148 LYS CE 1
1 150 LYS CG C 13 25.916 0 1 A 148 LYS CG 1
1 150 LYS H H 1 7.798 0.001 1 A 148 LYS H 1
1 150 LYS HA H 1 4.181 0.007 1 A 148 LYS HA 1
1 150 LYS HB2 H 1 1.834 0.008 2 A 148 LYS HBx 1
1 150 LYS HB3 H 1 1.692 0.002 2 A 148 LYS HBy 1
1 150 LYS HD2 H 1 1.68 0.007 2 A 148 LYS HDx 1
1 150 LYS HD3 H 1 1.678 0.006 2 A 148 LYS HDy 1
1 150 LYS HE2 H 1 3 0.006 2 A 148 LYS HEx 1
1 150 LYS HE3 H 1 2.996 0.004 2 A 148 LYS HEy 1
1 150 LYS HG2 H 1 1.405 0.003 2 A 148 LYS HGx 1
1 150 LYS HG3 H 1 1.405 0.004 2 A 148 LYS HGy 1
1 150 LYS N N 15 125.338 0.025 1 A 148 LYS N 1
1 256 ALA CB C 13 19.26 0 1 A 654 ALA CB 1
1 256 ALA H H 1 8.23 0 1 A 654 ALA H 1
1 256 ALA HA H 1 4.369 0 1 A 654 ALA HA 1
1 256 ALA HB1 H 1 1.424 0.001 1 A 654 ALA HB% 1
1 256 ALA HB2 H 1 1.424 0.001 1 A 654 ALA HB% 1
1 256 ALA HB3 H 1 1.424 0.001 1 A 654 ALA HB% 1
1 256 ALA N N 15 124.741 0 1 A 654 ALA N 1
1 259 GLU CB C 13 30.188 0 1 A 657 GLU CB 1
1 259 GLU HB2 H 1 2.102 0.004 2 A 657 GLU HBx 1
1 259 GLU HB3 H 1 1.95 0.003 2 A 657 GLU HBy 1
1 260 ASP CB C 13 41.326 0 1 A 658 ASP CB 1
1 260 ASP HA H 1 4.621 0 1 A 658 ASP HA 1
1 260 ASP HB2 H 1 2.713 0 2 A 658 ASP HBx 1
1 260 ASP HB3 H 1 2.713 0 2 A 658 ASP HBy 1
1 261 ASP CA C 13 54.411 0.011 1 A 659 ASP CA 1
1 261 ASP CB C 13 41.184 0 1 A 659 ASP CB 1
1 261 ASP H H 1 8.249 0 1 A 659 ASP H 1
1 261 ASP HA H 1 4.614 0 1 A 659 ASP HA 1
1 261 ASP N N 15 120.834 0 1 A 659 ASP N 1
1 262 GLN CB C 13 29.642 0 1 A 660 GLN CB 1
1 262 GLN H H 1 8.224 0 1 A 660 GLN H 1
1 262 GLN N N 15 119.857 0.021 1 A 660 GLN N 1
1 279 ALA CA C 13 52.767 0.081 1 A 677 ALA CA 1
1 279 ALA CB C 13 19.212 0 1 A 677 ALA CB 1
1 279 ALA HA H 1 4.353 0.002 1 A 677 ALA HA 1
1 279 ALA HB1 H 1 1.382 0.001 1 A 677 ALA HB% 1
1 279 ALA HB2 H 1 1.382 0.001 1 A 677 ALA HB% 1
1 279 ALA HB3 H 1 1.382 0.001 1 A 677 ALA HB% 1
1 282 SER CA C 13 58.366 0 1 A 680 SER CA 1
1 282 SER CB C 13 63.826 0.022 1 A 680 SER CB 1
1 282 SER HA H 1 4.444 0 1 A 680 SER HA 1
1 282 SER HB2 H 1 3.892 0.002 2 A 680 SER HBx 1
1 282 SER HB3 H 1 3.892 0.002 2 A 680 SER HBy 1
