data_nef_c25595_2n2c save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 2N2C stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 307 MET start . . 2 A 308 GLY middle . false 3 A 309 GLY middle . false 4 A 310 GLY middle . false 5 A 311 MET middle . . 6 A 312 ASN middle . . 7 A 313 PHE middle . . 8 A 314 GLY middle . false 9 A 315 ALA middle . . 10 A 316 PHE middle . . 11 A 317 SER middle . . 12 A 318 ILE middle . . 13 A 319 ASN middle . . 14 A 320 PRO middle . false 15 A 321 ALA middle . . 16 A 322 MET middle . . 17 A 323 MET middle . . 18 A 324 ALA middle . . 19 A 325 ALA middle . . 20 A 326 ALA middle . . 21 A 327 GLN middle . . 22 A 328 ALA middle . . 23 A 329 ALA middle . . 24 A 330 LEU middle . . 25 A 331 GLN middle . . 26 A 332 SER middle . . 27 A 333 SER middle . . 28 A 334 TRP middle . . 29 A 335 GLY middle . false 30 A 336 MET middle . . 31 A 337 MET middle . . 32 A 338 GLY middle . false 33 A 339 MET middle . . 34 A 340 LEU middle . . 35 A 341 ALA middle . . 36 A 342 SER middle . . 37 A 343 GLN middle . . 38 A 344 GLN middle . . 39 A 345 ASN middle . . 40 A 346 GLN middle . . 41 A 347 SER middle . . 42 A 348 GLY middle . false 43 A 349 PRO end . false stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 307 MET H1 H 1 8.39 . A 307 MET HA H 1 4.56 . A 307 MET HBx H 1 2.09 . A 307 MET HBy H 1 2.21 . A 307 MET HE1 H 1 2.68 . A 307 MET HE2 H 1 2.59 . A 307 MET HE3 H 1 2.59 . A 307 MET CA C 13 56.05 . A 307 MET CB C 13 33.04 . A 307 MET N N 15 120.26 . A 308 GLY H H 1 8.43 . A 308 GLY HAx H 1 4.05 . A 308 GLY CA C 13 45.57 . A 308 GLY N N 15 109.29 . A 309 GLY H H 1 8.31 . A 309 GLY HAx H 1 4.05 . A 309 GLY CA C 13 45.59 . A 309 GLY N N 15 108.72 . A 310 GLY H H 1 7.98 . A 310 GLY HAx H 1 3.99 . A 310 GLY CA C 13 45.29 . A 310 GLY N N 15 107.76 . A 311 MET H H 1 8.37 . A 311 MET HA H 1 4.47 . A 311 MET HBx H 1 1.97 . A 311 MET HE% H 1 2.50 . A 311 MET CA C 13 55.56 . A 311 MET CB C 13 33.82 . A 311 MET N N 15 119.52 . A 312 ASN H H 1 8.36 . A 312 ASN HA H 1 4.88 . A 312 ASN HBx H 1 2.75 . A 312 ASN HBy H 1 2.90 . A 312 ASN CA C 13 52.90 . A 312 ASN CB C 13 39.49 . A 312 ASN N N 15 120.20 . A 313 PHE H H 1 8.54 . A 313 PHE HA H 1 4.62 . A 313 PHE HBx H 1 2.96 . A 313 PHE HBy H 1 3.27 . A 313 PHE CA C 13 58.47 . A 313 PHE CB C 13 39.65 . A 313 PHE N N 15 121.51 . A 314 GLY H H 1 8.51 . A 314 GLY HAx H 1 3.86 . A 314 GLY HAy H 1 4.00 . A 314 GLY CA C 13 46.44 . A 314 GLY N N 15 108.90 . A 315 ALA H H 1 8.13 . A 315 ALA HA H 1 4.34 . A 315 ALA HB% H 1 1.37 . A 315 ALA CA C 13 52.77 . A 315 ALA CB C 13 19.32 . A 315 ALA N N 15 123.79 . A 316 PHE H H 1 7.82 . A 316 PHE HA H 1 4.71 . A 316 PHE HBx H 1 3.18 . A 316 PHE HBy H 1 3.24 . A 316 PHE CA C 13 57.56 . A 316 PHE CB C 13 40.27 . A 316 PHE N N 15 116.81 . A 317 SER H H 1 8.13 . A 317 SER HA H 1 4.73 . A 317 SER HBx H 1 3.86 . A 317 SER CA C 13 57.76 . A 317 SER CB C 13 64.70 . A 317 SER N N 15 116.50 . A 318 ILE H H 1 8.29 . A 318 ILE HA H 1 4.41 . A 318 ILE HB H 1 1.97 . A 318 ILE HD1% H 1 1.01 . A 318 ILE HG1y H 1 1.64 . A 318 ILE HG2% H 1 1.27 . A 318 ILE CA C 13 60.37 . A 318 ILE CB C 13 39.08 . A 318 ILE CD1 C 13 13.38 . A 318 ILE CG1 C 13 27.72 . A 318 ILE CG2 C 13 18.21 . A 318 ILE N N 15 121.18 . A 319 ASN H H 1 8.16 . A 319 ASN HA H 1 5.01 . A 319 ASN HBx H 1 2.85 . A 319 ASN CA C 