1 283 LEU CA C 13 55.401 0.167 1 A 681 LEU CA 1
1 283 LEU CB C 13 42.454 0.029 1 A 681 LEU CB 1
1 283 LEU HA H 1 4.318 0.037 1 A 681 LEU HA 1
1 283 LEU HB2 H 1 1.646 0.002 2 A 681 LEU HBx 1
1 283 LEU HB3 H 1 1.646 0.002 2 A 681 LEU HBy 1
1 284 ALA CA C 13 52.113 0.014 1 A 682 ALA CA 1
1 284 ALA CB C 13 19.198 0.015 1 A 682 ALA CB 1
1 284 ALA H H 1 8.107 0.002 1 A 682 ALA H 1
1 284 ALA HA H 1 4.346 0 1 A 682 ALA HA 1
1 284 ALA HB1 H 1 1.358 0 1 A 682 ALA HB% 1
1 284 ALA HB2 H 1 1.358 0 1 A 682 ALA HB% 1
1 284 ALA HB3 H 1 1.358 0 1 A 682 ALA HB% 1
1 284 ALA N N 15 124.518 0.044 1 A 682 ALA N 1
1 285 LEU H H 1 8.069 0.002 1 A 683 LEU H 1
1 285 LEU N N 15 122.725 0.015 1 A 683 LEU N 1
1 302 GLY CA C 13 47.203 0.035 1 A 700 GLY CA 1
1 302 GLY H H 1 10.014 0.032 1 A 700 GLY H 1
1 302 GLY HA2 H 1 3.579 0.004 1 A 700 GLY HA2 1
1 302 GLY HA3 H 1 4.173 0.007 1 A 700 GLY HA3 1
1 303 TRP CA C 13 60.563 0.033 1 A 701 TRP CA 1
1 303 TRP CB C 13 29.141 0 1 A 701 TRP CB 1
1 303 TRP H H 1 8.045 0.005 1 A 701 TRP H 1
1 303 TRP HA H 1 4.402 0.003 1 A 701 TRP HA 1
1 303 TRP HB2 H 1 3.261 0.01 2 A 701 TRP HBx 1
1 303 TRP HB3 H 1 3.267 0.008 2 A 701 TRP HBy 1
1 303 TRP HD1 H 1 7.512 0.007 1 A 701 TRP HD1 1
1 303 TRP HE1 H 1 10.686 0.004 1 A 701 TRP HE1 1
1 303 TRP HE3 H 1 7.419 0.003 1 A 701 TRP HE3 1
1 303 TRP HH2 H 1 7.007 0.007 1 A 701 TRP HH2 1
1 303 TRP HZ2 H 1 7.075 0.006 1 A 701 TRP HZ2 1
1 303 TRP N N 15 120.238 0.02 1 A 701 TRP N 1
1 303 TRP NE1 N 15 129.412 0.014 1 A 701 TRP NE1 1
1 304 GLU CA C 13 59.591 0.029 1 A 702 GLU CA 1
1 304 GLU CB C 13 29.274 0.029 1 A 702 GLU CB 1
1 304 GLU CG C 13 36.263 0 1 A 702 GLU CG 1
1 304 GLU H H 1 7.916 0.004 1 A 702 GLU H 1
1 304 GLU HA H 1 4.185 0.004 1 A 702 GLU HA 1
1 304 GLU HB2 H 1 2.211 0.002 2 A 702 GLU HBx 1
1 304 GLU HB3 H 1 2.208 0.004 2 A 702 GLU HBy 1
1 304 GLU HG2 H 1 2.23 0.008 2 A 702 GLU HGx 1
1 304 GLU HG3 H 1 2.23 0.007 2 A 702 GLU HGy 1
1 304 GLU N N 15 120.488 0.014 1 A 702 GLU N 1
1 305 ILE CA C 13 64.67 0.022 1 A 703 ILE CA 1
1 305 ILE CB C 13 38.059 0.018 1 A 703 ILE CB 1
1 305 ILE CG1 C 13 28.883 0.02 1 A 703 ILE CG1 1
1 305 ILE CG2 C 13 17.443 0.02 1 A 703 ILE CG2 1
1 305 ILE H H 1 8.063 0.003 1 A 703 ILE H 1
1 305 ILE HA H 1 3.756 0.007 1 A 703 ILE HA 1
1 305 ILE HB H 1 1.907 0.004 1 A 703 ILE HB 1
1 305 ILE HG12 H 1 1.135 0.004 2 A 703 ILE HG1x 1
1 305 ILE HG13 H 1 1.66 0.005 2 A 703 ILE HG1y 1
1 305 ILE HG21 H 1 0.829 0.004 1 A 703 ILE HG2% 1
1 305 ILE HG22 H 1 0.829 0.004 1 A 703 ILE HG2% 1
1 305 ILE HG23 H 1 0.829 0.004 1 A 703 ILE HG2% 1
1 305 ILE N N 15 119.978 0.013 1 A 703 ILE N 1
1 306 LEU CA C 13 58.442 0.02 1 A 704 LEU CA 1
1 306 LEU CB C 13 41.98 0.098 1 A 704 LEU CB 1
1 306 LEU CD1 C 13 24.541 0.028 1 A 704 LEU CD1 1
1 306 LEU CD2 C 13 25.486 0.04 1 A 704 LEU CD2 1
1 306 LEU CG C 13 27.012 0.038 1 A 704 LEU CG 1
1 306 LEU H H 1 7.899 0.006 1 A 704 LEU H 1
1 306 LEU HA H 1 4.074 0.008 1 A 704 LEU HA 1
1 306 LEU HB2 H 1 1.683 0.009 1 A 704 LEU HB2 1
1 306 LEU HB3 H 1 1.848 0.006 1 A 704 LEU HB3 1
1 306 LEU HD11 H 1 0.756 0.007 1 A 704 LEU HD1% 1
1 306 LEU HD12 H 1 0.756 0.007 1 A 704 LEU HD1% 1
1 306 LEU HD13 H 1 0.756 0.007 1 A 704 LEU HD1% 1
1 306 LEU HD21 H 1 0.604 0.007 1 A 704 LEU HD2% 1
1 306 LEU HD22 H 1 0.604 0.007 1 A 704 LEU HD2% 1
1 306 LEU HD23 H 1 0.604 0.007 1 A 704 LEU HD2% 1
1 306 LEU HG H 1 1.656 0.011 1 A 704 LEU HG 1
1 306 LEU N N 15 120.709 0.02 1 A 704 LEU N 1
1 307 ARG CA C 13 60.903 0.022 1 A 705 ARG CA 1
1 307 ARG CB C 13 31.086 0.012 1 A 705 ARG CB 1
1 307 ARG CG C 13 30.85 0.037 1 A 705 ARG CG 1
1 307 ARG H H 1 8.891 0.005 1 A 705 ARG H 1
1 307 ARG HA H 1 4.059 0.006 1 A 705 ARG HA 1
1 307 ARG HB2 H 1 2.056 0.002 2 A 705 ARG HBx 1
1 307 ARG HB3 H 1 2.054 0.004 2 A 705 ARG HBy 1
1 307 ARG HD2 H 1 3.205 0.004 2 A 705 ARG HDx 1
1 307 ARG HD3 H 1 3.21 0 2 A 705 ARG HDy 1
1 307 ARG HG2 H 1 1.902 0.011 2 A 705 ARG HGx 1
1 307 ARG HG3 H 1 1.805 0.027 2 A 705 ARG HGy 1
1 307 ARG N N 15 122.348 0.007 1 A 705 ARG N 1
1 308 GLN CA C 13 58.586 0.058 1 A 706 GLN CA 1
1 308 GLN CB C 13 28.4 0.013 1 A 706 GLN CB 1