13 52.06 . A 319 ASN CB C 13 38.99 . A 319 ASN N N 15 124.88 . A 320 PRO CA C 13 65.96 . A 320 PRO CB C 13 32.25 . A 321 ALA H H 1 8.30 . A 321 ALA HA H 1 4.34 . A 321 ALA HB% H 1 1.56 . A 321 ALA CA C 13 55.29 . A 321 ALA CB C 13 18.34 . A 321 ALA N N 15 121.04 . A 322 MET CA C 13 58.49 . A 322 MET CB C 13 33.03 . A 323 MET H H 1 7.91 . A 323 MET HA H 1 4.25 . A 323 MET HBx H 1 2.22 . A 323 MET HE1 H 1 2.68 . A 323 MET HE2 H 1 2.59 . A 323 MET HE3 H 1 2.59 . A 323 MET CA C 13 58.66 . A 323 MET CB C 13 32.29 . A 323 MET N N 15 117.80 . A 324 ALA H H 1 8.18 . A 324 ALA HA H 1 4.23 . A 324 ALA HB% H 1 1.60 . A 324 ALA CA C 13 55.14 . A 324 ALA CB C 13 18.18 . A 324 ALA N N 15 121.02 . A 325 ALA H H 1 8.15 . A 325 ALA HA H 1 4.25 . A 325 ALA HB% H 1 1.61 . A 325 ALA CA C 13 55.12 . A 325 ALA CB C 13 18.52 . A 325 ALA N N 15 121.02 . A 326 ALA H H 1 8.34 . A 326 ALA HA H 1 4.11 . A 326 ALA HB% H 1 1.60 . A 326 ALA CA C 13 56.14 . A 326 ALA CB C 13 18.45 . A 326 ALA N N 15 120.87 . A 327 GLN H H 1 8.38 . A 327 GLN HA H 1 3.95 . A 327 GLN HBx H 1 2.26 . A 327 GLN HBy H 1 2.37 . A 327 GLN HGx H 1 2.51 . A 327 GLN CA C 13 60.00 . A 327 GLN CB C 13 28.82 . A 327 GLN N N 15 116.50 . A 328 ALA H H 1 8.02 . A 328 ALA HA H 1 4.28 . A 328 ALA HB% H 1 1.62 . A 328 ALA CA C 13 55.12 . A 328 ALA CB C 13 18.21 . A 328 ALA N N 15 120.80 . A 329 ALA H H 1 7.92 . A 329 ALA HA H 1 4.30 . A 329 ALA HB% H 1 1.65 . A 329 ALA CA C 13 55.10 . A 329 ALA CB C 13 18.53 . A 329 ALA N N 15 121.62 . A 330 LEU H H 1 8.24 . A 330 LEU HA H 1 4.26 . A 330 LEU HBx H 1 1.74 . A 330 LEU HBy H 1 1.91 . A 330 LEU HDx% H 1 0.97 . A 330 LEU HG H 1 1.62 . A 330 LEU CA C 13 57.80 . A 330 LEU CB C 13 42.06 . A 330 LEU N N 15 118.68 . A 331 GLN H H 1 8.16 . A 331 GLN HA H 1 4.17 . A 331 GLN HBx H 1 2.28 . A 331 GLN HGy H 1 2.61 . A 331 GLN HGx H 1 2.52 . A 331 GLN CA C 13 58.82 . A 331 GLN CB C 13 28.84 . A 331 GLN N N 15 117.20 . A 332 SER H H 1 8.12 . A 332 SER HA H 1 4.52 . A 332 SER HBx H 1 4.07 . A 332 SER CA C 13 60.65 . A 332 SER CB C 13 63.81 . A 332 SER N N 15 113.99 . A 333 SER H H 1 8.13 . A 333 SER HA H 1 4.46 . A 333 SER HBx H 1 3.98 . A 333 SER HBy H 1 3.98 . A 333 SER CA C 13 61.10 . A 333 SER CB C 13 63.84 . A 333 SER N N 15 116.99 . A 334 TRP H H 1 8.16 . A 334 TRP HA H 1 4.58 . A 334 TRP HBx H 1 3.44 . A 334 TRP CA C 13 59.45 . A 334 TRP CB C 13 29.90 . A 334 TRP N N 15 122.55 . A 335 GLY H H 1 8.40 . A 335 GLY HAx H 1 4.00 . A 335 GLY HAy H 1 4.05 . A 335 GLY CA C 13 46.79 . A 335 GLY N N 15 126.52 . A 336 MET H H 1 8.08 . A 336 MET HA H 1 4.41 . A 336 MET HBx H 1 2.20 . A 336 MET HE1 H 1 2.68 . A 336 MET HE2 H 1 2.63 . A 336 MET HE3 H 1 2.63 . A 336 MET CA C 13 57.38 . A 336 MET CB C 13 32.96 . A 336 MET N N 15 119.78 . A 337 MET H H 1 8.12 . A 337 MET HA H 1 4.30 . A 337 MET HBy H 1 2.13 . A 337 MET HBx H 1 2.11 . A 337 MET HE1 H 1 2.66 . A 337 MET HE2 H 1 2.57 . A 337 MET HE3 H 1 2.57 . A 337 MET CA C 13 57.66 . A 337 MET CB C 13 32.52 . A 337 MET N N 15 117.51 . A 338 GLY H H 1 8.18 . A 338 GLY HAx H 1 3.90 . A 338 GLY CA C 13 46.54 . A 338 GLY N N 15 126.46 . A 339 MET H H 1 7.91 . A 339 MET HA H 1 4.41 . A 339 MET HBx H 1 2.19 . A 339 MET HE1 H 1 2.70 . A 339 MET HE2 H 1 2.62 . A 339 MET HE3 H 1 2.62 . A 339 MET CA C 13 57.30 . A 339 MET CB C 13 32.54 . A 339 MET N N 15 119.21 . A 