1 308 GLN CG C 13 33.932 0.018 1 A 706 GLN CG 1
1 308 GLN H H 1 8.402 0.006 1 A 706 GLN H 1
1 308 GLN HA H 1 4.073 0.007 1 A 706 GLN HA 1
1 308 GLN HB2 H 1 2.172 0.006 1 A 706 GLN HB2 1
1 308 GLN HB3 H 1 2.219 0.006 1 A 706 GLN HB3 1
1 308 GLN HE21 H 1 7.575 0.004 2 A 706 GLN HE2x 1
1 308 GLN HE22 H 1 6.811 0.008 2 A 706 GLN HE2y 1
1 308 GLN HG2 H 1 2.563 0.011 2 A 706 GLN HGx 1
1 308 GLN HG3 H 1 2.493 0.003 2 A 706 GLN HGy 1
1 308 GLN N N 15 117.815 0.017 1 A 706 GLN N 1
1 308 GLN NE2 N 15 112.738 0.021 1 A 706 GLN NE2 1
1 309 ASN CA C 13 55.879 0 1 A 707 ASN CA 1
1 309 ASN CB C 13 40.904 0.026 1 A 707 ASN CB 1
1 309 ASN H H 1 7.934 0.008 1 A 707 ASN H 1
1 309 ASN HA H 1 4.657 0.017 1 A 707 ASN HA 1
1 309 ASN HB2 H 1 2.79 0.004 1 A 707 ASN HB2 1
1 309 ASN HB3 H 1 2.82 0.011 1 A 707 ASN HB3 1
1 309 ASN HD21 H 1 7.689 0.003 1 A 707 ASN HD21 1
1 309 ASN HD22 H 1 7.371 0.005 1 A 707 ASN HD22 1
1 309 ASN N N 15 115.22 0.008 1 A 707 ASN N 1
1 309 ASN ND2 N 15 114.457 0.013 1 A 707 ASN ND2 1
1 310 THR CA C 13 65.255 0.037 1 A 708 THR CA 1
1 310 THR CB C 13 69.896 0.055 1 A 708 THR CB 1
1 310 THR CG2 C 13 21.99 0.038 1 A 708 THR CG2 1
1 310 THR H H 1 7.976 0.002 1 A 708 THR H 1
1 310 THR HA H 1 4.334 0.003 1 A 708 THR HA 1
1 310 THR HB H 1 4.231 0.022 1 A 708 THR HB 1
1 310 THR HG21 H 1 1.302 0.01 1 A 708 THR HG2% 1
1 310 THR HG22 H 1 1.302 0.01 1 A 708 THR HG2% 1
1 310 THR HG23 H 1 1.302 0.01 1 A 708 THR HG2% 1
1 310 THR N N 15 113.869 0.019 1 A 708 THR N 1
1 311 LEU CA C 13 55.174 0.026 1 A 709 LEU CA 1
1 311 LEU CB C 13 41.937 0.071 1 A 709 LEU CB 1
1 311 LEU H H 1 8.182 0.007 1 A 709 LEU H 1
1 311 LEU HA H 1 4.493 0.011 1 A 709 LEU HA 1
1 311 LEU HB2 H 1 1.79 0.003 2 A 709 LEU HBx 1
1 311 LEU HB3 H 1 1.611 0.005 2 A 709 LEU HBy 1
1 311 LEU HD11 H 1 0.914 0.003 2 A 709 LEU HDx% 1
1 311 LEU HD12 H 1 0.914 0.003 2 A 709 LEU HDx% 1
1 311 LEU HD13 H 1 0.914 0.003 2 A 709 LEU HDx% 1
1 311 LEU HD21 H 1 0.914 0.003 2 A 709 LEU HDx% 1
1 311 LEU HD22 H 1 0.914 0.003 2 A 709 LEU HDx% 1
1 311 LEU HD23 H 1 0.914 0.003 2 A 709 LEU HDx% 1