340 LEU H H 1 7.96 . A 340 LEU HA H 1 4.32 . A 340 LEU HBx H 1 1.85 . A 340 LEU HDx% H 1 0.97 . A 340 LEU HDy% H 1 1.02 . A 340 LEU HG H 1 1.69 . A 340 LEU CA C 13 56.23 . A 340 LEU CB C 13 42.42 . A 340 LEU N N 15 119.45 . A 341 ALA H H 1 7.98 . A 341 ALA HA H 1 4.37 . A 341 ALA HB% H 1 1.50 . A 341 ALA CA C 13 53.10 . A 341 ALA CB C 13 19.46 . A 341 ALA N N 15 121.25 . A 342 SER H H 1 8.05 . A 342 SER HA H 1 4.47 . A 342 SER HBx H 1 3.99 . A 342 SER CA C 13 59.15 . A 342 SER CB C 13 64.02 . A 342 SER N N 15 113.59 . A 343 GLN H H 1 8.28 . A 343 GLN HA H 1 4.40 . A 343 GLN HBx H 1 2.09 . A 343 GLN HBy H 1 2.24 . A 343 GLN HGx H 1 2.46 . A 343 GLN CA C 13 56.36 . A 343 GLN CB C 13 29.45 . A 343 GLN N N 15 121.24 . A 344 GLN H H 1 8.29 . A 344 GLN HA H 1 4.40 . A 344 GLN HBx H 1 2.07 . A 344 GLN HBy H 1 2.20 . A 344 GLN HGx H 1 2.44 . A 344 GLN CA C 13 56.37 . A 344 GLN CB C 13 29.46 . A 344 GLN N N 15 120.20 . A 345 ASN H H 1 8.43 . A 345 ASN HA H 1 4.78 . A 345 ASN HBx H 1 2.81 . A 345 ASN HBy H 1 2.88 . A 345 ASN CA C 13 53.66 . A 345 ASN CB C 13 38.97 . A 345 ASN N N 15 119.01 . A 346 GLN H H 1 8.37 . A 346 GLN HA H 1 4.48 . A 346 GLN HBx H 1 2.07 . A 346 GLN HBy H 1 2.24 . A 346 GLN HGx H 1 2.44 . A 346 GLN CA C 13 56.11 . A 346 GLN CB C 13 29.55 . A 346 GLN N N 15 120.68 . A 347 SER H H 1 8.35 . A 347 SER HA H 1 4.58 . A 347 SER HBx H 1 3.96 . A 347 SER CA C 13 58.70 . A 347 SER CB C 13 64.28 . A 347 SER N N 15 116.65 . A 348 GLY H H 1 8.22 . A 348 GLY HAx H 1 4.18 . A 348 GLY HAy H 1 4.24 . A 348 GLY CA C 13 44.93 . A 348 GLY N N 15 110.40 . A 349 PRO HA H 1 4.55 . A 349 PRO HBy H 1 2.06 . A 349 PRO CA C 13 63.63 . A 349 PRO CB C 13 32.27 . A 349 PRO CD C 13 49.97 . A 349 PRO CG C 13 27.286 . stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 307 MET H1 A 307 MET HA 1.0 . 3.760 2 2 A 307 MET H1 A 307 MET HBx 1.0 . 3.640 3 3 A 307 MET H1 A 307 MET HBy 1.0 . 4.310 4 4 A 307 MET H1 A 307 MET HGx 1.0 . 4.800 5 5 A 307 MET H1 A 307 MET HGy 1.0 . 4.880 6 6 A 308 GLY H A 308 GLY HAy 1.0 . 3.280 7 7 A 309 GLY H A 309 GLY HAy 1.0 . 3.450 8 8 A 310 GLY H A 310 GLY HAy 1.0 . 3.110 9 9 A 311 MET H A 311 MET HA 1.0 . 3.620 10 10 A 311 MET H A 311 MET HBx 1.0 . 3.160 11 11 A 311 MET H A 311 MET HGx 1.0 . 4.010 12 12 A 312 ASN H A 312 ASN HA 1.0 . 3.680 13 13 A 312 ASN H A 312 ASN HBx 1.0 . 3.640 14 14 A 312 ASN H A 312 ASN HBy 1.0 . 3.660 15 15 A 313 PHE H A 313 PHE HA 1.0 . 3.680 16 16 A 313 PHE H A 313 PHE HBx 1.0 . 3.490 17 17 A 313 PHE H A 313 PHE HBy 1.0 . 3.770 18 18 A 314 GLY H A 314 GLY HAx 1.0 . 3.290 19 19 A 314 GLY H A 314 GLY HAy 1.0 . 3.280 20 20 A 315 ALA H A 315 ALA HA 1.0 . 3.550 21 21 A 315 ALA H A 315 ALA HB% 1.0 . 3.100 22 22 A 316 PHE H A 316 PHE HA 1.0 . 4.340 23 23 A 316 PHE H A 316 PHE HBx 1.0 . 3.420 24 24 A 316 PHE H A 316 PHE HBy 1.0 . 3.510 25 25 A 317 SER H A 317 SER HA 1.0 . 3.480 26 26 A 317 SER H A 317 SER HBx 1.0 . 3.420 27 27 A 318 ILE H A 318 ILE HA 1.0 . 3.550 28 28 A 318 ILE H A 318 ILE HB 1.0 . 3.520 29 29 A 318 ILE H A 318 ILE HG1x 1.0 . 3.920 30 30 A 318 ILE H A 318 ILE HD1% 1.0 . 4.050 31 31 A 318 ILE H A 318 ILE HG2% 1.0 . 3.990 32 32 A 319 ASN H A 319 ASN HA 1.0 . 4.000 33 33 A 319 ASN H A 319 ASN HBx 1.0 . 5.000 34 34 A 321 ALA H A 321 ALA HB% 1.0 . 3.190 35 35 A 321 ALA H A 321 ALA HA 1.0 . 3.460 36 36 A 323 MET H A 323 MET HA 1.0 . 3.940 37 37 A 323 MET H A 323 MET HBx 1.0 . 3.550 38 38 A 323 MET H A 323 MET HGx 1.0 . 4.340 39 39 A 323 MET H A 323 MET HGy 1.0 . 4.390 40 40 A 324 ALA H A 324 ALA HA 1.0 . 3.760 41 41 A 324 ALA H A 324 ALA HB% 1.0 . 3.300 42 42 A 325 ALA H A 325 ALA HA 1.0 . 3.720 43 43 A 325 ALA H A 325 ALA HB% 1.0 . 3.130 44 44 A 326 ALA H A 326 ALA HA 1.0 . 3.920 45 45 A 326 ALA H A 326 ALA HB% 1.0 . 3.300 46 46 A 327 GLN H A 327 GLN HA 1.0 . 3.870 47 47 A 327 GLN H A 327 GLN HBx 1.0 . 3.530 48 48 A 327 GLN H A 327 GLN HBy 1.0 . 4.640 49 49 A 327 GLN H A 327 GLN HGx 1.0 . 4.480 50 50 A 328 ALA H A 328 ALA HA 1.0 . 3.550 51 51 A 328 ALA H A 328 ALA HB% 1.0 . 3.190 52 52 A 329 ALA H A 329 ALA HA 1.0 . 3.460 53 53 A 329 ALA H A 329 ALA HB% 1.0 . 3.220 54 54 A 330 LEU H A 330 LEU HA 1.0 . 4.410 55 55 A 330 LEU H A 330 LEU HBx 1.0 . 4.090 56 56 A 330 LEU H A 330 LEU HBy 1.0 . 3.770 57 57 A 330 LEU H A 330 LEU HG 1.0 . 3.780 58 58 A 330 LEU H A 330 LEU HDx% 1.0 . 4.030 59 59 A 331 GLN H A 331 GLN HA 1.0 . 3.790 60 60 A 331 GLN H A 331 GLN HBx 1.0 . 3.600 61 61 A 331 GLN H A 331 GLN HGy 1.0 . 4.590 62 62 A 331 GLN H A 331 GLN HGx 1.0 . 4.440 63 63 A 332 SER H A 332 SER HA 1.0 . 3.840 64 64 A 332 SER H A 332 SER HBx 1.0 . 3.930 65 65 A 333 SER H A 333 SER HA 1.0 . 4.000 66 66 A 333 SER H A 333 SER HBy 1.0 . 4.060 67 66 A 333 SER H A 333 SER HBx 1.0 . 4.060 68 67 A 333 SER H A 333 SER HBy 1.0 . 4.070 69 67 A 333 SER H A 333 SER HBx 1.0 . 4.070 70 68 A 334 TRP H A 334 TRP HA 1.0 . 3.930 71 69 A 334 TRP H A 334 TRP HBx 1.0 . 3.490 72 70 A 335 GLY H A 335 GLY HAx 1.0 . 3.580 73 71 A 335 GLY H A 335 GLY HAy 1.0 . 3.570 74 72 A 336 MET H A 336 MET HA 1.0 . 3.640 75 73 A 336 MET H A 336 MET HBx 1.0 . 3.470 76 74 A 336 MET H A 336 MET HGx 1.0 . 4.110 77 75 A 336 MET H A 336 MET HGy 1.0 . 4.060 78 76 A 337 MET H A 337 MET HA 1.0 . 3.730 79 77 A 337 MET H A 337 MET HBy 1.0 . 3.670 80 78 A 337 MET H A 337 MET HGx 1.0 . 4.040 81 79 A 337 MET H A 337 MET HGy 1.0 . 3.890 82 80 A 338 GLY H A 338 GLY HAy 1.0 . 3.340 83 81 A 339 MET H A 339 MET HA 1.0 . 3.500 84 82 A 339 MET H A 339 MET HBx 1.0 . 3.290 85 83 A 339 MET H A 339 MET HGx 1.0 . 4.250 86 84 A 339 MET H A 339 MET HGy 1.0 . 4.150 87 85 A 340 LEU H A 340 LEU HA 1.0 . 3.550 88 86 A 340 LEU H A 340 LEU HBx 1.0 . 3.510 89 87 A 340 LEU H A 340 LEU HG 1.0 . 3.780 90 88 A 340 LEU H A 340 LEU HDx% 1.0 . 4.390 91 89 A 340 LEU H A 340 LEU HDy% 1.0 . 4.180 92 90 A 341 ALA H A 341 ALA HA 1.0 . 3.540 93 91 A 341 ALA H A 341 ALA HB% 1.0 . 3.160 94 92 A 342 SER H A 342 SER HA 1.0 . 3.570 95 93 A 342 SER H A 342 SER HBx 1.0 . 3.500 96 94 A 343 GLN H A 343 GLN HA 1.0 . 3.390 97 95 A 343 GLN H A 343 GLN HBx 1.0 . 3.540 98 96 A 343 GLN H A 343 GLN HBy 1.0 . 3.950 99 97 A 343 GLN H A 343 GLN HGx 1.0 . 3.770 100 98 A 344 GLN H A 344 GLN HA 1.0 . 3.730 101 99 A 344 GLN H A 344 GLN HBx 1.0 . 3.300 102 100 A 344 GLN H A 344 GLN HBy 1.0 . 3.780 103 101 A 344 GLN H A 344 GLN HGx 1.0 . 3.730 104 102 A 345 ASN H A 345 ASN HA 1.0 . 3.400 105 103 A 345 ASN H A 345 ASN HBx 1.0 . 3.830 106 104 A 345 ASN H A 345 ASN HBy 1.0 . 4.120 107 105 A 346 GLN H A 346 GLN HA 1.0 . 3.870 108 106 A 346 GLN H A 346 GLN HBx 1.0 . 3.930 109 107 A 346 GLN H A 346 GLN HBy 1.0 . 4.480 110 108 A 346 GLN H A 346 GLN HGx 1.0 . 4.370 111 109 A 347 SER H A 347 SER HA 1.0 . 