1 311 LEU HD23 H 1 0.866 0 2 A 709 LEU HDy% 1
1 311 LEU HD22 H 1 0.866 0 2 A 709 LEU HDy% 1
1 311 LEU HD21 H 1 0.866 0 2 A 709 LEU HDy% 1
1 311 LEU HD13 H 1 0.866 0 2 A 709 LEU HDy% 1
1 311 LEU HD12 H 1 0.866 0 2 A 709 LEU HDy% 1
1 311 LEU HD11 H 1 0.866 0 2 A 709 LEU HDy% 1
1 311 LEU N N 15 119.282 0.02 1 A 709 LEU N 1
1 312 GLY CA C 13 46.454 0 1 A 710 GLY CA 1
1 312 GLY H H 1 8.292 0.002 1 A 710 GLY H 1
1 312 GLY N N 15 109.444 0.015 1 A 710 GLY N 1
1 313 HIS CB C 13 30.259 0 1 A 711 HIS CB 1
1 313 HIS HA H 1 4.589 0 1 A 711 HIS HA 1
1 313 HIS HB2 H 1 3.161 0 2 A 711 HIS HBx 1
1 313 HIS HB3 H 1 3.161 0 2 A 711 HIS HBy 1
1 313 HIS N N 15 119.87 0 1 A 711 HIS N 1
1 314 LEU CA C 13 55.138 0.014 1 A 712 LEU CA 1
1 314 LEU CB C 13 42.518 0 1 A 712 LEU CB 1
1 314 LEU H H 1 7.899 0.004 1 A 712 LEU H 1
1 314 LEU HA H 1 4.354 0.004 1 A 712 LEU HA 1
1 314 LEU HB2 H 1 1.609 0.002 2 A 712 LEU HBx 1
1 314 LEU HB3 H 1 1.609 0.002 2 A 712 LEU HBy 1
1 314 LEU N N 15 121.629 0.018 1 A 712 LEU N 1
1 315 ASN CA C 13 53.023 0.007 1 A 713 ASN CA 1
1 315 ASN H H 1 8.48 0.005 1 A 713 ASN H 1
1 315 ASN HA H 1 4.622 0.001 1 A 713 ASN HA 1
1 315 ASN N N 15 119.361 0.003 1 A 713 ASN N 1
1 316 LEU CA C 13 55.609 0.026 1 A 714 LEU CA 1
1 316 LEU CB C 13 42.306 0.016 1 A 714 LEU CB 1
1 316 LEU H H 1 8.18 0.006 1 A 714 LEU H 1
1 316 LEU HB2 H 1 1.671 0.002 2 A 714 LEU HBx 1
1 316 LEU HB3 H 1 1.671 0.002 2 A 714 LEU HBy 1
1 316 LEU HD11 H 1 0.981 0 2 A 714 LEU HDx% 1
1 316 LEU HD12 H 1 0.981 0 2 A 714 LEU HDx% 1
1 316 LEU HD13 H 1 0.981 0 2 A 714 LEU HDx% 1
1 316 LEU HD21 H 1 0.981 0 2 A 714 LEU HDx% 1
1 316 LEU HD22 H 1 0.981 0 2 A 714 LEU HDx% 1
1 316 LEU HD23 H 1 0.981 0 2 A 714 LEU HDx% 1
1 316 LEU HD23 H 1 0.981 0 2 A 714 LEU HDy% 1
1 316 LEU HD22 H 1 0.981 0 2 A 714 LEU HDy% 1
1 316 LEU HD21 H 1 0.981 0 2 A 714 LEU HDy% 1
1 316 LEU HD13 H 1 0.981 0 2 A 714 LEU HDy% 1
1 316 LEU HD12 H 1 0.981 0 2 A 714 LEU HDy% 1
1 316 LEU HD11 H 1 0.981 0 2 A 714 LEU HDy% 1
1 316 LEU N N 15 121.792 0.023 1 A 714 LEU N 1