4.120 112 110 A 347 SER H A 347 SER HBx 1.0 . 3.970 113 111 A 348 GLY H A 348 GLY HAx 1.0 . 4.120 114 112 A 348 GLY H A 348 GLY HAy 1.0 . 4.080 115 113 A 307 MET H1 A 308 GLY H 1.0 . 3.330 116 114 A 307 MET H1 A 308 GLY HAy 1.0 . 5.130 117 115 A 307 MET HA A 308 GLY H 1.0 . 3.810 118 116 A 307 MET HBx A 308 GLY H 1.0 . 5.090 119 117 A 307 MET HBy A 308 GLY H 1.0 . 5.130 120 118 A 308 GLY H A 309 GLY H 1.0 . 4.730 121 119 A 311 MET H A 312 ASN H 1.0 . 3.800 122 120 A 311 MET HA A 312 ASN H 1.0 . 3.000 123 121 A 311 MET HBx A 312 ASN H 1.0 . 3.860 124 122 A 312 ASN H A 313 PHE H 1.0 . 4.150 125 123 A 312 ASN HA A 313 PHE H 1.0 . 3.020 126 124 A 312 ASN HBx A 313 PHE H 1.0 . 4.150 127 125 A 312 ASN HBy A 313 PHE H 1.0 . 4.130 128 126 A 313 PHE H A 314 GLY HAx 1.0 . 5.440 129 127 A 313 PHE H A 314 GLY HAy 1.0 . 4.920 130 128 A 313 PHE HA A 314 GLY H 1.0 . 3.540 131 129 A 313 PHE HBx A 314 GLY H 1.0 . 4.310 132 130 A 313 PHE HBy A 314 GLY H 1.0 . 4.270 133 131 A 314 GLY H A 315 ALA H 1.0 . 6.000 134 132 A 314 GLY H A 315 ALA H 1.0 . 3.810 135 133 A 314 GLY H A 315 ALA HB% 1.0 . 4.550 136 134 A 314 GLY HAx A 315 ALA H 1.0 . 3.500 137 135 A 314 GLY HAy A 315 ALA H 1.0 . 3.660 138 136 A 315 ALA H A 316 PHE H 1.0 . 6.000 139 137 A 315 ALA H A 316 PHE H 1.0 . 3.460 140 138 A 315 ALA H A 316 PHE HBx 1.0 . 5.160 141 139 A 315 ALA H A 316 PHE HBy 1.0 . 5.020 142 140 A 315 ALA HA A 316 PHE H 1.0 . 3.490 143 141 A 315 ALA HB% A 316 PHE H 1.0 . 3.590 144 142 A 316 PHE H A 317 SER H 1.0 . 3.260 145 143 A 316 PHE H A 317 SER H 1.0 . 4.150 146 144 A 316 PHE HBx A 317 SER H 1.0 . 3.860 147 145 A 316 PHE HBy A 317 SER H 1.0 . 3.860 148 146 A 317 SER H A 318 ILE H 1.0 . 3.690 149 147 A 317 SER H A 318 ILE H 1.0 . 4.220 150 148 A 317 SER H A 318 ILE HB 1.0 . 5.780 151 149 A 317 SER H A 318 ILE HG1x 1.0 . 5.570 152 150 A 317 SER H A 318 ILE HD1% 1.0 . 5.790 153 151 A 317 SER HA A 318 ILE H 1.0 . 3.640 154 152 A 317 SER HBx A 318 ILE H 1.0 . 3.770 155 153 A 318 ILE H A 319 ASN H 1.0 . 4.410 156 154 A 318 ILE HA A 319 ASN H 1.0 . 3.250 157 155 A 318 ILE HB A 319 ASN H 1.0 . 4.410 158 156 A 318 ILE HG1x A 319 ASN H 1.0 . 4.910 159 157 A 318 ILE HD1% A 319 ASN H 1.0 . 3.790 160 158 A 318 ILE HG2% A 319 ASN H 1.0 . 4.820 161 159 A 323 MET H A 324 ALA H 1.0 . 3.610 162 160 A 323 MET H A 324 ALA H 1.0 . 3.780 163 161 A 323 MET H A 324 ALA HB% 1.0 . 4.120 164 162 A 323 MET HBx A 324 ALA H 1.0 . 3.970 165 163 A 323 MET HGx A 324 ALA H 1.0 . 5.430 166 164 A 323 MET HGy A 324 ALA H 1.0 . 5.370 167 165 A 324 ALA H A 325 ALA H 1.0 . 3.290 168 166 A 325 ALA H A 326 ALA HA 1.0 . 4.440 169 167 A 326 ALA H A 327 GLN HA 1.0 . 4.730 170 168 A 326 ALA HA A 327 GLN H 1.0 . 4.690 171 169 A 326 ALA HB% A 327 GLN H 1.0 . 4.530 172 170 A 326 ALA H A 327 GLN HBx 1.0 . 4.840 173 171 A 327 GLN H A 328 ALA H 1.0 . 4.050 174 172 A 327 GLN H A 328 ALA H 1.0 . 4.180 175 173 A 327 GLN HA A 328 ALA H 1.0 . 4.440 176 174 A 328 ALA H A 329 ALA HA 1.0 . 4.270 177 175 A 327 GLN H A 328 ALA HA 1.0 . 4.940 178 176 A 330 LEU H A 331 GLN H 1.0 . 3.750 179 177 A 330 LEU H A 331 GLN H 1.0 . 3.970 180 178 A 330 LEU HBx A 331 GLN H 1.0 . 4.670 181 179 A 330 LEU HBy A 331 GLN H 1.0 . 4.380 182 180 A 330 LEU HG A 331 GLN H 1.0 . 4.520 183 181 A 330 LEU HDx% A 331 GLN H 1.0 . 4.730 184 182 A 331 GLN H A 332 SER H 1.0 . 