1 317 GLY CA C 13 45.624 0.01 1 A 715 GLY CA 1
1 317 GLY H H 1 8.356 0.001 1 A 715 GLY H 1
1 317 GLY HA2 H 1 3.937 0 2 A 715 GLY HAx 1
1 317 GLY HA3 H 1 3.937 0 2 A 715 GLY HAy 1
1 317 GLY N N 15 108.349 0.011 1 A 715 GLY N 1
1 318 LEU CB C 13 42.202 0.055 1 A 716 LEU CB 1
1 318 LEU H H 1 7.916 0.002 1 A 716 LEU H 1
1 318 LEU HB2 H 1 1.656 0.004 2 A 716 LEU HBx 1
1 318 LEU HB3 H 1 1.558 0.008 2 A 716 LEU HBy 1
1 318 LEU N N 15 120.921 0.015 1 A 716 LEU N 1
1 319 ASN CA C 13 53.25 0.013 1 A 717 ASN CA 1
1 319 ASN CB C 13 38.702 0.005 1 A 717 ASN CB 1
1 319 ASN H H 1 8.369 0.005 1 A 717 ASN H 1
1 319 ASN HA H 1 4.732 0.004 1 A 717 ASN HA 1
1 319 ASN HB2 H 1 2.88 0.006 2 A 717 ASN HBx 1
1 319 ASN HB3 H 1 2.734 0.005 2 A 717 ASN HBy 1
1 319 ASN N N 15 118.897 0.012 1 A 717 ASN N 1
1 320 LEU CA C 13 55.243 0.003 1 A 718 LEU CA 1
1 320 LEU CB C 13 42.289 0 1 A 718 LEU CB 1
1 320 LEU H H 1 8.222 0.003 1 A 718 LEU H 1
1 320 LEU HA H 1 4.394 0.001 1 A 718 LEU HA 1
1 320 LEU HB2 H 1 1.654 0.001 2 A 718 LEU HBx 1
1 320 LEU HB3 H 1 1.654 0.001 2 A 718 LEU HBy 1
1 320 LEU N N 15 122.669 0.011 1 A 718 LEU N 1
1 321 SER H H 1 8.277 0 1 A 719 SER H 1
1 321 SER N N 15 116.153 0 1 A 719 SER N 1
1 322 GLU CA C 13 56.66 0 1 A 720 GLU CA 1
1 322 GLU CB C 13 30.378 0.019 1 A 720 GLU CB 1
1 322 GLU HA H 1 4.366 0.003 1 A 720 GLU HA 1
1 322 GLU HB2 H 1 2.107 0.007 2 A 720 GLU HBx 1
1 322 GLU HB3 H 1 1.969 0.01 2 A 720 GLU HBy 1
1 323 GLY CA C 13 45.313 0 1 A 721 GLY CA 1
1 324 ASP CB C 13 40.928 0.008 1 A 722 ASP CB 1
1 324 ASP H H 1 8.009 0 1 A 722 ASP H 1
1 324 ASP HB2 H 1 2.856 0 2 A 722 ASP HBx 1
1 324 ASP HB3 H 1 2.745 0 2 A 722 ASP HBy 1
1 324 ASP N N 15 124.191 0 1 A 722 ASP N 1
1 325 GLY CA C 13 45.441 0.014 1 A 723 GLY CA 1
1 325 GLY HA2 H 1 4.006 0.003 2 A 723 GLY HAx 1
1 325 GLY HA3 H 1 4.006 0.003 2 A 723 GLY HAy 1
1 326 GLU H H 1 8.242 0 1 A 724 GLU H 1
1 326 GLU N N 15 120.91 0 1 A 724 GLU N 1
1 327 GLU H H 1 8.062 0 1 A 725 GLU H 1
1 327 GLU N N 15 127.109 0 1 A 725 GLU N 1
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