3.550 185 183 A 330 LEU H A 331 GLN HA 1.0 . 4.430 186 184 A 330 LEU H A 331 GLN HBx 1.0 . 4.660 187 185 A 332 SER HA A 333 SER H 1.0 . 4.120 188 186 A 332 SER HBx A 333 SER H 1.0 . 4.190 189 187 A 333 SER HA A 334 TRP H 1.0 . 4.310 190 188 A 333 SER HBx A 334 TRP H 1.0 . 4.270 191 189 A 334 TRP H A 335 GLY H 1.0 . 4.020 192 190 A 334 TRP H A 335 GLY H 1.0 . 4.220 193 191 A 334 TRP HA A 335 GLY H 1.0 . 4.310 194 192 A 334 TRP HBx A 335 GLY H 1.0 . 4.030 195 193 A 335 GLY H A 336 MET H 1.0 . 4.000 196 194 A 335 GLY H A 336 MET H 1.0 . 4.060 197 195 A 335 GLY H A 336 MET HA 1.0 . 5.030 198 196 A 335 GLY H A 336 MET HBx 1.0 . 5.340 199 197 A 335 GLY HAx A 336 MET H 1.0 . 3.890 200 198 A 335 GLY HAy A 336 MET H 1.0 . 3.920 201 199 A 336 MET H A 337 MET H 1.0 . 6.000 202 200 A 336 MET HA A 337 MET H 1.0 . 4.140 203 201 A 336 MET HBx A 337 MET H 1.0 . 4.000 204 202 A 337 MET H A 338 GLY H 1.0 . 3.760 205 203 A 337 MET H A 338 GLY H 1.0 . 3.820 206 204 A 337 MET H A 338 GLY HAy 1.0 . 4.630 207 205 A 337 MET HA A 338 GLY H 1.0 . 4.250 208 206 A 337 MET HBy A 338 GLY H 1.0 . 4.250 209 207 A 337 MET HGx A 338 GLY H 1.0 . 5.380 210 208 A 337 MET HGy A 338 GLY H 1.0 . 5.100 211 209 A 338 GLY H A 339 MET H 1.0 . 3.830 212 210 A 338 GLY H A 339 MET H 1.0 . 4.010 213 211 A 338 GLY HAy A 339 MET H 1.0 . 3.860 214 212 A 339 MET H A 340 LEU H 1.0 . 3.540 215 213 A 339 MET H A 340 LEU HBx 1.0 . 5.010 216 214 A 339 MET H A 340 LEU HG 1.0 . 5.340 217 215 A 338 GLY H A 339 MET HA 1.0 . 4.800 218 216 A 339 MET HA A 340 LEU H 1.0 . 3.870 219 217 A 339 MET HBx A 340 LEU H 1.0 . 3.770 220 218 A 340 LEU H A 341 ALA H 1.0 . 4.100 221 219 A 340 LEU H A 341 ALA HB% 1.0 . 4.730 222 220 A 340 LEU HA A 341 ALA H 1.0 . 3.640 223 221 A 340 LEU HBx A 341 ALA H 1.0 . 4.040 224 222 A 340 LEU HG A 341 ALA H 1.0 . 4.130 225 223 A 340 LEU HDy% A 341 ALA H 1.0 . 4.710 226 224 A 341 ALA H A 342 SER H 1.0 . 3.290 227 225 A 341 ALA H A 342 SER H 1.0 . 3.450 228 226 A 341 ALA H A 342 SER HA 1.0 . 4.890 229 227 A 341 ALA H A 342 SER HBx 1.0 . 5.080 230 228 A 341 ALA HA A 342 SER H 1.0 . 3.380 231 229 A 341 ALA HB% A 342 SER H 1.0 . 3.550 232 230 A 342 SER H A 343 GLN H 1.0 . 3.660 233 231 A 342 SER H A 343 GLN H 1.0 . 3.680 234 232 A 342 SER HA A 343 GLN H 1.0 . 3.250 235 233 A 342 SER HBx A 343 GLN H 1.0 . 4.140 236 234 A 343 GLN H A 344 GLN HA 1.0 . 4.350 237 235 A 344 GLN H A 345 ASN H 1.0 . 3.320 238 236 A 345 ASN H A 346 GLN H 1.0 . 3.080 239 237 A 344 GLN H A 345 ASN HA 1.0 . 3.840 240 238 A 345 ASN HA A 346 GLN H 1.0 . 3.500 241 239 A 345 ASN HBx A 346 GLN H 1.0 . 4.890 242 240 A 345 ASN HBy A 346 GLN H 1.0 . 4.920 243 241 A 347 SER H A 348 GLY H 1.0 . 4.270 244 242 A 347 SER HA A 348 GLY H 1.0 . 3.650 245 243 A 347 SER HBx A 348 GLY H 1.0 . 4.990 246 244 A 309 GLY H A 311 MET H 1.0 . 3.470 247 245 A 309 GLY HAy A 311 MET H 1.0 . 3.150 248 246 A 310 GLY H A 312 ASN H 1.0 . 4.200 249 247 A 311 MET HA A 313 PHE H 1.0 . 5.360 250 248 A 313 PHE H A 315 ALA HB% 1.0 . 4.910 251 249 A 313 PHE HA A 315 ALA H 1.0 . 4.970 252 250 A 313 PHE HA A 316 PHE H 1.0 . 5.020 253 251 A 313 PHE HBx A 315 ALA H 1.0 . 5.730 254 252 A 313 PHE HBx A 316 PHE H 1.0 . 5.100 255 253 A 312 ASN HA A 314 GLY H 1.0 . 4.480 256 254 A 314 GLY H A 316 PHE H 1.0 . 4.720 257 255 A 314 GLY H A 316 PHE H 1.0 . 5.060 258 256 A 314 GLY H A 316 PHE HA 1.0 . 5.350 259 257 A 314 GLY H A 317 SER H 1.0 . 3.820 260 258 A 314 GLY HAx A 316 PHE H 1.0 . 4.720 261 259 A 314 GLY HAy A 316 PHE H 1.0 . 4.650 262 260 A 315 ALA HA A 317 SER H 1.0 . 5.320 263 261 A 315 ALA HA A 318 ILE H 1.0 . 4.520 264 262 A 315 ALA HB% A 317 SER H 1.0 . 4.520 265 263 A 316 PHE HA A 318 ILE H 1.0 . 3.640 266 264 A 316 PHE HBx A 319 ASN H 1.0 . 5.680 267 265 A 317 SER HA A 319 ASN H 1.0 . 5.900 268 266 A 319 ASN H A 321 ALA H 1.0 . 3.590 269 267 A 319 ASN H A 323 MET H 1.0 . 4.780 270 268 A 319 ASN H A 323 MET HBx 1.0 . 4.350 271 269 A 319 ASN HA A 321 ALA H 1.0 . 4.790 272 270 A 321 ALA H A 320 PRO HA 1.0 . 5.350 273 271 A 321 ALA H A 323 MET H 1.0 . 4.350 274 272 A 321 ALA HA A 323 MET H 1.0 . 4.330 275 273 A 323 MET H A 325 ALA HA 1.0 . 5.990 276 274 A 323 MET H A 326 ALA H 1.0 . 4.280 277 275 A 325 ALA H A 327 GLN HBx 1.0 . 5.700 278 276 A 327 GLN H A 329 ALA H 1.0 . 5.410 279 277 A 325 ALA H A 328 ALA H 1.0 . 4.910 280 278 A 326 ALA HA A 328 ALA H 1.0 . 5.410 281 279 A 328 ALA H A 330 LEU H 1.0 . 4.840 282 280 A 328 ALA HA A 331 GLN H 1.0 . 5.730 283 281 A 326 ALA H A 329 ALA H 1.0 . 4.790 284 282 A 326 ALA HA A 329 ALA H 1.0 . 5.410 285 283 A 329 ALA H A 331 GLN H 1.0 . 3.980 286 284 A 326 ALA H A 329 ALA HA 1.0 . 5.680 287 285 A 327 GLN H A 329 ALA HA 1.0 . 5.140 288 286 A 326 ALA H A 329 ALA HB% 1.0 . 5.940 289 287 A 327 GLN H A 329 ALA HB% 1.0 . 5.640 290 288 A 327 GLN HA A 330 LEU H 1.0 . 4.540 291 289 A 327 GLN H A 330 LEU HDx% 1.0 . 5.430 292 290 A 327 GLN HA A 331 GLN H 1.0 . 4.770 293 291 A 331 GLN HA A 334 TRP H 1.0 . 4.550 294 292 A 331 GLN HBx A 334 TRP H 1.0 . 6.070 295 293 A 332 SER HBx A 334 TRP H 1.0 . 4.760 296 294 A 331 GLN HA A 333 SER H 1.0 . 4.460 297 295 A 333 SER HA A 335 GLY H 1.0 . 5.060 298 296 A 334 TRP H A 336 MET HGx 1.0 . 6.240 299 297 A 334 TRP HA A 336 MET H 1.0 . 4.670 300 298 A 334 TRP HBx A 336 MET H 1.0 . 5.100 301 299 A 331 GLN HA A 335 GLY H 1.0 . 5.050 302 300 A 335 GLY HAy A 337 MET H 1.0 . 5.300 303 301 A 334 TRP HA A 337 MET H 1.0 . 4.880 304 302 A 337 MET H A 340 LEU H 1.0 . 5.030 305 303 A 334 TRP HA A 338 GLY H 1.0 . 5.820 306 304 A 336 MET H A 338 GLY H 1.0 . 4.000 307 305 A 338 GLY HAy A 341 ALA H 1.0 . 4.720 308 306 A 337 MET H A 339 MET H 1.0 . 4.970 309 307 A 337 MET HA A 339 MET H 1.0 . 4.440 310 308 A 339 MET H A 341 ALA H 1.0 . 3.720 311 309 A 339 MET HBx A 341 ALA H 1.0 . 5.200 312 310 A 340 LEU H A 342 SER H 1.0 . 4.290 313 311 A 340 LEU H A 343 GLN H 1.0 . 4.630 314 312 A 341 ALA H A 343 GLN HBx 1.0 . 5.840 315 313 A 340 LEU H A 342 SER H 1.0 . 3.420 316 314 A 344 GLN H A 346 GLN H 1.0 . 6.000 317 315 A 345 ASN H A 347 SER H 1.0 . 4.360 318 316 A 343 GLN H A 346 GLN H 1.0 . 3.470 319 317 A 343 GLN HA A 346 GLN H 1.0 . 4.730 320 318 A 318 ILE H A 323 MET H 1.0 . 5.680 321 319 A 318 ILE HD1% A 323 MET H 1.0 . 4.800 322 320 A 311 MET H A 318 ILE HD1% 1.0 . 5.611 323 321 A 313 PHE H A 318 ILE HB 1.0 . 4.766 324 322 A 315 ALA H A 324 ALA H 1.0 . 3.800 325 323 A 315 ALA HB% A 325 ALA H 1.0 . 4.523 326 324 A 314 GLY HAx A 319 ASN H 1.0 . 4.080 327 325 A 312 ASN H A 318 ILE HB 1.0 . 4.960 stop_ save_ save_DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 318 ILE C A 319 ASN N A 319 ASN CA A 319 ASN C 1.0 -131.4 -26.0 PHI 2 2 A 319 ASN N A 319 ASN CA A 319 ASN C A 320 PRO N 1.0 113.6 173.6 PSI 3 3 A 321 ALA C A 322 MET N A 322 MET CA A 322 MET C 1.0 -84.8 -44.8 PHI 4 4 A 322 MET N A 322 MET CA A 322 MET C A 323 MET N 1.0 -63.4 -23.4 PSI 5 5 A 322 MET C A 323 MET N A 323 MET CA A 323 MET C 1.0 -79.9 -39.9 PHI 6 6 A 323 MET N A 323 MET CA A 323 MET C A 324 ALA N 1.0 -63.3 -23.3 PSI 7 7 A 323 MET C A 324 ALA N A 324 ALA CA A 324 ALA C 1.0 -92.5 -40.1 PHI 8 8 A 324 ALA N A 324 ALA CA A 324 ALA C A 325 ALA N 1.0 -59.3 -19.3 PSI 9 9 A 324 ALA C A 325 ALA N A 325 ALA CA A 325 ALA C 1.0 -84.9 -44.9 PHI 10 10 A 325 ALA N A 325 ALA CA A 325 ALA C A 326 ALA N 1.0 -60.8 -20.8 PSI 11 11 A 325 ALA C A 326 ALA N A 326 ALA CA A 326 ALA C 1.0 -82.7 -42.7 PHI 12 12 A 326 ALA N A 326 ALA CA A 326 ALA C A 327 GLN N 1.0 -59.0 -19.0 PSI 13 13 A 326 ALA C A 327 GLN N A 327 GLN CA A 327 GLN C 1.0 -83.1 -43.1 PHI 14 14 A 327 GLN N A 327 GLN CA A 327 GLN C A 328 ALA N 1.0 -60.5 -15.2 PSI 15 15 A 327 GLN C A 328 ALA N A 328 ALA CA A 328 ALA C 1.0 -92.1 -39.0 PHI 16 16 A 328 ALA N A 328 ALA CA A 328 ALA C A 329 ALA N 1.0 -58.5 -18.5 PSI 17 17 A 328 ALA C A 329 ALA N A 329 ALA CA A 329 ALA C 1.0 -85.0 -45.0 PHI 18 18 A 329 ALA N A 329 ALA CA A 329 ALA C A 330 LEU N 1.0 -63.5 -23.5 PSI 19 19 A 329 ALA C A 330 LEU N A 330 LEU CA A 330 LEU C 1.0 -84.3 -44.3 PHI 20 20 A 330 LEU N A 330 LEU CA A 330 LEU C A 331 GLN N 1.0 -60.9 -20.9 PSI 21 21 A 330 LEU C A 331 GLN N A 331 GLN CA A 331 GLN C 1.0 -85.3 -45.3 PHI 22 22 A 331 GLN N A 331 GLN CA A 331 GLN C A 332 SER N 1.0 -51.5 -10.5 PSI 23 23 A 331 GLN C A 332 SER N A 332 SER CA A 332 SER C 1.0 -93.2 -41.7 PHI 24 24 A 332 SER N A 332 SER CA A 332 SER C A 333 SER N 1.0 -58.2 -18.2 PSI 25 25 A 332 SER C A 333 SER N A 333 SER CA A 333 SER C 1.0 -85.4 -45.4 PHI 26 26 A 333 SER N A 333 SER CA A 333 SER C A 334 TRP N 1.0 -61.6 -21.6 PSI 27 27 A 333 SER C A 334 TRP N A 334 TRP CA A 334 TRP C 1.0 -87.9 -40.9 PHI 28 28 A 334 TRP N A 334 TRP CA A 334 TRP C A 335 GLY N 1.0 -59.6 -19.6 PSI 29 29 A 334 TRP C A 335 GLY N A 335 GLY CA A 335 GLY C 1.0 -85.5 -45.5 PHI 30 30 A 335 GLY N A 335 GLY CA A 335 GLY C A 336 MET N 1.0 -64.2 -24.2 PSI 31 31 A 335 GLY C A 336 MET N A 336 MET CA A 336 MET C 1.0 -83.7 -43.7 PHI 32 32 A 336 MET N A 336 MET CA A 336 MET C A 337 MET N 1.0 -62.8 -6.8 PSI 33 33 A 336 MET C A 337 MET N A 337 MET CA A 337 MET C 1.0 -86.9 -46.9 PHI 34 34 A 337 MET N A 337 MET CA A 337 MET C A 338 GLY N 1.0 -57.2 -17.2 PSI 35 35 A 337 MET C A 338 GLY N A 338 GLY CA A 338 GLY C 1.0 -85.1 -45.1 PHI 36 36 A 338 GLY N A 338 GLY CA A 338 GLY C A 339 MET N 1.0 -63.9 -23.9 PSI 37 37 A 338 GLY C A 339 MET N A 339 MET CA A 339 MET C 1.0 -83.0 -43.0 PHI 38 38 A 339 MET N A 339 MET CA A 339 MET C A 340 LEU N 1.0 -61.1 -5.5 PSI 39 39 A 339 MET C A 340 LEU N A 340 LEU CA A 340 LEU C 1.0 -86.4 -46.4 PHI 40 40 A 340 LEU N A 340 LEU CA A 340 LEU C A 341 ALA N 1.0 -65.9 -14.8 PSI 41 41 A 340 LEU C A 341 ALA N A 341 ALA CA A 341 ALA C 1.0 -98.2 -41.1 PHI 42 42 A 341 ALA N A 341 ALA CA A 341 ALA C A 342 SER N 1.0 -60.4 -7.1 PSI 43 43 A 341 ALA C A 342 SER N A 342 SER CA A 342 SER C 1.0 -107.1 -40.5 PHI 44 44 A 342 SER N A 342 SER CA A 342 SER C A 343 GLN N 1.0 -71.9 10.6 PSI 45 45 A 342 SER C A 343 GLN N A 343 GLN CA A 343 GLN C 1.0 -94.6 -45.3 PHI 46 46 A 343 GLN N A 343 GLN CA A 343 GLN C A 344 GLN N 1.0 -64.3 0.9 PSI stop_ save_